NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | position | program | type |
19002 | 2ean | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 H GLY 1 1.811 -0.001 0.854 2 HA2 GLY 1 1HA GLY 1 2.970 -0.584 -1.120 3 HA3 GLY 1 2HA GLY 1 1.463 -0.454 -2.015 4 H SER 2 H SER 2 0.986 1.408 -3.049 5 HA SER 2 HA SER 2 2.896 3.627 -2.714 6 HB2 SER 2 1HB SER 2 1.878 2.256 -5.079 7 HB3 SER 2 2HB SER 2 1.663 4.004 -5.174 8 HG SER 2 HG SER 2 4.090 2.626 -4.650 9 H SER 3 H SER 3 -0.486 2.772 -3.223 10 HA SER 3 HA SER 3 -1.279 5.283 -1.976 11 HB2 SER 3 1HB SER 3 -1.408 4.918 -4.783 12 HB3 SER 3 2HB SER 3 -3.062 4.828 -4.179 13 HG SER 3 HG SER 3 -2.863 6.937 -4.284 14 H GLY 4 H GLY 4 -2.718 2.502 -3.699 15 HA2 GLY 4 1HA GLY 4 -3.842 1.337 -1.394 16 HA3 GLY 4 2HA GLY 4 -5.048 2.367 -2.150 17 H SER 5 H SER 5 -6.316 1.435 -3.605 18 HA SER 5 HA SER 5 -5.304 -0.942 -5.022 19 HB2 SER 5 1HB SER 5 -8.181 -0.973 -4.755 20 HB3 SER 5 2HB SER 5 -7.005 -2.190 -4.261 21 HG SER 5 HG SER 5 -8.404 -0.985 -2.612 22 H SER 6 H SER 6 -4.972 -0.280 -7.048 23 HA SER 6 HA SER 6 -7.214 0.945 -8.478 24 HB2 SER 6 1HB SER 6 -5.067 2.474 -7.678 25 HB3 SER 6 2HB SER 6 -4.616 2.014 -9.319 26 HG SER 6 HG SER 6 -6.782 3.546 -8.424 27 H GLY 7 H GLY 7 -7.602 -0.051 -10.348 28 HA2 GLY 7 1HA GLY 7 -5.383 -1.428 -11.706 29 HA3 GLY 7 2HA GLY 7 -6.856 -2.314 -11.342 30 H VAL 8 H VAL 8 -8.834 -0.584 -11.965 31 HA VAL 8 HA VAL 8 -8.980 -0.768 -14.765 32 HB VAL 8 HB VAL 8 -10.643 1.038 -13.007 33 HG11 VAL 8 1HG1 VAL 8 -12.365 0.622 -14.756 34 HG12 VAL 8 2HG1 VAL 8 -10.958 1.515 -15.338 35 HG13 VAL 8 3HG1 VAL 8 -11.132 -0.200 -15.712 36 HG21 VAL 8 1HG2 VAL 8 -10.686 -1.185 -12.076 37 HG22 VAL 8 2HG2 VAL 8 -12.219 -0.871 -12.889 38 HG23 VAL 8 3HG2 VAL 8 -11.001 -1.884 -13.665 39 H SER 9 H SER 9 -7.742 1.696 -12.677 40 HA SER 9 HA SER 9 -7.887 3.853 -14.538 41 HB2 SER 9 1HB SER 9 -5.749 4.058 -12.556 42 HB3 SER 9 2HB SER 9 -7.154 5.094 -12.806 43 HG SER 9 HG SER 9 -7.221 4.038 -10.779 44 H LYS 10 H LYS 10 -5.671 1.250 -13.981 45 HA LYS 10 HA LYS 10 -3.731 2.447 -15.837 46 HB2 LYS 10 1HB LYS 10 -3.341 0.036 -14.059 47 HB3 LYS 10 2HB LYS 10 -2.103 0.896 -14.965 48 HG2 LYS 10 1HG LYS 10 -3.405 2.772 -13.287 49 HG3 LYS 10 2HG LYS 10 -3.007 1.352 -12.316 50 HD2 LYS 10 1HD LYS 10 -0.686 1.479 -13.083 51 HD3 LYS 10 2HD LYS 10 -1.084 2.892 -14.062 52 HE2 LYS 10 1HE LYS 10 -1.346 2.720 -11.062 53 HE3 LYS 10 2HE LYS 10 -0.012 3.486 -11.922 54 HZ1 LYS 10 1HZ LYS 10 -1.202 5.332 -12.022 55 HZ2 LYS 10 2HZ LYS 10 -2.497 4.585 -11.232 56 HZ3 LYS 10 3HZ LYS 10 -2.397 4.540 -12.921 57 H TRP 11 H TRP 11 -6.322 1.078 -16.489 58 HA TRP 11 HA TRP 11 -5.672 -1.441 -17.661 59 HB2 TRP 11 1HB TRP 11 -8.029 0.310 -17.491 60 HB3 TRP 11 2HB TRP 11 -7.929 -0.626 -18.980 61 HD1 TRP 11 HD1 TRP 11 -6.621 -2.143 -15.735 62 HE1 TRP 11 HE1 TRP 11 -8.151 -4.100 -15.059 63 HE3 TRP 11 HE3 TRP 11 -10.351 -1.484 -19.169 64 HZ2 TRP 11 HZ2 TRP 11 -10.612 -5.216 -15.873 65 HZ3 TRP 11 HZ3 TRP 11 -12.257 -3.039 -19.154 66 HH2 TRP 11 HH2 TRP 11 -12.383 -4.867 -17.539 67 H SER 12 H SER 12 -4.737 -1.859 -19.551 68 HA SER 12 HA SER 12 -3.593 0.110 -21.161 69 HB2 SER 12 1HB SER 12 -3.817 -2.783 -21.186 70 HB3 SER 12 2HB SER 12 -3.906 -2.122 -22.818 71 HG SER 12 HG SER 12 -1.774 -2.327 -21.160 72 HA PRO 13 HA PRO 13 -6.689 1.480 -23.949 73 HB2 PRO 13 1HB PRO 13 -5.339 1.634 -26.299 74 HB3 PRO 13 2HB PRO 13 -5.075 2.762 -24.964 75 HG2 PRO 13 1HG PRO 13 -3.477 0.358 -25.756 76 HG3 PRO 13 2HG PRO 13 -2.911 1.961 -25.251 77 HD2 PRO 13 1HD PRO 13 -2.954 -0.164 -23.573 78 HD3 PRO 13 2HD PRO 13 -3.211 1.500 -23.013 79 H SER 14 H SER 14 -5.044 -1.500 -24.623 80 HA SER 14 HA SER 14 -6.969 -2.251 -26.685 81 HB2 SER 14 1HB SER 14 -5.132 -4.357 -25.914 82 HB3 SER 14 2HB SER 14 -5.335 -3.570 -27.479 83 HG SER 14 HG SER 14 -3.587 -2.955 -25.384 84 H GLN 15 H GLN 15 -6.255 -2.801 -23.342 85 HA GLN 15 HA GLN 15 -7.664 -5.229 -22.999 86 HB2 GLN 15 1HB GLN 15 -6.727 -3.058 -21.161 87 HB3 GLN 15 2HB GLN 15 -7.810 -4.303 -20.552 88 HG2 GLN 15 1HG GLN 15 -5.603 -5.433 -22.043 89 HG3 GLN 15 2HG GLN 15 -5.053 -4.430 -20.701 90 HE21 GLN 15 2HE2 GLN 15 -7.910 -6.489 -21.050 91 HE22 GLN 15 1HE2 GLN 15 -7.557 -7.507 -19.699 92 H VAL 16 H VAL 16 -8.612 -1.835 -22.570 93 HA VAL 16 HA VAL 16 -11.157 -2.166 -21.558 94 HB VAL 16 HB VAL 16 -10.267 -0.089 -23.564 95 HG11 VAL 16 1HG1 VAL 16 -12.127 1.151 -22.082 96 HG12 VAL 16 2HG1 VAL 16 -12.495 0.311 -23.590 97 HG13 VAL 16 3HG1 VAL 16 -12.767 -0.491 -22.042 98 HG21 VAL 16 1HG2 VAL 16 -9.154 0.934 -21.929 99 HG22 VAL 16 2HG2 VAL 16 -10.506 0.766 -20.809 100 HG23 VAL 16 3HG2 VAL 16 -9.340 -0.545 -20.986 101 H VAL 17 H VAL 17 -10.019 -2.590 -24.842 102 HA VAL 17 HA VAL 17 -12.491 -2.606 -26.171 103 HB VAL 17 HB VAL 17 -9.982 -4.142 -26.863 104 HG11 VAL 17 1HG1 VAL 17 -12.576 -4.203 -28.022 105 HG12 VAL 17 2HG1 VAL 17 -11.485 -3.393 -29.148 106 HG13 VAL 17 3HG1 VAL 17 -11.108 -5.014 -28.565 107 HG21 VAL 17 1HG2 VAL 17 -9.719 -1.671 -26.638 108 HG22 VAL 17 2HG2 VAL 17 -9.395 -2.285 -28.260 109 HG23 VAL 17 3HG2 VAL 17 -10.924 -1.477 -27.912 110 H ASP 18 H ASP 18 -10.706 -5.161 -24.516 111 HA ASP 18 HA ASP 18 -12.372 -7.303 -25.311 112 HB2 ASP 18 1HB ASP 18 -10.013 -7.334 -24.211 113 HB3 ASP 18 2HB ASP 18 -10.903 -7.273 -22.692 114 H TRP 19 H TRP 19 -12.615 -4.899 -22.808 115 HA TRP 19 HA TRP 19 -14.536 -6.222 -21.194 116 HB2 TRP 19 1HB TRP 19 -13.279 -4.399 -20.257 117 HB3 TRP 19 2HB TRP 19 -13.844 -3.297 -21.509 118 HD1 TRP 19 HD1 TRP 19 -15.522 -5.481 -18.757 119 HE1 TRP 19 HE1 TRP 19 -17.432 -4.102 -17.721 120 HE3 TRP 19 HE3 TRP 19 -15.118 -1.260 -21.613 121 HZ2 TRP 19 HZ2 TRP 19 -18.612 -1.562 -18.069 122 HZ3 TRP 19 HZ3 TRP 19 -16.676 0.598 -21.198 123 HH2 TRP 19 HH2 TRP 19 -18.387 0.449 -19.462 124 H MET 20 H MET 20 -14.803 -3.876 -23.840 125 HA MET 20 HA MET 20 -17.593 -3.550 -23.736 126 HB2 MET 20 1HB MET 20 -15.787 -3.346 -26.152 127 HB3 MET 20 2HB MET 20 -17.399 -2.658 -26.002 128 HG2 MET 20 1HG MET 20 -15.500 -1.852 -23.914 129 HG3 MET 20 2HG MET 20 -15.105 -1.312 -25.544 130 HE1 MET 20 1HE MET 20 -18.001 0.973 -26.542 131 HE2 MET 20 2HE MET 20 -16.449 0.248 -26.962 132 HE3 MET 20 3HE MET 20 -17.909 -0.742 -26.947 133 H LYS 21 H LYS 21 -15.624 -6.114 -24.928 134 HA LYS 21 HA LYS 21 -17.449 -7.240 -26.781 135 HB2 LYS 21 1HB LYS 21 -15.233 -8.556 -25.198 136 HB3 LYS 21 2HB LYS 21 -16.070 -9.282 -26.564 137 HG2 LYS 21 1HG LYS 21 -15.273 -7.086 -27.782 138 HG3 LYS 21 2HG LYS 21 -14.049 -7.106 -26.510 139 HD2 LYS 21 1HD LYS 21 -13.066 -9.013 -27.298 140 HD3 LYS 21 2HD LYS 21 -14.571 -9.639 -27.975 141 HE2 LYS 21 1HE LYS 21 -14.349 -7.644 -29.625 142 HE3 LYS 21 2HE LYS 21 -12.659 -7.644 -29.123 143 HZ1 LYS 21 1HZ LYS 21 -14.156 -9.826 -30.455 144 HZ2 LYS 21 2HZ LYS 21 -12.653 -10.070 -29.720 145 HZ3 LYS 21 3HZ LYS 21 -12.792 -9.001 -31.024 146 H GLY 22 H GLY 22 -17.517 -7.021 -23.413 147 HA2 GLY 22 1HA GLY 22 -19.396 -9.297 -23.247 148 HA3 GLY 22 2HA GLY 22 -18.397 -8.754 -21.906 149 H LEU 23 H LEU 23 -19.820 -6.349 -23.921 150 HA LEU 23 HA LEU 23 -21.747 -5.743 -21.778 151 HB2 LEU 23 1HB LEU 23 -20.601 -3.824 -23.796 152 HB3 LEU 23 2HB LEU 23 -21.583 -3.429 -22.387 153 HG LEU 23 HG LEU 23 -18.746 -4.454 -22.378 154 HD11 LEU 23 1HD1 LEU 23 -18.222 -2.277 -21.427 155 HD12 LEU 23 2HD1 LEU 23 -19.916 -1.802 -21.548 156 HD13 LEU 23 3HD1 LEU 23 -18.978 -2.103 -23.011 157 HD21 LEU 23 1HD2 LEU 23 -19.240 -5.268 -20.361 158 HD22 LEU 23 2HD2 LEU 23 -20.812 -4.469 -20.330 159 HD23 LEU 23 3HD2 LEU 23 -19.365 -3.589 -19.837 160 H ASP 24 H ASP 24 -23.356 -3.939 -23.012 161 HA ASP 24 HA ASP 24 -25.245 -5.472 -24.314 162 HB2 ASP 24 1HB ASP 24 -25.115 -2.877 -23.434 163 HB3 ASP 24 2HB ASP 24 -25.216 -2.666 -25.180 164 H ASP 25 H ASP 25 -25.910 -5.662 -26.483 165 HA ASP 25 HA ASP 25 -23.801 -5.996 -28.343 166 HB2 ASP 25 1HB ASP 25 -26.623 -6.588 -28.202 167 HB3 ASP 25 2HB ASP 25 -26.215 -5.926 -29.783 168 H CYS 26 H CYS 26 -25.939 -3.368 -27.619 169 HA CYS 26 HA CYS 26 -25.667 -1.971 -30.080 170 HB2 CYS 26 1HB CYS 26 -26.525 -1.134 -27.315 171 HB3 CYS 26 2HB CYS 26 -26.433 0.010 -28.648 172 HG CYS 26 HG CYS 26 -29.059 -1.314 -27.882 173 H LEU 27 H LEU 27 -23.671 -2.316 -27.295 174 HA LEU 27 HA LEU 27 -22.054 0.015 -27.988 175 HB2 LEU 27 1HB LEU 27 -21.426 -1.895 -25.773 176 HB3 LEU 27 2HB LEU 27 -21.038 -0.181 -25.906 177 HG LEU 27 HG LEU 27 -23.824 -1.250 -25.471 178 HD11 LEU 27 1HD1 LEU 27 -23.353 -1.536 -23.327 179 HD12 LEU 27 2HD1 LEU 27 -22.795 0.133 -23.212 180 HD13 LEU 27 3HD1 LEU 27 -21.663 -1.148 -23.645 181 HD21 LEU 27 1HD2 LEU 27 -22.595 1.460 -25.663 182 HD22 LEU 27 2HD2 LEU 27 -23.973 1.213 -24.589 183 HD23 LEU 27 3HD2 LEU 27 -24.124 0.865 -26.312 184 H GLN 28 H GLN 28 -22.246 -2.547 -29.580 185 HA GLN 28 HA GLN 28 -19.535 -3.592 -29.374 186 HB2 GLN 28 1HB GLN 28 -21.836 -4.369 -31.173 187 HB3 GLN 28 2HB GLN 28 -20.275 -5.176 -31.137 188 HG2 GLN 28 1HG GLN 28 -22.148 -4.966 -28.792 189 HG3 GLN 28 2HG GLN 28 -22.030 -6.357 -29.868 190 HE21 GLN 28 2HE2 GLN 28 -21.289 -5.527 -26.924 191 HE22 GLN 28 1HE2 GLN 28 -19.767 -6.315 -26.704 192 H GLN 29 H GLN 29 -21.600 -1.995 -31.786 193 HA GLN 29 HA GLN 29 -19.752 -1.819 -33.854 194 HB2 GLN 29 1HB GLN 29 -21.108 0.023 -34.712 195 HB3 GLN 29 2HB GLN 29 -22.130 -1.280 -34.119 196 HG2 GLN 29 1HG GLN 29 -22.095 0.153 -31.912 197 HG3 GLN 29 2HG GLN 29 -21.720 1.455 -33.040 198 HE21 GLN 29 2HE2 GLN 29 -24.146 0.424 -31.372 199 HE22 GLN 29 1HE2 GLN 29 -25.462 0.611 -32.476 200 H TYR 30 H TYR 30 -19.963 -0.037 -30.893 201 HA TYR 30 HA TYR 30 -18.308 2.149 -31.730 202 HB2 TYR 30 1HB TYR 30 -18.993 1.226 -28.932 203 HB3 TYR 30 2HB TYR 30 -18.305 2.785 -29.370 204 HD1 TYR 30 HD2 TYR 30 -19.942 3.476 -31.739 205 HD2 TYR 30 HD1 TYR 30 -21.072 1.760 -28.013 206 HE1 TYR 30 HE2 TYR 30 -22.205 4.402 -32.005 207 HE2 TYR 30 HE1 TYR 30 -23.338 2.680 -28.270 208 HH TYR 30 HH TYR 30 -24.554 3.801 -31.125 209 H ILE 31 H ILE 31 -17.778 -1.024 -30.455 210 HA ILE 31 HA ILE 31 -15.308 -0.816 -29.248 211 HB ILE 31 HB ILE 31 -16.231 -3.065 -31.039 212 HG12 ILE 31 1HG1 ILE 31 -16.536 -2.678 -28.053 213 HG13 ILE 31 2HG1 ILE 31 -17.831 -2.554 -29.239 214 HG21 ILE 31 1HG2 ILE 31 -14.278 -4.028 -30.621 215 HG22 ILE 31 2HG2 ILE 31 -13.774 -2.630 -29.673 216 HG23 ILE 31 3HG2 ILE 31 -14.623 -3.965 -28.893 217 HD11 ILE 31 1HD1 ILE 31 -18.126 -4.673 -28.402 218 HD12 ILE 31 2HD1 ILE 31 -17.154 -4.984 -29.840 219 HD13 ILE 31 3HD1 ILE 31 -16.395 -4.970 -28.248 220 H LYS 32 H LYS 32 -16.017 -1.239 -32.702 221 HA LYS 32 HA LYS 32 -13.421 -1.454 -33.657 222 HB2 LYS 32 1HB LYS 32 -15.862 -0.204 -34.923 223 HB3 LYS 32 2HB LYS 32 -14.357 -0.484 -35.789 224 HG2 LYS 32 1HG LYS 32 -14.643 -2.934 -35.027 225 HG3 LYS 32 2HG LYS 32 -16.320 -2.472 -34.727 226 HD2 LYS 32 1HD LYS 32 -15.128 -1.731 -37.345 227 HD3 LYS 32 2HD LYS 32 -15.515 -3.431 -37.070 228 HE2 LYS 32 1HE LYS 32 -17.787 -3.002 -36.827 229 HE3 LYS 32 2HE LYS 32 -17.526 -1.296 -36.468 230 HZ1 LYS 32 1HZ LYS 32 -16.912 -0.920 -38.755 231 HZ2 LYS 32 2HZ LYS 32 -18.435 -1.653 -38.695 232 HZ3 LYS 32 3HZ LYS 32 -17.074 -2.565 -39.115 233 H ASN 33 H ASN 33 -15.140 1.327 -32.491 234 HA ASN 33 HA ASN 33 -13.238 3.215 -33.589 235 HB2 ASN 33 1HB ASN 33 -15.581 3.563 -31.710 236 HB3 ASN 33 2HB ASN 33 -14.577 4.889 -32.287 237 HD21 ASN 33 2HD2 ASN 33 -17.395 4.516 -32.671 238 HD22 ASN 33 1HD2 ASN 33 -17.663 4.429 -34.375 239 H PHE 34 H PHE 34 -13.821 1.530 -30.598 240 HA PHE 34 HA PHE 34 -12.117 3.170 -28.989 241 HB2 PHE 34 1HB PHE 34 -13.575 0.597 -28.635 242 HB3 PHE 34 2HB PHE 34 -12.230 0.927 -27.549 243 HD1 PHE 34 HD2 PHE 34 -14.968 3.009 -29.003 244 HD2 PHE 34 HD1 PHE 34 -12.967 1.641 -25.504 245 HE1 PHE 34 HE2 PHE 34 -16.439 4.412 -27.618 246 HE2 PHE 34 HE1 PHE 34 -14.436 3.042 -24.113 247 HZ PHE 34 HZ PHE 34 -16.174 4.431 -25.169 248 H GLU 35 H GLU 35 -11.663 0.460 -31.098 249 HA GLU 35 HA GLU 35 -9.152 -0.394 -30.059 250 HB2 GLU 35 1HB GLU 35 -10.956 -1.257 -32.056 251 HB3 GLU 35 2HB GLU 35 -9.416 -0.982 -32.858 252 HG2 GLU 35 1HG GLU 35 -9.797 -2.693 -30.412 253 HG3 GLU 35 2HG GLU 35 -9.711 -3.296 -32.066 254 H ARG 36 H ARG 36 -10.130 1.784 -32.668 255 HA ARG 36 HA ARG 36 -7.414 2.331 -33.454 256 HB2 ARG 36 1HB ARG 36 -9.766 2.508 -34.766 257 HB3 ARG 36 2HB ARG 36 -9.574 4.184 -34.269 258 HG2 ARG 36 1HG ARG 36 -8.075 4.554 -35.856 259 HG3 ARG 36 2HG ARG 36 -7.115 3.161 -35.356 260 HD2 ARG 36 1HD ARG 36 -8.297 1.703 -36.763 261 HD3 ARG 36 2HD ARG 36 -9.619 2.848 -36.980 262 HE ARG 36 HE ARG 36 -7.410 4.098 -38.016 263 HH11 ARG 36 1HH1 ARG 36 -9.091 1.106 -38.600 264 HH12 ARG 36 2HH1 ARG 36 -8.671 1.047 -40.280 265 HH21 ARG 36 1HH2 ARG 36 -6.852 4.032 -40.226 266 HH22 ARG 36 2HH2 ARG 36 -7.397 2.712 -41.204 267 H GLU 37 H GLU 37 -9.823 3.781 -31.377 268 HA GLU 37 HA GLU 37 -8.432 6.270 -31.062 269 HB2 GLU 37 1HB GLU 37 -10.760 4.984 -29.657 270 HB3 GLU 37 2HB GLU 37 -10.055 6.484 -29.072 271 HG2 GLU 37 1HG GLU 37 -11.035 6.150 -31.889 272 HG3 GLU 37 2HG GLU 37 -12.076 6.686 -30.571 273 H LYS 38 H LYS 38 -8.224 3.146 -29.657 274 HA LYS 38 HA LYS 38 -6.929 2.255 -28.013 275 HB2 LYS 38 1HB LYS 38 -5.343 4.816 -28.263 276 HB3 LYS 38 2HB LYS 38 -4.780 3.298 -27.576 277 HG2 LYS 38 1HG LYS 38 -5.757 2.935 -30.270 278 HG3 LYS 38 2HG LYS 38 -4.487 4.158 -30.196 279 HD2 LYS 38 1HD LYS 38 -3.057 2.565 -28.975 280 HD3 LYS 38 2HD LYS 38 -4.323 1.342 -29.119 281 HE2 LYS 38 1HE LYS 38 -3.470 0.752 -31.083 282 HE3 LYS 38 2HE LYS 38 -3.892 2.345 -31.709 283 HZ1 LYS 38 1HZ LYS 38 -1.441 2.185 -30.154 284 HZ2 LYS 38 2HZ LYS 38 -1.777 3.064 -31.559 285 HZ3 LYS 38 3HZ LYS 38 -1.413 1.415 -31.661 286 H ILE 39 H ILE 39 -9.222 3.506 -27.124 287 HA ILE 39 HA ILE 39 -8.909 5.413 -25.111 288 HB ILE 39 HB ILE 39 -10.947 3.187 -25.243 289 HG12 ILE 39 1HG1 ILE 39 -10.969 4.578 -27.251 290 HG13 ILE 39 2HG1 ILE 39 -12.398 4.896 -26.274 291 HG21 ILE 39 1HG2 ILE 39 -10.937 5.768 -23.685 292 HG22 ILE 39 2HG2 ILE 39 -12.319 4.684 -23.837 293 HG23 ILE 39 3HG2 ILE 39 -10.853 4.135 -23.024 294 HD11 ILE 39 1HD1 ILE 39 -9.928 6.605 -26.431 295 HD12 ILE 39 2HD1 ILE 39 -11.501 6.955 -27.149 296 HD13 ILE 39 3HD1 ILE 39 -11.320 6.916 -25.395 297 H SER 40 H SER 40 -7.558 5.256 -23.447 298 HA SER 40 HA SER 40 -6.922 2.686 -22.270 299 HB2 SER 40 1HB SER 40 -5.513 4.255 -20.725 300 HB3 SER 40 2HB SER 40 -5.016 4.021 -22.401 301 HG SER 40 HG SER 40 -6.211 6.250 -21.188 302 H GLY 41 H GLY 41 -7.020 2.340 -19.931 303 HA2 GLY 41 1HA GLY 41 -9.582 2.663 -18.894 304 HA3 GLY 41 2HA GLY 41 -8.163 2.250 -17.943 305 H ASP 42 H ASP 42 -6.665 4.579 -18.261 306 HA ASP 42 HA ASP 42 -7.592 6.186 -16.218 307 HB2 ASP 42 1HB ASP 42 -5.301 6.350 -16.818 308 HB3 ASP 42 2HB ASP 42 -5.690 6.773 -18.483 309 H GLN 43 H GLN 43 -8.348 6.293 -19.619 310 HA GLN 43 HA GLN 43 -9.683 8.862 -19.402 311 HB2 GLN 43 1HB GLN 43 -9.195 6.940 -21.662 312 HB3 GLN 43 2HB GLN 43 -10.315 8.284 -21.836 313 HG2 GLN 43 1HG GLN 43 -7.749 9.099 -20.747 314 HG3 GLN 43 2HG GLN 43 -7.613 8.339 -22.332 315 HE21 GLN 43 2HE2 GLN 43 -9.081 9.184 -24.017 316 HE22 GLN 43 1HE2 GLN 43 -9.412 10.879 -24.028 317 H LEU 44 H LEU 44 -10.517 5.455 -19.794 318 HA LEU 44 HA LEU 44 -13.257 5.720 -20.235 319 HB2 LEU 44 1HB LEU 44 -12.116 3.613 -20.515 320 HB3 LEU 44 2HB LEU 44 -11.729 3.557 -18.796 321 HG LEU 44 HG LEU 44 -14.343 3.576 -18.531 322 HD11 LEU 44 1HD1 LEU 44 -15.326 2.183 -20.405 323 HD12 LEU 44 2HD1 LEU 44 -13.918 2.650 -21.358 324 HD13 LEU 44 3HD1 LEU 44 -15.028 3.884 -20.762 325 HD21 LEU 44 1HD2 LEU 44 -14.229 1.009 -18.889 326 HD22 LEU 44 2HD2 LEU 44 -13.220 1.756 -17.650 327 HD23 LEU 44 3HD2 LEU 44 -12.519 1.304 -19.205 328 H LEU 45 H LEU 45 -11.530 5.260 -17.153 329 HA LEU 45 HA LEU 45 -13.707 5.298 -15.444 330 HB2 LEU 45 1HB LEU 45 -10.888 5.446 -15.223 331 HB3 LEU 45 2HB LEU 45 -11.565 6.732 -14.226 332 HG LEU 45 HG LEU 45 -12.829 5.131 -12.939 333 HD11 LEU 45 1HD1 LEU 45 -12.152 2.631 -13.479 334 HD12 LEU 45 2HD1 LEU 45 -11.997 3.285 -15.109 335 HD13 LEU 45 3HD1 LEU 45 -13.533 3.410 -14.251 336 HD21 LEU 45 1HD2 LEU 45 -10.929 5.130 -11.765 337 HD22 LEU 45 2HD2 LEU 45 -9.929 4.997 -13.211 338 HD23 LEU 45 3HD2 LEU 45 -10.632 3.549 -12.489 339 H ARG 46 H ARG 46 -12.174 7.916 -17.139 340 HA ARG 46 HA ARG 46 -13.955 9.824 -15.771 341 HB2 ARG 46 1HB ARG 46 -12.377 11.568 -16.256 342 HB3 ARG 46 2HB ARG 46 -11.509 10.241 -15.497 343 HG2 ARG 46 1HG ARG 46 -10.710 9.507 -17.685 344 HG3 ARG 46 2HG ARG 46 -11.584 10.838 -18.447 345 HD2 ARG 46 1HD ARG 46 -9.973 11.879 -16.337 346 HD3 ARG 46 2HD ARG 46 -8.973 10.843 -17.354 347 HE ARG 46 HE ARG 46 -10.326 12.394 -19.130 348 HH11 ARG 46 1HH1 ARG 46 -8.325 13.052 -16.358 349 HH12 ARG 46 2HH1 ARG 46 -7.743 14.563 -16.974 350 HH21 ARG 46 1HH2 ARG 46 -9.567 14.382 -19.951 351 HH22 ARG 46 2HH2 ARG 46 -8.451 15.319 -19.017 352 H ILE 47 H ILE 47 -14.615 8.087 -18.039 353 HA ILE 47 HA ILE 47 -14.623 9.644 -20.426 354 HB ILE 47 HB ILE 47 -14.795 7.164 -20.407 355 HG12 ILE 47 1HG1 ILE 47 -17.182 7.512 -21.869 356 HG13 ILE 47 2HG1 ILE 47 -16.312 9.038 -21.982 357 HG21 ILE 47 1HG2 ILE 47 -16.664 6.012 -19.678 358 HG22 ILE 47 2HG2 ILE 47 -16.503 7.276 -18.460 359 HG23 ILE 47 3HG2 ILE 47 -17.697 7.439 -19.747 360 HD11 ILE 47 1HD1 ILE 47 -15.903 6.739 -23.492 361 HD12 ILE 47 2HD1 ILE 47 -14.896 8.186 -23.450 362 HD13 ILE 47 3HD1 ILE 47 -14.528 6.825 -22.392 363 H THR 48 H THR 48 -16.097 11.044 -21.204 364 HA THR 48 HA THR 48 -18.566 11.447 -19.646 365 HB THR 48 HB THR 48 -16.941 13.256 -19.185 366 HG1 THR 48 HG1 THR 48 -18.969 14.405 -20.771 367 HG21 THR 48 1HG2 THR 48 -15.818 13.188 -21.405 368 HG22 THR 48 2HG2 THR 48 -16.288 14.813 -20.906 369 HG23 THR 48 3HG2 THR 48 -17.246 13.948 -22.107 370 H HIS 49 H HIS 49 -20.203 12.773 -20.921 371 HA HIS 49 HA HIS 49 -20.998 11.412 -23.189 372 HB2 HIS 49 1HB HIS 49 -21.711 14.039 -21.981 373 HB3 HIS 49 2HB HIS 49 -22.257 13.723 -23.625 374 HD1 HIS 49 HD1 HIS 49 -22.722 12.572 -20.091 375 HD2 HIS 49 HD2 HIS 49 -24.295 11.838 -23.865 376 HE1 HIS 49 HE1 HIS 49 -24.796 11.205 -19.700 377 H GLN 50 H GLN 50 -19.008 14.309 -22.925 378 HA GLN 50 HA GLN 50 -18.944 15.003 -25.641 379 HB2 GLN 50 1HB GLN 50 -17.829 15.985 -23.298 380 HB3 GLN 50 2HB GLN 50 -16.432 15.508 -24.253 381 HG2 GLN 50 1HG GLN 50 -16.823 17.758 -24.775 382 HG3 GLN 50 2HG GLN 50 -17.434 16.839 -26.150 383 HE21 GLN 50 2HE2 GLN 50 -18.983 18.155 -26.896 384 HE22 GLN 50 1HE2 GLN 50 -20.352 18.682 -25.984 385 H GLU 51 H GLU 51 -16.832 12.886 -23.735 386 HA GLU 51 HA GLU 51 -15.011 12.298 -25.804 387 HB2 GLU 51 1HB GLU 51 -15.709 11.077 -23.178 388 HB3 GLU 51 2HB GLU 51 -14.774 10.109 -24.310 389 HG2 GLU 51 1HG GLU 51 -13.466 12.516 -24.359 390 HG3 GLU 51 2HG GLU 51 -13.971 12.379 -22.676 391 H LEU 52 H LEU 52 -17.845 10.505 -24.612 392 HA LEU 52 HA LEU 52 -17.715 8.334 -26.335 393 HB2 LEU 52 1HB LEU 52 -20.045 9.737 -25.059 394 HB3 LEU 52 2HB LEU 52 -20.248 8.289 -26.043 395 HG LEU 52 HG LEU 52 -18.661 8.481 -23.483 396 HD11 LEU 52 1HD1 LEU 52 -20.908 6.646 -23.581 397 HD12 LEU 52 2HD1 LEU 52 -21.394 8.326 -23.804 398 HD13 LEU 52 3HD1 LEU 52 -20.484 7.856 -22.369 399 HD21 LEU 52 1HD2 LEU 52 -18.671 5.961 -23.729 400 HD22 LEU 52 2HD2 LEU 52 -17.611 6.849 -24.825 401 HD23 LEU 52 3HD2 LEU 52 -19.155 6.222 -25.405 402 H GLU 53 H GLU 53 -19.153 11.523 -26.835 403 HA GLU 53 HA GLU 53 -20.401 10.997 -29.294 404 HB2 GLU 53 1HB GLU 53 -20.380 13.114 -27.647 405 HB3 GLU 53 2HB GLU 53 -19.235 13.692 -28.850 406 HG2 GLU 53 1HG GLU 53 -21.007 13.088 -30.579 407 HG3 GLU 53 2HG GLU 53 -22.117 12.960 -29.216 408 H ASP 54 H ASP 54 -17.108 11.927 -28.488 409 HA ASP 54 HA ASP 54 -16.223 12.537 -31.089 410 HB2 ASP 54 1HB ASP 54 -15.013 13.075 -28.953 411 HB3 ASP 54 2HB ASP 54 -14.555 11.377 -28.851 412 H LEU 55 H LEU 55 -16.124 9.510 -29.234 413 HA LEU 55 HA LEU 55 -14.780 7.959 -31.137 414 HB2 LEU 55 1HB LEU 55 -16.835 7.122 -29.097 415 HB3 LEU 55 2HB LEU 55 -15.778 6.022 -29.979 416 HG LEU 55 HG LEU 55 -14.360 8.120 -28.503 417 HD11 LEU 55 1HD1 LEU 55 -16.411 6.502 -27.180 418 HD12 LEU 55 2HD1 LEU 55 -15.599 7.972 -26.644 419 HD13 LEU 55 3HD1 LEU 55 -14.813 6.407 -26.440 420 HD21 LEU 55 1HD2 LEU 55 -13.874 5.573 -29.563 421 HD22 LEU 55 2HD2 LEU 55 -13.734 5.404 -27.813 422 HD23 LEU 55 3HD2 LEU 55 -12.754 6.597 -28.666 423 H GLY 56 H GLY 56 -18.096 8.990 -30.937 424 HA2 GLY 56 1HA GLY 56 -19.075 8.975 -33.299 425 HA3 GLY 56 2HA GLY 56 -18.782 7.245 -33.213 426 H VAL 57 H VAL 57 -19.500 7.489 -30.233 427 HA VAL 57 HA VAL 57 -22.167 6.618 -30.464 428 HB VAL 57 HB VAL 57 -20.859 7.678 -27.958 429 HG11 VAL 57 1HG1 VAL 57 -22.443 6.455 -26.756 430 HG12 VAL 57 2HG1 VAL 57 -23.375 7.176 -28.070 431 HG13 VAL 57 3HG1 VAL 57 -22.892 5.481 -28.157 432 HG21 VAL 57 1HG2 VAL 57 -19.396 6.012 -28.090 433 HG22 VAL 57 2HG2 VAL 57 -20.738 4.871 -28.012 434 HG23 VAL 57 3HG2 VAL 57 -20.139 5.422 -29.577 435 H SER 58 H SER 58 -23.450 8.123 -31.497 436 HA SER 58 HA SER 58 -23.662 10.808 -30.382 437 HB2 SER 58 1HB SER 58 -24.281 9.541 -32.941 438 HB3 SER 58 2HB SER 58 -25.571 10.603 -32.378 439 HG SER 58 HG SER 58 -23.198 11.256 -33.438 440 H ARG 59 H ARG 59 -25.423 7.803 -30.511 441 HA ARG 59 HA ARG 59 -27.965 8.715 -29.763 442 HB2 ARG 59 1HB ARG 59 -26.535 6.130 -29.751 443 HB3 ARG 59 2HB ARG 59 -27.879 6.256 -28.624 444 HG2 ARG 59 1HG ARG 59 -28.484 7.234 -31.312 445 HG3 ARG 59 2HG ARG 59 -28.079 5.518 -31.235 446 HD2 ARG 59 1HD ARG 59 -29.738 5.617 -29.164 447 HD3 ARG 59 2HD ARG 59 -30.377 6.991 -30.066 448 HE ARG 59 HE ARG 59 -30.231 5.043 -31.934 449 HH11 ARG 59 1HH1 ARG 59 -31.634 5.200 -28.752 450 HH12 ARG 59 2HH1 ARG 59 -32.898 4.071 -29.111 451 HH21 ARG 59 1HH2 ARG 59 -31.891 3.555 -32.419 452 HH22 ARG 59 2HH2 ARG 59 -33.042 3.135 -31.197 453 H ILE 60 H ILE 60 -29.023 8.273 -27.636 454 HA ILE 60 HA ILE 60 -27.283 9.241 -25.482 455 HB ILE 60 HB ILE 60 -30.299 9.210 -25.648 456 HG12 ILE 60 1HG1 ILE 60 -29.244 10.792 -27.217 457 HG13 ILE 60 2HG1 ILE 60 -30.107 11.631 -25.933 458 HG21 ILE 60 1HG2 ILE 60 -28.499 9.558 -23.434 459 HG22 ILE 60 2HG2 ILE 60 -29.432 11.028 -23.709 460 HG23 ILE 60 3HG2 ILE 60 -30.261 9.494 -23.445 461 HD11 ILE 60 1HD1 ILE 60 -28.277 12.773 -25.475 462 HD12 ILE 60 2HD1 ILE 60 -27.439 11.273 -25.075 463 HD13 ILE 60 3HD1 ILE 60 -27.400 11.893 -26.726 464 H GLY 61 H GLY 61 -29.934 6.908 -25.998 465 HA2 GLY 61 1HA GLY 61 -29.812 5.633 -23.527 466 HA3 GLY 61 2HA GLY 61 -30.368 4.881 -25.014 467 H HIS 62 H HIS 62 -27.636 5.426 -26.206 468 HA HIS 62 HA HIS 62 -26.437 2.951 -25.271 469 HB2 HIS 62 1HB HIS 62 -25.571 4.784 -27.516 470 HB3 HIS 62 2HB HIS 62 -24.964 3.160 -27.207 471 HD1 HIS 62 HD1 HIS 62 -26.456 4.168 -29.845 472 HD2 HIS 62 HD2 HIS 62 -28.106 1.911 -26.772 473 HE1 HIS 62 HE1 HIS 62 -28.410 2.963 -30.871 474 H GLN 63 H GLN 63 -25.662 6.392 -25.435 475 HA GLN 63 HA GLN 63 -23.014 6.288 -24.574 476 HB2 GLN 63 1HB GLN 63 -25.162 8.342 -24.550 477 HB3 GLN 63 2HB GLN 63 -23.768 8.628 -23.516 478 HG2 GLN 63 1HG GLN 63 -22.343 8.215 -25.571 479 HG3 GLN 63 2HG GLN 63 -23.838 8.326 -26.499 480 HE21 GLN 63 2HE2 GLN 63 -24.616 10.276 -27.008 481 HE22 GLN 63 1HE2 GLN 63 -23.956 11.778 -26.467 482 H GLU 64 H GLU 64 -26.017 6.204 -22.747 483 HA GLU 64 HA GLU 64 -24.667 6.352 -20.198 484 HB2 GLU 64 1HB GLU 64 -27.525 5.995 -21.049 485 HB3 GLU 64 2HB GLU 64 -27.047 5.736 -19.377 486 HG2 GLU 64 1HG GLU 64 -26.277 8.271 -20.737 487 HG3 GLU 64 2HG GLU 64 -27.931 8.058 -20.166 488 H LEU 65 H LEU 65 -25.906 3.889 -22.331 489 HA LEU 65 HA LEU 65 -26.150 1.725 -20.626 490 HB2 LEU 65 1HB LEU 65 -25.634 2.112 -23.492 491 HB3 LEU 65 2HB LEU 65 -25.101 0.561 -22.846 492 HG LEU 65 HG LEU 65 -27.911 1.620 -22.578 493 HD11 LEU 65 1HD1 LEU 65 -26.666 -0.167 -24.649 494 HD12 LEU 65 2HD1 LEU 65 -27.598 1.310 -24.893 495 HD13 LEU 65 3HD1 LEU 65 -28.398 -0.152 -24.316 496 HD21 LEU 65 1HD2 LEU 65 -26.470 -0.661 -21.512 497 HD22 LEU 65 2HD2 LEU 65 -27.897 -1.141 -22.430 498 HD23 LEU 65 3HD2 LEU 65 -28.055 -0.020 -21.078 499 H ILE 66 H ILE 66 -23.242 2.970 -22.225 500 HA ILE 66 HA ILE 66 -21.518 0.943 -21.207 501 HB ILE 66 HB ILE 66 -20.760 3.690 -22.203 502 HG12 ILE 66 1HG1 ILE 66 -20.908 1.098 -23.754 503 HG13 ILE 66 2HG1 ILE 66 -22.133 2.360 -23.819 504 HG21 ILE 66 1HG2 ILE 66 -19.171 1.141 -21.942 505 HG22 ILE 66 2HG2 ILE 66 -18.598 2.623 -22.705 506 HG23 ILE 66 3HG2 ILE 66 -18.972 2.607 -20.982 507 HD11 ILE 66 1HD1 ILE 66 -19.531 2.197 -25.125 508 HD12 ILE 66 2HD1 ILE 66 -20.978 3.100 -25.574 509 HD13 ILE 66 3HD1 ILE 66 -19.865 3.757 -24.375 510 H LEU 67 H LEU 67 -22.251 4.269 -20.229 511 HA LEU 67 HA LEU 67 -20.384 4.510 -18.170 512 HB2 LEU 67 1HB LEU 67 -23.141 5.713 -18.364 513 HB3 LEU 67 2HB LEU 67 -21.873 6.244 -17.261 514 HG LEU 67 HG LEU 67 -21.537 6.311 -20.250 515 HD11 LEU 67 1HD1 LEU 67 -23.511 7.691 -19.098 516 HD12 LEU 67 2HD1 LEU 67 -22.551 8.326 -20.434 517 HD13 LEU 67 3HD1 LEU 67 -22.173 8.795 -18.777 518 HD21 LEU 67 1HD2 LEU 67 -20.221 8.077 -18.222 519 HD22 LEU 67 2HD2 LEU 67 -19.684 7.645 -19.845 520 HD23 LEU 67 3HD2 LEU 67 -19.598 6.458 -18.542 521 H GLU 68 H GLU 68 -23.771 3.426 -18.027 522 HA GLU 68 HA GLU 68 -23.980 2.970 -15.311 523 HB2 GLU 68 1HB GLU 68 -25.844 2.800 -16.948 524 HB3 GLU 68 2HB GLU 68 -25.186 1.265 -17.496 525 HG2 GLU 68 1HG GLU 68 -25.465 0.402 -15.174 526 HG3 GLU 68 2HG GLU 68 -26.301 1.902 -14.777 527 H ALA 69 H ALA 69 -22.327 1.098 -17.740 528 HA ALA 69 HA ALA 69 -21.963 -1.209 -16.047 529 HB1 ALA 69 1HB ALA 69 -20.713 -2.144 -17.853 530 HB2 ALA 69 2HB ALA 69 -22.122 -1.332 -18.537 531 HB3 ALA 69 3HB ALA 69 -20.536 -0.566 -18.621 532 H VAL 70 H VAL 70 -20.168 1.670 -16.905 533 HA VAL 70 HA VAL 70 -17.640 0.848 -15.935 534 HB VAL 70 HB VAL 70 -18.762 3.642 -16.187 535 HG11 VAL 70 1HG1 VAL 70 -16.056 2.586 -15.509 536 HG12 VAL 70 2HG1 VAL 70 -16.193 4.081 -16.438 537 HG13 VAL 70 3HG1 VAL 70 -16.927 3.964 -14.838 538 HG21 VAL 70 1HG2 VAL 70 -17.600 1.729 -18.109 539 HG22 VAL 70 2HG2 VAL 70 -18.749 3.041 -18.367 540 HG23 VAL 70 3HG2 VAL 70 -17.027 3.393 -18.225 541 H ASP 71 H ASP 71 -20.420 2.381 -14.421 542 HA ASP 71 HA ASP 71 -19.302 3.224 -12.030 543 HB2 ASP 71 1HB ASP 71 -21.770 3.340 -13.003 544 HB3 ASP 71 2HB ASP 71 -21.994 1.939 -11.959 545 H LEU 72 H LEU 72 -20.058 0.008 -13.117 546 HA LEU 72 HA LEU 72 -19.855 -1.199 -10.514 547 HB2 LEU 72 1HB LEU 72 -20.029 -2.274 -13.311 548 HB3 LEU 72 2HB LEU 72 -19.743 -3.331 -11.930 549 HG LEU 72 HG LEU 72 -22.101 -1.519 -11.842 550 HD11 LEU 72 1HD1 LEU 72 -21.751 -3.810 -13.716 551 HD12 LEU 72 2HD1 LEU 72 -22.591 -2.278 -13.952 552 HD13 LEU 72 3HD1 LEU 72 -23.322 -3.540 -12.960 553 HD21 LEU 72 1HD2 LEU 72 -21.084 -3.518 -10.240 554 HD22 LEU 72 2HD2 LEU 72 -22.388 -4.320 -11.116 555 HD23 LEU 72 3HD2 LEU 72 -22.721 -2.865 -10.175 556 H LEU 73 H LEU 73 -17.711 -0.513 -13.177 557 HA LEU 73 HA LEU 73 -15.611 -2.264 -12.443 558 HB2 LEU 73 1HB LEU 73 -15.993 -0.013 -14.291 559 HB3 LEU 73 2HB LEU 73 -14.340 -0.231 -13.720 560 HG LEU 73 HG LEU 73 -15.963 -2.397 -15.050 561 HD11 LEU 73 1HD1 LEU 73 -14.100 -0.338 -16.176 562 HD12 LEU 73 2HD1 LEU 73 -15.693 -0.829 -16.750 563 HD13 LEU 73 3HD1 LEU 73 -14.312 -1.907 -16.954 564 HD21 LEU 73 1HD2 LEU 73 -14.207 -3.755 -14.751 565 HD22 LEU 73 2HD2 LEU 73 -13.742 -2.621 -13.482 566 HD23 LEU 73 3HD2 LEU 73 -13.038 -2.480 -15.094 567 H CYS 74 H CYS 74 -16.503 0.975 -11.461 568 HA CYS 74 HA CYS 74 -14.039 1.371 -9.985 569 HB2 CYS 74 1HB CYS 74 -15.537 3.161 -11.202 570 HB3 CYS 74 2HB CYS 74 -16.429 3.148 -9.686 571 HG CYS 74 HG CYS 74 -14.915 4.880 -8.570 572 H ALA 75 H ALA 75 -17.417 0.620 -9.343 573 HA ALA 75 HA ALA 75 -17.291 0.860 -6.525 574 HB1 ALA 75 1HB ALA 75 -19.188 -0.360 -8.464 575 HB2 ALA 75 2HB ALA 75 -19.327 -0.795 -6.760 576 HB3 ALA 75 3HB ALA 75 -19.458 0.893 -7.252 577 H LEU 76 H LEU 76 -16.356 -1.637 -8.742 578 HA LEU 76 HA LEU 76 -16.232 -3.706 -6.731 579 HB2 LEU 76 1HB LEU 76 -15.746 -3.495 -9.636 580 HB3 LEU 76 2HB LEU 76 -14.810 -4.717 -8.778 581 HG LEU 76 HG LEU 76 -17.761 -4.649 -8.378 582 HD11 LEU 76 1HD1 LEU 76 -18.252 -5.788 -10.361 583 HD12 LEU 76 2HD1 LEU 76 -16.551 -6.072 -10.726 584 HD13 LEU 76 3HD1 LEU 76 -17.223 -4.448 -10.866 585 HD21 LEU 76 1HD2 LEU 76 -16.583 -6.222 -7.062 586 HD22 LEU 76 2HD2 LEU 76 -15.611 -6.753 -8.434 587 HD23 LEU 76 3HD2 LEU 76 -17.332 -7.137 -8.370 588 H ASN 77 H ASN 77 -14.098 -1.349 -8.139 589 HA ASN 77 HA ASN 77 -11.660 -2.562 -7.276 590 HB2 ASN 77 1HB ASN 77 -12.462 0.022 -8.498 591 HB3 ASN 77 2HB ASN 77 -10.952 0.014 -7.591 592 HD21 ASN 77 2HD2 ASN 77 -12.469 -2.470 -9.605 593 HD22 ASN 77 1HD2 ASN 77 -11.153 -2.620 -10.714 594 H SER 78 H SER 78 -13.524 0.240 -6.100 595 HA SER 78 HA SER 78 -11.978 0.888 -3.905 596 HB2 SER 78 1HB SER 78 -14.866 1.218 -4.580 597 HB3 SER 78 2HB SER 78 -14.359 1.548 -2.923 598 HG SER 78 HG SER 78 -14.213 3.429 -4.154 599 H GLY 79 H GLY 79 -14.437 -1.614 -4.231 600 HA2 GLY 79 1HA GLY 79 -14.676 -2.308 -1.519 601 HA3 GLY 79 2HA GLY 79 -15.014 -3.373 -2.875 602 HA PRO 80 HA PRO 80 -11.357 -5.004 -0.482 603 HB2 PRO 80 1HB PRO 80 -12.359 -7.506 -0.155 604 HB3 PRO 80 2HB PRO 80 -12.682 -6.186 0.976 605 HG2 PRO 80 1HG PRO 80 -14.397 -7.248 -1.236 606 HG3 PRO 80 2HG PRO 80 -14.858 -6.777 0.410 607 HD2 PRO 80 1HD PRO 80 -15.257 -5.168 -1.731 608 HD3 PRO 80 2HD PRO 80 -14.908 -4.532 -0.111 609 H SER 81 H SER 81 -9.722 -5.555 -1.766 610 HA SER 81 HA SER 81 -10.276 -7.226 -4.126 611 HB2 SER 81 1HB SER 81 -8.021 -5.264 -3.641 612 HB3 SER 81 2HB SER 81 -8.209 -6.252 -5.089 613 HG SER 81 HG SER 81 -9.209 -3.895 -4.707 614 H SER 82 H SER 82 -8.918 -8.954 -4.620 615 HA SER 82 HA SER 82 -7.593 -10.755 -4.199 616 HB2 SER 82 1HB SER 82 -5.873 -8.885 -3.961 617 HB3 SER 82 2HB SER 82 -6.092 -9.040 -2.218 618 HG SER 82 HG SER 82 -4.589 -10.506 -2.458 619 H GLY 83 H GLY 83 -6.489 -11.909 -2.065 620 HA2 GLY 83 1HA GLY 83 -8.794 -12.274 -0.276 621 HA3 GLY 83 2HA GLY 83 -7.522 -13.454 -0.561 Start of MODEL 2 1 H1 GLY 1 H GLY 1 -4.498 11.624 -7.508 2 HA2 GLY 1 1HA GLY 1 -3.908 12.788 -4.863 3 HA3 GLY 1 2HA GLY 1 -5.374 11.908 -5.269 4 H SER 2 H SER 2 -4.666 9.606 -6.288 5 HA SER 2 HA SER 2 -2.940 8.394 -4.232 6 HB2 SER 2 1HB SER 2 -4.643 6.512 -5.645 7 HB3 SER 2 2HB SER 2 -4.507 6.816 -3.913 8 HG SER 2 HG SER 2 -5.862 8.710 -4.335 9 H SER 3 H SER 3 -1.554 6.670 -4.835 10 HA SER 3 HA SER 3 -0.916 6.595 -7.712 11 HB2 SER 3 1HB SER 3 1.048 6.373 -5.419 12 HB3 SER 3 2HB SER 3 1.441 6.376 -7.138 13 HG SER 3 HG SER 3 1.751 8.439 -6.394 14 H GLY 4 H GLY 4 -1.652 4.690 -8.424 15 HA2 GLY 4 1HA GLY 4 -1.702 2.406 -8.727 16 HA3 GLY 4 2HA GLY 4 -0.460 2.268 -7.492 17 H SER 5 H SER 5 -3.892 3.237 -7.639 18 HA SER 5 HA SER 5 -4.361 1.492 -5.309 19 HB2 SER 5 1HB SER 5 -4.599 3.849 -4.696 20 HB3 SER 5 2HB SER 5 -5.749 4.091 -6.011 21 HG SER 5 HG SER 5 -7.177 3.568 -4.564 22 H SER 6 H SER 6 -5.684 2.779 -8.317 23 HA SER 6 HA SER 6 -7.684 0.616 -8.301 24 HB2 SER 6 1HB SER 6 -8.984 2.515 -8.483 25 HB3 SER 6 2HB SER 6 -7.738 3.414 -9.348 26 HG SER 6 HG SER 6 -9.802 2.196 -10.386 27 H GLY 7 H GLY 7 -7.707 -0.851 -9.916 28 HA2 GLY 7 1HA GLY 7 -5.434 -0.934 -11.687 29 HA3 GLY 7 2HA GLY 7 -6.699 -2.146 -11.553 30 H VAL 8 H VAL 8 -8.921 -0.468 -12.046 31 HA VAL 8 HA VAL 8 -9.063 -0.566 -14.833 32 HB VAL 8 HB VAL 8 -10.740 1.194 -13.042 33 HG11 VAL 8 1HG1 VAL 8 -12.437 0.951 -14.762 34 HG12 VAL 8 2HG1 VAL 8 -10.959 1.626 -15.452 35 HG13 VAL 8 3HG1 VAL 8 -11.358 -0.073 -15.709 36 HG21 VAL 8 1HG2 VAL 8 -11.248 -0.754 -12.031 37 HG22 VAL 8 2HG2 VAL 8 -12.243 -1.018 -13.463 38 HG23 VAL 8 3HG2 VAL 8 -10.632 -1.728 -13.366 39 H SER 9 H SER 9 -7.849 1.887 -12.717 40 HA SER 9 HA SER 9 -8.023 4.062 -14.556 41 HB2 SER 9 1HB SER 9 -6.671 5.283 -12.976 42 HB3 SER 9 2HB SER 9 -7.827 4.311 -12.065 43 HG SER 9 HG SER 9 -6.238 3.193 -11.248 44 H LYS 10 H LYS 10 -5.723 1.522 -13.955 45 HA LYS 10 HA LYS 10 -3.823 2.748 -15.832 46 HB2 LYS 10 1HB LYS 10 -3.392 0.369 -14.019 47 HB3 LYS 10 2HB LYS 10 -2.167 1.212 -14.957 48 HG2 LYS 10 1HG LYS 10 -3.454 3.129 -13.323 49 HG3 LYS 10 2HG LYS 10 -3.060 1.735 -12.314 50 HD2 LYS 10 1HD LYS 10 -0.754 1.927 -13.617 51 HD3 LYS 10 2HD LYS 10 -1.266 3.611 -13.761 52 HE2 LYS 10 1HE LYS 10 -1.725 3.407 -11.209 53 HE3 LYS 10 2HE LYS 10 -0.645 2.018 -11.306 54 HZ1 LYS 10 1HZ LYS 10 1.080 3.426 -12.179 55 HZ2 LYS 10 2HZ LYS 10 0.515 4.082 -10.727 56 HZ3 LYS 10 3HZ LYS 10 0.045 4.764 -12.202 57 H TRP 11 H TRP 11 -6.379 1.314 -16.481 58 HA TRP 11 HA TRP 11 -5.669 -1.195 -17.639 59 HB2 TRP 11 1HB TRP 11 -8.064 0.506 -17.490 60 HB3 TRP 11 2HB TRP 11 -7.937 -0.440 -18.971 61 HD1 TRP 11 HD1 TRP 11 -6.608 -1.903 -15.711 62 HE1 TRP 11 HE1 TRP 11 -8.099 -3.886 -15.023 63 HE3 TRP 11 HE3 TRP 11 -10.343 -1.347 -19.158 64 HZ2 TRP 11 HZ2 TRP 11 -10.535 -5.059 -15.834 65 HZ3 TRP 11 HZ3 TRP 11 -12.217 -2.942 -19.134 66 HH2 TRP 11 HH2 TRP 11 -12.308 -4.759 -17.506 67 H SER 12 H SER 12 -4.798 -1.632 -19.564 68 HA SER 12 HA SER 12 -3.659 0.358 -21.169 69 HB2 SER 12 1HB SER 12 -4.192 -2.135 -22.598 70 HB3 SER 12 2HB SER 12 -2.652 -1.381 -22.189 71 HG SER 12 HG SER 12 -2.488 -2.888 -20.747 72 HA PRO 13 HA PRO 13 -6.781 1.666 -23.958 73 HB2 PRO 13 1HB PRO 13 -5.437 1.831 -26.311 74 HB3 PRO 13 2HB PRO 13 -5.189 2.970 -24.982 75 HG2 PRO 13 1HG PRO 13 -3.554 0.588 -25.766 76 HG3 PRO 13 2HG PRO 13 -3.013 2.202 -25.269 77 HD2 PRO 13 1HD PRO 13 -3.019 0.084 -23.582 78 HD3 PRO 13 2HD PRO 13 -3.302 1.747 -23.028 79 H SER 14 H SER 14 -5.097 -1.294 -24.609 80 HA SER 14 HA SER 14 -7.004 -2.084 -26.674 81 HB2 SER 14 1HB SER 14 -4.334 -2.582 -26.422 82 HB3 SER 14 2HB SER 14 -5.019 -4.062 -25.750 83 HG SER 14 HG SER 14 -6.252 -4.246 -27.693 84 H GLN 15 H GLN 15 -6.297 -2.600 -23.324 85 HA GLN 15 HA GLN 15 -7.673 -5.043 -22.965 86 HB2 GLN 15 1HB GLN 15 -6.811 -2.833 -21.132 87 HB3 GLN 15 2HB GLN 15 -7.844 -4.123 -20.530 88 HG2 GLN 15 1HG GLN 15 -5.504 -5.046 -22.024 89 HG3 GLN 15 2HG GLN 15 -5.130 -4.167 -20.543 90 HE21 GLN 15 2HE2 GLN 15 -4.313 -6.058 -19.604 91 HE22 GLN 15 1HE2 GLN 15 -5.358 -7.303 -19.018 92 H VAL 16 H VAL 16 -8.678 -1.662 -22.560 93 HA VAL 16 HA VAL 16 -11.228 -2.031 -21.574 94 HB VAL 16 HB VAL 16 -10.347 0.060 -23.569 95 HG11 VAL 16 1HG1 VAL 16 -12.688 0.128 -23.570 96 HG12 VAL 16 2HG1 VAL 16 -12.786 -0.189 -21.837 97 HG13 VAL 16 3HG1 VAL 16 -12.211 1.374 -22.417 98 HG21 VAL 16 1HG2 VAL 16 -9.092 0.854 -21.916 99 HG22 VAL 16 2HG2 VAL 16 -10.569 1.146 -20.996 100 HG23 VAL 16 3HG2 VAL 16 -9.695 -0.374 -20.803 101 H VAL 17 H VAL 17 -10.076 -2.320 -24.885 102 HA VAL 17 HA VAL 17 -12.551 -2.434 -26.195 103 HB VAL 17 HB VAL 17 -10.063 -3.941 -27.002 104 HG11 VAL 17 1HG1 VAL 17 -11.005 -4.247 -29.030 105 HG12 VAL 17 2HG1 VAL 17 -12.508 -4.079 -28.121 106 HG13 VAL 17 3HG1 VAL 17 -11.845 -2.697 -28.994 107 HG21 VAL 17 1HG2 VAL 17 -10.568 -1.086 -26.822 108 HG22 VAL 17 2HG2 VAL 17 -9.057 -1.950 -27.107 109 HG23 VAL 17 3HG2 VAL 17 -10.136 -1.592 -28.455 110 H ASP 18 H ASP 18 -10.694 -4.893 -24.509 111 HA ASP 18 HA ASP 18 -12.245 -7.111 -25.388 112 HB2 ASP 18 1HB ASP 18 -9.889 -7.136 -24.371 113 HB3 ASP 18 2HB ASP 18 -10.691 -7.005 -22.809 114 H TRP 19 H TRP 19 -12.612 -4.742 -22.885 115 HA TRP 19 HA TRP 19 -14.434 -6.190 -21.254 116 HB2 TRP 19 1HB TRP 19 -13.250 -4.303 -20.326 117 HB3 TRP 19 2HB TRP 19 -13.926 -3.224 -21.543 118 HD1 TRP 19 HD1 TRP 19 -15.470 -5.620 -18.888 119 HE1 TRP 19 HE1 TRP 19 -17.398 -4.366 -17.732 120 HE3 TRP 19 HE3 TRP 19 -15.196 -1.191 -21.427 121 HZ2 TRP 19 HZ2 TRP 19 -18.639 -1.835 -17.879 122 HZ3 TRP 19 HZ3 TRP 19 -16.790 0.595 -20.859 123 HH2 TRP 19 HH2 TRP 19 -18.476 0.277 -19.122 124 H MET 20 H MET 20 -14.848 -3.833 -23.871 125 HA MET 20 HA MET 20 -17.639 -3.625 -23.745 126 HB2 MET 20 1HB MET 20 -15.984 -3.438 -26.262 127 HB3 MET 20 2HB MET 20 -17.529 -2.662 -25.936 128 HG2 MET 20 1HG MET 20 -16.419 -1.345 -24.146 129 HG3 MET 20 2HG MET 20 -14.882 -2.041 -24.652 130 HE1 MET 20 1HE MET 20 -18.039 -0.473 -25.790 131 HE2 MET 20 2HE MET 20 -17.559 0.938 -26.732 132 HE3 MET 20 3HE MET 20 -17.702 -0.637 -27.514 133 H LYS 21 H LYS 21 -15.594 -6.129 -24.948 134 HA LYS 21 HA LYS 21 -17.378 -7.349 -26.765 135 HB2 LYS 21 1HB LYS 21 -15.147 -8.568 -25.127 136 HB3 LYS 21 2HB LYS 21 -15.958 -9.359 -26.473 137 HG2 LYS 21 1HG LYS 21 -15.204 -7.154 -27.734 138 HG3 LYS 21 2HG LYS 21 -13.966 -7.165 -26.476 139 HD2 LYS 21 1HD LYS 21 -13.142 -9.262 -27.158 140 HD3 LYS 21 2HD LYS 21 -14.573 -9.596 -28.137 141 HE2 LYS 21 1HE LYS 21 -13.943 -7.841 -29.693 142 HE3 LYS 21 2HE LYS 21 -12.553 -7.425 -28.693 143 HZ1 LYS 21 1HZ LYS 21 -12.263 -10.094 -29.161 144 HZ2 LYS 21 2HZ LYS 21 -11.429 -8.852 -29.950 145 HZ3 LYS 21 3HZ LYS 21 -12.832 -9.500 -30.640 146 H GLY 22 H GLY 22 -17.444 -7.098 -23.385 147 HA2 GLY 22 1HA GLY 22 -19.338 -9.361 -23.219 148 HA3 GLY 22 2HA GLY 22 -18.311 -8.856 -21.885 149 H LEU 23 H LEU 23 -19.897 -6.536 -23.949 150 HA LEU 23 HA LEU 23 -21.725 -5.889 -21.730 151 HB2 LEU 23 1HB LEU 23 -20.592 -3.950 -23.735 152 HB3 LEU 23 2HB LEU 23 -21.555 -3.569 -22.309 153 HG LEU 23 HG LEU 23 -18.717 -4.587 -22.364 154 HD11 LEU 23 1HD1 LEU 23 -18.087 -2.470 -21.588 155 HD12 LEU 23 2HD1 LEU 23 -19.747 -2.020 -21.200 156 HD13 LEU 23 3HD1 LEU 23 -19.239 -2.147 -22.884 157 HD21 LEU 23 1HD2 LEU 23 -20.746 -4.510 -20.219 158 HD22 LEU 23 2HD2 LEU 23 -19.137 -3.921 -19.800 159 HD23 LEU 23 3HD2 LEU 23 -19.343 -5.559 -20.421 160 H ASP 24 H ASP 24 -23.337 -4.060 -22.924 161 HA ASP 24 HA ASP 24 -25.250 -5.565 -24.223 162 HB2 ASP 24 1HB ASP 24 -25.145 -3.019 -23.280 163 HB3 ASP 24 2HB ASP 24 -25.159 -2.723 -25.017 164 H ASP 25 H ASP 25 -25.882 -5.838 -26.362 165 HA ASP 25 HA ASP 25 -23.814 -6.121 -28.252 166 HB2 ASP 25 1HB ASP 25 -26.753 -6.466 -28.228 167 HB3 ASP 25 2HB ASP 25 -26.025 -6.192 -29.809 168 H CYS 26 H CYS 26 -25.923 -3.487 -27.484 169 HA CYS 26 HA CYS 26 -25.678 -2.076 -29.941 170 HB2 CYS 26 1HB CYS 26 -26.256 -0.887 -27.225 171 HB3 CYS 26 2HB CYS 26 -26.698 -0.230 -28.796 172 HG CYS 26 HG CYS 26 -29.094 -1.051 -27.970 173 H LEU 27 H LEU 27 -23.648 -2.452 -27.185 174 HA LEU 27 HA LEU 27 -22.025 -0.125 -27.883 175 HB2 LEU 27 1HB LEU 27 -21.453 -2.075 -25.676 176 HB3 LEU 27 2HB LEU 27 -20.930 -0.398 -25.825 177 HG LEU 27 HG LEU 27 -23.751 -1.315 -25.266 178 HD11 LEU 27 1HD1 LEU 27 -23.140 -1.453 -23.141 179 HD12 LEU 27 2HD1 LEU 27 -22.695 0.253 -23.180 180 HD13 LEU 27 3HD1 LEU 27 -21.491 -0.981 -23.551 181 HD21 LEU 27 1HD2 LEU 27 -24.046 0.711 -26.318 182 HD22 LEU 27 2HD2 LEU 27 -22.504 1.354 -25.752 183 HD23 LEU 27 3HD2 LEU 27 -23.864 1.215 -24.638 184 H GLN 28 H GLN 28 -22.254 -2.676 -29.489 185 HA GLN 28 HA GLN 28 -19.539 -3.724 -29.331 186 HB2 GLN 28 1HB GLN 28 -21.873 -4.512 -31.083 187 HB3 GLN 28 2HB GLN 28 -20.311 -5.320 -31.066 188 HG2 GLN 28 1HG GLN 28 -22.157 -5.097 -28.700 189 HG3 GLN 28 2HG GLN 28 -22.038 -6.498 -29.763 190 HE21 GLN 28 2HE2 GLN 28 -21.355 -5.793 -26.832 191 HE22 GLN 28 1HE2 GLN 28 -19.795 -6.503 -26.617 192 H GLN 29 H GLN 29 -21.659 -2.132 -31.697 193 HA GLN 29 HA GLN 29 -19.862 -1.962 -33.810 194 HB2 GLN 29 1HB GLN 29 -21.268 -0.265 -34.718 195 HB3 GLN 29 2HB GLN 29 -22.312 -1.393 -33.862 196 HG2 GLN 29 1HG GLN 29 -22.054 0.262 -31.886 197 HG3 GLN 29 2HG GLN 29 -21.544 1.398 -33.134 198 HE21 GLN 29 2HE2 GLN 29 -24.100 0.468 -31.381 199 HE22 GLN 29 1HE2 GLN 29 -25.386 0.878 -32.459 200 H TYR 30 H TYR 30 -20.000 -0.171 -30.849 201 HA TYR 30 HA TYR 30 -18.363 2.010 -31.727 202 HB2 TYR 30 1HB TYR 30 -18.978 1.087 -28.913 203 HB3 TYR 30 2HB TYR 30 -18.297 2.645 -29.368 204 HD1 TYR 30 HD2 TYR 30 -19.988 3.347 -31.692 205 HD2 TYR 30 HD1 TYR 30 -21.034 1.622 -27.945 206 HE1 TYR 30 HE2 TYR 30 -22.254 4.280 -31.901 207 HE2 TYR 30 HE1 TYR 30 -23.303 2.549 -28.145 208 HH TYR 30 HH TYR 30 -24.759 3.343 -30.564 209 H ILE 31 H ILE 31 -17.804 -1.163 -30.461 210 HA ILE 31 HA ILE 31 -15.301 -0.954 -29.321 211 HB ILE 31 HB ILE 31 -16.275 -3.209 -31.079 212 HG12 ILE 31 1HG1 ILE 31 -16.505 -2.806 -28.089 213 HG13 ILE 31 2HG1 ILE 31 -17.829 -2.692 -29.243 214 HG21 ILE 31 1HG2 ILE 31 -13.781 -2.773 -29.786 215 HG22 ILE 31 2HG2 ILE 31 -14.612 -4.094 -28.966 216 HG23 ILE 31 3HG2 ILE 31 -14.317 -4.180 -30.703 217 HD11 ILE 31 1HD1 ILE 31 -16.302 -5.124 -28.389 218 HD12 ILE 31 2HD1 ILE 31 -18.033 -4.806 -28.272 219 HD13 ILE 31 3HD1 ILE 31 -17.295 -5.100 -29.846 220 H LYS 32 H LYS 32 -16.119 -1.337 -32.752 221 HA LYS 32 HA LYS 32 -13.540 -1.570 -33.775 222 HB2 LYS 32 1HB LYS 32 -16.015 -0.337 -34.989 223 HB3 LYS 32 2HB LYS 32 -14.533 -0.632 -35.889 224 HG2 LYS 32 1HG LYS 32 -14.888 -3.078 -34.924 225 HG3 LYS 32 2HG LYS 32 -16.569 -2.541 -34.898 226 HD2 LYS 32 1HD LYS 32 -16.068 -1.752 -37.330 227 HD3 LYS 32 2HD LYS 32 -14.725 -2.893 -37.226 228 HE2 LYS 32 1HE LYS 32 -16.838 -4.341 -36.234 229 HE3 LYS 32 2HE LYS 32 -17.589 -3.381 -37.508 230 HZ1 LYS 32 1HZ LYS 32 -15.110 -4.483 -38.364 231 HZ2 LYS 32 2HZ LYS 32 -16.646 -4.639 -39.053 232 HZ3 LYS 32 3HZ LYS 32 -16.156 -5.700 -37.830 233 H ASN 33 H ASN 33 -15.266 1.218 -32.617 234 HA ASN 33 HA ASN 33 -13.391 3.102 -33.762 235 HB2 ASN 33 1HB ASN 33 -15.739 3.425 -31.889 236 HB3 ASN 33 2HB ASN 33 -14.722 4.770 -32.399 237 HD21 ASN 33 2HD2 ASN 33 -17.429 4.723 -32.887 238 HD22 ASN 33 1HD2 ASN 33 -17.700 4.572 -34.587 239 H PHE 34 H PHE 34 -14.033 1.590 -30.660 240 HA PHE 34 HA PHE 34 -12.256 3.217 -29.147 241 HB2 PHE 34 1HB PHE 34 -13.748 0.681 -28.693 242 HB3 PHE 34 2HB PHE 34 -12.385 1.023 -27.633 243 HD1 PHE 34 HD2 PHE 34 -15.199 2.993 -29.102 244 HD2 PHE 34 HD1 PHE 34 -12.992 1.924 -25.623 245 HE1 PHE 34 HE2 PHE 34 -16.630 4.465 -27.746 246 HE2 PHE 34 HE1 PHE 34 -14.420 3.393 -24.261 247 HZ PHE 34 HZ PHE 34 -16.241 4.667 -25.323 248 H GLU 35 H GLU 35 -11.882 0.353 -31.091 249 HA GLU 35 HA GLU 35 -9.387 -0.504 -30.074 250 HB2 GLU 35 1HB GLU 35 -11.197 -1.376 -32.028 251 HB3 GLU 35 2HB GLU 35 -9.696 -1.073 -32.892 252 HG2 GLU 35 1HG GLU 35 -9.989 -2.827 -30.464 253 HG3 GLU 35 2HG GLU 35 -9.878 -3.388 -32.132 254 H ARG 36 H ARG 36 -10.294 1.737 -32.643 255 HA ARG 36 HA ARG 36 -7.535 2.206 -33.387 256 HB2 ARG 36 1HB ARG 36 -9.681 2.272 -34.898 257 HB3 ARG 36 2HB ARG 36 -9.808 3.923 -34.307 258 HG2 ARG 36 1HG ARG 36 -7.378 4.182 -35.078 259 HG3 ARG 36 2HG ARG 36 -7.654 2.691 -35.982 260 HD2 ARG 36 1HD ARG 36 -9.783 3.947 -36.828 261 HD3 ARG 36 2HD ARG 36 -8.894 5.385 -36.332 262 HE ARG 36 HE ARG 36 -7.106 4.032 -37.853 263 HH11 ARG 36 1HH1 ARG 36 -10.385 5.088 -38.358 264 HH12 ARG 36 2HH1 ARG 36 -10.195 5.287 -40.068 265 HH21 ARG 36 1HH2 ARG 36 -6.844 4.290 -40.104 266 HH22 ARG 36 2HH2 ARG 36 -8.181 4.832 -41.061 267 H GLU 37 H GLU 37 -10.011 3.703 -31.434 268 HA GLU 37 HA GLU 37 -8.675 6.219 -31.154 269 HB2 GLU 37 1HB GLU 37 -11.026 4.902 -29.854 270 HB3 GLU 37 2HB GLU 37 -10.316 6.324 -29.102 271 HG2 GLU 37 1HG GLU 37 -10.809 6.622 -31.965 272 HG3 GLU 37 2HG GLU 37 -12.263 6.345 -31.008 273 H LYS 38 H LYS 38 -8.392 3.135 -29.674 274 HA LYS 38 HA LYS 38 -7.091 2.319 -27.996 275 HB2 LYS 38 1HB LYS 38 -5.555 4.901 -28.341 276 HB3 LYS 38 2HB LYS 38 -4.964 3.429 -27.580 277 HG2 LYS 38 1HG LYS 38 -5.864 2.752 -30.178 278 HG3 LYS 38 2HG LYS 38 -4.850 4.191 -30.310 279 HD2 LYS 38 1HD LYS 38 -3.365 2.725 -28.608 280 HD3 LYS 38 2HD LYS 38 -4.147 1.432 -29.522 281 HE2 LYS 38 1HE LYS 38 -3.184 2.094 -31.524 282 HE3 LYS 38 2HE LYS 38 -2.886 3.735 -30.954 283 HZ1 LYS 38 1HZ LYS 38 -0.891 2.227 -31.153 284 HZ2 LYS 38 2HZ LYS 38 -1.489 1.391 -29.809 285 HZ3 LYS 38 3HZ LYS 38 -1.074 3.025 -29.672 286 H ILE 39 H ILE 39 -9.395 3.472 -27.107 287 HA ILE 39 HA ILE 39 -9.128 5.473 -25.164 288 HB ILE 39 HB ILE 39 -11.116 3.200 -25.232 289 HG12 ILE 39 1HG1 ILE 39 -11.108 4.594 -27.277 290 HG13 ILE 39 2HG1 ILE 39 -12.596 4.777 -26.355 291 HG21 ILE 39 1HG2 ILE 39 -10.646 5.242 -23.292 292 HG22 ILE 39 2HG2 ILE 39 -12.206 5.522 -24.065 293 HG23 ILE 39 3HG2 ILE 39 -11.870 3.972 -23.294 294 HD11 ILE 39 1HD1 ILE 39 -12.296 6.963 -26.369 295 HD12 ILE 39 2HD1 ILE 39 -10.811 6.753 -25.439 296 HD13 ILE 39 3HD1 ILE 39 -10.754 6.769 -27.202 297 H SER 40 H SER 40 -7.783 5.395 -23.490 298 HA SER 40 HA SER 40 -7.049 2.882 -22.262 299 HB2 SER 40 1HB SER 40 -5.344 4.052 -21.188 300 HB3 SER 40 2HB SER 40 -5.543 4.977 -22.676 301 HG SER 40 HG SER 40 -5.928 6.616 -21.436 302 H GLY 41 H GLY 41 -7.133 2.595 -19.897 303 HA2 GLY 41 1HA GLY 41 -9.742 2.798 -18.912 304 HA3 GLY 41 2HA GLY 41 -8.323 2.432 -17.942 305 H ASP 42 H ASP 42 -6.896 4.797 -18.209 306 HA ASP 42 HA ASP 42 -7.925 6.375 -16.190 307 HB2 ASP 42 1HB ASP 42 -5.564 6.388 -17.098 308 HB3 ASP 42 2HB ASP 42 -6.152 7.414 -18.404 309 H GLN 43 H GLN 43 -8.585 6.468 -19.611 310 HA GLN 43 HA GLN 43 -10.011 8.993 -19.413 311 HB2 GLN 43 1HB GLN 43 -9.407 7.126 -21.698 312 HB3 GLN 43 2HB GLN 43 -10.499 8.493 -21.874 313 HG2 GLN 43 1HG GLN 43 -8.138 9.453 -20.659 314 HG3 GLN 43 2HG GLN 43 -7.661 8.437 -22.018 315 HE21 GLN 43 2HE2 GLN 43 -9.458 8.844 -23.897 316 HE22 GLN 43 1HE2 GLN 43 -9.545 10.507 -24.359 317 H LEU 44 H LEU 44 -10.658 5.587 -19.448 318 HA LEU 44 HA LEU 44 -13.431 5.786 -20.110 319 HB2 LEU 44 1HB LEU 44 -12.237 3.736 -20.524 320 HB3 LEU 44 2HB LEU 44 -11.823 3.590 -18.817 321 HG LEU 44 HG LEU 44 -14.469 3.546 -18.573 322 HD11 LEU 44 1HD1 LEU 44 -13.969 2.450 -21.336 323 HD12 LEU 44 2HD1 LEU 44 -14.945 3.860 -20.924 324 HD13 LEU 44 3HD1 LEU 44 -15.460 2.252 -20.414 325 HD21 LEU 44 1HD2 LEU 44 -14.092 0.937 -19.134 326 HD22 LEU 44 2HD2 LEU 44 -13.542 1.712 -17.648 327 HD23 LEU 44 3HD2 LEU 44 -12.418 1.473 -18.987 328 H LEU 45 H LEU 45 -11.598 5.498 -17.095 329 HA LEU 45 HA LEU 45 -13.783 5.252 -15.352 330 HB2 LEU 45 1HB LEU 45 -11.014 5.379 -15.129 331 HB3 LEU 45 2HB LEU 45 -11.596 6.767 -14.212 332 HG LEU 45 HG LEU 45 -12.940 5.301 -12.810 333 HD11 LEU 45 1HD1 LEU 45 -13.629 3.380 -13.700 334 HD12 LEU 45 2HD1 LEU 45 -12.032 2.745 -13.308 335 HD13 LEU 45 3HD1 LEU 45 -12.353 3.392 -14.917 336 HD21 LEU 45 1HD2 LEU 45 -10.086 4.358 -13.066 337 HD22 LEU 45 2HD2 LEU 45 -11.126 4.143 -11.658 338 HD23 LEU 45 3HD2 LEU 45 -10.634 5.764 -12.153 339 H ARG 46 H ARG 46 -12.389 8.009 -16.946 340 HA ARG 46 HA ARG 46 -14.333 9.743 -15.568 341 HB2 ARG 46 1HB ARG 46 -12.808 11.593 -15.771 342 HB3 ARG 46 2HB ARG 46 -11.963 10.257 -15.002 343 HG2 ARG 46 1HG ARG 46 -11.106 9.698 -17.350 344 HG3 ARG 46 2HG ARG 46 -11.653 11.319 -17.784 345 HD2 ARG 46 1HD ARG 46 -10.290 12.013 -15.656 346 HD3 ARG 46 2HD ARG 46 -9.467 10.478 -15.934 347 HE ARG 46 HE ARG 46 -8.397 11.430 -17.712 348 HH11 ARG 46 1HH1 ARG 46 -11.188 13.355 -16.922 349 HH12 ARG 46 2HH1 ARG 46 -10.799 14.615 -18.045 350 HH21 ARG 46 1HH2 ARG 46 -7.874 13.083 -19.194 351 HH22 ARG 46 2HH2 ARG 46 -8.914 14.459 -19.338 352 H ILE 47 H ILE 47 -14.600 8.148 -18.044 353 HA ILE 47 HA ILE 47 -14.442 9.828 -20.310 354 HB ILE 47 HB ILE 47 -14.612 7.395 -20.513 355 HG12 ILE 47 1HG1 ILE 47 -17.015 7.791 -21.957 356 HG13 ILE 47 2HG1 ILE 47 -16.153 9.325 -21.977 357 HG21 ILE 47 1HG2 ILE 47 -16.243 6.140 -19.621 358 HG22 ILE 47 2HG2 ILE 47 -16.556 7.556 -18.618 359 HG23 ILE 47 3HG2 ILE 47 -17.506 7.282 -20.078 360 HD11 ILE 47 1HD1 ILE 47 -15.593 6.854 -23.384 361 HD12 ILE 47 2HD1 ILE 47 -15.034 8.496 -23.704 362 HD13 ILE 47 3HD1 ILE 47 -14.184 7.488 -22.533 363 H THR 48 H THR 48 -15.730 11.401 -21.021 364 HA THR 48 HA THR 48 -18.310 11.801 -19.653 365 HB THR 48 HB THR 48 -16.678 13.603 -19.231 366 HG1 THR 48 HG1 THR 48 -19.024 13.985 -19.496 367 HG21 THR 48 1HG2 THR 48 -16.028 15.106 -21.061 368 HG22 THR 48 2HG2 THR 48 -16.827 14.040 -22.217 369 HG23 THR 48 3HG2 THR 48 -15.419 13.472 -21.321 370 H HIS 49 H HIS 49 -19.966 12.952 -20.975 371 HA HIS 49 HA HIS 49 -20.639 11.541 -23.254 372 HB2 HIS 49 1HB HIS 49 -21.526 14.131 -22.075 373 HB3 HIS 49 2HB HIS 49 -22.036 13.758 -23.719 374 HD1 HIS 49 HD1 HIS 49 -22.254 12.331 -20.218 375 HD2 HIS 49 HD2 HIS 49 -24.157 12.047 -23.901 376 HE1 HIS 49 HE1 HIS 49 -24.295 10.919 -19.813 377 H GLN 50 H GLN 50 -18.646 14.388 -22.921 378 HA GLN 50 HA GLN 50 -18.632 15.172 -25.637 379 HB2 GLN 50 1HB GLN 50 -17.359 15.983 -23.203 380 HB3 GLN 50 2HB GLN 50 -16.143 15.851 -24.466 381 HG2 GLN 50 1HG GLN 50 -18.702 17.373 -24.840 382 HG3 GLN 50 2HG GLN 50 -17.243 18.105 -24.174 383 HE21 GLN 50 2HE2 GLN 50 -18.836 18.410 -26.742 384 HE22 GLN 50 1HE2 GLN 50 -17.637 18.338 -27.984 385 H GLU 51 H GLU 51 -16.719 12.879 -23.788 386 HA GLU 51 HA GLU 51 -14.768 12.431 -25.819 387 HB2 GLU 51 1HB GLU 51 -15.538 11.021 -23.286 388 HB3 GLU 51 2HB GLU 51 -14.419 10.264 -24.412 389 HG2 GLU 51 1HG GLU 51 -13.206 12.592 -24.248 390 HG3 GLU 51 2HG GLU 51 -14.065 12.672 -22.711 391 H LEU 52 H LEU 52 -17.591 10.569 -24.706 392 HA LEU 52 HA LEU 52 -17.434 8.433 -26.446 393 HB2 LEU 52 1HB LEU 52 -19.678 9.827 -25.077 394 HB3 LEU 52 2HB LEU 52 -20.064 8.624 -26.307 395 HG LEU 52 HG LEU 52 -18.161 7.804 -24.191 396 HD11 LEU 52 1HD1 LEU 52 -21.040 7.636 -23.497 397 HD12 LEU 52 2HD1 LEU 52 -20.216 9.172 -23.232 398 HD13 LEU 52 3HD1 LEU 52 -19.622 7.707 -22.451 399 HD21 LEU 52 1HD2 LEU 52 -19.329 5.700 -24.427 400 HD22 LEU 52 2HD2 LEU 52 -18.884 6.315 -26.019 401 HD23 LEU 52 3HD2 LEU 52 -20.548 6.458 -25.451 402 H GLU 53 H GLU 53 -19.023 11.567 -26.973 403 HA GLU 53 HA GLU 53 -20.136 11.113 -29.459 404 HB2 GLU 53 1HB GLU 53 -20.032 13.248 -27.847 405 HB3 GLU 53 2HB GLU 53 -18.831 13.748 -29.029 406 HG2 GLU 53 1HG GLU 53 -20.667 13.111 -30.758 407 HG3 GLU 53 2HG GLU 53 -21.754 13.283 -29.381 408 H ASP 54 H ASP 54 -16.829 12.100 -28.670 409 HA ASP 54 HA ASP 54 -15.878 12.560 -31.241 410 HB2 ASP 54 1HB ASP 54 -14.713 12.937 -28.977 411 HB3 ASP 54 2HB ASP 54 -14.204 11.255 -29.106 412 H LEU 55 H LEU 55 -15.846 9.534 -29.370 413 HA LEU 55 HA LEU 55 -14.611 7.928 -31.290 414 HB2 LEU 55 1HB LEU 55 -16.672 7.167 -29.226 415 HB3 LEU 55 2HB LEU 55 -15.655 6.032 -30.112 416 HG LEU 55 HG LEU 55 -14.135 8.075 -28.680 417 HD11 LEU 55 1HD1 LEU 55 -15.356 8.058 -26.806 418 HD12 LEU 55 2HD1 LEU 55 -14.689 6.444 -26.566 419 HD13 LEU 55 3HD1 LEU 55 -16.280 6.641 -27.302 420 HD21 LEU 55 1HD2 LEU 55 -12.621 6.449 -28.742 421 HD22 LEU 55 2HD2 LEU 55 -13.773 5.506 -29.688 422 HD23 LEU 55 3HD2 LEU 55 -13.707 5.318 -27.935 423 H GLY 56 H GLY 56 -17.896 9.057 -31.028 424 HA2 GLY 56 1HA GLY 56 -18.923 9.097 -33.364 425 HA3 GLY 56 2HA GLY 56 -18.657 7.360 -33.317 426 H VAL 57 H VAL 57 -19.315 7.551 -30.322 427 HA VAL 57 HA VAL 57 -21.988 6.711 -30.506 428 HB VAL 57 HB VAL 57 -20.639 7.769 -28.021 429 HG11 VAL 57 1HG1 VAL 57 -23.111 7.353 -27.967 430 HG12 VAL 57 2HG1 VAL 57 -22.766 5.653 -28.295 431 HG13 VAL 57 3HG1 VAL 57 -22.173 6.404 -26.813 432 HG21 VAL 57 1HG2 VAL 57 -20.142 5.349 -29.603 433 HG22 VAL 57 2HG2 VAL 57 -19.122 6.158 -28.413 434 HG23 VAL 57 3HG2 VAL 57 -20.399 5.063 -27.881 435 H SER 58 H SER 58 -23.322 8.192 -31.484 436 HA SER 58 HA SER 58 -23.618 10.804 -30.163 437 HB2 SER 58 1HB SER 58 -23.252 10.296 -32.819 438 HB3 SER 58 2HB SER 58 -25.011 10.376 -32.727 439 HG SER 58 HG SER 58 -24.864 12.451 -32.480 440 H ARG 59 H ARG 59 -24.723 8.522 -28.957 441 HA ARG 59 HA ARG 59 -27.601 9.034 -29.323 442 HB2 ARG 59 1HB ARG 59 -26.108 6.506 -29.231 443 HB3 ARG 59 2HB ARG 59 -27.511 6.550 -28.172 444 HG2 ARG 59 1HG ARG 59 -27.808 7.443 -30.996 445 HG3 ARG 59 2HG ARG 59 -27.716 5.717 -30.640 446 HD2 ARG 59 1HD ARG 59 -29.940 5.899 -30.362 447 HD3 ARG 59 2HD ARG 59 -29.501 6.525 -28.774 448 HE ARG 59 HE ARG 59 -29.539 8.655 -30.590 449 HH11 ARG 59 1HH1 ARG 59 -31.730 6.415 -29.072 450 HH12 ARG 59 2HH1 ARG 59 -33.080 7.501 -29.122 451 HH21 ARG 59 1HH2 ARG 59 -31.308 10.093 -30.661 452 HH22 ARG 59 2HH2 ARG 59 -32.839 9.592 -30.026 453 H ILE 60 H ILE 60 -28.871 8.355 -27.311 454 HA ILE 60 HA ILE 60 -27.468 9.433 -24.965 455 HB ILE 60 HB ILE 60 -30.436 9.221 -25.483 456 HG12 ILE 60 1HG1 ILE 60 -29.388 10.895 -26.910 457 HG13 ILE 60 2HG1 ILE 60 -30.334 11.687 -25.654 458 HG21 ILE 60 1HG2 ILE 60 -30.358 9.180 -23.198 459 HG22 ILE 60 2HG2 ILE 60 -28.831 10.057 -23.125 460 HG23 ILE 60 3HG2 ILE 60 -30.328 10.922 -23.473 461 HD11 ILE 60 1HD1 ILE 60 -28.094 11.816 -24.381 462 HD12 ILE 60 2HD1 ILE 60 -27.371 11.520 -25.963 463 HD13 ILE 60 3HD1 ILE 60 -28.396 12.933 -25.712 464 H GLY 61 H GLY 61 -29.752 6.879 -25.921 465 HA2 GLY 61 1HA GLY 61 -29.744 5.584 -23.387 466 HA3 GLY 61 2HA GLY 61 -30.317 4.897 -24.899 467 H HIS 62 H HIS 62 -27.561 5.536 -26.052 468 HA HIS 62 HA HIS 62 -26.382 2.992 -25.302 469 HB2 HIS 62 1HB HIS 62 -25.571 5.020 -27.395 470 HB3 HIS 62 2HB HIS 62 -24.809 3.450 -27.166 471 HD1 HIS 62 HD1 HIS 62 -26.369 4.460 -29.767 472 HD2 HIS 62 HD2 HIS 62 -27.807 1.864 -26.859 473 HE1 HIS 62 HE1 HIS 62 -28.178 3.124 -30.893 474 H GLN 63 H GLN 63 -25.456 6.420 -25.322 475 HA GLN 63 HA GLN 63 -22.879 6.151 -24.307 476 HB2 GLN 63 1HB GLN 63 -24.913 8.351 -24.207 477 HB3 GLN 63 2HB GLN 63 -23.396 8.515 -23.332 478 HG2 GLN 63 1HG GLN 63 -22.252 7.981 -25.541 479 HG3 GLN 63 2HG GLN 63 -23.826 8.259 -26.287 480 HE21 GLN 63 2HE2 GLN 63 -24.191 10.237 -26.967 481 HE22 GLN 63 1HE2 GLN 63 -23.425 11.674 -26.388 482 H GLU 64 H GLU 64 -25.950 5.881 -22.730 483 HA GLU 64 HA GLU 64 -24.819 6.112 -20.068 484 HB2 GLU 64 1HB GLU 64 -27.596 5.570 -21.104 485 HB3 GLU 64 2HB GLU 64 -27.199 5.455 -19.396 486 HG2 GLU 64 1HG GLU 64 -26.185 7.905 -20.067 487 HG3 GLU 64 2HG GLU 64 -27.631 7.801 -21.069 488 H LEU 65 H LEU 65 -25.703 3.637 -22.339 489 HA LEU 65 HA LEU 65 -25.953 1.448 -20.608 490 HB2 LEU 65 1HB LEU 65 -25.455 1.860 -23.478 491 HB3 LEU 65 2HB LEU 65 -24.893 0.320 -22.830 492 HG LEU 65 HG LEU 65 -27.724 1.328 -22.579 493 HD11 LEU 65 1HD1 LEU 65 -26.335 -0.145 -24.735 494 HD12 LEU 65 2HD1 LEU 65 -27.726 0.936 -24.809 495 HD13 LEU 65 3HD1 LEU 65 -27.932 -0.729 -24.264 496 HD21 LEU 65 1HD2 LEU 65 -28.167 -1.059 -22.053 497 HD22 LEU 65 2HD2 LEU 65 -27.162 -0.244 -20.854 498 HD23 LEU 65 3HD2 LEU 65 -26.426 -1.336 -22.027 499 H ILE 66 H ILE 66 -23.113 2.861 -22.173 500 HA ILE 66 HA ILE 66 -21.299 0.881 -21.193 501 HB ILE 66 HB ILE 66 -20.683 3.656 -22.213 502 HG12 ILE 66 1HG1 ILE 66 -20.615 1.045 -23.733 503 HG13 ILE 66 2HG1 ILE 66 -21.969 2.168 -23.792 504 HG21 ILE 66 1HG2 ILE 66 -19.042 1.597 -21.092 505 HG22 ILE 66 2HG2 ILE 66 -18.615 1.840 -22.785 506 HG23 ILE 66 3HG2 ILE 66 -18.582 3.200 -21.663 507 HD11 ILE 66 1HD1 ILE 66 -19.158 2.637 -24.740 508 HD12 ILE 66 2HD1 ILE 66 -20.629 2.546 -25.709 509 HD13 ILE 66 3HD1 ILE 66 -20.375 3.906 -24.615 510 H LEU 67 H LEU 67 -22.020 4.240 -20.268 511 HA LEU 67 HA LEU 67 -20.194 4.445 -18.165 512 HB2 LEU 67 1HB LEU 67 -22.889 5.763 -18.461 513 HB3 LEU 67 2HB LEU 67 -21.628 6.262 -17.334 514 HG LEU 67 HG LEU 67 -21.171 6.237 -20.303 515 HD11 LEU 67 1HD1 LEU 67 -21.880 8.761 -18.914 516 HD12 LEU 67 2HD1 LEU 67 -23.190 7.668 -19.362 517 HD13 LEU 67 3HD1 LEU 67 -22.100 8.292 -20.601 518 HD21 LEU 67 1HD2 LEU 67 -19.899 7.711 -18.000 519 HD22 LEU 67 2HD2 LEU 67 -19.490 7.936 -19.701 520 HD23 LEU 67 3HD2 LEU 67 -19.193 6.382 -18.920 521 H GLU 68 H GLU 68 -23.611 3.464 -18.122 522 HA GLU 68 HA GLU 68 -23.945 3.099 -15.404 523 HB2 GLU 68 1HB GLU 68 -25.687 2.893 -17.243 524 HB3 GLU 68 2HB GLU 68 -25.106 1.252 -17.487 525 HG2 GLU 68 1HG GLU 68 -27.084 1.271 -16.091 526 HG3 GLU 68 2HG GLU 68 -25.685 0.695 -15.186 527 H ALA 69 H ALA 69 -22.234 1.120 -17.703 528 HA ALA 69 HA ALA 69 -21.990 -1.132 -15.908 529 HB1 ALA 69 1HB ALA 69 -20.687 -2.161 -17.646 530 HB2 ALA 69 2HB ALA 69 -22.106 -1.405 -18.371 531 HB3 ALA 69 3HB ALA 69 -20.531 -0.624 -18.497 532 H VAL 70 H VAL 70 -20.122 1.675 -16.817 533 HA VAL 70 HA VAL 70 -17.621 0.836 -15.795 534 HB VAL 70 HB VAL 70 -18.698 3.642 -16.110 535 HG11 VAL 70 1HG1 VAL 70 -16.842 3.726 -14.628 536 HG12 VAL 70 2HG1 VAL 70 -15.914 2.603 -15.624 537 HG13 VAL 70 3HG1 VAL 70 -16.257 4.230 -16.213 538 HG21 VAL 70 1HG2 VAL 70 -16.939 3.326 -18.119 539 HG22 VAL 70 2HG2 VAL 70 -17.546 1.676 -17.986 540 HG23 VAL 70 3HG2 VAL 70 -18.666 3.007 -18.280 541 H ASP 71 H ASP 71 -20.367 2.516 -14.353 542 HA ASP 71 HA ASP 71 -19.256 3.339 -11.957 543 HB2 ASP 71 1HB ASP 71 -21.714 3.514 -12.985 544 HB3 ASP 71 2HB ASP 71 -21.996 2.176 -11.874 545 H LEU 72 H LEU 72 -20.190 0.141 -12.986 546 HA LEU 72 HA LEU 72 -20.012 -1.010 -10.351 547 HB2 LEU 72 1HB LEU 72 -20.281 -2.195 -13.103 548 HB3 LEU 72 2HB LEU 72 -20.152 -3.177 -11.646 549 HG LEU 72 HG LEU 72 -22.365 -1.226 -12.278 550 HD11 LEU 72 1HD1 LEU 72 -23.377 -3.794 -11.932 551 HD12 LEU 72 2HD1 LEU 72 -21.944 -4.003 -12.938 552 HD13 LEU 72 3HD1 LEU 72 -23.227 -2.905 -13.448 553 HD21 LEU 72 1HD2 LEU 72 -22.213 -1.199 -9.959 554 HD22 LEU 72 2HD2 LEU 72 -21.734 -2.894 -9.871 555 HD23 LEU 72 3HD2 LEU 72 -23.399 -2.467 -10.269 556 H LEU 73 H LEU 73 -17.908 -0.541 -13.089 557 HA LEU 73 HA LEU 73 -15.921 -2.426 -12.434 558 HB2 LEU 73 1HB LEU 73 -16.190 -0.118 -14.215 559 HB3 LEU 73 2HB LEU 73 -14.543 -0.409 -13.660 560 HG LEU 73 HG LEU 73 -16.278 -2.429 -15.081 561 HD11 LEU 73 1HD1 LEU 73 -15.164 -1.948 -17.052 562 HD12 LEU 73 2HD1 LEU 73 -13.845 -1.118 -16.227 563 HD13 LEU 73 3HD1 LEU 73 -15.426 -0.348 -16.358 564 HD21 LEU 73 1HD2 LEU 73 -14.757 -3.955 -14.548 565 HD22 LEU 73 2HD2 LEU 73 -14.017 -2.778 -13.463 566 HD23 LEU 73 3HD2 LEU 73 -13.449 -2.923 -15.127 567 H CYS 74 H CYS 74 -16.500 0.874 -11.379 568 HA CYS 74 HA CYS 74 -14.003 1.027 -9.932 569 HB2 CYS 74 1HB CYS 74 -16.141 2.862 -10.687 570 HB3 CYS 74 2HB CYS 74 -15.605 3.105 -9.029 571 HG CYS 74 HG CYS 74 -13.495 4.438 -9.611 572 H ALA 75 H ALA 75 -17.318 0.199 -9.291 573 HA ALA 75 HA ALA 75 -17.170 0.432 -6.447 574 HB1 ALA 75 1HB ALA 75 -19.173 -1.441 -7.279 575 HB2 ALA 75 2HB ALA 75 -19.368 0.177 -6.603 576 HB3 ALA 75 3HB ALA 75 -19.185 -0.035 -8.345 577 H LEU 76 H LEU 76 -16.724 -2.193 -8.762 578 HA LEU 76 HA LEU 76 -16.498 -4.255 -6.816 579 HB2 LEU 76 1HB LEU 76 -16.122 -3.976 -9.718 580 HB3 LEU 76 2HB LEU 76 -15.135 -5.221 -8.954 581 HG LEU 76 HG LEU 76 -18.067 -5.172 -8.410 582 HD11 LEU 76 1HD1 LEU 76 -16.869 -6.428 -10.871 583 HD12 LEU 76 2HD1 LEU 76 -17.783 -4.920 -10.873 584 HD13 LEU 76 3HD1 LEU 76 -18.564 -6.423 -10.383 585 HD21 LEU 76 1HD2 LEU 76 -16.034 -7.377 -8.733 586 HD22 LEU 76 2HD2 LEU 76 -17.724 -7.586 -8.273 587 HD23 LEU 76 3HD2 LEU 76 -16.619 -6.722 -7.203 588 H ASN 77 H ASN 77 -14.273 -1.975 -8.224 589 HA ASN 77 HA ASN 77 -11.951 -3.350 -7.139 590 HB2 ASN 77 1HB ASN 77 -12.309 -1.743 -9.345 591 HB3 ASN 77 2HB ASN 77 -11.541 -0.648 -8.201 592 HD21 ASN 77 2HD2 ASN 77 -11.170 -3.443 -10.180 593 HD22 ASN 77 1HD2 ASN 77 -9.470 -3.644 -9.951 594 H SER 78 H SER 78 -11.435 -3.094 -5.077 595 HA SER 78 HA SER 78 -11.159 -2.195 -3.005 596 HB2 SER 78 1HB SER 78 -9.667 -0.680 -4.332 597 HB3 SER 78 2HB SER 78 -11.014 0.450 -4.468 598 HG SER 78 HG SER 78 -10.069 1.168 -2.690 599 H GLY 79 H GLY 79 -13.846 -2.545 -3.955 600 HA2 GLY 79 1HA GLY 79 -15.994 -2.056 -3.312 601 HA3 GLY 79 2HA GLY 79 -15.276 -1.265 -1.917 602 HA PRO 80 HA PRO 80 -17.396 1.833 -4.772 603 HB2 PRO 80 1HB PRO 80 -19.313 2.622 -3.020 604 HB3 PRO 80 2HB PRO 80 -19.536 1.279 -4.147 605 HG2 PRO 80 1HG PRO 80 -18.810 1.214 -1.243 606 HG3 PRO 80 2HG PRO 80 -19.954 0.192 -2.134 607 HD2 PRO 80 1HD PRO 80 -17.454 -0.631 -1.498 608 HD3 PRO 80 2HD PRO 80 -18.286 -1.158 -2.975 609 H SER 81 H SER 81 -16.417 1.809 -1.404 610 HA SER 81 HA SER 81 -15.350 3.338 -0.100 611 HB2 SER 81 1HB SER 81 -14.014 3.472 -2.369 612 HB3 SER 81 2HB SER 81 -14.758 5.067 -2.472 613 HG SER 81 HG SER 81 -12.602 4.528 -1.205 614 H SER 82 H SER 82 -15.244 5.854 0.313 615 HA SER 82 HA SER 82 -17.978 6.696 0.572 616 HB2 SER 82 1HB SER 82 -16.784 8.787 1.576 617 HB3 SER 82 2HB SER 82 -16.703 7.254 2.445 618 HG SER 82 HG SER 82 -14.712 8.649 1.097 619 H GLY 83 H GLY 83 -18.771 8.807 -0.099 620 HA2 GLY 83 1HA GLY 83 -18.525 9.272 -2.826 621 HA3 GLY 83 2HA GLY 83 -19.176 10.427 -1.673 Start of MODEL 3 1 H1 GLY 1 H GLY 1 -10.187 5.773 2.621 2 HA2 GLY 1 1HA GLY 1 -7.770 4.689 3.843 3 HA3 GLY 1 2HA GLY 1 -9.374 3.972 3.893 4 H SER 2 H SER 2 -7.970 5.064 0.897 5 HA SER 2 HA SER 2 -7.938 2.287 -0.034 6 HB2 SER 2 1HB SER 2 -7.998 4.930 -1.496 7 HB3 SER 2 2HB SER 2 -7.748 3.390 -2.319 8 HG SER 2 HG SER 2 -10.043 4.488 -1.338 9 H SER 3 H SER 3 -5.968 1.613 0.840 10 HA SER 3 HA SER 3 -3.537 3.054 0.385 11 HB2 SER 3 1HB SER 3 -3.677 1.659 2.342 12 HB3 SER 3 2HB SER 3 -4.073 0.244 1.368 13 HG SER 3 HG SER 3 -1.615 1.625 1.552 14 H GLY 4 H GLY 4 -5.278 0.500 -1.243 15 HA2 GLY 4 1HA GLY 4 -3.805 0.864 -3.647 16 HA3 GLY 4 2HA GLY 4 -3.296 -0.607 -2.832 17 H SER 5 H SER 5 -5.947 1.023 -4.432 18 HA SER 5 HA SER 5 -7.084 -1.562 -5.126 19 HB2 SER 5 1HB SER 5 -9.318 -1.028 -4.377 20 HB3 SER 5 2HB SER 5 -8.220 -0.852 -3.008 21 HG SER 5 HG SER 5 -8.311 1.356 -3.236 22 H SER 6 H SER 6 -5.697 0.314 -6.686 23 HA SER 6 HA SER 6 -7.845 1.356 -8.416 24 HB2 SER 6 1HB SER 6 -5.096 2.453 -8.686 25 HB3 SER 6 2HB SER 6 -6.654 3.265 -8.836 26 HG SER 6 HG SER 6 -5.144 2.706 -6.541 27 H GLY 7 H GLY 7 -8.106 0.091 -10.130 28 HA2 GLY 7 1HA GLY 7 -5.685 -0.936 -11.473 29 HA3 GLY 7 2HA GLY 7 -7.095 -1.955 -11.228 30 H VAL 8 H VAL 8 -9.165 -0.316 -11.887 31 HA VAL 8 HA VAL 8 -9.231 -0.462 -14.673 32 HB VAL 8 HB VAL 8 -10.937 1.368 -12.984 33 HG11 VAL 8 1HG1 VAL 8 -11.134 1.728 -15.385 34 HG12 VAL 8 2HG1 VAL 8 -11.452 0.009 -15.628 35 HG13 VAL 8 3HG1 VAL 8 -12.606 1.004 -14.739 36 HG21 VAL 8 1HG2 VAL 8 -10.754 -1.523 -13.021 37 HG22 VAL 8 2HG2 VAL 8 -11.648 -0.464 -11.930 38 HG23 VAL 8 3HG2 VAL 8 -12.365 -0.960 -13.463 39 H SER 9 H SER 9 -8.046 2.019 -12.573 40 HA SER 9 HA SER 9 -8.148 4.162 -14.452 41 HB2 SER 9 1HB SER 9 -6.681 5.340 -12.866 42 HB3 SER 9 2HB SER 9 -8.031 4.572 -12.032 43 HG SER 9 HG SER 9 -6.605 2.859 -11.488 44 H LYS 10 H LYS 10 -5.906 1.593 -13.776 45 HA LYS 10 HA LYS 10 -3.952 2.764 -15.634 46 HB2 LYS 10 1HB LYS 10 -3.573 0.421 -13.763 47 HB3 LYS 10 2HB LYS 10 -2.325 1.242 -14.691 48 HG2 LYS 10 1HG LYS 10 -3.702 3.150 -13.071 49 HG3 LYS 10 2HG LYS 10 -3.186 1.789 -12.072 50 HD2 LYS 10 1HD LYS 10 -0.924 2.078 -13.335 51 HD3 LYS 10 2HD LYS 10 -1.537 3.696 -13.682 52 HE2 LYS 10 1HE LYS 10 -1.665 4.243 -11.388 53 HE3 LYS 10 2HE LYS 10 -1.456 2.562 -10.898 54 HZ1 LYS 10 1HZ LYS 10 0.758 2.702 -11.077 55 HZ2 LYS 10 2HZ LYS 10 0.516 4.373 -10.971 56 HZ3 LYS 10 3HZ LYS 10 0.707 3.641 -12.484 57 H TRP 11 H TRP 11 -6.509 1.338 -16.297 58 HA TRP 11 HA TRP 11 -5.800 -1.203 -17.383 59 HB2 TRP 11 1HB TRP 11 -8.184 0.518 -17.313 60 HB3 TRP 11 2HB TRP 11 -8.040 -0.463 -18.769 61 HD1 TRP 11 HD1 TRP 11 -6.777 -1.860 -15.455 62 HE1 TRP 11 HE1 TRP 11 -8.293 -3.815 -14.746 63 HE3 TRP 11 HE3 TRP 11 -10.449 -1.357 -18.976 64 HZ2 TRP 11 HZ2 TRP 11 -10.724 -4.989 -15.570 65 HZ3 TRP 11 HZ3 TRP 11 -12.335 -2.937 -18.947 66 HH2 TRP 11 HH2 TRP 11 -12.468 -4.715 -17.279 67 H SER 12 H SER 12 -4.941 -1.704 -19.302 68 HA SER 12 HA SER 12 -3.743 0.241 -20.928 69 HB2 SER 12 1HB SER 12 -4.297 -2.293 -22.290 70 HB3 SER 12 2HB SER 12 -2.752 -1.527 -21.919 71 HG SER 12 HG SER 12 -3.019 -2.316 -19.755 72 HA PRO 13 HA PRO 13 -6.812 1.519 -23.789 73 HB2 PRO 13 1HB PRO 13 -5.434 1.618 -26.126 74 HB3 PRO 13 2HB PRO 13 -5.192 2.783 -24.819 75 HG2 PRO 13 1HG PRO 13 -3.572 0.367 -25.526 76 HG3 PRO 13 2HG PRO 13 -3.021 1.986 -25.058 77 HD2 PRO 13 1HD PRO 13 -3.073 -0.094 -23.324 78 HD3 PRO 13 2HD PRO 13 -3.346 1.584 -22.812 79 H SER 14 H SER 14 -5.153 -1.473 -24.347 80 HA SER 14 HA SER 14 -7.038 -2.289 -26.423 81 HB2 SER 14 1HB SER 14 -5.389 -4.465 -25.800 82 HB3 SER 14 2HB SER 14 -5.215 -3.365 -27.167 83 HG SER 14 HG SER 14 -3.538 -2.512 -26.237 84 H GLN 15 H GLN 15 -6.387 -2.737 -23.051 85 HA GLN 15 HA GLN 15 -7.782 -5.156 -22.647 86 HB2 GLN 15 1HB GLN 15 -6.987 -2.882 -20.857 87 HB3 GLN 15 2HB GLN 15 -8.006 -4.180 -20.248 88 HG2 GLN 15 1HG GLN 15 -5.554 -5.000 -21.666 89 HG3 GLN 15 2HG GLN 15 -5.335 -4.202 -20.110 90 HE21 GLN 15 2HE2 GLN 15 -4.952 -7.018 -21.063 91 HE22 GLN 15 1HE2 GLN 15 -5.824 -7.984 -19.927 92 H VAL 16 H VAL 16 -8.798 -1.765 -22.342 93 HA VAL 16 HA VAL 16 -11.375 -2.121 -21.426 94 HB VAL 16 HB VAL 16 -10.446 -0.060 -23.431 95 HG11 VAL 16 1HG1 VAL 16 -12.971 -0.434 -21.912 96 HG12 VAL 16 2HG1 VAL 16 -12.357 1.209 -22.106 97 HG13 VAL 16 3HG1 VAL 16 -12.707 0.223 -23.527 98 HG21 VAL 16 1HG2 VAL 16 -10.751 0.976 -20.804 99 HG22 VAL 16 2HG2 VAL 16 -9.743 -0.468 -20.711 100 HG23 VAL 16 3HG2 VAL 16 -9.285 0.860 -21.777 101 H VAL 17 H VAL 17 -10.147 -2.379 -24.723 102 HA VAL 17 HA VAL 17 -12.568 -2.534 -26.097 103 HB VAL 17 HB VAL 17 -10.057 -4.059 -26.794 104 HG11 VAL 17 1HG1 VAL 17 -12.241 -4.533 -28.017 105 HG12 VAL 17 2HG1 VAL 17 -12.095 -2.903 -28.675 106 HG13 VAL 17 3HG1 VAL 17 -10.846 -4.104 -29.006 107 HG21 VAL 17 1HG2 VAL 17 -10.474 -1.241 -26.577 108 HG22 VAL 17 2HG2 VAL 17 -9.025 -2.112 -27.077 109 HG23 VAL 17 3HG2 VAL 17 -10.240 -1.665 -28.273 110 H ASP 18 H ASP 18 -10.832 -4.948 -24.249 111 HA ASP 18 HA ASP 18 -12.375 -7.174 -25.164 112 HB2 ASP 18 1HB ASP 18 -10.029 -7.195 -24.092 113 HB3 ASP 18 2HB ASP 18 -10.879 -7.081 -22.553 114 H TRP 19 H TRP 19 -12.754 -4.760 -22.711 115 HA TRP 19 HA TRP 19 -14.624 -6.166 -21.090 116 HB2 TRP 19 1HB TRP 19 -13.404 -4.289 -20.169 117 HB3 TRP 19 2HB TRP 19 -14.072 -3.208 -21.389 118 HD1 TRP 19 HD1 TRP 19 -15.631 -5.584 -18.725 119 HE1 TRP 19 HE1 TRP 19 -17.550 -4.313 -17.573 120 HE3 TRP 19 HE3 TRP 19 -15.329 -1.167 -21.281 121 HZ2 TRP 19 HZ2 TRP 19 -18.774 -1.775 -17.728 122 HZ3 TRP 19 HZ3 TRP 19 -16.911 0.631 -20.719 123 HH2 TRP 19 HH2 TRP 19 -18.598 0.332 -18.979 124 H MET 20 H MET 20 -14.942 -3.829 -23.737 125 HA MET 20 HA MET 20 -17.732 -3.561 -23.656 126 HB2 MET 20 1HB MET 20 -16.021 -3.416 -26.139 127 HB3 MET 20 2HB MET 20 -17.564 -2.620 -25.858 128 HG2 MET 20 1HG MET 20 -16.504 -1.279 -24.076 129 HG3 MET 20 2HG MET 20 -14.959 -2.026 -24.477 130 HE1 MET 20 1HE MET 20 -17.727 -0.780 -27.261 131 HE2 MET 20 2HE MET 20 -17.941 -0.045 -25.672 132 HE3 MET 20 3HE MET 20 -17.359 0.929 -27.023 133 H LYS 21 H LYS 21 -15.716 -6.111 -24.808 134 HA LYS 21 HA LYS 21 -17.491 -7.306 -26.651 135 HB2 LYS 21 1HB LYS 21 -15.285 -8.514 -24.976 136 HB3 LYS 21 2HB LYS 21 -16.121 -9.360 -26.271 137 HG2 LYS 21 1HG LYS 21 -15.357 -7.215 -27.638 138 HG3 LYS 21 2HG LYS 21 -14.095 -7.207 -26.404 139 HD2 LYS 21 1HD LYS 21 -13.518 -9.510 -26.965 140 HD3 LYS 21 2HD LYS 21 -14.804 -9.548 -28.174 141 HE2 LYS 21 1HE LYS 21 -13.695 -7.968 -29.538 142 HE3 LYS 21 2HE LYS 21 -12.567 -7.539 -28.253 143 HZ1 LYS 21 1HZ LYS 21 -11.868 -9.994 -28.423 144 HZ2 LYS 21 2HZ LYS 21 -11.325 -8.914 -29.606 145 HZ3 LYS 21 3HZ LYS 21 -12.616 -9.954 -29.941 146 H GLY 22 H GLY 22 -17.614 -7.033 -23.274 147 HA2 GLY 22 1HA GLY 22 -19.551 -9.261 -23.128 148 HA3 GLY 22 2HA GLY 22 -18.543 -8.760 -21.779 149 H LEU 23 H LEU 23 -20.039 -6.426 -23.889 150 HA LEU 23 HA LEU 23 -21.907 -5.734 -21.717 151 HB2 LEU 23 1HB LEU 23 -20.697 -3.827 -23.709 152 HB3 LEU 23 2HB LEU 23 -21.682 -3.421 -22.305 153 HG LEU 23 HG LEU 23 -18.862 -4.491 -22.295 154 HD11 LEU 23 1HD1 LEU 23 -18.191 -2.385 -21.584 155 HD12 LEU 23 2HD1 LEU 23 -19.825 -1.908 -21.126 156 HD13 LEU 23 3HD1 LEU 23 -19.387 -2.028 -22.830 157 HD21 LEU 23 1HD2 LEU 23 -20.796 -3.992 -20.043 158 HD22 LEU 23 2HD2 LEU 23 -19.051 -4.109 -19.815 159 HD23 LEU 23 3HD2 LEU 23 -19.954 -5.490 -20.441 160 H ASP 24 H ASP 24 -23.458 -3.884 -22.959 161 HA ASP 24 HA ASP 24 -25.368 -5.365 -24.291 162 HB2 ASP 24 1HB ASP 24 -25.048 -2.679 -23.511 163 HB3 ASP 24 2HB ASP 24 -25.430 -2.639 -25.230 164 H ASP 25 H ASP 25 -25.996 -5.561 -26.461 165 HA ASP 25 HA ASP 25 -23.880 -5.923 -28.300 166 HB2 ASP 25 1HB ASP 25 -26.506 -6.760 -28.126 167 HB3 ASP 25 2HB ASP 25 -26.532 -5.669 -29.508 168 H CYS 26 H CYS 26 -25.952 -3.243 -27.583 169 HA CYS 26 HA CYS 26 -25.622 -1.842 -30.035 170 HB2 CYS 26 1HB CYS 26 -26.499 -1.017 -27.275 171 HB3 CYS 26 2HB CYS 26 -26.332 0.155 -28.576 172 HG CYS 26 HG CYS 26 -29.034 -0.452 -28.319 173 H LEU 27 H LEU 27 -23.663 -2.252 -27.232 174 HA LEU 27 HA LEU 27 -21.976 0.036 -27.902 175 HB2 LEU 27 1HB LEU 27 -21.452 -1.904 -25.682 176 HB3 LEU 27 2HB LEU 27 -20.965 -0.216 -25.814 177 HG LEU 27 HG LEU 27 -23.797 -1.157 -25.369 178 HD11 LEU 27 1HD1 LEU 27 -22.899 0.243 -23.141 179 HD12 LEU 27 2HD1 LEU 27 -21.582 -0.857 -23.544 180 HD13 LEU 27 3HD1 LEU 27 -23.202 -1.490 -23.256 181 HD21 LEU 27 1HD2 LEU 27 -24.102 0.920 -26.250 182 HD22 LEU 27 2HD2 LEU 27 -22.506 1.487 -25.760 183 HD23 LEU 27 3HD2 LEU 27 -23.804 1.372 -24.571 184 H GLN 28 H GLN 28 -22.222 -2.516 -29.503 185 HA GLN 28 HA GLN 28 -19.535 -3.622 -29.278 186 HB2 GLN 28 1HB GLN 28 -21.849 -4.366 -31.075 187 HB3 GLN 28 2HB GLN 28 -20.303 -5.204 -31.030 188 HG2 GLN 28 1HG GLN 28 -22.184 -4.942 -28.696 189 HG3 GLN 28 2HG GLN 28 -22.075 -6.346 -29.757 190 HE21 GLN 28 2HE2 GLN 28 -21.424 -5.645 -26.815 191 HE22 GLN 28 1HE2 GLN 28 -19.884 -6.390 -26.574 192 H GLN 29 H GLN 29 -21.562 -1.974 -31.685 193 HA GLN 29 HA GLN 29 -19.726 -1.860 -33.767 194 HB2 GLN 29 1HB GLN 29 -21.008 0.122 -34.545 195 HB3 GLN 29 2HB GLN 29 -22.031 -1.243 -34.116 196 HG2 GLN 29 1HG GLN 29 -22.166 -0.050 -31.803 197 HG3 GLN 29 2HG GLN 29 -21.675 1.368 -32.728 198 HE21 GLN 29 2HE2 GLN 29 -24.205 -0.832 -32.004 199 HE22 GLN 29 1HE2 GLN 29 -25.438 -0.070 -32.944 200 H TYR 30 H TYR 30 -19.858 -0.063 -30.809 201 HA TYR 30 HA TYR 30 -18.136 2.063 -31.657 202 HB2 TYR 30 1HB TYR 30 -18.819 1.160 -28.852 203 HB3 TYR 30 2HB TYR 30 -18.091 2.698 -29.300 204 HD1 TYR 30 HD2 TYR 30 -19.722 3.468 -31.631 205 HD2 TYR 30 HD1 TYR 30 -20.882 1.723 -27.928 206 HE1 TYR 30 HE2 TYR 30 -21.959 4.461 -31.871 207 HE2 TYR 30 HE1 TYR 30 -23.123 2.710 -28.158 208 HH TYR 30 HH TYR 30 -23.869 5.007 -30.675 209 H ILE 31 H ILE 31 -17.700 -1.126 -30.380 210 HA ILE 31 HA ILE 31 -15.209 -0.997 -29.204 211 HB ILE 31 HB ILE 31 -16.227 -3.223 -30.973 212 HG12 ILE 31 1HG1 ILE 31 -16.494 -2.811 -27.987 213 HG13 ILE 31 2HG1 ILE 31 -17.794 -2.646 -29.163 214 HG21 ILE 31 1HG2 ILE 31 -13.859 -3.443 -30.571 215 HG22 ILE 31 2HG2 ILE 31 -14.096 -3.190 -28.842 216 HG23 ILE 31 3HG2 ILE 31 -14.728 -4.644 -29.615 217 HD11 ILE 31 1HD1 ILE 31 -17.337 -5.073 -29.761 218 HD12 ILE 31 2HD1 ILE 31 -16.374 -5.132 -28.284 219 HD13 ILE 31 3HD1 ILE 31 -18.094 -4.752 -28.201 220 H LYS 32 H LYS 32 -15.991 -1.347 -32.645 221 HA LYS 32 HA LYS 32 -13.370 -1.632 -33.595 222 HB2 LYS 32 1HB LYS 32 -15.840 -0.494 -34.908 223 HB3 LYS 32 2HB LYS 32 -14.329 -0.773 -35.765 224 HG2 LYS 32 1HG LYS 32 -14.584 -3.198 -34.836 225 HG3 LYS 32 2HG LYS 32 -16.281 -2.741 -34.671 226 HD2 LYS 32 1HD LYS 32 -16.476 -2.303 -37.000 227 HD3 LYS 32 2HD LYS 32 -14.729 -2.411 -37.232 228 HE2 LYS 32 1HE LYS 32 -15.070 -4.539 -37.805 229 HE3 LYS 32 2HE LYS 32 -15.388 -4.842 -36.098 230 HZ1 LYS 32 1HZ LYS 32 -17.293 -4.509 -38.311 231 HZ2 LYS 32 2HZ LYS 32 -17.773 -4.093 -36.743 232 HZ3 LYS 32 3HZ LYS 32 -17.269 -5.672 -37.081 233 H ASN 33 H ASN 33 -15.171 1.172 -32.594 234 HA ASN 33 HA ASN 33 -13.306 3.046 -33.764 235 HB2 ASN 33 1HB ASN 33 -15.730 3.339 -31.998 236 HB3 ASN 33 2HB ASN 33 -14.690 4.708 -32.377 237 HD21 ASN 33 2HD2 ASN 33 -17.386 4.588 -33.054 238 HD22 ASN 33 1HD2 ASN 33 -17.521 4.539 -34.776 239 H PHE 34 H PHE 34 -13.841 1.486 -30.696 240 HA PHE 34 HA PHE 34 -12.155 3.235 -29.180 241 HB2 PHE 34 1HB PHE 34 -13.560 0.651 -28.679 242 HB3 PHE 34 2HB PHE 34 -12.240 1.100 -27.604 243 HD1 PHE 34 HD2 PHE 34 -15.020 2.992 -29.226 244 HD2 PHE 34 HD1 PHE 34 -13.032 1.918 -25.619 245 HE1 PHE 34 HE2 PHE 34 -16.554 4.436 -27.955 246 HE2 PHE 34 HE1 PHE 34 -14.564 3.360 -24.342 247 HZ PHE 34 HZ PHE 34 -16.327 4.622 -25.510 248 H GLU 35 H GLU 35 -11.698 0.362 -31.084 249 HA GLU 35 HA GLU 35 -9.198 -0.436 -30.035 250 HB2 GLU 35 1HB GLU 35 -10.939 -1.225 -32.177 251 HB3 GLU 35 2HB GLU 35 -9.289 -1.125 -32.775 252 HG2 GLU 35 1HG GLU 35 -9.778 -2.541 -30.211 253 HG3 GLU 35 2HG GLU 35 -10.241 -3.333 -31.716 254 H ARG 36 H ARG 36 -10.106 1.722 -32.685 255 HA ARG 36 HA ARG 36 -7.355 2.259 -33.379 256 HB2 ARG 36 1HB ARG 36 -9.520 2.291 -34.890 257 HB3 ARG 36 2HB ARG 36 -9.620 3.957 -34.335 258 HG2 ARG 36 1HG ARG 36 -7.583 4.532 -35.344 259 HG3 ARG 36 2HG ARG 36 -7.122 2.843 -35.564 260 HD2 ARG 36 1HD ARG 36 -8.167 2.731 -37.528 261 HD3 ARG 36 2HD ARG 36 -9.640 3.428 -36.856 262 HE ARG 36 HE ARG 36 -7.691 5.439 -37.249 263 HH11 ARG 36 1HH1 ARG 36 -9.904 3.395 -38.993 264 HH12 ARG 36 2HH1 ARG 36 -10.089 4.501 -40.314 265 HH21 ARG 36 1HH2 ARG 36 -7.927 6.904 -38.981 266 HH22 ARG 36 2HH2 ARG 36 -8.963 6.496 -40.307 267 H GLU 37 H GLU 37 -9.802 3.632 -31.346 268 HA GLU 37 HA GLU 37 -8.550 6.210 -31.105 269 HB2 GLU 37 1HB GLU 37 -10.911 4.848 -29.926 270 HB3 GLU 37 2HB GLU 37 -10.191 6.146 -28.983 271 HG2 GLU 37 1HG GLU 37 -10.504 6.921 -31.741 272 HG3 GLU 37 2HG GLU 37 -12.034 6.387 -31.047 273 H LYS 38 H LYS 38 -8.186 3.131 -29.633 274 HA LYS 38 HA LYS 38 -6.857 2.342 -27.963 275 HB2 LYS 38 1HB LYS 38 -5.396 4.959 -28.364 276 HB3 LYS 38 2HB LYS 38 -4.764 3.546 -27.528 277 HG2 LYS 38 1HG LYS 38 -5.649 3.379 -30.383 278 HG3 LYS 38 2HG LYS 38 -4.042 3.971 -29.955 279 HD2 LYS 38 1HD LYS 38 -3.458 1.912 -28.933 280 HD3 LYS 38 2HD LYS 38 -5.127 1.338 -28.978 281 HE2 LYS 38 1HE LYS 38 -3.740 0.282 -30.707 282 HE3 LYS 38 2HE LYS 38 -5.053 1.232 -31.400 283 HZ1 LYS 38 1HZ LYS 38 -2.533 2.628 -31.026 284 HZ2 LYS 38 2HZ LYS 38 -3.630 2.697 -32.312 285 HZ3 LYS 38 3HZ LYS 38 -2.531 1.415 -32.207 286 H ILE 39 H ILE 39 -9.209 3.621 -27.148 287 HA ILE 39 HA ILE 39 -8.894 5.543 -25.139 288 HB ILE 39 HB ILE 39 -10.993 3.378 -25.321 289 HG12 ILE 39 1HG1 ILE 39 -10.871 4.806 -27.328 290 HG13 ILE 39 2HG1 ILE 39 -12.361 5.073 -26.429 291 HG21 ILE 39 1HG2 ILE 39 -12.141 5.560 -24.119 292 HG22 ILE 39 2HG2 ILE 39 -11.567 4.113 -23.291 293 HG23 ILE 39 3HG2 ILE 39 -10.525 5.530 -23.412 294 HD11 ILE 39 1HD1 ILE 39 -11.398 7.097 -25.454 295 HD12 ILE 39 2HD1 ILE 39 -9.921 6.832 -26.381 296 HD13 ILE 39 3HD1 ILE 39 -11.438 7.165 -27.216 297 H SER 40 H SER 40 -7.611 5.357 -23.426 298 HA SER 40 HA SER 40 -7.051 2.775 -22.243 299 HB2 SER 40 1HB SER 40 -5.617 4.202 -20.677 300 HB3 SER 40 2HB SER 40 -5.163 4.203 -22.381 301 HG SER 40 HG SER 40 -5.571 6.259 -22.457 302 H GLY 41 H GLY 41 -7.157 2.509 -19.851 303 HA2 GLY 41 1HA GLY 41 -9.771 2.756 -18.916 304 HA3 GLY 41 2HA GLY 41 -8.373 2.419 -17.907 305 H ASP 42 H ASP 42 -6.949 4.792 -18.239 306 HA ASP 42 HA ASP 42 -8.001 6.417 -16.271 307 HB2 ASP 42 1HB ASP 42 -5.670 6.559 -16.913 308 HB3 ASP 42 2HB ASP 42 -6.109 7.145 -18.515 309 H GLN 43 H GLN 43 -8.645 6.409 -19.697 310 HA GLN 43 HA GLN 43 -10.091 8.926 -19.582 311 HB2 GLN 43 1HB GLN 43 -9.418 6.997 -21.787 312 HB3 GLN 43 2HB GLN 43 -10.595 8.281 -22.031 313 HG2 GLN 43 1HG GLN 43 -8.746 9.853 -21.193 314 HG3 GLN 43 2HG GLN 43 -7.660 8.499 -21.498 315 HE21 GLN 43 2HE2 GLN 43 -9.860 10.790 -22.944 316 HE22 GLN 43 1HE2 GLN 43 -9.289 10.614 -24.565 317 H LEU 44 H LEU 44 -10.720 5.514 -19.521 318 HA LEU 44 HA LEU 44 -13.497 5.683 -20.176 319 HB2 LEU 44 1HB LEU 44 -12.271 3.630 -20.533 320 HB3 LEU 44 2HB LEU 44 -11.892 3.525 -18.815 321 HG LEU 44 HG LEU 44 -14.597 3.533 -18.727 322 HD11 LEU 44 1HD1 LEU 44 -14.366 3.435 -21.348 323 HD12 LEU 44 2HD1 LEU 44 -15.603 2.508 -20.501 324 HD13 LEU 44 3HD1 LEU 44 -14.119 1.718 -21.032 325 HD21 LEU 44 1HD2 LEU 44 -13.051 1.006 -19.222 326 HD22 LEU 44 2HD2 LEU 44 -14.434 1.261 -18.158 327 HD23 LEU 44 3HD2 LEU 44 -12.863 1.947 -17.742 328 H LEU 45 H LEU 45 -11.655 5.465 -17.159 329 HA LEU 45 HA LEU 45 -13.851 5.278 -15.415 330 HB2 LEU 45 1HB LEU 45 -11.110 5.277 -15.168 331 HB3 LEU 45 2HB LEU 45 -11.580 6.769 -14.356 332 HG LEU 45 HG LEU 45 -13.030 5.504 -12.852 333 HD11 LEU 45 1HD1 LEU 45 -12.562 3.411 -14.798 334 HD12 LEU 45 2HD1 LEU 45 -13.815 3.551 -13.566 335 HD13 LEU 45 3HD1 LEU 45 -12.243 2.869 -13.150 336 HD21 LEU 45 1HD2 LEU 45 -11.242 4.233 -11.666 337 HD22 LEU 45 2HD2 LEU 45 -10.790 5.881 -12.103 338 HD23 LEU 45 3HD2 LEU 45 -10.188 4.521 -13.051 339 H ARG 46 H ARG 46 -12.392 7.980 -17.047 340 HA ARG 46 HA ARG 46 -14.297 9.778 -15.696 341 HB2 ARG 46 1HB ARG 46 -12.718 11.606 -16.037 342 HB3 ARG 46 2HB ARG 46 -11.970 10.309 -15.114 343 HG2 ARG 46 1HG ARG 46 -10.303 10.267 -16.563 344 HG3 ARG 46 2HG ARG 46 -11.434 9.795 -17.833 345 HD2 ARG 46 1HD ARG 46 -10.609 11.713 -18.753 346 HD3 ARG 46 2HD ARG 46 -11.957 12.383 -17.836 347 HE ARG 46 HE ARG 46 -9.854 12.472 -16.104 348 HH11 ARG 46 1HH1 ARG 46 -10.438 13.671 -19.320 349 HH12 ARG 46 2HH1 ARG 46 -9.394 15.041 -19.139 350 HH21 ARG 46 1HH2 ARG 46 -8.476 14.273 -15.854 351 HH22 ARG 46 2HH2 ARG 46 -8.278 15.382 -17.168 352 H ILE 47 H ILE 47 -14.727 8.167 -18.085 353 HA ILE 47 HA ILE 47 -14.539 9.840 -20.389 354 HB ILE 47 HB ILE 47 -14.646 7.397 -20.584 355 HG12 ILE 47 1HG1 ILE 47 -17.072 7.800 -22.028 356 HG13 ILE 47 2HG1 ILE 47 -16.149 9.298 -22.086 357 HG21 ILE 47 1HG2 ILE 47 -16.579 7.491 -18.695 358 HG22 ILE 47 2HG2 ILE 47 -17.550 7.263 -20.149 359 HG23 ILE 47 3HG2 ILE 47 -16.285 6.104 -19.743 360 HD11 ILE 47 1HD1 ILE 47 -14.574 6.887 -22.600 361 HD12 ILE 47 2HD1 ILE 47 -15.838 7.216 -23.787 362 HD13 ILE 47 3HD1 ILE 47 -14.607 8.433 -23.449 363 H THR 48 H THR 48 -15.890 11.357 -21.117 364 HA THR 48 HA THR 48 -18.477 11.675 -19.740 365 HB THR 48 HB THR 48 -16.930 13.519 -19.254 366 HG1 THR 48 HG1 THR 48 -18.803 14.510 -19.234 367 HG21 THR 48 1HG2 THR 48 -15.864 14.796 -20.840 368 HG22 THR 48 2HG2 THR 48 -17.070 14.456 -22.081 369 HG23 THR 48 3HG2 THR 48 -15.874 13.233 -21.655 370 H HIS 49 H HIS 49 -20.134 12.854 -21.068 371 HA HIS 49 HA HIS 49 -20.782 11.452 -23.358 372 HB2 HIS 49 1HB HIS 49 -21.680 14.045 -22.189 373 HB3 HIS 49 2HB HIS 49 -22.182 13.660 -23.833 374 HD1 HIS 49 HD1 HIS 49 -22.350 12.159 -20.350 375 HD2 HIS 49 HD2 HIS 49 -24.360 12.040 -23.985 376 HE1 HIS 49 HE1 HIS 49 -24.405 10.769 -19.937 377 H GLN 50 H GLN 50 -18.801 14.306 -22.999 378 HA GLN 50 HA GLN 50 -18.760 15.096 -25.712 379 HB2 GLN 50 1HB GLN 50 -17.638 16.000 -23.295 380 HB3 GLN 50 2HB GLN 50 -16.280 15.699 -24.372 381 HG2 GLN 50 1HG GLN 50 -17.740 17.041 -26.082 382 HG3 GLN 50 2HG GLN 50 -18.500 17.663 -24.619 383 HE21 GLN 50 2HE2 GLN 50 -16.604 18.070 -22.878 384 HE22 GLN 50 1HE2 GLN 50 -15.379 19.135 -23.469 385 H GLU 51 H GLU 51 -16.870 12.794 -23.852 386 HA GLU 51 HA GLU 51 -14.907 12.354 -25.881 387 HB2 GLU 51 1HB GLU 51 -15.638 11.031 -23.303 388 HB3 GLU 51 2HB GLU 51 -14.598 10.174 -24.432 389 HG2 GLU 51 1HG GLU 51 -13.809 12.947 -23.918 390 HG3 GLU 51 2HG GLU 51 -13.738 11.885 -22.513 391 H LEU 52 H LEU 52 -17.731 10.507 -24.753 392 HA LEU 52 HA LEU 52 -17.535 8.369 -26.522 393 HB2 LEU 52 1HB LEU 52 -19.858 9.672 -25.147 394 HB3 LEU 52 2HB LEU 52 -20.097 8.310 -26.240 395 HG LEU 52 HG LEU 52 -18.345 8.217 -23.788 396 HD11 LEU 52 1HD1 LEU 52 -21.210 7.368 -24.168 397 HD12 LEU 52 2HD1 LEU 52 -20.595 8.589 -23.055 398 HD13 LEU 52 3HD1 LEU 52 -20.199 6.889 -22.804 399 HD21 LEU 52 1HD2 LEU 52 -18.489 5.797 -24.118 400 HD22 LEU 52 2HD2 LEU 52 -17.763 6.597 -25.513 401 HD23 LEU 52 3HD2 LEU 52 -19.440 6.052 -25.582 402 H GLU 53 H GLU 53 -18.988 11.552 -26.953 403 HA GLU 53 HA GLU 53 -20.250 11.047 -29.421 404 HB2 GLU 53 1HB GLU 53 -20.107 13.179 -27.683 405 HB3 GLU 53 2HB GLU 53 -19.228 13.770 -29.086 406 HG2 GLU 53 1HG GLU 53 -21.118 13.370 -30.509 407 HG3 GLU 53 2HG GLU 53 -21.996 12.597 -29.191 408 H ASP 54 H ASP 54 -16.955 11.689 -28.568 409 HA ASP 54 HA ASP 54 -16.089 12.494 -31.172 410 HB2 ASP 54 1HB ASP 54 -14.850 13.129 -29.146 411 HB3 ASP 54 2HB ASP 54 -14.490 11.434 -28.833 412 H LEU 55 H LEU 55 -16.130 9.452 -29.376 413 HA LEU 55 HA LEU 55 -14.687 7.943 -31.289 414 HB2 LEU 55 1HB LEU 55 -16.677 7.047 -29.209 415 HB3 LEU 55 2HB LEU 55 -15.602 5.981 -30.112 416 HG LEU 55 HG LEU 55 -14.186 8.100 -28.691 417 HD11 LEU 55 1HD1 LEU 55 -14.585 6.553 -26.537 418 HD12 LEU 55 2HD1 LEU 55 -16.186 6.462 -27.271 419 HD13 LEU 55 3HD1 LEU 55 -15.495 8.030 -26.855 420 HD21 LEU 55 1HD2 LEU 55 -13.686 5.567 -29.704 421 HD22 LEU 55 2HD2 LEU 55 -13.626 5.357 -27.954 422 HD23 LEU 55 3HD2 LEU 55 -12.588 6.551 -28.736 423 H GLY 56 H GLY 56 -18.058 8.807 -30.942 424 HA2 GLY 56 1HA GLY 56 -19.186 8.858 -33.202 425 HA3 GLY 56 2HA GLY 56 -18.678 7.180 -33.329 426 H VAL 57 H VAL 57 -19.873 8.703 -30.393 427 HA VAL 57 HA VAL 57 -22.260 6.980 -30.562 428 HB VAL 57 HB VAL 57 -20.909 7.884 -28.019 429 HG11 VAL 57 1HG1 VAL 57 -22.349 6.355 -26.904 430 HG12 VAL 57 2HG1 VAL 57 -23.361 7.333 -27.969 431 HG13 VAL 57 3HG1 VAL 57 -22.926 5.687 -28.431 432 HG21 VAL 57 1HG2 VAL 57 -20.638 5.119 -28.275 433 HG22 VAL 57 2HG2 VAL 57 -20.190 5.774 -29.850 434 HG23 VAL 57 3HG2 VAL 57 -19.361 6.329 -28.396 435 H SER 58 H SER 58 -23.617 8.532 -31.444 436 HA SER 58 HA SER 58 -23.917 11.090 -30.090 437 HB2 SER 58 1HB SER 58 -24.849 11.847 -32.016 438 HB3 SER 58 2HB SER 58 -24.115 10.405 -32.716 439 HG SER 58 HG SER 58 -26.683 11.027 -32.592 440 H ARG 59 H ARG 59 -25.593 8.043 -30.458 441 HA ARG 59 HA ARG 59 -28.131 8.725 -29.565 442 HB2 ARG 59 1HB ARG 59 -26.586 6.298 -29.895 443 HB3 ARG 59 2HB ARG 59 -27.610 6.206 -28.468 444 HG2 ARG 59 1HG ARG 59 -29.101 5.437 -29.974 445 HG3 ARG 59 2HG ARG 59 -29.397 7.161 -30.205 446 HD2 ARG 59 1HD ARG 59 -28.242 7.227 -32.202 447 HD3 ARG 59 2HD ARG 59 -27.281 5.801 -31.812 448 HE ARG 59 HE ARG 59 -28.892 4.520 -32.791 449 HH11 ARG 59 1HH1 ARG 59 -30.280 7.602 -31.958 450 HH12 ARG 59 2HH1 ARG 59 -31.800 7.270 -32.720 451 HH21 ARG 59 1HH2 ARG 59 -30.889 4.071 -33.798 452 HH22 ARG 59 2HH2 ARG 59 -32.146 5.261 -33.765 453 H ILE 60 H ILE 60 -29.138 8.373 -27.476 454 HA ILE 60 HA ILE 60 -27.380 9.244 -25.301 455 HB ILE 60 HB ILE 60 -30.398 9.222 -25.415 456 HG12 ILE 60 1HG1 ILE 60 -29.407 10.795 -27.028 457 HG13 ILE 60 2HG1 ILE 60 -30.215 11.646 -25.717 458 HG21 ILE 60 1HG2 ILE 60 -28.570 9.530 -23.247 459 HG22 ILE 60 2HG2 ILE 60 -29.405 11.059 -23.519 460 HG23 ILE 60 3HG2 ILE 60 -30.332 9.588 -23.228 461 HD11 ILE 60 1HD1 ILE 60 -27.257 11.248 -26.073 462 HD12 ILE 60 2HD1 ILE 60 -28.163 12.757 -26.203 463 HD13 ILE 60 3HD1 ILE 60 -28.001 11.957 -24.640 464 H GLY 61 H GLY 61 -29.803 6.783 -26.085 465 HA2 GLY 61 1HA GLY 61 -29.814 5.492 -23.578 466 HA3 GLY 61 2HA GLY 61 -30.297 4.767 -25.104 467 H HIS 62 H HIS 62 -27.503 5.468 -26.131 468 HA HIS 62 HA HIS 62 -26.291 2.972 -25.267 469 HB2 HIS 62 1HB HIS 62 -25.407 4.950 -27.378 470 HB3 HIS 62 2HB HIS 62 -24.693 3.366 -27.095 471 HD1 HIS 62 HD1 HIS 62 -26.137 4.376 -29.767 472 HD2 HIS 62 HD2 HIS 62 -27.731 1.851 -26.878 473 HE1 HIS 62 HE1 HIS 62 -27.934 3.064 -30.938 474 H GLN 63 H GLN 63 -25.519 6.430 -25.305 475 HA GLN 63 HA GLN 63 -22.951 6.334 -24.267 476 HB2 GLN 63 1HB GLN 63 -25.138 8.385 -23.974 477 HB3 GLN 63 2HB GLN 63 -23.529 8.630 -23.307 478 HG2 GLN 63 1HG GLN 63 -22.536 8.620 -25.449 479 HG3 GLN 63 2HG GLN 63 -24.010 8.019 -26.207 480 HE21 GLN 63 2HE2 GLN 63 -22.268 10.526 -26.432 481 HE22 GLN 63 1HE2 GLN 63 -23.417 11.816 -26.418 482 H GLU 64 H GLU 64 -26.052 6.145 -22.616 483 HA GLU 64 HA GLU 64 -24.868 6.226 -19.989 484 HB2 GLU 64 1HB GLU 64 -27.649 5.786 -21.035 485 HB3 GLU 64 2HB GLU 64 -27.268 5.478 -19.347 486 HG2 GLU 64 1HG GLU 64 -26.196 7.979 -19.811 487 HG3 GLU 64 2HG GLU 64 -27.703 7.986 -20.726 488 H LEU 65 H LEU 65 -25.825 3.797 -22.291 489 HA LEU 65 HA LEU 65 -26.057 1.568 -20.638 490 HB2 LEU 65 1HB LEU 65 -25.651 2.090 -23.468 491 HB3 LEU 65 2HB LEU 65 -24.858 0.608 -22.937 492 HG LEU 65 HG LEU 65 -27.788 1.224 -22.565 493 HD11 LEU 65 1HD1 LEU 65 -26.413 -0.556 -24.572 494 HD12 LEU 65 2HD1 LEU 65 -27.243 0.960 -24.922 495 HD13 LEU 65 3HD1 LEU 65 -28.155 -0.428 -24.329 496 HD21 LEU 65 1HD2 LEU 65 -28.023 -0.817 -21.573 497 HD22 LEU 65 2HD2 LEU 65 -26.400 -0.408 -21.019 498 HD23 LEU 65 3HD2 LEU 65 -26.616 -1.501 -22.387 499 H ILE 66 H ILE 66 -23.184 2.978 -22.158 500 HA ILE 66 HA ILE 66 -21.398 0.991 -21.145 501 HB ILE 66 HB ILE 66 -20.721 3.760 -22.139 502 HG12 ILE 66 1HG1 ILE 66 -20.788 1.165 -23.691 503 HG13 ILE 66 2HG1 ILE 66 -22.046 2.394 -23.764 504 HG21 ILE 66 1HG2 ILE 66 -18.709 1.902 -22.753 505 HG22 ILE 66 2HG2 ILE 66 -18.639 3.227 -21.591 506 HG23 ILE 66 3HG2 ILE 66 -19.145 1.621 -21.068 507 HD11 ILE 66 1HD1 ILE 66 -20.472 2.492 -25.652 508 HD12 ILE 66 2HD1 ILE 66 -20.501 3.979 -24.704 509 HD13 ILE 66 3HD1 ILE 66 -19.168 2.840 -24.517 510 H LEU 67 H LEU 67 -21.923 4.419 -20.309 511 HA LEU 67 HA LEU 67 -20.184 4.610 -18.176 512 HB2 LEU 67 1HB LEU 67 -22.893 5.910 -18.417 513 HB3 LEU 67 2HB LEU 67 -21.581 6.440 -17.366 514 HG LEU 67 HG LEU 67 -21.243 6.342 -20.347 515 HD11 LEU 67 1HD1 LEU 67 -23.197 7.686 -20.045 516 HD12 LEU 67 2HD1 LEU 67 -21.831 8.762 -20.340 517 HD13 LEU 67 3HD1 LEU 67 -22.454 8.557 -18.703 518 HD21 LEU 67 1HD2 LEU 67 -19.475 7.864 -19.965 519 HD22 LEU 67 2HD2 LEU 67 -19.299 6.595 -18.752 520 HD23 LEU 67 3HD2 LEU 67 -19.986 8.157 -18.303 521 H GLU 68 H GLU 68 -23.621 3.682 -18.084 522 HA GLU 68 HA GLU 68 -23.905 3.292 -15.366 523 HB2 GLU 68 1HB GLU 68 -25.707 3.152 -17.124 524 HB3 GLU 68 2HB GLU 68 -25.142 1.525 -17.479 525 HG2 GLU 68 1HG GLU 68 -26.033 0.651 -15.598 526 HG3 GLU 68 2HG GLU 68 -25.761 2.115 -14.655 527 H ALA 69 H ALA 69 -22.294 1.291 -17.721 528 HA ALA 69 HA ALA 69 -22.062 -0.985 -15.962 529 HB1 ALA 69 1HB ALA 69 -20.511 -0.528 -18.497 530 HB2 ALA 69 2HB ALA 69 -20.922 -2.060 -17.725 531 HB3 ALA 69 3HB ALA 69 -22.182 -1.092 -18.491 532 H VAL 70 H VAL 70 -20.097 1.757 -16.922 533 HA VAL 70 HA VAL 70 -17.626 0.862 -15.905 534 HB VAL 70 HB VAL 70 -18.635 3.697 -16.186 535 HG11 VAL 70 1HG1 VAL 70 -16.154 4.188 -16.338 536 HG12 VAL 70 2HG1 VAL 70 -16.771 3.769 -14.739 537 HG13 VAL 70 3HG1 VAL 70 -15.891 2.570 -15.689 538 HG21 VAL 70 1HG2 VAL 70 -17.077 3.523 -18.253 539 HG22 VAL 70 2HG2 VAL 70 -17.316 1.785 -18.073 540 HG23 VAL 70 3HG2 VAL 70 -18.702 2.842 -18.339 541 H ASP 71 H ASP 71 -20.369 2.457 -14.406 542 HA ASP 71 HA ASP 71 -19.219 3.301 -12.021 543 HB2 ASP 71 1HB ASP 71 -21.709 3.420 -13.031 544 HB3 ASP 71 2HB ASP 71 -21.939 2.124 -11.860 545 H LEU 72 H LEU 72 -20.005 0.109 -13.110 546 HA LEU 72 HA LEU 72 -19.842 -1.076 -10.478 547 HB2 LEU 72 1HB LEU 72 -20.187 -2.155 -13.253 548 HB3 LEU 72 2HB LEU 72 -19.860 -3.227 -11.892 549 HG LEU 72 HG LEU 72 -22.153 -1.332 -11.701 550 HD11 LEU 72 1HD1 LEU 72 -23.547 -2.478 -13.084 551 HD12 LEU 72 2HD1 LEU 72 -22.653 -3.989 -12.921 552 HD13 LEU 72 3HD1 LEU 72 -22.036 -2.707 -13.964 553 HD21 LEU 72 1HD2 LEU 72 -23.014 -3.614 -10.669 554 HD22 LEU 72 2HD2 LEU 72 -22.006 -2.497 -9.749 555 HD23 LEU 72 3HD2 LEU 72 -21.282 -3.911 -10.516 556 H LEU 73 H LEU 73 -17.788 -0.674 -13.295 557 HA LEU 73 HA LEU 73 -15.765 -2.477 -12.743 558 HB2 LEU 73 1HB LEU 73 -15.981 0.066 -14.216 559 HB3 LEU 73 2HB LEU 73 -14.350 -0.406 -13.744 560 HG LEU 73 HG LEU 73 -16.216 -2.152 -15.345 561 HD11 LEU 73 1HD1 LEU 73 -15.715 -0.170 -16.629 562 HD12 LEU 73 2HD1 LEU 73 -14.808 -1.539 -17.272 563 HD13 LEU 73 3HD1 LEU 73 -13.996 -0.336 -16.271 564 HD21 LEU 73 1HD2 LEU 73 -14.035 -2.879 -13.903 565 HD22 LEU 73 2HD2 LEU 73 -13.304 -2.510 -15.466 566 HD23 LEU 73 3HD2 LEU 73 -14.596 -3.707 -15.356 567 H CYS 74 H CYS 74 -15.912 0.944 -11.745 568 HA CYS 74 HA CYS 74 -13.597 0.840 -10.133 569 HB2 CYS 74 1HB CYS 74 -15.344 2.819 -10.996 570 HB3 CYS 74 2HB CYS 74 -15.568 2.797 -9.251 571 HG CYS 74 HG CYS 74 -13.600 4.392 -8.873 572 H ALA 75 H ALA 75 -16.962 0.125 -9.517 573 HA ALA 75 HA ALA 75 -16.846 0.120 -6.691 574 HB1 ALA 75 1HB ALA 75 -18.724 -0.971 -8.729 575 HB2 ALA 75 2HB ALA 75 -18.871 -1.510 -7.056 576 HB3 ALA 75 3HB ALA 75 -19.008 0.204 -7.445 577 H LEU 76 H LEU 76 -16.164 -2.317 -9.130 578 HA LEU 76 HA LEU 76 -16.040 -4.555 -7.429 579 HB2 LEU 76 1HB LEU 76 -15.157 -3.879 -10.154 580 HB3 LEU 76 2HB LEU 76 -14.257 -5.176 -9.369 581 HG LEU 76 HG LEU 76 -17.239 -5.129 -9.832 582 HD11 LEU 76 1HD1 LEU 76 -16.745 -5.842 -11.875 583 HD12 LEU 76 2HD1 LEU 76 -16.059 -7.290 -11.139 584 HD13 LEU 76 3HD1 LEU 76 -15.023 -5.909 -11.499 585 HD21 LEU 76 1HD2 LEU 76 -16.854 -6.377 -7.868 586 HD22 LEU 76 2HD2 LEU 76 -15.405 -7.129 -8.536 587 HD23 LEU 76 3HD2 LEU 76 -16.995 -7.561 -9.167 588 H ASN 77 H ASN 77 -13.504 -2.342 -8.570 589 HA ASN 77 HA ASN 77 -11.298 -3.536 -7.413 590 HB2 ASN 77 1HB ASN 77 -11.987 -0.858 -8.379 591 HB3 ASN 77 2HB ASN 77 -10.766 -0.848 -7.111 592 HD21 ASN 77 2HD2 ASN 77 -11.567 -2.007 -10.306 593 HD22 ASN 77 1HD2 ASN 77 -9.947 -2.350 -10.799 594 H SER 78 H SER 78 -13.144 -0.829 -5.994 595 HA SER 78 HA SER 78 -12.049 -1.484 -3.372 596 HB2 SER 78 1HB SER 78 -13.902 0.800 -4.070 597 HB3 SER 78 2HB SER 78 -12.866 0.649 -2.650 598 HG SER 78 HG SER 78 -11.091 0.586 -4.276 599 H GLY 79 H GLY 79 -13.467 -3.559 -3.800 600 HA2 GLY 79 1HA GLY 79 -16.255 -3.156 -3.042 601 HA3 GLY 79 2HA GLY 79 -15.515 -4.677 -3.517 602 HA PRO 80 HA PRO 80 -16.025 -4.313 1.177 603 HB2 PRO 80 1HB PRO 80 -17.950 -6.206 1.467 604 HB3 PRO 80 2HB PRO 80 -18.315 -4.496 1.204 605 HG2 PRO 80 1HG PRO 80 -18.289 -6.751 -0.764 606 HG3 PRO 80 2HG PRO 80 -19.465 -5.436 -0.585 607 HD2 PRO 80 1HD PRO 80 -17.526 -5.410 -2.475 608 HD3 PRO 80 2HD PRO 80 -18.137 -3.927 -1.714 609 H SER 81 H SER 81 -15.838 -6.951 -1.125 610 HA SER 81 HA SER 81 -14.804 -8.981 -1.083 611 HB2 SER 81 1HB SER 81 -12.826 -7.530 -0.870 612 HB3 SER 81 2HB SER 81 -12.993 -7.557 0.885 613 HG SER 81 HG SER 81 -12.400 -9.653 0.924 614 H SER 82 H SER 82 -17.029 -8.807 0.594 615 HA SER 82 HA SER 82 -16.300 -10.793 2.622 616 HB2 SER 82 1HB SER 82 -17.996 -9.656 4.169 617 HB3 SER 82 2HB SER 82 -16.441 -8.849 3.968 618 HG SER 82 HG SER 82 -17.521 -7.193 3.292 619 H GLY 83 H GLY 83 -17.185 -12.228 0.989 620 HA2 GLY 83 1HA GLY 83 -19.922 -12.841 1.493 621 HA3 GLY 83 2HA GLY 83 -19.721 -12.136 -0.104 Start of MODEL 4 1 H1 GLY 1 H GLY 1 -7.790 9.838 -6.989 2 HA2 GLY 1 1HA GLY 1 -9.123 7.952 -8.252 3 HA3 GLY 1 2HA GLY 1 -7.818 8.188 -9.405 4 H SER 2 H SER 2 -6.011 8.821 -7.041 5 HA SER 2 HA SER 2 -5.389 6.020 -6.427 6 HB2 SER 2 1HB SER 2 -3.213 7.393 -5.560 7 HB3 SER 2 2HB SER 2 -3.391 6.774 -7.202 8 HG SER 2 HG SER 2 -2.872 9.152 -6.759 9 H SER 3 H SER 3 -6.434 5.442 -4.613 10 HA SER 3 HA SER 3 -5.894 7.017 -2.195 11 HB2 SER 3 1HB SER 3 -8.255 7.382 -3.178 12 HB3 SER 3 2HB SER 3 -8.585 5.737 -2.634 13 HG SER 3 HG SER 3 -7.509 7.687 -0.898 14 H GLY 4 H GLY 4 -4.721 4.570 -3.296 15 HA2 GLY 4 1HA GLY 4 -3.938 3.031 -1.396 16 HA3 GLY 4 2HA GLY 4 -5.634 2.578 -1.325 17 H SER 5 H SER 5 -6.481 2.094 -3.717 18 HA SER 5 HA SER 5 -4.513 0.588 -5.245 19 HB2 SER 5 1HB SER 5 -5.240 -1.087 -3.664 20 HB3 SER 5 2HB SER 5 -6.933 -0.693 -3.957 21 HG SER 5 HG SER 5 -6.368 -2.524 -5.137 22 H SER 6 H SER 6 -5.107 0.216 -7.379 23 HA SER 6 HA SER 6 -7.727 0.698 -8.378 24 HB2 SER 6 1HB SER 6 -7.066 2.721 -9.762 25 HB3 SER 6 2HB SER 6 -7.279 3.018 -8.036 26 HG SER 6 HG SER 6 -5.147 3.250 -7.791 27 H GLY 7 H GLY 7 -7.891 -0.615 -10.064 28 HA2 GLY 7 1HA GLY 7 -5.442 -1.269 -11.568 29 HA3 GLY 7 2HA GLY 7 -6.846 -2.316 -11.422 30 H VAL 8 H VAL 8 -8.880 -0.510 -12.009 31 HA VAL 8 HA VAL 8 -8.918 -0.582 -14.807 32 HB VAL 8 HB VAL 8 -10.582 1.204 -13.027 33 HG11 VAL 8 1HG1 VAL 8 -11.113 0.122 -15.792 34 HG12 VAL 8 2HG1 VAL 8 -12.211 1.121 -14.838 35 HG13 VAL 8 3HG1 VAL 8 -10.678 1.786 -15.403 36 HG21 VAL 8 1HG2 VAL 8 -12.194 -0.870 -13.595 37 HG22 VAL 8 2HG2 VAL 8 -10.640 -1.702 -13.544 38 HG23 VAL 8 3HG2 VAL 8 -11.196 -0.786 -12.144 39 H SER 9 H SER 9 -7.678 1.782 -12.605 40 HA SER 9 HA SER 9 -7.684 3.999 -14.393 41 HB2 SER 9 1HB SER 9 -6.065 4.988 -12.757 42 HB3 SER 9 2HB SER 9 -7.554 4.404 -12.015 43 HG SER 9 HG SER 9 -5.007 3.635 -11.564 44 H LYS 10 H LYS 10 -5.576 1.296 -13.877 45 HA LYS 10 HA LYS 10 -3.582 2.470 -15.695 46 HB2 LYS 10 1HB LYS 10 -3.282 0.108 -13.831 47 HB3 LYS 10 2HB LYS 10 -2.011 0.816 -14.819 48 HG2 LYS 10 1HG LYS 10 -3.184 2.859 -13.209 49 HG3 LYS 10 2HG LYS 10 -2.751 1.486 -12.188 50 HD2 LYS 10 1HD LYS 10 -0.847 2.638 -14.209 51 HD3 LYS 10 2HD LYS 10 -0.967 3.273 -12.566 52 HE2 LYS 10 1HE LYS 10 -0.790 0.464 -12.360 53 HE3 LYS 10 2HE LYS 10 0.442 0.973 -13.514 54 HZ1 LYS 10 1HZ LYS 10 1.470 2.315 -11.937 55 HZ2 LYS 10 2HZ LYS 10 1.062 0.928 -11.060 56 HZ3 LYS 10 3HZ LYS 10 0.127 2.329 -10.909 57 H TRP 11 H TRP 11 -6.186 1.134 -16.363 58 HA TRP 11 HA TRP 11 -5.551 -1.398 -17.522 59 HB2 TRP 11 1HB TRP 11 -7.899 0.367 -17.360 60 HB3 TRP 11 2HB TRP 11 -7.801 -0.575 -18.845 61 HD1 TRP 11 HD1 TRP 11 -6.507 -2.088 -15.593 62 HE1 TRP 11 HE1 TRP 11 -8.048 -4.033 -14.912 63 HE3 TRP 11 HE3 TRP 11 -10.228 -1.419 -19.035 64 HZ2 TRP 11 HZ2 TRP 11 -10.514 -5.139 -15.726 65 HZ3 TRP 11 HZ3 TRP 11 -12.142 -2.965 -19.017 66 HH2 TRP 11 HH2 TRP 11 -12.281 -4.786 -17.396 67 H SER 12 H SER 12 -4.843 -1.890 -19.519 68 HA SER 12 HA SER 12 -3.600 0.083 -21.104 69 HB2 SER 12 1HB SER 12 -3.993 -2.830 -21.224 70 HB3 SER 12 2HB SER 12 -3.843 -2.055 -22.801 71 HG SER 12 HG SER 12 -1.967 -2.386 -20.800 72 HA PRO 13 HA PRO 13 -6.708 1.500 -23.855 73 HB2 PRO 13 1HB PRO 13 -5.385 1.629 -26.222 74 HB3 PRO 13 2HB PRO 13 -5.086 2.754 -24.892 75 HG2 PRO 13 1HG PRO 13 -3.538 0.323 -25.701 76 HG3 PRO 13 2HG PRO 13 -2.939 1.917 -25.205 77 HD2 PRO 13 1HD PRO 13 -2.995 -0.205 -23.524 78 HD3 PRO 13 2HD PRO 13 -3.219 1.465 -22.963 79 H SER 14 H SER 14 -5.144 -1.519 -24.509 80 HA SER 14 HA SER 14 -7.082 -2.239 -26.571 81 HB2 SER 14 1HB SER 14 -5.111 -3.132 -27.299 82 HB3 SER 14 2HB SER 14 -4.459 -3.294 -25.668 83 HG SER 14 HG SER 14 -4.886 -5.336 -26.083 84 H GLN 15 H GLN 15 -6.397 -2.768 -23.219 85 HA GLN 15 HA GLN 15 -7.846 -5.158 -22.837 86 HB2 GLN 15 1HB GLN 15 -7.011 -2.924 -21.008 87 HB3 GLN 15 2HB GLN 15 -8.013 -4.245 -20.422 88 HG2 GLN 15 1HG GLN 15 -6.262 -5.833 -21.186 89 HG3 GLN 15 2HG GLN 15 -5.249 -4.448 -21.590 90 HE21 GLN 15 2HE2 GLN 15 -3.971 -5.886 -19.983 91 HE22 GLN 15 1HE2 GLN 15 -4.067 -5.393 -18.330 92 H VAL 16 H VAL 16 -8.781 -1.749 -22.522 93 HA VAL 16 HA VAL 16 -11.361 -2.065 -21.569 94 HB VAL 16 HB VAL 16 -10.386 0.013 -23.535 95 HG11 VAL 16 1HG1 VAL 16 -12.913 -0.297 -21.984 96 HG12 VAL 16 2HG1 VAL 16 -12.267 1.322 -22.259 97 HG13 VAL 16 3HG1 VAL 16 -12.665 0.285 -23.630 98 HG21 VAL 16 1HG2 VAL 16 -10.652 1.080 -20.953 99 HG22 VAL 16 2HG2 VAL 16 -9.795 -0.449 -20.765 100 HG23 VAL 16 3HG2 VAL 16 -9.162 0.789 -21.850 101 H VAL 17 H VAL 17 -10.115 -2.487 -24.814 102 HA VAL 17 HA VAL 17 -12.584 -2.516 -26.184 103 HB VAL 17 HB VAL 17 -10.089 -4.021 -26.969 104 HG11 VAL 17 1HG1 VAL 17 -12.091 -2.766 -28.811 105 HG12 VAL 17 2HG1 VAL 17 -10.922 -4.045 -29.143 106 HG13 VAL 17 3HG1 VAL 17 -12.345 -4.384 -28.157 107 HG21 VAL 17 1HG2 VAL 17 -10.168 -1.639 -28.392 108 HG22 VAL 17 2HG2 VAL 17 -10.562 -1.175 -26.736 109 HG23 VAL 17 3HG2 VAL 17 -9.066 -2.044 -27.076 110 H ASP 18 H ASP 18 -10.793 -4.969 -24.438 111 HA ASP 18 HA ASP 18 -12.338 -7.180 -25.375 112 HB2 ASP 18 1HB ASP 18 -9.964 -7.129 -24.267 113 HB3 ASP 18 2HB ASP 18 -10.873 -7.217 -22.761 114 H TRP 19 H TRP 19 -12.702 -4.826 -22.864 115 HA TRP 19 HA TRP 19 -14.537 -6.284 -21.249 116 HB2 TRP 19 1HB TRP 19 -13.310 -4.410 -20.315 117 HB3 TRP 19 2HB TRP 19 -14.030 -3.312 -21.489 118 HD1 TRP 19 HD1 TRP 19 -15.466 -5.776 -18.837 119 HE1 TRP 19 HE1 TRP 19 -17.380 -4.572 -17.607 120 HE3 TRP 19 HE3 TRP 19 -15.332 -1.304 -21.310 121 HZ2 TRP 19 HZ2 TRP 19 -18.663 -2.058 -17.677 122 HZ3 TRP 19 HZ3 TRP 19 -16.937 0.447 -20.668 123 HH2 TRP 19 HH2 TRP 19 -18.567 0.076 -18.889 124 H MET 20 H MET 20 -14.913 -3.891 -23.837 125 HA MET 20 HA MET 20 -17.704 -3.650 -23.712 126 HB2 MET 20 1HB MET 20 -16.007 -3.425 -26.200 127 HB3 MET 20 2HB MET 20 -17.572 -2.678 -25.912 128 HG2 MET 20 1HG MET 20 -16.537 -1.361 -24.078 129 HG3 MET 20 2HG MET 20 -14.975 -2.028 -24.545 130 HE1 MET 20 1HE MET 20 -17.590 0.993 -26.665 131 HE2 MET 20 2HE MET 20 -17.807 -0.614 -27.359 132 HE3 MET 20 3HE MET 20 -18.096 -0.349 -25.639 133 H LYS 21 H LYS 21 -15.682 -6.155 -24.948 134 HA LYS 21 HA LYS 21 -17.469 -7.324 -26.795 135 HB2 LYS 21 1HB LYS 21 -15.235 -8.554 -25.172 136 HB3 LYS 21 2HB LYS 21 -16.078 -9.374 -26.480 137 HG2 LYS 21 1HG LYS 21 -15.349 -7.233 -27.833 138 HG3 LYS 21 2HG LYS 21 -14.103 -7.159 -26.585 139 HD2 LYS 21 1HD LYS 21 -13.097 -9.090 -27.282 140 HD3 LYS 21 2HD LYS 21 -14.601 -9.778 -27.901 141 HE2 LYS 21 1HE LYS 21 -14.351 -7.723 -29.589 142 HE3 LYS 21 2HE LYS 21 -12.648 -7.972 -29.208 143 HZ1 LYS 21 1HZ LYS 21 -13.754 -10.475 -29.685 144 HZ2 LYS 21 2HZ LYS 21 -12.642 -9.637 -30.644 145 HZ3 LYS 21 3HZ LYS 21 -14.301 -9.467 -30.928 146 H GLY 22 H GLY 22 -17.553 -7.128 -23.412 147 HA2 GLY 22 1HA GLY 22 -19.469 -9.376 -23.292 148 HA3 GLY 22 2HA GLY 22 -18.451 -8.894 -21.943 149 H LEU 23 H LEU 23 -19.977 -6.518 -23.979 150 HA LEU 23 HA LEU 23 -21.834 -5.895 -21.777 151 HB2 LEU 23 1HB LEU 23 -20.659 -3.932 -23.734 152 HB3 LEU 23 2HB LEU 23 -21.632 -3.568 -22.310 153 HG LEU 23 HG LEU 23 -18.805 -4.618 -22.354 154 HD11 LEU 23 1HD1 LEU 23 -20.020 -1.987 -21.535 155 HD12 LEU 23 2HD1 LEU 23 -18.876 -2.282 -22.845 156 HD13 LEU 23 3HD1 LEU 23 -18.363 -2.470 -21.168 157 HD21 LEU 23 1HD2 LEU 23 -18.989 -4.262 -19.855 158 HD22 LEU 23 2HD2 LEU 23 -19.833 -5.667 -20.507 159 HD23 LEU 23 3HD2 LEU 23 -20.737 -4.212 -20.086 160 H ASP 24 H ASP 24 -23.409 -4.028 -22.962 161 HA ASP 24 HA ASP 24 -25.322 -5.491 -24.311 162 HB2 ASP 24 1HB ASP 24 -25.114 -2.899 -23.382 163 HB3 ASP 24 2HB ASP 24 -25.281 -2.680 -25.122 164 H ASP 25 H ASP 25 -25.964 -5.650 -26.477 165 HA ASP 25 HA ASP 25 -23.864 -5.953 -28.343 166 HB2 ASP 25 1HB ASP 25 -26.839 -6.156 -28.439 167 HB3 ASP 25 2HB ASP 25 -25.965 -6.046 -29.964 168 H CYS 26 H CYS 26 -25.950 -3.306 -27.549 169 HA CYS 26 HA CYS 26 -25.652 -1.850 -29.974 170 HB2 CYS 26 1HB CYS 26 -26.460 -1.027 -27.184 171 HB3 CYS 26 2HB CYS 26 -26.414 0.100 -28.534 172 HG CYS 26 HG CYS 26 -28.790 -0.400 -29.339 173 H LEU 27 H LEU 27 -23.665 -2.306 -27.198 174 HA LEU 27 HA LEU 27 -22.003 0.011 -27.829 175 HB2 LEU 27 1HB LEU 27 -21.491 -1.988 -25.651 176 HB3 LEU 27 2HB LEU 27 -20.938 -0.318 -25.761 177 HG LEU 27 HG LEU 27 -23.803 -1.150 -25.311 178 HD11 LEU 27 1HD1 LEU 27 -23.385 -1.334 -23.142 179 HD12 LEU 27 2HD1 LEU 27 -22.561 0.225 -23.118 180 HD13 LEU 27 3HD1 LEU 27 -21.662 -1.241 -23.510 181 HD21 LEU 27 1HD2 LEU 27 -24.017 0.955 -26.160 182 HD22 LEU 27 2HD2 LEU 27 -22.401 1.447 -25.651 183 HD23 LEU 27 3HD2 LEU 27 -23.710 1.358 -24.471 184 H GLN 28 H GLN 28 -22.242 -2.505 -29.487 185 HA GLN 28 HA GLN 28 -19.545 -3.593 -29.310 186 HB2 GLN 28 1HB GLN 28 -21.865 -4.315 -31.108 187 HB3 GLN 28 2HB GLN 28 -20.314 -5.143 -31.089 188 HG2 GLN 28 1HG GLN 28 -22.185 -4.945 -28.741 189 HG3 GLN 28 2HG GLN 28 -22.071 -6.325 -29.832 190 HE21 GLN 28 2HE2 GLN 28 -21.423 -5.709 -26.880 191 HE22 GLN 28 1HE2 GLN 28 -19.872 -6.436 -26.662 192 H GLN 29 H GLN 29 -21.605 -1.902 -31.657 193 HA GLN 29 HA GLN 29 -19.790 -1.726 -33.754 194 HB2 GLN 29 1HB GLN 29 -21.117 0.137 -34.566 195 HB3 GLN 29 2HB GLN 29 -22.175 -1.112 -33.923 196 HG2 GLN 29 1HG GLN 29 -22.230 0.225 -31.779 197 HG3 GLN 29 2HG GLN 29 -21.454 1.524 -32.683 198 HE21 GLN 29 2HE2 GLN 29 -24.275 0.739 -31.501 199 HE22 GLN 29 1HE2 GLN 29 -25.346 1.343 -32.714 200 H TYR 30 H TYR 30 -19.901 -0.007 -30.750 201 HA TYR 30 HA TYR 30 -18.203 2.152 -31.564 202 HB2 TYR 30 1HB TYR 30 -18.845 1.180 -28.773 203 HB3 TYR 30 2HB TYR 30 -18.144 2.737 -29.197 204 HD1 TYR 30 HD2 TYR 30 -19.826 3.505 -31.507 205 HD2 TYR 30 HD1 TYR 30 -20.893 1.723 -27.794 206 HE1 TYR 30 HE2 TYR 30 -22.080 4.471 -31.698 207 HE2 TYR 30 HE1 TYR 30 -23.150 2.683 -27.975 208 HH TYR 30 HH TYR 30 -23.949 5.130 -30.008 209 H ILE 31 H ILE 31 -17.734 -1.065 -30.376 210 HA ILE 31 HA ILE 31 -15.234 -0.950 -29.216 211 HB ILE 31 HB ILE 31 -16.252 -3.134 -31.037 212 HG12 ILE 31 1HG1 ILE 31 -16.493 -2.808 -28.038 213 HG13 ILE 31 2HG1 ILE 31 -17.805 -2.615 -29.196 214 HG21 ILE 31 1HG2 ILE 31 -14.101 -3.143 -28.925 215 HG22 ILE 31 2HG2 ILE 31 -14.733 -4.580 -29.727 216 HG23 ILE 31 3HG2 ILE 31 -13.881 -3.352 -30.662 217 HD11 ILE 31 1HD1 ILE 31 -17.957 -4.765 -28.136 218 HD12 ILE 31 2HD1 ILE 31 -17.539 -4.977 -29.836 219 HD13 ILE 31 3HD1 ILE 31 -16.297 -5.147 -28.595 220 H LYS 32 H LYS 32 -16.041 -1.216 -32.660 221 HA LYS 32 HA LYS 32 -13.425 -1.454 -33.637 222 HB2 LYS 32 1HB LYS 32 -15.915 -0.304 -34.902 223 HB3 LYS 32 2HB LYS 32 -14.409 -0.550 -35.777 224 HG2 LYS 32 1HG LYS 32 -15.643 -2.837 -34.316 225 HG3 LYS 32 2HG LYS 32 -16.301 -2.336 -35.875 226 HD2 LYS 32 1HD LYS 32 -13.588 -2.389 -36.334 227 HD3 LYS 32 2HD LYS 32 -13.834 -3.762 -35.252 228 HE2 LYS 32 1HE LYS 32 -15.434 -3.267 -37.759 229 HE3 LYS 32 2HE LYS 32 -14.018 -4.314 -37.679 230 HZ1 LYS 32 1HZ LYS 32 -16.625 -4.676 -36.324 231 HZ2 LYS 32 2HZ LYS 32 -15.245 -5.545 -35.877 232 HZ3 LYS 32 3HZ LYS 32 -15.876 -5.707 -37.438 233 H ASN 33 H ASN 33 -15.237 1.304 -32.539 234 HA ASN 33 HA ASN 33 -13.369 3.214 -33.664 235 HB2 ASN 33 1HB ASN 33 -15.820 3.486 -31.925 236 HB3 ASN 33 2HB ASN 33 -14.791 4.859 -32.324 237 HD21 ASN 33 2HD2 ASN 33 -17.559 4.454 -32.993 238 HD22 ASN 33 1HD2 ASN 33 -17.664 4.476 -34.717 239 H PHE 34 H PHE 34 -13.957 1.590 -30.644 240 HA PHE 34 HA PHE 34 -12.352 3.326 -29.038 241 HB2 PHE 34 1HB PHE 34 -13.721 0.712 -28.662 242 HB3 PHE 34 2HB PHE 34 -12.399 1.095 -27.565 243 HD1 PHE 34 HD2 PHE 34 -15.254 2.982 -29.062 244 HD2 PHE 34 HD1 PHE 34 -13.106 1.905 -25.549 245 HE1 PHE 34 HE2 PHE 34 -16.782 4.357 -27.710 246 HE2 PHE 34 HE1 PHE 34 -14.631 3.277 -24.191 247 HZ PHE 34 HZ PHE 34 -16.471 4.507 -25.272 248 H GLU 35 H GLU 35 -11.746 0.583 -31.070 249 HA GLU 35 HA GLU 35 -9.237 -0.169 -29.974 250 HB2 GLU 35 1HB GLU 35 -10.938 -1.051 -32.066 251 HB3 GLU 35 2HB GLU 35 -9.356 -0.754 -32.773 252 HG2 GLU 35 1HG GLU 35 -9.795 -2.439 -30.323 253 HG3 GLU 35 2HG GLU 35 -9.741 -3.084 -31.962 254 H ARG 36 H ARG 36 -10.105 1.772 -32.832 255 HA ARG 36 HA ARG 36 -7.425 2.476 -33.451 256 HB2 ARG 36 1HB ARG 36 -9.623 2.557 -34.900 257 HB3 ARG 36 2HB ARG 36 -9.732 4.194 -34.267 258 HG2 ARG 36 1HG ARG 36 -7.651 4.797 -35.250 259 HG3 ARG 36 2HG ARG 36 -7.308 3.121 -35.686 260 HD2 ARG 36 1HD ARG 36 -8.370 3.376 -37.619 261 HD3 ARG 36 2HD ARG 36 -9.838 3.866 -36.774 262 HE ARG 36 HE ARG 36 -8.336 6.116 -36.761 263 HH11 ARG 36 1HH1 ARG 36 -9.335 3.919 -39.271 264 HH12 ARG 36 2HH1 ARG 36 -9.358 5.134 -40.505 265 HH21 ARG 36 1HH2 ARG 36 -8.363 7.724 -38.378 266 HH22 ARG 36 2HH2 ARG 36 -8.804 7.298 -39.996 267 H GLU 37 H GLU 37 -9.822 3.775 -31.306 268 HA GLU 37 HA GLU 37 -8.530 6.330 -30.990 269 HB2 GLU 37 1HB GLU 37 -10.853 4.951 -29.693 270 HB3 GLU 37 2HB GLU 37 -10.155 6.377 -28.939 271 HG2 GLU 37 1HG GLU 37 -10.669 6.732 -31.779 272 HG3 GLU 37 2HG GLU 37 -12.119 6.355 -30.852 273 H LYS 38 H LYS 38 -8.221 3.193 -29.631 274 HA LYS 38 HA LYS 38 -6.907 2.321 -27.992 275 HB2 LYS 38 1HB LYS 38 -5.394 4.916 -28.338 276 HB3 LYS 38 2HB LYS 38 -4.790 3.485 -27.513 277 HG2 LYS 38 1HG LYS 38 -5.675 3.335 -30.366 278 HG3 LYS 38 2HG LYS 38 -4.068 3.934 -29.946 279 HD2 LYS 38 1HD LYS 38 -3.676 1.829 -28.684 280 HD3 LYS 38 2HD LYS 38 -5.233 1.234 -29.266 281 HE2 LYS 38 1HE LYS 38 -4.451 1.422 -31.569 282 HE3 LYS 38 2HE LYS 38 -2.906 2.055 -31.003 283 HZ1 LYS 38 1HZ LYS 38 -3.056 -0.413 -31.574 284 HZ2 LYS 38 2HZ LYS 38 -3.890 -0.582 -30.112 285 HZ3 LYS 38 3HZ LYS 38 -2.305 0.009 -30.118 286 H ILE 39 H ILE 39 -9.228 3.650 -27.135 287 HA ILE 39 HA ILE 39 -8.895 5.500 -25.082 288 HB ILE 39 HB ILE 39 -10.974 3.315 -25.264 289 HG12 ILE 39 1HG1 ILE 39 -10.966 4.725 -27.252 290 HG13 ILE 39 2HG1 ILE 39 -12.384 5.081 -26.272 291 HG21 ILE 39 1HG2 ILE 39 -11.536 4.010 -23.219 292 HG22 ILE 39 2HG2 ILE 39 -10.489 5.425 -23.320 293 HG23 ILE 39 3HG2 ILE 39 -12.112 5.479 -24.006 294 HD11 ILE 39 1HD1 ILE 39 -11.373 7.105 -27.164 295 HD12 ILE 39 2HD1 ILE 39 -11.292 7.072 -25.403 296 HD13 ILE 39 3HD1 ILE 39 -9.855 6.709 -26.358 297 H SER 40 H SER 40 -7.560 5.291 -23.410 298 HA SER 40 HA SER 40 -6.981 2.693 -22.267 299 HB2 SER 40 1HB SER 40 -5.179 4.356 -22.581 300 HB3 SER 40 2HB SER 40 -5.993 5.437 -21.450 301 HG SER 40 HG SER 40 -5.397 4.203 -19.811 302 H GLY 41 H GLY 41 -7.108 2.311 -19.935 303 HA2 GLY 41 1HA GLY 41 -9.663 2.615 -18.910 304 HA3 GLY 41 2HA GLY 41 -8.245 2.243 -17.940 305 H ASP 42 H ASP 42 -6.796 4.602 -18.271 306 HA ASP 42 HA ASP 42 -7.783 6.210 -16.253 307 HB2 ASP 42 1HB ASP 42 -5.458 6.311 -16.964 308 HB3 ASP 42 2HB ASP 42 -5.936 6.970 -18.526 309 H GLN 43 H GLN 43 -8.503 6.259 -19.662 310 HA GLN 43 HA GLN 43 -9.921 8.792 -19.462 311 HB2 GLN 43 1HB GLN 43 -9.229 6.943 -21.723 312 HB3 GLN 43 2HB GLN 43 -10.455 8.186 -21.933 313 HG2 GLN 43 1HG GLN 43 -8.397 9.596 -20.825 314 HG3 GLN 43 2HG GLN 43 -7.549 8.411 -21.817 315 HE21 GLN 43 2HE2 GLN 43 -9.004 8.105 -23.989 316 HE22 GLN 43 1HE2 GLN 43 -9.219 9.594 -24.838 317 H LEU 44 H LEU 44 -10.584 5.358 -19.809 318 HA LEU 44 HA LEU 44 -13.333 5.538 -20.371 319 HB2 LEU 44 1HB LEU 44 -12.085 3.490 -20.697 320 HB3 LEU 44 2HB LEU 44 -11.767 3.379 -18.967 321 HG LEU 44 HG LEU 44 -14.266 3.147 -18.652 322 HD11 LEU 44 1HD1 LEU 44 -15.248 2.097 -20.868 323 HD12 LEU 44 2HD1 LEU 44 -14.092 3.199 -21.616 324 HD13 LEU 44 3HD1 LEU 44 -15.341 3.828 -20.542 325 HD21 LEU 44 1HD2 LEU 44 -14.219 0.743 -19.583 326 HD22 LEU 44 2HD2 LEU 44 -13.046 1.193 -18.345 327 HD23 LEU 44 3HD2 LEU 44 -12.557 1.115 -20.038 328 H LEU 45 H LEU 45 -11.607 5.157 -17.287 329 HA LEU 45 HA LEU 45 -13.835 5.014 -15.614 330 HB2 LEU 45 1HB LEU 45 -11.000 5.865 -15.243 331 HB3 LEU 45 2HB LEU 45 -12.156 6.126 -13.939 332 HG LEU 45 HG LEU 45 -11.909 3.399 -15.123 333 HD11 LEU 45 1HD1 LEU 45 -9.676 3.527 -14.748 334 HD12 LEU 45 2HD1 LEU 45 -10.194 3.160 -13.103 335 HD13 LEU 45 3HD1 LEU 45 -9.833 4.823 -13.563 336 HD21 LEU 45 1HD2 LEU 45 -12.185 2.991 -12.543 337 HD22 LEU 45 2HD2 LEU 45 -13.573 3.408 -13.548 338 HD23 LEU 45 3HD2 LEU 45 -12.790 4.648 -12.566 339 H ARG 46 H ARG 46 -12.310 7.743 -17.152 340 HA ARG 46 HA ARG 46 -14.190 9.545 -15.774 341 HB2 ARG 46 1HB ARG 46 -12.648 11.351 -16.160 342 HB3 ARG 46 2HB ARG 46 -11.772 10.023 -15.409 343 HG2 ARG 46 1HG ARG 46 -11.061 9.358 -17.750 344 HG3 ARG 46 2HG ARG 46 -11.684 10.926 -18.269 345 HD2 ARG 46 1HD ARG 46 -9.829 10.871 -15.952 346 HD3 ARG 46 2HD ARG 46 -9.151 10.570 -17.552 347 HE ARG 46 HE ARG 46 -10.719 12.835 -17.779 348 HH11 ARG 46 1HH1 ARG 46 -7.904 11.838 -15.991 349 HH12 ARG 46 2HH1 ARG 46 -7.231 13.432 -15.907 350 HH21 ARG 46 1HH2 ARG 46 -9.844 14.939 -17.676 351 HH22 ARG 46 2HH2 ARG 46 -8.336 15.196 -16.865 352 H ILE 47 H ILE 47 -14.724 7.877 -18.133 353 HA ILE 47 HA ILE 47 -14.695 9.478 -20.473 354 HB ILE 47 HB ILE 47 -14.903 7.017 -20.531 355 HG12 ILE 47 1HG1 ILE 47 -17.385 7.591 -21.887 356 HG13 ILE 47 2HG1 ILE 47 -16.249 8.916 -22.115 357 HG21 ILE 47 1HG2 ILE 47 -17.801 7.135 -19.949 358 HG22 ILE 47 2HG2 ILE 47 -16.635 5.845 -19.657 359 HG23 ILE 47 3HG2 ILE 47 -16.704 7.234 -18.573 360 HD11 ILE 47 1HD1 ILE 47 -15.944 7.419 -23.915 361 HD12 ILE 47 2HD1 ILE 47 -14.565 7.201 -22.837 362 HD13 ILE 47 3HD1 ILE 47 -15.879 6.026 -22.835 363 H THR 48 H THR 48 -16.166 10.865 -21.308 364 HA THR 48 HA THR 48 -18.654 11.302 -19.794 365 HB THR 48 HB THR 48 -17.040 13.077 -19.229 366 HG1 THR 48 HG1 THR 48 -18.633 14.489 -19.274 367 HG21 THR 48 1HG2 THR 48 -15.788 14.162 -20.739 368 HG22 THR 48 2HG2 THR 48 -17.161 14.417 -21.816 369 HG23 THR 48 3HG2 THR 48 -16.268 12.897 -21.869 370 H HIS 49 H HIS 49 -20.252 12.635 -21.077 371 HA HIS 49 HA HIS 49 -20.940 11.346 -23.432 372 HB2 HIS 49 1HB HIS 49 -21.727 14.032 -22.316 373 HB3 HIS 49 2HB HIS 49 -22.399 13.423 -23.826 374 HD1 HIS 49 HD1 HIS 49 -23.514 13.782 -20.627 375 HD2 HIS 49 HD2 HIS 49 -23.201 10.427 -23.058 376 HE1 HIS 49 HE1 HIS 49 -25.147 12.116 -19.688 377 H GLN 50 H GLN 50 -19.031 14.264 -22.948 378 HA GLN 50 HA GLN 50 -18.910 15.093 -25.634 379 HB2 GLN 50 1HB GLN 50 -17.850 15.948 -23.168 380 HB3 GLN 50 2HB GLN 50 -16.471 15.706 -24.233 381 HG2 GLN 50 1HG GLN 50 -16.985 17.467 -25.515 382 HG3 GLN 50 2HG GLN 50 -18.716 17.142 -25.448 383 HE21 GLN 50 2HE2 GLN 50 -19.933 18.424 -24.242 384 HE22 GLN 50 1HE2 GLN 50 -19.354 19.549 -23.066 385 H GLU 51 H GLU 51 -16.856 12.925 -23.738 386 HA GLU 51 HA GLU 51 -14.932 12.515 -25.791 387 HB2 GLU 51 1HB GLU 51 -15.609 10.877 -23.344 388 HB3 GLU 51 2HB GLU 51 -14.234 10.562 -24.393 389 HG2 GLU 51 1HG GLU 51 -14.629 13.215 -23.056 390 HG3 GLU 51 2HG GLU 51 -13.816 11.873 -22.253 391 H LEU 52 H LEU 52 -17.753 10.670 -24.688 392 HA LEU 52 HA LEU 52 -17.490 8.444 -26.323 393 HB2 LEU 52 1HB LEU 52 -19.741 9.810 -24.971 394 HB3 LEU 52 2HB LEU 52 -20.153 8.656 -26.238 395 HG LEU 52 HG LEU 52 -18.369 7.918 -23.934 396 HD11 LEU 52 1HD1 LEU 52 -20.080 7.983 -22.530 397 HD12 LEU 52 2HD1 LEU 52 -20.952 6.849 -23.559 398 HD13 LEU 52 3HD1 LEU 52 -21.139 8.585 -23.805 399 HD21 LEU 52 1HD2 LEU 52 -18.784 6.602 -26.211 400 HD22 LEU 52 2HD2 LEU 52 -20.192 6.033 -25.314 401 HD23 LEU 52 3HD2 LEU 52 -18.571 5.778 -24.667 402 H GLU 53 H GLU 53 -19.018 11.565 -27.004 403 HA GLU 53 HA GLU 53 -20.146 11.004 -29.471 404 HB2 GLU 53 1HB GLU 53 -19.783 13.268 -27.915 405 HB3 GLU 53 2HB GLU 53 -18.899 13.639 -29.389 406 HG2 GLU 53 1HG GLU 53 -20.907 13.126 -30.704 407 HG3 GLU 53 2HG GLU 53 -21.787 12.814 -29.210 408 H ASP 54 H ASP 54 -16.853 12.120 -28.749 409 HA ASP 54 HA ASP 54 -15.889 12.399 -31.326 410 HB2 ASP 54 1HB ASP 54 -14.761 12.822 -28.999 411 HB3 ASP 54 2HB ASP 54 -14.150 11.183 -29.208 412 H LEU 55 H LEU 55 -15.893 9.477 -29.298 413 HA LEU 55 HA LEU 55 -14.638 7.774 -31.131 414 HB2 LEU 55 1HB LEU 55 -16.661 7.160 -28.983 415 HB3 LEU 55 2HB LEU 55 -15.728 5.943 -29.850 416 HG LEU 55 HG LEU 55 -14.158 8.045 -28.500 417 HD11 LEU 55 1HD1 LEU 55 -14.500 6.325 -26.429 418 HD12 LEU 55 2HD1 LEU 55 -16.135 6.410 -27.082 419 HD13 LEU 55 3HD1 LEU 55 -15.309 7.885 -26.583 420 HD21 LEU 55 1HD2 LEU 55 -13.682 5.587 -29.665 421 HD22 LEU 55 2HD2 LEU 55 -13.586 5.255 -27.936 422 HD23 LEU 55 3HD2 LEU 55 -12.561 6.498 -28.654 423 H GLY 56 H GLY 56 -17.881 8.986 -30.988 424 HA2 GLY 56 1HA GLY 56 -19.078 8.950 -33.142 425 HA3 GLY 56 2HA GLY 56 -18.567 7.276 -33.299 426 H VAL 57 H VAL 57 -19.726 8.708 -30.312 427 HA VAL 57 HA VAL 57 -22.128 7.009 -30.513 428 HB VAL 57 HB VAL 57 -20.690 7.809 -27.980 429 HG11 VAL 57 1HG1 VAL 57 -22.175 6.326 -26.846 430 HG12 VAL 57 2HG1 VAL 57 -23.158 7.410 -27.833 431 HG13 VAL 57 3HG1 VAL 57 -22.859 5.755 -28.367 432 HG21 VAL 57 1HG2 VAL 57 -20.623 5.023 -28.341 433 HG22 VAL 57 2HG2 VAL 57 -20.115 5.733 -29.873 434 HG23 VAL 57 3HG2 VAL 57 -19.267 6.150 -28.384 435 H SER 58 H SER 58 -23.182 8.853 -31.518 436 HA SER 58 HA SER 58 -23.548 11.270 -30.005 437 HB2 SER 58 1HB SER 58 -23.655 10.833 -32.621 438 HB3 SER 58 2HB SER 58 -25.360 10.552 -32.269 439 HG SER 58 HG SER 58 -24.971 12.693 -31.013 440 H ARG 59 H ARG 59 -25.290 8.278 -30.481 441 HA ARG 59 HA ARG 59 -27.826 8.965 -29.618 442 HB2 ARG 59 1HB ARG 59 -26.223 6.484 -29.687 443 HB3 ARG 59 2HB ARG 59 -27.574 6.482 -28.561 444 HG2 ARG 59 1HG ARG 59 -27.945 7.313 -31.412 445 HG3 ARG 59 2HG ARG 59 -27.957 5.612 -30.942 446 HD2 ARG 59 1HD ARG 59 -30.154 5.955 -30.621 447 HD3 ARG 59 2HD ARG 59 -29.634 6.670 -29.095 448 HE ARG 59 HE ARG 59 -30.381 8.676 -29.867 449 HH11 ARG 59 1HH1 ARG 59 -29.717 6.626 -32.602 450 HH12 ARG 59 2HH1 ARG 59 -30.296 7.771 -33.766 451 HH21 ARG 59 1HH2 ARG 59 -31.145 10.192 -31.391 452 HH22 ARG 59 2HH2 ARG 59 -31.107 9.799 -33.076 453 H ILE 60 H ILE 60 -28.874 8.552 -27.539 454 HA ILE 60 HA ILE 60 -27.166 9.450 -25.332 455 HB ILE 60 HB ILE 60 -30.180 9.413 -25.541 456 HG12 ILE 60 1HG1 ILE 60 -29.149 11.043 -27.054 457 HG13 ILE 60 2HG1 ILE 60 -29.973 11.857 -25.729 458 HG21 ILE 60 1HG2 ILE 60 -30.051 9.482 -23.305 459 HG22 ILE 60 2HG2 ILE 60 -28.336 9.891 -23.320 460 HG23 ILE 60 3HG2 ILE 60 -29.546 11.155 -23.543 461 HD11 ILE 60 1HD1 ILE 60 -27.790 12.120 -24.599 462 HD12 ILE 60 2HD1 ILE 60 -27.013 11.424 -26.021 463 HD13 ILE 60 3HD1 ILE 60 -27.888 12.949 -26.153 464 H GLY 61 H GLY 61 -29.795 7.119 -25.953 465 HA2 GLY 61 1HA GLY 61 -29.637 5.777 -23.497 466 HA3 GLY 61 2HA GLY 61 -30.282 5.097 -24.983 467 H HIS 62 H HIS 62 -27.526 5.687 -26.205 468 HA HIS 62 HA HIS 62 -26.417 3.092 -25.558 469 HB2 HIS 62 1HB HIS 62 -25.624 5.200 -27.572 470 HB3 HIS 62 2HB HIS 62 -24.772 3.672 -27.374 471 HD1 HIS 62 HD1 HIS 62 -26.267 4.545 -30.002 472 HD2 HIS 62 HD2 HIS 62 -27.784 2.011 -27.079 473 HE1 HIS 62 HE1 HIS 62 -28.018 3.157 -31.157 474 H GLN 63 H GLN 63 -25.578 6.486 -25.152 475 HA GLN 63 HA GLN 63 -22.940 6.098 -24.229 476 HB2 GLN 63 1HB GLN 63 -24.913 8.341 -23.811 477 HB3 GLN 63 2HB GLN 63 -23.261 8.397 -23.212 478 HG2 GLN 63 1HG GLN 63 -22.379 8.310 -25.426 479 HG3 GLN 63 2HG GLN 63 -23.976 8.000 -26.105 480 HE21 GLN 63 2HE2 GLN 63 -21.819 10.226 -26.211 481 HE22 GLN 63 1HE2 GLN 63 -22.757 11.671 -26.089 482 H GLU 64 H GLU 64 -26.053 6.252 -22.569 483 HA GLU 64 HA GLU 64 -24.959 6.164 -19.941 484 HB2 GLU 64 1HB GLU 64 -27.668 5.921 -21.144 485 HB3 GLU 64 2HB GLU 64 -27.442 5.270 -19.526 486 HG2 GLU 64 1HG GLU 64 -26.372 7.973 -19.958 487 HG3 GLU 64 2HG GLU 64 -28.125 7.821 -20.059 488 H LEU 65 H LEU 65 -25.863 3.763 -22.301 489 HA LEU 65 HA LEU 65 -26.130 1.513 -20.687 490 HB2 LEU 65 1HB LEU 65 -25.506 2.044 -23.511 491 HB3 LEU 65 2HB LEU 65 -24.952 0.485 -22.904 492 HG LEU 65 HG LEU 65 -27.805 1.448 -22.733 493 HD11 LEU 65 1HD1 LEU 65 -27.877 1.072 -24.931 494 HD12 LEU 65 2HD1 LEU 65 -27.746 -0.636 -24.513 495 HD13 LEU 65 3HD1 LEU 65 -26.301 0.281 -24.940 496 HD21 LEU 65 1HD2 LEU 65 -28.049 -1.143 -22.527 497 HD22 LEU 65 2HD2 LEU 65 -27.613 -0.179 -21.115 498 HD23 LEU 65 3HD2 LEU 65 -26.368 -1.063 -21.998 499 H ILE 66 H ILE 66 -23.207 2.826 -22.229 500 HA ILE 66 HA ILE 66 -21.447 0.868 -21.191 501 HB ILE 66 HB ILE 66 -20.733 3.684 -22.010 502 HG12 ILE 66 1HG1 ILE 66 -20.881 1.188 -23.716 503 HG13 ILE 66 2HG1 ILE 66 -22.039 2.514 -23.760 504 HG21 ILE 66 1HG2 ILE 66 -19.113 1.143 -21.899 505 HG22 ILE 66 2HG2 ILE 66 -18.546 2.686 -22.534 506 HG23 ILE 66 3HG2 ILE 66 -18.958 2.533 -20.826 507 HD11 ILE 66 1HD1 ILE 66 -20.515 2.715 -25.600 508 HD12 ILE 66 2HD1 ILE 66 -20.214 4.024 -24.456 509 HD13 ILE 66 3HD1 ILE 66 -19.130 2.635 -24.512 510 H LEU 67 H LEU 67 -22.069 4.232 -20.188 511 HA LEU 67 HA LEU 67 -20.370 4.363 -18.019 512 HB2 LEU 67 1HB LEU 67 -23.121 5.581 -18.199 513 HB3 LEU 67 2HB LEU 67 -21.809 6.113 -17.149 514 HG LEU 67 HG LEU 67 -21.485 6.140 -20.128 515 HD11 LEU 67 1HD1 LEU 67 -23.268 7.809 -18.524 516 HD12 LEU 67 2HD1 LEU 67 -23.192 7.577 -20.271 517 HD13 LEU 67 3HD1 LEU 67 -22.104 8.721 -19.485 518 HD21 LEU 67 1HD2 LEU 67 -19.461 6.515 -19.005 519 HD22 LEU 67 2HD2 LEU 67 -20.224 7.535 -17.785 520 HD23 LEU 67 3HD2 LEU 67 -20.039 8.124 -19.438 521 H GLU 68 H GLU 68 -23.751 3.261 -18.069 522 HA GLU 68 HA GLU 68 -24.104 2.742 -15.381 523 HB2 GLU 68 1HB GLU 68 -25.917 2.583 -17.006 524 HB3 GLU 68 2HB GLU 68 -25.165 1.171 -17.735 525 HG2 GLU 68 1HG GLU 68 -25.564 0.792 -14.905 526 HG3 GLU 68 2HG GLU 68 -27.072 1.207 -15.718 527 H ALA 69 H ALA 69 -22.296 0.939 -17.752 528 HA ALA 69 HA ALA 69 -21.975 -1.378 -16.054 529 HB1 ALA 69 1HB ALA 69 -20.459 -0.745 -18.576 530 HB2 ALA 69 2HB ALA 69 -20.706 -2.322 -17.826 531 HB3 ALA 69 3HB ALA 69 -22.065 -1.474 -18.564 532 H VAL 70 H VAL 70 -20.067 1.421 -17.039 533 HA VAL 70 HA VAL 70 -17.613 0.631 -15.915 534 HB VAL 70 HB VAL 70 -18.685 3.428 -16.313 535 HG11 VAL 70 1HG1 VAL 70 -16.139 3.875 -16.479 536 HG12 VAL 70 2HG1 VAL 70 -16.881 3.719 -14.885 537 HG13 VAL 70 3HG1 VAL 70 -15.985 2.367 -15.579 538 HG21 VAL 70 1HG2 VAL 70 -16.860 1.822 -18.096 539 HG22 VAL 70 2HG2 VAL 70 -18.596 1.996 -18.355 540 HG23 VAL 70 3HG2 VAL 70 -17.549 3.413 -18.424 541 H ASP 71 H ASP 71 -20.425 2.235 -14.549 542 HA ASP 71 HA ASP 71 -19.371 3.172 -12.162 543 HB2 ASP 71 1HB ASP 71 -21.866 3.088 -13.267 544 HB3 ASP 71 2HB ASP 71 -22.042 1.952 -11.932 545 H LEU 72 H LEU 72 -20.082 -0.078 -13.153 546 HA LEU 72 HA LEU 72 -19.981 -1.181 -10.493 547 HB2 LEU 72 1HB LEU 72 -20.067 -2.380 -13.245 548 HB3 LEU 72 2HB LEU 72 -19.866 -3.369 -11.801 549 HG LEU 72 HG LEU 72 -22.178 -1.520 -11.835 550 HD11 LEU 72 1HD1 LEU 72 -21.692 -3.357 -13.987 551 HD12 LEU 72 2HD1 LEU 72 -23.035 -2.239 -13.749 552 HD13 LEU 72 3HD1 LEU 72 -23.104 -3.860 -13.057 553 HD21 LEU 72 1HD2 LEU 72 -23.246 -3.466 -10.766 554 HD22 LEU 72 2HD2 LEU 72 -21.777 -2.960 -9.931 555 HD23 LEU 72 3HD2 LEU 72 -21.753 -4.380 -10.977 556 H LEU 73 H LEU 73 -17.759 -0.619 -13.120 557 HA LEU 73 HA LEU 73 -15.696 -2.359 -12.282 558 HB2 LEU 73 1HB LEU 73 -15.978 -0.105 -14.161 559 HB3 LEU 73 2HB LEU 73 -14.347 -0.401 -13.561 560 HG LEU 73 HG LEU 73 -16.041 -2.508 -14.894 561 HD11 LEU 73 1HD1 LEU 73 -14.808 -0.251 -16.075 562 HD12 LEU 73 2HD1 LEU 73 -15.578 -1.623 -16.870 563 HD13 LEU 73 3HD1 LEU 73 -13.854 -1.671 -16.503 564 HD21 LEU 73 1HD2 LEU 73 -13.096 -2.617 -14.879 565 HD22 LEU 73 2HD2 LEU 73 -14.284 -3.905 -14.675 566 HD23 LEU 73 3HD2 LEU 73 -13.883 -2.851 -13.318 567 H CYS 74 H CYS 74 -16.237 1.112 -11.731 568 HA CYS 74 HA CYS 74 -13.932 1.469 -10.115 569 HB2 CYS 74 1HB CYS 74 -15.760 3.146 -11.300 570 HB3 CYS 74 2HB CYS 74 -16.163 3.302 -9.595 571 HG CYS 74 HG CYS 74 -14.522 5.410 -10.009 572 H ALA 75 H ALA 75 -17.303 0.717 -9.420 573 HA ALA 75 HA ALA 75 -17.138 1.000 -6.608 574 HB1 ALA 75 1HB ALA 75 -19.078 -0.065 -8.540 575 HB2 ALA 75 2HB ALA 75 -19.148 -0.786 -6.932 576 HB3 ALA 75 3HB ALA 75 -19.325 0.958 -7.125 577 H LEU 76 H LEU 76 -16.391 -1.613 -8.807 578 HA LEU 76 HA LEU 76 -16.166 -3.602 -6.739 579 HB2 LEU 76 1HB LEU 76 -15.621 -3.504 -9.672 580 HB3 LEU 76 2HB LEU 76 -14.950 -4.820 -8.710 581 HG LEU 76 HG LEU 76 -17.886 -4.213 -8.650 582 HD11 LEU 76 1HD1 LEU 76 -17.353 -6.394 -10.384 583 HD12 LEU 76 2HD1 LEU 76 -16.434 -5.001 -10.955 584 HD13 LEU 76 3HD1 LEU 76 -18.180 -4.877 -10.741 585 HD21 LEU 76 1HD2 LEU 76 -16.073 -6.336 -7.720 586 HD22 LEU 76 2HD2 LEU 76 -17.578 -6.892 -8.455 587 HD23 LEU 76 3HD2 LEU 76 -17.623 -5.797 -7.072 588 H ASN 77 H ASN 77 -13.952 -1.586 -8.614 589 HA ASN 77 HA ASN 77 -11.662 -2.680 -7.173 590 HB2 ASN 77 1HB ASN 77 -12.069 -1.271 -9.707 591 HB3 ASN 77 2HB ASN 77 -10.691 -0.667 -8.792 592 HD21 ASN 77 2HD2 ASN 77 -12.144 -3.838 -9.463 593 HD22 ASN 77 1HD2 ASN 77 -10.666 -4.605 -9.924 594 H SER 78 H SER 78 -12.058 -1.850 -5.099 595 HA SER 78 HA SER 78 -11.092 0.837 -4.709 596 HB2 SER 78 1HB SER 78 -13.104 1.428 -3.248 597 HB3 SER 78 2HB SER 78 -13.362 1.467 -4.992 598 HG SER 78 HG SER 78 -15.043 0.365 -3.892 599 H GLY 79 H GLY 79 -9.501 -0.751 -3.810 600 HA2 GLY 79 1HA GLY 79 -8.801 -0.729 -1.370 601 HA3 GLY 79 2HA GLY 79 -10.282 -1.637 -1.105 602 HA PRO 80 HA PRO 80 -6.611 -4.481 -1.952 603 HB2 PRO 80 1HB PRO 80 -6.539 -5.656 0.494 604 HB3 PRO 80 2HB PRO 80 -5.623 -4.196 0.103 605 HG2 PRO 80 1HG PRO 80 -8.234 -4.465 1.542 606 HG3 PRO 80 2HG PRO 80 -6.846 -3.431 1.926 607 HD2 PRO 80 1HD PRO 80 -9.056 -2.496 0.671 608 HD3 PRO 80 2HD PRO 80 -7.434 -1.845 0.360 609 H SER 81 H SER 81 -6.911 -6.553 -2.613 610 HA SER 81 HA SER 81 -9.050 -8.181 -1.556 611 HB2 SER 81 1HB SER 81 -9.346 -8.154 -4.439 612 HB3 SER 81 2HB SER 81 -10.569 -7.926 -3.188 613 HG SER 81 HG SER 81 -8.774 -5.853 -3.825 614 H SER 82 H SER 82 -7.161 -8.017 -4.578 615 HA SER 82 HA SER 82 -6.235 -10.757 -4.042 616 HB2 SER 82 1HB SER 82 -5.600 -10.580 -6.571 617 HB3 SER 82 2HB SER 82 -7.286 -10.833 -6.120 618 HG SER 82 HG SER 82 -7.587 -9.122 -7.311 619 H GLY 83 H GLY 83 -5.199 -7.491 -4.772 620 HA2 GLY 83 1HA GLY 83 -2.574 -8.043 -3.729 621 HA3 GLY 83 2HA GLY 83 -2.577 -7.757 -5.463 Start of MODEL 5 1 H1 GLY 1 H GLY 1 -3.521 0.416 1.134 2 HA2 GLY 1 1HA GLY 1 -2.723 -1.721 1.383 3 HA3 GLY 1 2HA GLY 1 -3.792 -2.158 0.058 4 H SER 2 H SER 2 -2.027 -3.683 -0.428 5 HA SER 2 HA SER 2 0.307 -2.438 -1.689 6 HB2 SER 2 1HB SER 2 0.420 -4.416 0.002 7 HB3 SER 2 2HB SER 2 -0.064 -5.403 -1.376 8 HG SER 2 HG SER 2 1.841 -5.121 -2.262 9 H SER 3 H SER 3 -1.803 -5.222 -2.420 10 HA SER 3 HA SER 3 -1.710 -4.414 -5.254 11 HB2 SER 3 1HB SER 3 -1.200 -6.994 -3.963 12 HB3 SER 3 2HB SER 3 -2.355 -7.096 -5.292 13 HG SER 3 HG SER 3 0.305 -6.130 -5.351 14 H GLY 4 H GLY 4 -3.598 -4.889 -6.531 15 HA2 GLY 4 1HA GLY 4 -5.869 -5.249 -6.880 16 HA3 GLY 4 2HA GLY 4 -6.036 -5.665 -5.181 17 H SER 5 H SER 5 -4.495 -2.699 -6.146 18 HA SER 5 HA SER 5 -6.911 -1.207 -5.364 19 HB2 SER 5 1HB SER 5 -5.665 -0.780 -3.485 20 HB3 SER 5 2HB SER 5 -4.129 -1.012 -4.320 21 HG SER 5 HG SER 5 -4.222 1.027 -5.087 22 H SER 6 H SER 6 -7.597 0.050 -6.951 23 HA SER 6 HA SER 6 -7.651 1.416 -8.770 24 HB2 SER 6 1HB SER 6 -4.725 1.950 -8.221 25 HB3 SER 6 2HB SER 6 -5.852 2.980 -9.104 26 HG SER 6 HG SER 6 -6.468 2.284 -6.466 27 H GLY 7 H GLY 7 -7.955 -0.472 -10.085 28 HA2 GLY 7 1HA GLY 7 -5.559 -1.265 -11.615 29 HA3 GLY 7 2HA GLY 7 -6.987 -2.267 -11.406 30 H VAL 8 H VAL 8 -9.018 -0.534 -12.009 31 HA VAL 8 HA VAL 8 -9.091 -0.612 -14.799 32 HB VAL 8 HB VAL 8 -10.741 1.224 -13.062 33 HG11 VAL 8 1HG1 VAL 8 -12.431 0.904 -14.831 34 HG12 VAL 8 2HG1 VAL 8 -10.960 1.676 -15.428 35 HG13 VAL 8 3HG1 VAL 8 -11.256 -0.032 -15.755 36 HG21 VAL 8 1HG2 VAL 8 -10.923 -0.943 -12.094 37 HG22 VAL 8 2HG2 VAL 8 -12.379 -0.682 -13.054 38 HG23 VAL 8 3HG2 VAL 8 -11.084 -1.705 -13.676 39 H SER 9 H SER 9 -7.830 1.777 -12.639 40 HA SER 9 HA SER 9 -7.873 3.973 -14.456 41 HB2 SER 9 1HB SER 9 -6.218 4.976 -12.838 42 HB3 SER 9 2HB SER 9 -7.735 4.452 -12.107 43 HG SER 9 HG SER 9 -5.398 3.789 -11.297 44 H LYS 10 H LYS 10 -5.746 1.291 -13.919 45 HA LYS 10 HA LYS 10 -3.752 2.463 -15.737 46 HB2 LYS 10 1HB LYS 10 -3.475 0.087 -13.887 47 HB3 LYS 10 2HB LYS 10 -2.197 0.782 -14.875 48 HG2 LYS 10 1HG LYS 10 -3.384 2.807 -13.222 49 HG3 LYS 10 2HG LYS 10 -2.868 1.432 -12.242 50 HD2 LYS 10 1HD LYS 10 -0.914 2.616 -12.296 51 HD3 LYS 10 2HD LYS 10 -0.701 1.636 -13.748 52 HE2 LYS 10 1HE LYS 10 -2.169 4.042 -14.345 53 HE3 LYS 10 2HE LYS 10 -0.644 4.427 -13.549 54 HZ1 LYS 10 1HZ LYS 10 0.406 2.877 -15.222 55 HZ2 LYS 10 2HZ LYS 10 -0.172 4.346 -15.828 56 HZ3 LYS 10 3HZ LYS 10 -1.059 2.925 -16.065 57 H TRP 11 H TRP 11 -6.363 1.149 -16.423 58 HA TRP 11 HA TRP 11 -5.740 -1.376 -17.604 59 HB2 TRP 11 1HB TRP 11 -8.079 0.399 -17.427 60 HB3 TRP 11 2HB TRP 11 -7.984 -0.529 -18.922 61 HD1 TRP 11 HD1 TRP 11 -6.701 -2.079 -15.683 62 HE1 TRP 11 HE1 TRP 11 -8.252 -4.024 -15.022 63 HE3 TRP 11 HE3 TRP 11 -10.415 -1.360 -19.122 64 HZ2 TRP 11 HZ2 TRP 11 -10.723 -5.109 -15.849 65 HZ3 TRP 11 HZ3 TRP 11 -12.337 -2.895 -19.120 66 HH2 TRP 11 HH2 TRP 11 -12.486 -4.731 -17.517 67 H SER 12 H SER 12 -4.859 -1.807 -19.523 68 HA SER 12 HA SER 12 -3.705 0.197 -21.116 69 HB2 SER 12 1HB SER 12 -4.005 -2.116 -22.716 70 HB3 SER 12 2HB SER 12 -2.578 -1.608 -21.813 71 HG SER 12 HG SER 12 -2.935 -3.183 -20.485 72 HA PRO 13 HA PRO 13 -6.817 1.449 -23.942 73 HB2 PRO 13 1HB PRO 13 -5.454 1.620 -26.283 74 HB3 PRO 13 2HB PRO 13 -5.234 2.768 -24.957 75 HG2 PRO 13 1HG PRO 13 -3.560 0.404 -25.712 76 HG3 PRO 13 2HG PRO 13 -3.045 2.028 -25.219 77 HD2 PRO 13 1HD PRO 13 -3.039 -0.081 -23.521 78 HD3 PRO 13 2HD PRO 13 -3.349 1.580 -22.979 79 H SER 14 H SER 14 -5.118 -1.506 -24.517 80 HA SER 14 HA SER 14 -6.963 -2.328 -26.626 81 HB2 SER 14 1HB SER 14 -4.461 -3.562 -25.474 82 HB3 SER 14 2HB SER 14 -5.510 -4.433 -26.593 83 HG SER 14 HG SER 14 -5.125 -2.842 -28.134 84 H GLN 15 H GLN 15 -6.356 -2.793 -23.248 85 HA GLN 15 HA GLN 15 -7.772 -5.225 -22.910 86 HB2 GLN 15 1HB GLN 15 -6.807 -3.058 -21.097 87 HB3 GLN 15 2HB GLN 15 -7.976 -4.215 -20.476 88 HG2 GLN 15 1HG GLN 15 -5.633 -5.331 -21.883 89 HG3 GLN 15 2HG GLN 15 -5.334 -4.566 -20.323 90 HE21 GLN 15 2HE2 GLN 15 -4.738 -6.624 -19.514 91 HE22 GLN 15 1HE2 GLN 15 -5.940 -7.783 -19.070 92 H VAL 16 H VAL 16 -8.708 -1.823 -22.506 93 HA VAL 16 HA VAL 16 -11.279 -2.140 -21.557 94 HB VAL 16 HB VAL 16 -10.352 -0.062 -23.546 95 HG11 VAL 16 1HG1 VAL 16 -12.165 1.296 -22.386 96 HG12 VAL 16 2HG1 VAL 16 -12.702 0.037 -23.499 97 HG13 VAL 16 3HG1 VAL 16 -12.761 -0.240 -21.758 98 HG21 VAL 16 1HG2 VAL 16 -9.580 -0.538 -20.853 99 HG22 VAL 16 2HG2 VAL 16 -9.108 0.789 -21.915 100 HG23 VAL 16 3HG2 VAL 16 -10.541 0.940 -20.899 101 H VAL 17 H VAL 17 -10.097 -2.406 -24.865 102 HA VAL 17 HA VAL 17 -12.554 -2.474 -26.202 103 HB VAL 17 HB VAL 17 -10.091 -4.029 -26.992 104 HG11 VAL 17 1HG1 VAL 17 -12.404 -4.286 -28.161 105 HG12 VAL 17 2HG1 VAL 17 -12.008 -2.720 -28.873 106 HG13 VAL 17 3HG1 VAL 17 -10.945 -4.103 -29.134 107 HG21 VAL 17 1HG2 VAL 17 -10.466 -1.189 -26.715 108 HG22 VAL 17 2HG2 VAL 17 -9.015 -2.089 -27.155 109 HG23 VAL 17 3HG2 VAL 17 -10.170 -1.614 -28.401 110 H ASP 18 H ASP 18 -10.786 -4.968 -24.481 111 HA ASP 18 HA ASP 18 -12.362 -7.154 -25.404 112 HB2 ASP 18 1HB ASP 18 -10.034 -7.282 -24.392 113 HB3 ASP 18 2HB ASP 18 -10.800 -7.050 -22.823 114 H TRP 19 H TRP 19 -12.723 -4.784 -22.905 115 HA TRP 19 HA TRP 19 -14.597 -6.207 -21.306 116 HB2 TRP 19 1HB TRP 19 -13.382 -4.359 -20.342 117 HB3 TRP 19 2HB TRP 19 -14.012 -3.252 -21.559 118 HD1 TRP 19 HD1 TRP 19 -15.655 -5.634 -18.950 119 HE1 TRP 19 HE1 TRP 19 -17.569 -4.344 -17.811 120 HE3 TRP 19 HE3 TRP 19 -15.233 -1.189 -21.441 121 HZ2 TRP 19 HZ2 TRP 19 -18.744 -1.781 -17.950 122 HZ3 TRP 19 HZ3 TRP 19 -16.791 0.630 -20.879 123 HH2 TRP 19 HH2 TRP 19 -18.510 0.338 -19.170 124 H MET 20 H MET 20 -14.912 -3.825 -23.913 125 HA MET 20 HA MET 20 -17.697 -3.539 -23.825 126 HB2 MET 20 1HB MET 20 -15.998 -3.390 -26.315 127 HB3 MET 20 2HB MET 20 -17.529 -2.578 -26.015 128 HG2 MET 20 1HG MET 20 -16.430 -1.278 -24.217 129 HG3 MET 20 2HG MET 20 -14.899 -2.027 -24.665 130 HE1 MET 20 1HE MET 20 -17.343 0.923 -27.193 131 HE2 MET 20 2HE MET 20 -17.696 -0.794 -27.383 132 HE3 MET 20 3HE MET 20 -17.907 -0.019 -25.813 133 H LYS 21 H LYS 21 -15.708 -6.097 -25.008 134 HA LYS 21 HA LYS 21 -17.510 -7.259 -26.848 135 HB2 LYS 21 1HB LYS 21 -15.293 -8.506 -25.214 136 HB3 LYS 21 2HB LYS 21 -16.144 -9.321 -26.519 137 HG2 LYS 21 1HG LYS 21 -15.388 -7.276 -27.933 138 HG3 LYS 21 2HG LYS 21 -14.198 -7.063 -26.648 139 HD2 LYS 21 1HD LYS 21 -13.335 -9.285 -27.018 140 HD3 LYS 21 2HD LYS 21 -14.605 -9.621 -28.196 141 HE2 LYS 21 1HE LYS 21 -13.354 -8.764 -29.817 142 HE3 LYS 21 2HE LYS 21 -13.264 -7.227 -28.960 143 HZ1 LYS 21 1HZ LYS 21 -11.400 -9.517 -28.807 144 HZ2 LYS 21 2HZ LYS 21 -11.423 -8.308 -27.625 145 HZ3 LYS 21 3HZ LYS 21 -11.062 -7.914 -29.230 146 H GLY 22 H GLY 22 -17.599 -7.015 -23.471 147 HA2 GLY 22 1HA GLY 22 -19.537 -9.242 -23.322 148 HA3 GLY 22 2HA GLY 22 -18.513 -8.755 -21.980 149 H LEU 23 H LEU 23 -20.014 -6.389 -24.046 150 HA LEU 23 HA LEU 23 -21.858 -5.713 -21.849 151 HB2 LEU 23 1HB LEU 23 -20.671 -3.796 -23.845 152 HB3 LEU 23 2HB LEU 23 -21.636 -3.398 -22.425 153 HG LEU 23 HG LEU 23 -18.819 -4.474 -22.461 154 HD11 LEU 23 1HD1 LEU 23 -19.002 -2.108 -23.009 155 HD12 LEU 23 2HD1 LEU 23 -18.273 -2.335 -21.419 156 HD13 LEU 23 3HD1 LEU 23 -19.959 -1.835 -21.552 157 HD21 LEU 23 1HD2 LEU 23 -19.241 -5.310 -20.445 158 HD22 LEU 23 2HD2 LEU 23 -20.860 -4.610 -20.423 159 HD23 LEU 23 3HD2 LEU 23 -19.478 -3.655 -19.885 160 H ASP 24 H ASP 24 -23.420 -3.851 -23.060 161 HA ASP 24 HA ASP 24 -25.354 -5.317 -24.372 162 HB2 ASP 24 1HB ASP 24 -25.110 -2.708 -23.496 163 HB3 ASP 24 2HB ASP 24 -25.290 -2.525 -25.239 164 H ASP 25 H ASP 25 -25.907 -5.701 -26.487 165 HA ASP 25 HA ASP 25 -23.852 -5.999 -28.362 166 HB2 ASP 25 1HB ASP 25 -26.774 -6.336 -28.326 167 HB3 ASP 25 2HB ASP 25 -26.105 -5.976 -29.915 168 H CYS 26 H CYS 26 -25.905 -3.307 -27.642 169 HA CYS 26 HA CYS 26 -25.597 -1.923 -30.106 170 HB2 CYS 26 1HB CYS 26 -26.539 -1.188 -27.361 171 HB3 CYS 26 2HB CYS 26 -26.200 0.091 -28.522 172 HG CYS 26 HG CYS 26 -28.337 -0.160 -29.960 173 H LEU 27 H LEU 27 -23.597 -2.342 -27.339 174 HA LEU 27 HA LEU 27 -21.913 -0.056 -28.026 175 HB2 LEU 27 1HB LEU 27 -21.338 -2.005 -25.829 176 HB3 LEU 27 2HB LEU 27 -20.880 -0.308 -25.955 177 HG LEU 27 HG LEU 27 -23.702 -1.270 -25.497 178 HD11 LEU 27 1HD1 LEU 27 -21.458 -0.958 -23.666 179 HD12 LEU 27 2HD1 LEU 27 -23.016 -1.751 -23.430 180 HD13 LEU 27 3HD1 LEU 27 -22.871 -0.007 -23.207 181 HD21 LEU 27 1HD2 LEU 27 -22.386 1.387 -25.746 182 HD22 LEU 27 2HD2 LEU 27 -23.725 1.210 -24.612 183 HD23 LEU 27 3HD2 LEU 27 -23.964 0.847 -26.322 184 H GLN 28 H GLN 28 -22.196 -2.599 -29.636 185 HA GLN 28 HA GLN 28 -19.509 -3.715 -29.463 186 HB2 GLN 28 1HB GLN 28 -21.837 -4.443 -31.249 187 HB3 GLN 28 2HB GLN 28 -20.304 -5.301 -31.183 188 HG2 GLN 28 1HG GLN 28 -22.202 -4.993 -28.869 189 HG3 GLN 28 2HG GLN 28 -22.102 -6.408 -29.916 190 HE21 GLN 28 2HE2 GLN 28 -21.403 -5.562 -26.975 191 HE22 GLN 28 1HE2 GLN 28 -19.901 -6.374 -26.713 192 H GLN 29 H GLN 29 -21.579 -2.111 -31.870 193 HA GLN 29 HA GLN 29 -19.739 -1.968 -33.948 194 HB2 GLN 29 1HB GLN 29 -21.093 -0.154 -34.836 195 HB3 GLN 29 2HB GLN 29 -22.128 -1.416 -34.182 196 HG2 GLN 29 1HG GLN 29 -21.917 0.166 -32.024 197 HG3 GLN 29 2HG GLN 29 -21.742 1.366 -33.304 198 HE21 GLN 29 2HE2 GLN 29 -23.796 -1.290 -32.209 199 HE22 GLN 29 1HE2 GLN 29 -25.272 -0.638 -32.825 200 H TYR 30 H TYR 30 -19.927 -0.155 -31.006 201 HA TYR 30 HA TYR 30 -18.263 2.013 -31.874 202 HB2 TYR 30 1HB TYR 30 -18.996 1.118 -29.078 203 HB3 TYR 30 2HB TYR 30 -18.225 2.644 -29.494 204 HD1 TYR 30 HD2 TYR 30 -19.782 3.427 -31.887 205 HD2 TYR 30 HD1 TYR 30 -21.063 1.747 -28.195 206 HE1 TYR 30 HE2 TYR 30 -21.992 4.464 -32.189 207 HE2 TYR 30 HE1 TYR 30 -23.277 2.778 -28.486 208 HH TYR 30 HH TYR 30 -23.956 4.929 -31.210 209 H ILE 31 H ILE 31 -17.749 -1.149 -30.571 210 HA ILE 31 HA ILE 31 -15.277 -0.944 -29.365 211 HB ILE 31 HB ILE 31 -16.218 -3.202 -31.138 212 HG12 ILE 31 1HG1 ILE 31 -16.506 -2.786 -28.154 213 HG13 ILE 31 2HG1 ILE 31 -17.806 -2.676 -29.336 214 HG21 ILE 31 1HG2 ILE 31 -14.679 -4.580 -29.790 215 HG22 ILE 31 2HG2 ILE 31 -13.841 -3.342 -30.724 216 HG23 ILE 31 3HG2 ILE 31 -14.099 -3.117 -28.994 217 HD11 ILE 31 1HD1 ILE 31 -17.947 -4.788 -28.243 218 HD12 ILE 31 2HD1 ILE 31 -17.402 -5.062 -29.898 219 HD13 ILE 31 3HD1 ILE 31 -16.248 -5.128 -28.567 220 H LYS 32 H LYS 32 -16.054 -1.086 -32.798 221 HA LYS 32 HA LYS 32 -13.463 -1.448 -33.801 222 HB2 LYS 32 1HB LYS 32 -15.853 -0.037 -34.996 223 HB3 LYS 32 2HB LYS 32 -14.376 -0.386 -35.886 224 HG2 LYS 32 1HG LYS 32 -15.197 -2.802 -34.695 225 HG3 LYS 32 2HG LYS 32 -16.632 -2.064 -35.411 226 HD2 LYS 32 1HD LYS 32 -14.031 -2.351 -36.900 227 HD3 LYS 32 2HD LYS 32 -15.284 -3.596 -36.916 228 HE2 LYS 32 1HE LYS 32 -16.342 -2.498 -38.528 229 HE3 LYS 32 2HE LYS 32 -16.535 -1.113 -37.454 230 HZ1 LYS 32 1HZ LYS 32 -14.020 -0.775 -38.222 231 HZ2 LYS 32 2HZ LYS 32 -15.334 -0.107 -39.051 232 HZ3 LYS 32 3HZ LYS 32 -14.626 -1.541 -39.603 233 H ASN 33 H ASN 33 -15.148 1.418 -32.695 234 HA ASN 33 HA ASN 33 -13.156 3.243 -33.686 235 HB2 ASN 33 1HB ASN 33 -15.368 3.707 -31.672 236 HB3 ASN 33 2HB ASN 33 -14.425 4.955 -32.481 237 HD21 ASN 33 2HD2 ASN 33 -17.307 4.450 -32.477 238 HD22 ASN 33 1HD2 ASN 33 -17.756 4.270 -34.135 239 H PHE 34 H PHE 34 -13.909 1.679 -30.625 240 HA PHE 34 HA PHE 34 -12.049 3.155 -29.063 241 HB2 PHE 34 1HB PHE 34 -13.640 0.655 -28.681 242 HB3 PHE 34 2HB PHE 34 -12.311 0.985 -27.574 243 HD1 PHE 34 HD2 PHE 34 -15.331 2.604 -29.032 244 HD2 PHE 34 HD1 PHE 34 -12.697 2.276 -25.705 245 HE1 PHE 34 HE2 PHE 34 -16.793 4.095 -27.732 246 HE2 PHE 34 HE1 PHE 34 -14.156 3.766 -24.399 247 HZ PHE 34 HZ PHE 34 -16.206 4.679 -25.412 248 H GLU 35 H GLU 35 -11.796 0.410 -31.158 249 HA GLU 35 HA GLU 35 -9.333 -0.594 -30.121 250 HB2 GLU 35 1HB GLU 35 -11.225 -1.414 -32.032 251 HB3 GLU 35 2HB GLU 35 -9.716 -1.213 -32.912 252 HG2 GLU 35 1HG GLU 35 -10.042 -2.867 -30.420 253 HG3 GLU 35 2HG GLU 35 -10.062 -3.501 -32.065 254 H ARG 36 H ARG 36 -10.226 1.792 -32.515 255 HA ARG 36 HA ARG 36 -7.475 2.087 -33.421 256 HB2 ARG 36 1HB ARG 36 -9.521 2.209 -34.948 257 HB3 ARG 36 2HB ARG 36 -9.826 3.787 -34.233 258 HG2 ARG 36 1HG ARG 36 -7.551 4.484 -34.970 259 HG3 ARG 36 2HG ARG 36 -7.416 2.944 -35.823 260 HD2 ARG 36 1HD ARG 36 -8.373 3.949 -37.564 261 HD3 ARG 36 2HD ARG 36 -9.867 3.957 -36.628 262 HE ARG 36 HE ARG 36 -8.295 6.192 -35.935 263 HH11 ARG 36 1HH1 ARG 36 -10.252 4.949 -38.532 264 HH12 ARG 36 2HH1 ARG 36 -10.692 6.517 -39.125 265 HH21 ARG 36 1HH2 ARG 36 -8.866 8.261 -36.706 266 HH22 ARG 36 2HH2 ARG 36 -9.902 8.400 -38.087 267 H GLU 37 H GLU 37 -9.886 3.805 -31.522 268 HA GLU 37 HA GLU 37 -8.380 6.203 -31.232 269 HB2 GLU 37 1HB GLU 37 -10.809 5.042 -29.945 270 HB3 GLU 37 2HB GLU 37 -9.996 6.377 -29.141 271 HG2 GLU 37 1HG GLU 37 -10.316 6.977 -31.920 272 HG3 GLU 37 2HG GLU 37 -11.864 6.496 -31.227 273 H LYS 38 H LYS 38 -8.264 3.120 -29.729 274 HA LYS 38 HA LYS 38 -6.969 2.237 -28.081 275 HB2 LYS 38 1HB LYS 38 -5.351 4.771 -28.410 276 HB3 LYS 38 2HB LYS 38 -4.809 3.285 -27.641 277 HG2 LYS 38 1HG LYS 38 -5.761 2.788 -30.320 278 HG3 LYS 38 2HG LYS 38 -4.486 4.009 -30.300 279 HD2 LYS 38 1HD LYS 38 -2.927 2.551 -29.401 280 HD3 LYS 38 2HD LYS 38 -4.162 1.481 -28.734 281 HE2 LYS 38 1HE LYS 38 -4.423 1.624 -31.588 282 HE3 LYS 38 2HE LYS 38 -2.765 1.209 -31.158 283 HZ1 LYS 38 1HZ LYS 38 -5.071 -0.189 -29.948 284 HZ2 LYS 38 2HZ LYS 38 -3.459 -0.693 -30.030 285 HZ3 LYS 38 3HZ LYS 38 -4.414 -0.685 -31.426 286 H ILE 39 H ILE 39 -9.233 3.449 -27.175 287 HA ILE 39 HA ILE 39 -8.860 5.405 -25.184 288 HB ILE 39 HB ILE 39 -11.008 3.288 -25.356 289 HG12 ILE 39 1HG1 ILE 39 -10.874 4.727 -27.356 290 HG13 ILE 39 2HG1 ILE 39 -12.349 5.019 -26.440 291 HG21 ILE 39 1HG2 ILE 39 -12.202 5.318 -24.104 292 HG22 ILE 39 2HG2 ILE 39 -11.356 4.033 -23.243 293 HG23 ILE 39 3HG2 ILE 39 -10.553 5.575 -23.535 294 HD11 ILE 39 1HD1 ILE 39 -11.858 7.169 -26.387 295 HD12 ILE 39 2HD1 ILE 39 -10.395 6.806 -25.470 296 HD13 ILE 39 3HD1 ILE 39 -10.341 6.862 -27.232 297 H SER 40 H SER 40 -7.575 5.185 -23.478 298 HA SER 40 HA SER 40 -7.069 2.580 -22.312 299 HB2 SER 40 1HB SER 40 -5.693 4.193 -20.695 300 HB3 SER 40 2HB SER 40 -5.089 3.745 -22.290 301 HG SER 40 HG SER 40 -5.337 6.131 -21.492 302 H GLY 41 H GLY 41 -7.085 2.394 -19.877 303 HA2 GLY 41 1HA GLY 41 -9.695 2.699 -18.910 304 HA3 GLY 41 2HA GLY 41 -8.289 2.325 -17.925 305 H ASP 42 H ASP 42 -6.801 4.656 -18.311 306 HA ASP 42 HA ASP 42 -7.772 6.324 -16.332 307 HB2 ASP 42 1HB ASP 42 -5.465 6.460 -16.905 308 HB3 ASP 42 2HB ASP 42 -5.833 6.858 -18.581 309 H GLN 43 H GLN 43 -8.480 6.295 -19.740 310 HA GLN 43 HA GLN 43 -9.841 8.864 -19.621 311 HB2 GLN 43 1HB GLN 43 -9.239 6.922 -21.837 312 HB3 GLN 43 2HB GLN 43 -10.366 8.252 -22.068 313 HG2 GLN 43 1HG GLN 43 -8.172 9.482 -20.961 314 HG3 GLN 43 2HG GLN 43 -7.463 8.252 -22.006 315 HE21 GLN 43 2HE2 GLN 43 -8.156 8.221 -24.246 316 HE22 GLN 43 1HE2 GLN 43 -8.598 9.705 -25.013 317 H LEU 44 H LEU 44 -10.559 5.460 -19.616 318 HA LEU 44 HA LEU 44 -13.330 5.705 -20.244 319 HB2 LEU 44 1HB LEU 44 -12.172 3.623 -20.616 320 HB3 LEU 44 2HB LEU 44 -11.766 3.504 -18.906 321 HG LEU 44 HG LEU 44 -14.449 3.558 -18.732 322 HD11 LEU 44 1HD1 LEU 44 -15.280 3.467 -20.823 323 HD12 LEU 44 2HD1 LEU 44 -14.934 1.746 -20.662 324 HD13 LEU 44 3HD1 LEU 44 -13.796 2.798 -21.502 325 HD21 LEU 44 1HD2 LEU 44 -13.209 0.940 -19.414 326 HD22 LEU 44 2HD2 LEU 44 -14.278 1.372 -18.079 327 HD23 LEU 44 3HD2 LEU 44 -12.577 1.841 -18.036 328 H LEU 45 H LEU 45 -11.489 5.430 -17.232 329 HA LEU 45 HA LEU 45 -13.665 5.271 -15.472 330 HB2 LEU 45 1HB LEU 45 -10.901 5.334 -15.263 331 HB3 LEU 45 2HB LEU 45 -11.429 6.774 -14.396 332 HG LEU 45 HG LEU 45 -12.813 5.403 -12.932 333 HD11 LEU 45 1HD1 LEU 45 -13.563 3.492 -13.820 334 HD12 LEU 45 2HD1 LEU 45 -12.031 2.811 -13.271 335 HD13 LEU 45 3HD1 LEU 45 -12.204 3.363 -14.937 336 HD21 LEU 45 1HD2 LEU 45 -10.375 3.850 -12.673 337 HD22 LEU 45 2HD2 LEU 45 -11.072 5.052 -11.587 338 HD23 LEU 45 3HD2 LEU 45 -10.055 5.565 -12.934 339 H ARG 46 H ARG 46 -12.089 8.014 -16.988 340 HA ARG 46 HA ARG 46 -14.008 9.807 -15.655 341 HB2 ARG 46 1HB ARG 46 -12.452 11.609 -15.977 342 HB3 ARG 46 2HB ARG 46 -11.593 10.269 -15.229 343 HG2 ARG 46 1HG ARG 46 -10.992 9.674 -17.708 344 HG3 ARG 46 2HG ARG 46 -11.350 11.381 -17.977 345 HD2 ARG 46 1HD ARG 46 -9.551 10.586 -15.731 346 HD3 ARG 46 2HD ARG 46 -8.923 10.613 -17.378 347 HE ARG 46 HE ARG 46 -10.296 13.022 -16.615 348 HH11 ARG 46 1HH1 ARG 46 -7.255 11.328 -16.610 349 HH12 ARG 46 2HH1 ARG 46 -6.303 12.770 -16.490 350 HH21 ARG 46 1HH2 ARG 46 -9.053 14.929 -16.457 351 HH22 ARG 46 2HH2 ARG 46 -7.327 14.818 -16.402 352 H ILE 47 H ILE 47 -14.689 8.224 -17.929 353 HA ILE 47 HA ILE 47 -14.579 9.924 -20.259 354 HB ILE 47 HB ILE 47 -14.562 7.436 -20.419 355 HG12 ILE 47 1HG1 ILE 47 -16.859 7.717 -22.020 356 HG13 ILE 47 2HG1 ILE 47 -16.129 9.317 -21.950 357 HG21 ILE 47 1HG2 ILE 47 -16.503 7.410 -18.605 358 HG22 ILE 47 2HG2 ILE 47 -17.503 7.356 -20.056 359 HG23 ILE 47 3HG2 ILE 47 -16.290 6.107 -19.773 360 HD11 ILE 47 1HD1 ILE 47 -13.952 7.801 -22.431 361 HD12 ILE 47 2HD1 ILE 47 -15.196 6.868 -23.263 362 HD13 ILE 47 3HD1 ILE 47 -14.934 8.560 -23.683 363 H THR 48 H THR 48 -16.130 11.252 -21.024 364 HA THR 48 HA THR 48 -18.661 11.398 -19.520 365 HB THR 48 HB THR 48 -17.155 13.320 -19.035 366 HG1 THR 48 HG1 THR 48 -19.342 14.288 -20.539 367 HG21 THR 48 1HG2 THR 48 -17.650 14.613 -21.614 368 HG22 THR 48 2HG2 THR 48 -16.554 13.235 -21.707 369 HG23 THR 48 3HG2 THR 48 -16.190 14.579 -20.626 370 H HIS 49 H HIS 49 -20.373 12.642 -20.801 371 HA HIS 49 HA HIS 49 -21.037 11.249 -23.098 372 HB2 HIS 49 1HB HIS 49 -22.016 13.673 -21.741 373 HB3 HIS 49 2HB HIS 49 -22.393 13.590 -23.459 374 HD1 HIS 49 HD1 HIS 49 -22.970 11.710 -20.239 375 HD2 HIS 49 HD2 HIS 49 -24.411 11.846 -24.134 376 HE1 HIS 49 HE1 HIS 49 -25.015 10.247 -20.251 377 H GLN 50 H GLN 50 -19.304 14.301 -22.759 378 HA GLN 50 HA GLN 50 -19.256 14.998 -25.487 379 HB2 GLN 50 1HB GLN 50 -18.217 16.031 -23.061 380 HB3 GLN 50 2HB GLN 50 -16.868 15.888 -24.181 381 HG2 GLN 50 1HG GLN 50 -17.501 17.855 -24.983 382 HG3 GLN 50 2HG GLN 50 -18.851 17.000 -25.728 383 HE21 GLN 50 2HE2 GLN 50 -20.847 17.546 -25.156 384 HE22 GLN 50 1HE2 GLN 50 -21.264 18.576 -23.834 385 H GLU 51 H GLU 51 -17.280 12.853 -23.561 386 HA GLU 51 HA GLU 51 -15.195 12.571 -25.500 387 HB2 GLU 51 1HB GLU 51 -15.959 10.975 -23.057 388 HB3 GLU 51 2HB GLU 51 -14.597 10.546 -24.083 389 HG2 GLU 51 1HG GLU 51 -14.534 13.334 -23.302 390 HG3 GLU 51 2HG GLU 51 -14.556 12.249 -21.913 391 H LEU 52 H LEU 52 -17.847 10.437 -24.442 392 HA LEU 52 HA LEU 52 -17.433 8.368 -26.242 393 HB2 LEU 52 1HB LEU 52 -19.806 9.411 -24.779 394 HB3 LEU 52 2HB LEU 52 -20.056 8.197 -26.033 395 HG LEU 52 HG LEU 52 -18.177 7.786 -23.717 396 HD11 LEU 52 1HD1 LEU 52 -19.847 6.861 -22.433 397 HD12 LEU 52 2HD1 LEU 52 -20.914 6.600 -23.812 398 HD13 LEU 52 3HD1 LEU 52 -20.687 8.226 -23.169 399 HD21 LEU 52 1HD2 LEU 52 -18.602 5.395 -24.306 400 HD22 LEU 52 2HD2 LEU 52 -17.745 6.312 -25.545 401 HD23 LEU 52 3HD2 LEU 52 -19.463 5.958 -25.738 402 H GLU 53 H GLU 53 -18.951 11.480 -26.712 403 HA GLU 53 HA GLU 53 -20.256 10.928 -29.151 404 HB2 GLU 53 1HB GLU 53 -20.171 13.064 -27.462 405 HB3 GLU 53 2HB GLU 53 -19.198 13.656 -28.801 406 HG2 GLU 53 1HG GLU 53 -21.226 12.732 -30.217 407 HG3 GLU 53 2HG GLU 53 -22.085 12.990 -28.699 408 H ASP 54 H ASP 54 -16.955 11.688 -28.354 409 HA ASP 54 HA ASP 54 -16.144 12.382 -31.006 410 HB2 ASP 54 1HB ASP 54 -14.991 12.972 -28.770 411 HB3 ASP 54 2HB ASP 54 -14.289 11.360 -28.870 412 H LEU 55 H LEU 55 -16.261 9.424 -29.121 413 HA LEU 55 HA LEU 55 -14.689 7.836 -30.860 414 HB2 LEU 55 1HB LEU 55 -16.624 7.311 -28.660 415 HB3 LEU 55 2HB LEU 55 -16.172 5.975 -29.718 416 HG LEU 55 HG LEU 55 -14.863 6.057 -27.624 417 HD11 LEU 55 1HD1 LEU 55 -12.578 6.399 -29.092 418 HD12 LEU 55 2HD1 LEU 55 -13.779 6.036 -30.332 419 HD13 LEU 55 3HD1 LEU 55 -13.524 4.913 -28.996 420 HD21 LEU 55 1HD2 LEU 55 -13.656 7.842 -26.940 421 HD22 LEU 55 2HD2 LEU 55 -14.855 8.725 -27.885 422 HD23 LEU 55 3HD2 LEU 55 -13.277 8.356 -28.584 423 H GLY 56 H GLY 56 -18.052 8.773 -30.842 424 HA2 GLY 56 1HA GLY 56 -18.868 8.685 -33.284 425 HA3 GLY 56 2HA GLY 56 -18.583 6.960 -33.101 426 H VAL 57 H VAL 57 -19.478 7.344 -30.183 427 HA VAL 57 HA VAL 57 -22.138 6.475 -30.548 428 HB VAL 57 HB VAL 57 -20.961 7.585 -28.000 429 HG11 VAL 57 1HG1 VAL 57 -23.394 7.239 -27.998 430 HG12 VAL 57 2HG1 VAL 57 -23.144 5.555 -28.460 431 HG13 VAL 57 3HG1 VAL 57 -22.568 6.137 -26.898 432 HG21 VAL 57 1HG2 VAL 57 -20.181 5.280 -29.517 433 HG22 VAL 57 2HG2 VAL 57 -19.511 5.900 -28.008 434 HG23 VAL 57 3HG2 VAL 57 -20.871 4.778 -27.974 435 H SER 58 H SER 58 -23.297 7.995 -31.723 436 HA SER 58 HA SER 58 -23.518 10.716 -30.755 437 HB2 SER 58 1HB SER 58 -25.066 11.003 -32.688 438 HB3 SER 58 2HB SER 58 -23.487 10.372 -33.157 439 HG SER 58 HG SER 58 -24.405 8.593 -33.805 440 H ARG 59 H ARG 59 -25.384 7.756 -30.724 441 HA ARG 59 HA ARG 59 -27.874 8.802 -29.973 442 HB2 ARG 59 1HB ARG 59 -26.575 6.175 -29.995 443 HB3 ARG 59 2HB ARG 59 -27.775 6.355 -28.722 444 HG2 ARG 59 1HG ARG 59 -29.216 5.700 -30.300 445 HG3 ARG 59 2HG ARG 59 -29.115 7.376 -30.845 446 HD2 ARG 59 1HD ARG 59 -27.466 6.812 -32.484 447 HD3 ARG 59 2HD ARG 59 -27.318 5.175 -31.846 448 HE ARG 59 HE ARG 59 -29.171 4.580 -33.048 449 HH11 ARG 59 1HH1 ARG 59 -29.007 8.052 -32.856 450 HH12 ARG 59 2HH1 ARG 59 -30.312 8.305 -33.969 451 HH21 ARG 59 1HH2 ARG 59 -30.889 4.900 -34.514 452 HH22 ARG 59 2HH2 ARG 59 -31.382 6.511 -34.910 453 H ILE 60 H ILE 60 -28.844 8.083 -27.727 454 HA ILE 60 HA ILE 60 -27.040 9.140 -25.650 455 HB ILE 60 HB ILE 60 -30.053 9.328 -25.738 456 HG12 ILE 60 1HG1 ILE 60 -28.953 10.754 -27.428 457 HG13 ILE 60 2HG1 ILE 60 -29.718 11.710 -26.163 458 HG21 ILE 60 1HG2 ILE 60 -29.209 9.212 -23.471 459 HG22 ILE 60 2HG2 ILE 60 -28.043 10.489 -23.814 460 HG23 ILE 60 3HG2 ILE 60 -29.770 10.847 -23.822 461 HD11 ILE 60 1HD1 ILE 60 -26.783 11.084 -26.376 462 HD12 ILE 60 2HD1 ILE 60 -27.556 12.622 -26.763 463 HD13 ILE 60 3HD1 ILE 60 -27.545 12.033 -25.100 464 H GLY 61 H GLY 61 -29.539 6.765 -26.394 465 HA2 GLY 61 1HA GLY 61 -29.720 5.597 -23.833 466 HA3 GLY 61 2HA GLY 61 -30.155 4.817 -25.347 467 H HIS 62 H HIS 62 -27.353 5.278 -26.347 468 HA HIS 62 HA HIS 62 -26.250 2.831 -25.245 469 HB2 HIS 62 1HB HIS 62 -25.094 4.577 -27.423 470 HB3 HIS 62 2HB HIS 62 -24.691 2.898 -27.076 471 HD1 HIS 62 HD1 HIS 62 -25.906 4.172 -29.796 472 HD2 HIS 62 HD2 HIS 62 -27.893 1.869 -26.966 473 HE1 HIS 62 HE1 HIS 62 -27.856 3.149 -31.010 474 H GLN 63 H GLN 63 -25.437 6.261 -25.424 475 HA GLN 63 HA GLN 63 -22.864 6.182 -24.378 476 HB2 GLN 63 1HB GLN 63 -25.038 8.252 -24.280 477 HB3 GLN 63 2HB GLN 63 -23.498 8.524 -23.475 478 HG2 GLN 63 1HG GLN 63 -22.448 7.961 -25.751 479 HG3 GLN 63 2HG GLN 63 -24.066 8.231 -26.397 480 HE21 GLN 63 2HE2 GLN 63 -24.493 10.211 -27.036 481 HE22 GLN 63 1HE2 GLN 63 -23.701 11.650 -26.502 482 H GLU 64 H GLU 64 -25.979 6.102 -22.744 483 HA GLU 64 HA GLU 64 -24.811 6.281 -20.115 484 HB2 GLU 64 1HB GLU 64 -27.572 5.944 -21.205 485 HB3 GLU 64 2HB GLU 64 -27.268 5.512 -19.529 486 HG2 GLU 64 1HG GLU 64 -26.294 8.150 -20.454 487 HG3 GLU 64 2HG GLU 64 -28.034 7.940 -20.263 488 H LEU 65 H LEU 65 -25.726 3.774 -22.333 489 HA LEU 65 HA LEU 65 -26.008 1.620 -20.568 490 HB2 LEU 65 1HB LEU 65 -25.564 1.998 -23.432 491 HB3 LEU 65 2HB LEU 65 -24.889 0.497 -22.802 492 HG LEU 65 HG LEU 65 -27.767 1.322 -22.453 493 HD11 LEU 65 1HD1 LEU 65 -28.286 0.500 -24.455 494 HD12 LEU 65 2HD1 LEU 65 -27.242 -0.905 -24.239 495 HD13 LEU 65 3HD1 LEU 65 -26.566 0.612 -24.833 496 HD21 LEU 65 1HD2 LEU 65 -26.119 -0.812 -21.409 497 HD22 LEU 65 2HD2 LEU 65 -27.488 -1.440 -22.327 498 HD23 LEU 65 3HD2 LEU 65 -27.762 -0.341 -20.975 499 H ILE 66 H ILE 66 -23.136 2.903 -22.203 500 HA ILE 66 HA ILE 66 -21.358 0.946 -21.145 501 HB ILE 66 HB ILE 66 -20.674 3.692 -22.200 502 HG12 ILE 66 1HG1 ILE 66 -20.770 1.060 -23.688 503 HG13 ILE 66 2HG1 ILE 66 -22.009 2.306 -23.791 504 HG21 ILE 66 1HG2 ILE 66 -19.079 1.766 -20.960 505 HG22 ILE 66 2HG2 ILE 66 -18.741 1.614 -22.684 506 HG23 ILE 66 3HG2 ILE 66 -18.538 3.170 -21.880 507 HD11 ILE 66 1HD1 ILE 66 -20.640 3.745 -24.970 508 HD12 ILE 66 2HD1 ILE 66 -19.163 2.946 -24.430 509 HD13 ILE 66 3HD1 ILE 66 -20.203 2.166 -25.620 510 H LEU 67 H LEU 67 -22.026 4.336 -20.297 511 HA LEU 67 HA LEU 67 -20.209 4.567 -18.194 512 HB2 LEU 67 1HB LEU 67 -22.903 5.893 -18.454 513 HB3 LEU 67 2HB LEU 67 -21.579 6.427 -17.420 514 HG LEU 67 HG LEU 67 -21.219 6.260 -20.390 515 HD11 LEU 67 1HD1 LEU 67 -23.235 7.762 -19.294 516 HD12 LEU 67 2HD1 LEU 67 -22.429 8.082 -20.829 517 HD13 LEU 67 3HD1 LEU 67 -21.891 8.903 -19.364 518 HD21 LEU 67 1HD2 LEU 67 -19.991 7.944 -18.210 519 HD22 LEU 67 2HD2 LEU 67 -19.606 8.064 -19.927 520 HD23 LEU 67 3HD2 LEU 67 -19.236 6.584 -19.041 521 H GLU 68 H GLU 68 -23.639 3.627 -18.122 522 HA GLU 68 HA GLU 68 -23.969 3.309 -15.401 523 HB2 GLU 68 1HB GLU 68 -25.801 3.128 -17.026 524 HB3 GLU 68 2HB GLU 68 -25.145 1.602 -17.601 525 HG2 GLU 68 1HG GLU 68 -25.646 1.699 -14.718 526 HG3 GLU 68 2HG GLU 68 -27.085 1.854 -15.724 527 H ALA 69 H ALA 69 -22.295 1.261 -17.670 528 HA ALA 69 HA ALA 69 -22.061 -0.954 -15.831 529 HB1 ALA 69 1HB ALA 69 -20.899 -2.081 -17.546 530 HB2 ALA 69 2HB ALA 69 -22.166 -1.156 -18.353 531 HB3 ALA 69 3HB ALA 69 -20.501 -0.575 -18.373 532 H VAL 70 H VAL 70 -20.062 1.718 -16.954 533 HA VAL 70 HA VAL 70 -17.604 0.912 -15.895 534 HB VAL 70 HB VAL 70 -18.667 3.725 -16.196 535 HG11 VAL 70 1HG1 VAL 70 -16.042 2.628 -15.385 536 HG12 VAL 70 2HG1 VAL 70 -16.025 3.986 -16.512 537 HG13 VAL 70 3HG1 VAL 70 -16.823 4.148 -14.947 538 HG21 VAL 70 1HG2 VAL 70 -16.940 3.389 -18.234 539 HG22 VAL 70 2HG2 VAL 70 -17.567 1.747 -18.089 540 HG23 VAL 70 3HG2 VAL 70 -18.674 3.092 -18.365 541 H ASP 71 H ASP 71 -20.360 2.481 -14.391 542 HA ASP 71 HA ASP 71 -19.185 3.341 -12.015 543 HB2 ASP 71 1HB ASP 71 -21.650 3.556 -12.998 544 HB3 ASP 71 2HB ASP 71 -21.935 2.198 -11.913 545 H LEU 72 H LEU 72 -20.072 0.155 -13.075 546 HA LEU 72 HA LEU 72 -19.898 -1.016 -10.440 547 HB2 LEU 72 1HB LEU 72 -20.258 -2.129 -13.205 548 HB3 LEU 72 2HB LEU 72 -19.999 -3.175 -11.810 549 HG LEU 72 HG LEU 72 -22.198 -1.203 -11.603 550 HD11 LEU 72 1HD1 LEU 72 -23.680 -2.256 -13.026 551 HD12 LEU 72 2HD1 LEU 72 -22.710 -3.725 -13.121 552 HD13 LEU 72 3HD1 LEU 72 -22.190 -2.269 -13.969 553 HD21 LEU 72 1HD2 LEU 72 -22.105 -2.546 -9.749 554 HD22 LEU 72 2HD2 LEU 72 -21.542 -3.950 -10.656 555 HD23 LEU 72 3HD2 LEU 72 -23.235 -3.461 -10.749 556 H LEU 73 H LEU 73 -17.816 -0.504 -13.183 557 HA LEU 73 HA LEU 73 -15.823 -2.401 -12.558 558 HB2 LEU 73 1HB LEU 73 -16.076 -0.046 -14.306 559 HB3 LEU 73 2HB LEU 73 -14.433 -0.451 -13.815 560 HG LEU 73 HG LEU 73 -16.332 -2.335 -15.210 561 HD11 LEU 73 1HD1 LEU 73 -14.019 -0.724 -16.276 562 HD12 LEU 73 2HD1 LEU 73 -15.721 -0.539 -16.699 563 HD13 LEU 73 3HD1 LEU 73 -14.854 -2.004 -17.156 564 HD21 LEU 73 1HD2 LEU 73 -14.784 -3.948 -15.007 565 HD22 LEU 73 2HD2 LEU 73 -14.216 -2.987 -13.641 566 HD23 LEU 73 3HD2 LEU 73 -13.439 -2.827 -15.217 567 H CYS 74 H CYS 74 -16.324 0.949 -11.580 568 HA CYS 74 HA CYS 74 -13.838 1.066 -10.121 569 HB2 CYS 74 1HB CYS 74 -15.885 2.934 -10.965 570 HB3 CYS 74 2HB CYS 74 -15.463 3.182 -9.275 571 HG CYS 74 HG CYS 74 -14.052 4.818 -11.294 572 H ALA 75 H ALA 75 -17.274 0.737 -9.363 573 HA ALA 75 HA ALA 75 -17.080 0.896 -6.571 574 HB1 ALA 75 1HB ALA 75 -19.069 -0.666 -8.216 575 HB2 ALA 75 2HB ALA 75 -19.256 -0.200 -6.524 576 HB3 ALA 75 3HB ALA 75 -19.203 1.038 -7.779 577 H LEU 76 H LEU 76 -16.372 -1.688 -8.789 578 HA LEU 76 HA LEU 76 -16.367 -3.772 -6.821 579 HB2 LEU 76 1HB LEU 76 -15.509 -3.535 -9.671 580 HB3 LEU 76 2HB LEU 76 -14.995 -4.926 -8.720 581 HG LEU 76 HG LEU 76 -17.866 -4.139 -9.210 582 HD11 LEU 76 1HD1 LEU 76 -16.084 -5.277 -11.007 583 HD12 LEU 76 2HD1 LEU 76 -17.844 -5.298 -11.106 584 HD13 LEU 76 3HD1 LEU 76 -16.988 -6.644 -10.354 585 HD21 LEU 76 1HD2 LEU 76 -17.953 -6.709 -8.490 586 HD22 LEU 76 2HD2 LEU 76 -18.064 -5.387 -7.328 587 HD23 LEU 76 3HD2 LEU 76 -16.526 -6.213 -7.580 588 H ASN 77 H ASN 77 -14.032 -1.518 -8.101 589 HA ASN 77 HA ASN 77 -11.893 -2.823 -6.569 590 HB2 ASN 77 1HB ASN 77 -11.918 -0.973 -8.925 591 HB3 ASN 77 2HB ASN 77 -10.499 -1.022 -7.883 592 HD21 ASN 77 2HD2 ASN 77 -12.329 -2.640 -10.289 593 HD22 ASN 77 1HD2 ASN 77 -11.264 -3.982 -10.512 594 H SER 78 H SER 78 -13.370 -1.816 -4.760 595 HA SER 78 HA SER 78 -11.901 0.422 -3.716 596 HB2 SER 78 1HB SER 78 -13.938 1.838 -3.353 597 HB3 SER 78 2HB SER 78 -13.469 1.686 -5.046 598 HG SER 78 HG SER 78 -15.748 1.392 -4.633 599 H GLY 79 H GLY 79 -15.096 -1.113 -3.258 600 HA2 GLY 79 1HA GLY 79 -14.976 -2.832 -1.350 601 HA3 GLY 79 2HA GLY 79 -14.414 -1.456 -0.413 602 HA PRO 80 HA PRO 80 -19.118 -1.844 -0.316 603 HB2 PRO 80 1HB PRO 80 -19.346 -2.398 2.332 604 HB3 PRO 80 2HB PRO 80 -19.171 -3.653 1.100 605 HG2 PRO 80 1HG PRO 80 -17.097 -2.467 2.903 606 HG3 PRO 80 2HG PRO 80 -17.356 -4.164 2.460 607 HD2 PRO 80 1HD PRO 80 -15.440 -2.634 1.310 608 HD3 PRO 80 2HD PRO 80 -16.280 -3.930 0.435 609 H SER 81 H SER 81 -20.016 0.109 -0.231 610 HA SER 81 HA SER 81 -18.883 2.139 1.543 611 HB2 SER 81 1HB SER 81 -20.951 3.266 -0.011 612 HB3 SER 81 2HB SER 81 -19.213 3.459 -0.237 613 HG SER 81 HG SER 81 -19.856 2.599 -2.114 614 H SER 82 H SER 82 -19.825 2.654 3.396 615 HA SER 82 HA SER 82 -22.680 2.007 3.749 616 HB2 SER 82 1HB SER 82 -22.231 1.551 6.096 617 HB3 SER 82 2HB SER 82 -21.166 0.563 5.095 618 HG SER 82 HG SER 82 -20.558 2.583 6.859 619 H GLY 83 H GLY 83 -23.977 3.664 4.194 620 HA2 GLY 83 1HA GLY 83 -23.361 5.800 5.912 621 HA3 GLY 83 2HA GLY 83 -23.075 6.322 4.258 Start of MODEL 6 1 H1 GLY 1 H GLY 1 -6.504 4.300 8.845 2 HA2 GLY 1 1HA GLY 1 -4.651 4.361 7.153 3 HA3 GLY 1 2HA GLY 1 -4.683 2.607 7.247 4 H SER 2 H SER 2 -4.915 3.306 4.813 5 HA SER 2 HA SER 2 -7.741 2.937 4.175 6 HB2 SER 2 1HB SER 2 -6.165 5.345 3.558 7 HB3 SER 2 2HB SER 2 -7.013 4.657 2.173 8 HG SER 2 HG SER 2 -8.748 5.518 2.957 9 H SER 3 H SER 3 -8.058 1.525 2.559 10 HA SER 3 HA SER 3 -5.834 0.092 1.500 11 HB2 SER 3 1HB SER 3 -7.904 -0.785 -0.010 12 HB3 SER 3 2HB SER 3 -7.578 -1.366 1.622 13 HG SER 3 HG SER 3 -9.313 -0.389 2.311 14 H GLY 4 H GLY 4 -4.835 0.239 -0.432 15 HA2 GLY 4 1HA GLY 4 -5.696 2.435 -2.195 16 HA3 GLY 4 2HA GLY 4 -4.060 1.800 -2.089 17 H SER 5 H SER 5 -6.847 1.821 -3.898 18 HA SER 5 HA SER 5 -5.916 -0.492 -5.444 19 HB2 SER 5 1HB SER 5 -8.795 -0.283 -5.577 20 HB3 SER 5 2HB SER 5 -7.799 -1.671 -5.141 21 HG SER 5 HG SER 5 -7.638 -0.666 -3.017 22 H SER 6 H SER 6 -5.692 -0.045 -7.535 23 HA SER 6 HA SER 6 -7.448 1.766 -8.916 24 HB2 SER 6 1HB SER 6 -5.263 3.067 -9.704 25 HB3 SER 6 2HB SER 6 -6.169 3.568 -8.277 26 HG SER 6 HG SER 6 -3.634 2.765 -8.433 27 H GLY 7 H GLY 7 -7.674 -0.380 -9.931 28 HA2 GLY 7 1HA GLY 7 -5.432 -1.184 -11.632 29 HA3 GLY 7 2HA GLY 7 -6.903 -2.104 -11.353 30 H VAL 8 H VAL 8 -8.870 -0.333 -11.979 31 HA VAL 8 HA VAL 8 -8.958 -0.463 -14.778 32 HB VAL 8 HB VAL 8 -10.606 1.337 -12.997 33 HG11 VAL 8 1HG1 VAL 8 -12.288 1.100 -14.808 34 HG12 VAL 8 2HG1 VAL 8 -10.826 1.950 -15.312 35 HG13 VAL 8 3HG1 VAL 8 -11.073 0.266 -15.776 36 HG21 VAL 8 1HG2 VAL 8 -11.140 -1.499 -13.879 37 HG22 VAL 8 2HG2 VAL 8 -10.684 -0.997 -12.251 38 HG23 VAL 8 3HG2 VAL 8 -12.228 -0.483 -12.932 39 H SER 9 H SER 9 -7.698 1.944 -12.636 40 HA SER 9 HA SER 9 -7.748 4.128 -14.467 41 HB2 SER 9 1HB SER 9 -6.366 5.283 -12.865 42 HB3 SER 9 2HB SER 9 -7.570 4.354 -11.972 43 HG SER 9 HG SER 9 -5.675 2.693 -12.115 44 H LYS 10 H LYS 10 -5.611 1.456 -13.914 45 HA LYS 10 HA LYS 10 -3.631 2.616 -15.754 46 HB2 LYS 10 1HB LYS 10 -3.326 0.264 -13.880 47 HB3 LYS 10 2HB LYS 10 -2.058 0.966 -14.875 48 HG2 LYS 10 1HG LYS 10 -3.243 3.006 -13.257 49 HG3 LYS 10 2HG LYS 10 -2.766 1.641 -12.245 50 HD2 LYS 10 1HD LYS 10 -0.517 1.765 -12.981 51 HD3 LYS 10 2HD LYS 10 -0.933 2.870 -14.293 52 HE2 LYS 10 1HE LYS 10 -1.620 3.773 -11.570 53 HE3 LYS 10 2HE LYS 10 0.101 3.660 -11.933 54 HZ1 LYS 10 1HZ LYS 10 -1.675 5.679 -12.664 55 HZ2 LYS 10 2HZ LYS 10 -1.205 4.898 -14.089 56 HZ3 LYS 10 3HZ LYS 10 -0.034 5.547 -13.055 57 H TRP 11 H TRP 11 -6.237 1.276 -16.409 58 HA TRP 11 HA TRP 11 -5.603 -1.261 -17.558 59 HB2 TRP 11 1HB TRP 11 -7.952 0.499 -17.389 60 HB3 TRP 11 2HB TRP 11 -7.859 -0.439 -18.877 61 HD1 TRP 11 HD1 TRP 11 -6.559 -1.948 -15.623 62 HE1 TRP 11 HE1 TRP 11 -8.092 -3.901 -14.945 63 HE3 TRP 11 HE3 TRP 11 -10.275 -1.299 -19.074 64 HZ2 TRP 11 HZ2 TRP 11 -10.551 -5.018 -15.764 65 HZ3 TRP 11 HZ3 TRP 11 -12.182 -2.853 -19.059 66 HH2 TRP 11 HH2 TRP 11 -12.315 -4.674 -17.438 67 H SER 12 H SER 12 -4.782 -1.731 -19.500 68 HA SER 12 HA SER 12 -3.606 0.243 -21.115 69 HB2 SER 12 1HB SER 12 -2.647 -1.506 -22.182 70 HB3 SER 12 2HB SER 12 -3.385 -2.481 -20.911 71 HG SER 12 HG SER 12 -3.783 -2.837 -23.385 72 HA PRO 13 HA PRO 13 -6.728 1.550 -23.905 73 HB2 PRO 13 1HB PRO 13 -5.390 1.684 -26.264 74 HB3 PRO 13 2HB PRO 13 -5.130 2.832 -24.945 75 HG2 PRO 13 1HG PRO 13 -3.515 0.431 -25.713 76 HG3 PRO 13 2HG PRO 13 -2.960 2.045 -25.232 77 HD2 PRO 13 1HD PRO 13 -2.977 -0.058 -23.526 78 HD3 PRO 13 2HD PRO 13 -3.246 1.612 -22.987 79 H SER 14 H SER 14 -5.085 -1.436 -24.511 80 HA SER 14 HA SER 14 -6.987 -2.228 -26.579 81 HB2 SER 14 1HB SER 14 -5.167 -4.321 -25.738 82 HB3 SER 14 2HB SER 14 -5.349 -3.569 -27.323 83 HG SER 14 HG SER 14 -3.734 -2.262 -26.902 84 H GLN 15 H GLN 15 -6.313 -2.707 -23.216 85 HA GLN 15 HA GLN 15 -7.728 -5.122 -22.831 86 HB2 GLN 15 1HB GLN 15 -6.826 -2.901 -21.036 87 HB3 GLN 15 2HB GLN 15 -7.916 -4.132 -20.412 88 HG2 GLN 15 1HG GLN 15 -5.636 -5.238 -21.847 89 HG3 GLN 15 2HG GLN 15 -5.182 -4.269 -20.446 90 HE21 GLN 15 2HE2 GLN 15 -4.522 -5.912 -19.150 91 HE22 GLN 15 1HE2 GLN 15 -5.575 -7.137 -18.538 92 H VAL 16 H VAL 16 -8.690 -1.722 -22.451 93 HA VAL 16 HA VAL 16 -11.258 -2.057 -21.502 94 HB VAL 16 HB VAL 16 -10.335 0.023 -23.490 95 HG11 VAL 16 1HG1 VAL 16 -12.205 1.277 -22.062 96 HG12 VAL 16 2HG1 VAL 16 -12.576 0.385 -23.538 97 HG13 VAL 16 3HG1 VAL 16 -12.843 -0.364 -21.963 98 HG21 VAL 16 1HG2 VAL 16 -9.211 1.011 -21.845 99 HG22 VAL 16 2HG2 VAL 16 -10.599 0.911 -20.761 100 HG23 VAL 16 3HG2 VAL 16 -9.471 -0.439 -20.875 101 H VAL 17 H VAL 17 -10.048 -2.432 -24.773 102 HA VAL 17 HA VAL 17 -12.506 -2.483 -26.133 103 HB VAL 17 HB VAL 17 -10.032 -4.040 -26.885 104 HG11 VAL 17 1HG1 VAL 17 -10.864 -4.113 -29.052 105 HG12 VAL 17 2HG1 VAL 17 -12.305 -4.379 -28.068 106 HG13 VAL 17 3HG1 VAL 17 -11.995 -2.790 -28.770 107 HG21 VAL 17 1HG2 VAL 17 -10.411 -1.207 -26.643 108 HG22 VAL 17 2HG2 VAL 17 -8.966 -2.102 -27.113 109 HG23 VAL 17 3HG2 VAL 17 -10.151 -1.638 -28.333 110 H ASP 18 H ASP 18 -10.741 -4.956 -24.378 111 HA ASP 18 HA ASP 18 -12.326 -7.149 -25.275 112 HB2 ASP 18 1HB ASP 18 -9.983 -7.244 -24.256 113 HB3 ASP 18 2HB ASP 18 -10.772 -7.051 -22.693 114 H TRP 19 H TRP 19 -12.666 -4.754 -22.799 115 HA TRP 19 HA TRP 19 -14.531 -6.156 -21.172 116 HB2 TRP 19 1HB TRP 19 -13.293 -4.286 -20.257 117 HB3 TRP 19 2HB TRP 19 -13.972 -3.198 -21.464 118 HD1 TRP 19 HD1 TRP 19 -15.508 -5.584 -18.794 119 HE1 TRP 19 HE1 TRP 19 -17.411 -4.314 -17.615 120 HE3 TRP 19 HE3 TRP 19 -15.223 -1.155 -21.331 121 HZ2 TRP 19 HZ2 TRP 19 -18.630 -1.772 -17.744 122 HZ3 TRP 19 HZ3 TRP 19 -16.794 0.645 -20.743 123 HH2 TRP 19 HH2 TRP 19 -18.462 0.340 -18.986 124 H MET 20 H MET 20 -14.863 -3.802 -23.802 125 HA MET 20 HA MET 20 -17.655 -3.535 -23.697 126 HB2 MET 20 1HB MET 20 -15.966 -3.357 -26.192 127 HB3 MET 20 2HB MET 20 -17.503 -2.561 -25.882 128 HG2 MET 20 1HG MET 20 -16.414 -1.254 -24.087 129 HG3 MET 20 2HG MET 20 -14.877 -1.992 -24.531 130 HE1 MET 20 1HE MET 20 -17.323 0.897 -27.147 131 HE2 MET 20 2HE MET 20 -17.705 -0.824 -27.179 132 HE3 MET 20 3HE MET 20 -17.875 0.089 -25.680 133 H LYS 21 H LYS 21 -15.644 -6.070 -24.887 134 HA LYS 21 HA LYS 21 -17.436 -7.243 -26.731 135 HB2 LYS 21 1HB LYS 21 -15.202 -8.468 -25.105 136 HB3 LYS 21 2HB LYS 21 -16.049 -9.293 -26.407 137 HG2 LYS 21 1HG LYS 21 -15.296 -7.052 -27.688 138 HG3 LYS 21 2HG LYS 21 -13.985 -7.198 -26.515 139 HD2 LYS 21 1HD LYS 21 -13.169 -9.091 -27.464 140 HD3 LYS 21 2HD LYS 21 -14.767 -9.671 -27.937 141 HE2 LYS 21 1HE LYS 21 -14.332 -7.353 -29.440 142 HE3 LYS 21 2HE LYS 21 -12.805 -8.232 -29.480 143 HZ1 LYS 21 1HZ LYS 21 -15.361 -9.605 -30.022 144 HZ2 LYS 21 2HZ LYS 21 -13.797 -10.065 -30.470 145 HZ3 LYS 21 3HZ LYS 21 -14.551 -8.765 -31.247 146 H GLY 22 H GLY 22 -17.527 -7.007 -23.355 147 HA2 GLY 22 1HA GLY 22 -19.436 -9.259 -23.209 148 HA3 GLY 22 2HA GLY 22 -18.421 -8.758 -21.865 149 H LEU 23 H LEU 23 -19.947 -6.409 -23.932 150 HA LEU 23 HA LEU 23 -21.805 -5.759 -21.738 151 HB2 LEU 23 1HB LEU 23 -20.641 -3.826 -23.733 152 HB3 LEU 23 2HB LEU 23 -21.613 -3.441 -22.313 153 HG LEU 23 HG LEU 23 -18.782 -4.482 -22.345 154 HD11 LEU 23 1HD1 LEU 23 -18.318 -2.318 -21.233 155 HD12 LEU 23 2HD1 LEU 23 -19.990 -1.844 -21.531 156 HD13 LEU 23 3HD1 LEU 23 -18.904 -2.144 -22.887 157 HD21 LEU 23 1HD2 LEU 23 -20.670 -3.978 -20.053 158 HD22 LEU 23 2HD2 LEU 23 -18.924 -4.147 -19.871 159 HD23 LEU 23 3HD2 LEU 23 -19.882 -5.495 -20.486 160 H ASP 24 H ASP 24 -23.390 -3.918 -22.951 161 HA ASP 24 HA ASP 24 -25.302 -5.411 -24.267 162 HB2 ASP 24 1HB ASP 24 -25.095 -2.799 -23.390 163 HB3 ASP 24 2HB ASP 24 -25.277 -2.618 -25.133 164 H ASP 25 H ASP 25 -25.870 -5.762 -26.393 165 HA ASP 25 HA ASP 25 -23.797 -6.036 -28.264 166 HB2 ASP 25 1HB ASP 25 -26.544 -6.735 -28.087 167 HB3 ASP 25 2HB ASP 25 -26.315 -5.892 -29.617 168 H CYS 26 H CYS 26 -25.920 -3.394 -27.548 169 HA CYS 26 HA CYS 26 -25.633 -2.000 -30.009 170 HB2 CYS 26 1HB CYS 26 -26.533 -1.209 -27.252 171 HB3 CYS 26 2HB CYS 26 -26.348 -0.005 -28.522 172 HG CYS 26 HG CYS 26 -28.793 -0.296 -29.241 173 H LEU 27 H LEU 27 -23.640 -2.364 -27.227 174 HA LEU 27 HA LEU 27 -22.007 -0.042 -27.912 175 HB2 LEU 27 1HB LEU 27 -21.389 -1.962 -25.705 176 HB3 LEU 27 2HB LEU 27 -20.994 -0.249 -25.832 177 HG LEU 27 HG LEU 27 -23.782 -1.313 -25.394 178 HD11 LEU 27 1HD1 LEU 27 -22.933 0.012 -23.107 179 HD12 LEU 27 2HD1 LEU 27 -21.573 -1.017 -23.556 180 HD13 LEU 27 3HD1 LEU 27 -23.168 -1.725 -23.300 181 HD21 LEU 27 1HD2 LEU 27 -22.579 1.362 -25.746 182 HD22 LEU 27 2HD2 LEU 27 -23.787 1.205 -24.470 183 HD23 LEU 27 3HD2 LEU 27 -24.200 0.783 -26.132 184 H GLN 28 H GLN 28 -22.218 -2.597 -29.512 185 HA GLN 28 HA GLN 28 -19.508 -3.651 -29.314 186 HB2 GLN 28 1HB GLN 28 -21.813 -4.434 -31.106 187 HB3 GLN 28 2HB GLN 28 -20.256 -5.250 -31.053 188 HG2 GLN 28 1HG GLN 28 -22.147 -5.006 -28.725 189 HG3 GLN 28 2HG GLN 28 -22.019 -6.411 -29.782 190 HE21 GLN 28 2HE2 GLN 28 -21.365 -5.657 -26.839 191 HE22 GLN 28 1HE2 GLN 28 -19.823 -6.397 -26.594 192 H GLN 29 H GLN 29 -21.587 -2.056 -31.714 193 HA GLN 29 HA GLN 29 -19.754 -1.893 -33.798 194 HB2 GLN 29 1HB GLN 29 -21.107 -0.016 -34.628 195 HB3 GLN 29 2HB GLN 29 -22.112 -1.353 -34.086 196 HG2 GLN 29 1HG GLN 29 -22.626 -0.198 -32.039 197 HG3 GLN 29 2HG GLN 29 -21.515 1.105 -32.457 198 HE21 GLN 29 2HE2 GLN 29 -24.662 0.309 -32.327 199 HE22 GLN 29 1HE2 GLN 29 -25.295 1.357 -33.546 200 H TYR 30 H TYR 30 -19.936 -0.104 -30.841 201 HA TYR 30 HA TYR 30 -18.283 2.077 -31.699 202 HB2 TYR 30 1HB TYR 30 -18.949 1.168 -28.891 203 HB3 TYR 30 2HB TYR 30 -18.266 2.726 -29.345 204 HD1 TYR 30 HD2 TYR 30 -19.921 3.405 -31.701 205 HD2 TYR 30 HD1 TYR 30 -21.022 1.701 -27.961 206 HE1 TYR 30 HE2 TYR 30 -22.187 4.327 -31.955 207 HE2 TYR 30 HE1 TYR 30 -23.291 2.618 -28.205 208 HH TYR 30 HH TYR 30 -24.700 3.404 -30.690 209 H ILE 31 H ILE 31 -17.752 -1.095 -30.427 210 HA ILE 31 HA ILE 31 -15.277 -0.893 -29.228 211 HB ILE 31 HB ILE 31 -16.215 -3.136 -31.020 212 HG12 ILE 31 1HG1 ILE 31 -16.490 -2.762 -28.029 213 HG13 ILE 31 2HG1 ILE 31 -17.796 -2.625 -29.201 214 HG21 ILE 31 1HG2 ILE 31 -14.670 -4.520 -29.673 215 HG22 ILE 31 2HG2 ILE 31 -13.843 -3.287 -30.623 216 HG23 ILE 31 3HG2 ILE 31 -14.082 -3.052 -28.892 217 HD11 ILE 31 1HD1 ILE 31 -18.026 -4.749 -28.256 218 HD12 ILE 31 2HD1 ILE 31 -17.270 -5.029 -29.825 219 HD13 ILE 31 3HD1 ILE 31 -16.296 -5.076 -28.357 220 H LYS 32 H LYS 32 -15.993 -1.328 -32.681 221 HA LYS 32 HA LYS 32 -13.387 -1.520 -33.629 222 HB2 LYS 32 1HB LYS 32 -14.254 -1.008 -35.778 223 HB3 LYS 32 2HB LYS 32 -15.534 -1.862 -34.927 224 HG2 LYS 32 1HG LYS 32 -16.264 0.604 -34.305 225 HG3 LYS 32 2HG LYS 32 -15.386 0.970 -35.792 226 HD2 LYS 32 1HD LYS 32 -16.760 -0.753 -36.952 227 HD3 LYS 32 2HD LYS 32 -17.699 -0.941 -35.469 228 HE2 LYS 32 1HE LYS 32 -18.989 0.749 -36.107 229 HE3 LYS 32 2HE LYS 32 -17.591 1.821 -36.021 230 HZ1 LYS 32 1HZ LYS 32 -17.065 1.057 -38.339 231 HZ2 LYS 32 2HZ LYS 32 -18.453 2.012 -38.188 232 HZ3 LYS 32 3HZ LYS 32 -18.596 0.337 -38.380 233 H ASN 33 H ASN 33 -15.205 1.268 -32.591 234 HA ASN 33 HA ASN 33 -13.340 3.172 -33.695 235 HB2 ASN 33 1HB ASN 33 -15.558 3.599 -31.680 236 HB3 ASN 33 2HB ASN 33 -14.705 4.856 -32.570 237 HD21 ASN 33 2HD2 ASN 33 -17.398 4.763 -32.685 238 HD22 ASN 33 1HD2 ASN 33 -17.918 4.241 -34.248 239 H PHE 34 H PHE 34 -13.827 1.504 -30.680 240 HA PHE 34 HA PHE 34 -12.082 3.209 -29.158 241 HB2 PHE 34 1HB PHE 34 -13.566 0.666 -28.642 242 HB3 PHE 34 2HB PHE 34 -12.242 1.105 -27.568 243 HD1 PHE 34 HD2 PHE 34 -15.027 2.970 -29.215 244 HD2 PHE 34 HD1 PHE 34 -12.979 2.020 -25.607 245 HE1 PHE 34 HE2 PHE 34 -16.539 4.458 -27.969 246 HE2 PHE 34 HE1 PHE 34 -14.488 3.506 -24.355 247 HZ PHE 34 HZ PHE 34 -16.270 4.728 -25.536 248 H GLU 35 H GLU 35 -11.758 0.369 -31.119 249 HA GLU 35 HA GLU 35 -9.249 -0.498 -30.080 250 HB2 GLU 35 1HB GLU 35 -11.127 -1.495 -31.884 251 HB3 GLU 35 2HB GLU 35 -9.695 -1.204 -32.862 252 HG2 GLU 35 1HG GLU 35 -9.824 -2.873 -30.361 253 HG3 GLU 35 2HG GLU 35 -9.730 -3.475 -32.015 254 H ARG 36 H ARG 36 -10.239 1.857 -32.433 255 HA ARG 36 HA ARG 36 -7.519 2.175 -33.441 256 HB2 ARG 36 1HB ARG 36 -9.773 2.284 -34.807 257 HB3 ARG 36 2HB ARG 36 -9.777 3.954 -34.255 258 HG2 ARG 36 1HG ARG 36 -7.273 3.822 -35.172 259 HG3 ARG 36 2HG ARG 36 -8.021 2.603 -36.206 260 HD2 ARG 36 1HD ARG 36 -9.705 4.221 -36.909 261 HD3 ARG 36 2HD ARG 36 -8.990 5.437 -35.851 262 HE ARG 36 HE ARG 36 -8.029 4.597 -38.431 263 HH11 ARG 36 1HH1 ARG 36 -7.193 6.077 -35.393 264 HH12 ARG 36 2HH1 ARG 36 -5.826 6.927 -36.035 265 HH21 ARG 36 1HH2 ARG 36 -6.233 5.712 -39.288 266 HH22 ARG 36 2HH2 ARG 36 -5.282 6.720 -38.250 267 H GLU 37 H GLU 37 -9.824 3.724 -31.337 268 HA GLU 37 HA GLU 37 -8.346 6.193 -31.156 269 HB2 GLU 37 1HB GLU 37 -10.846 5.095 -29.997 270 HB3 GLU 37 2HB GLU 37 -10.012 6.318 -29.047 271 HG2 GLU 37 1HG GLU 37 -10.132 7.186 -31.757 272 HG3 GLU 37 2HG GLU 37 -11.741 6.682 -31.243 273 H LYS 38 H LYS 38 -8.298 3.126 -29.616 274 HA LYS 38 HA LYS 38 -7.033 2.244 -27.944 275 HB2 LYS 38 1HB LYS 38 -5.377 4.762 -28.155 276 HB3 LYS 38 2HB LYS 38 -4.866 3.202 -27.522 277 HG2 LYS 38 1HG LYS 38 -5.636 3.741 -30.383 278 HG3 LYS 38 2HG LYS 38 -3.984 3.651 -29.767 279 HD2 LYS 38 1HD LYS 38 -4.690 1.315 -28.902 280 HD3 LYS 38 2HD LYS 38 -6.018 1.469 -30.055 281 HE2 LYS 38 1HE LYS 38 -3.129 1.837 -30.815 282 HE3 LYS 38 2HE LYS 38 -3.950 0.278 -30.889 283 HZ1 LYS 38 1HZ LYS 38 -4.161 2.555 -32.648 284 HZ2 LYS 38 2HZ LYS 38 -5.652 1.883 -32.216 285 HZ3 LYS 38 3HZ LYS 38 -4.471 0.920 -32.952 286 H ILE 39 H ILE 39 -9.316 3.539 -27.123 287 HA ILE 39 HA ILE 39 -8.997 5.488 -25.141 288 HB ILE 39 HB ILE 39 -11.099 3.324 -25.291 289 HG12 ILE 39 1HG1 ILE 39 -11.047 4.666 -27.322 290 HG13 ILE 39 2HG1 ILE 39 -12.470 5.081 -26.372 291 HG21 ILE 39 1HG2 ILE 39 -10.760 5.723 -23.564 292 HG22 ILE 39 2HG2 ILE 39 -12.385 5.270 -24.075 293 HG23 ILE 39 3HG2 ILE 39 -11.395 4.126 -23.168 294 HD11 ILE 39 1HD1 ILE 39 -9.984 6.671 -26.833 295 HD12 ILE 39 2HD1 ILE 39 -11.668 7.132 -27.079 296 HD13 ILE 39 3HD1 ILE 39 -11.023 6.992 -25.444 297 H SER 40 H SER 40 -7.703 5.320 -23.434 298 HA SER 40 HA SER 40 -7.120 2.764 -22.223 299 HB2 SER 40 1HB SER 40 -5.371 3.820 -21.153 300 HB3 SER 40 2HB SER 40 -5.571 4.893 -22.538 301 HG SER 40 HG SER 40 -5.722 6.342 -21.003 302 H GLY 41 H GLY 41 -7.238 2.512 -19.824 303 HA2 GLY 41 1HA GLY 41 -9.887 2.749 -18.933 304 HA3 GLY 41 2HA GLY 41 -8.508 2.348 -17.920 305 H ASP 42 H ASP 42 -7.025 4.693 -18.152 306 HA ASP 42 HA ASP 42 -8.068 6.279 -16.148 307 HB2 ASP 42 1HB ASP 42 -5.686 6.214 -17.200 308 HB3 ASP 42 2HB ASP 42 -6.306 7.472 -18.266 309 H GLN 43 H GLN 43 -8.657 6.398 -19.582 310 HA GLN 43 HA GLN 43 -10.075 8.933 -19.378 311 HB2 GLN 43 1HB GLN 43 -9.251 7.159 -21.650 312 HB3 GLN 43 2HB GLN 43 -10.494 8.379 -21.892 313 HG2 GLN 43 1HG GLN 43 -8.728 9.975 -20.825 314 HG3 GLN 43 2HG GLN 43 -7.593 8.718 -21.316 315 HE21 GLN 43 2HE2 GLN 43 -7.502 8.155 -23.563 316 HE22 GLN 43 1HE2 GLN 43 -7.909 9.329 -24.764 317 H LEU 44 H LEU 44 -10.710 5.531 -19.513 318 HA LEU 44 HA LEU 44 -13.451 5.733 -20.297 319 HB2 LEU 44 1HB LEU 44 -12.218 3.695 -20.684 320 HB3 LEU 44 2HB LEU 44 -11.907 3.518 -18.958 321 HG LEU 44 HG LEU 44 -14.495 3.387 -18.767 322 HD11 LEU 44 1HD1 LEU 44 -15.723 3.211 -20.615 323 HD12 LEU 44 2HD1 LEU 44 -14.601 2.065 -21.347 324 HD13 LEU 44 3HD1 LEU 44 -14.310 3.799 -21.491 325 HD21 LEU 44 1HD2 LEU 44 -13.430 0.967 -20.094 326 HD22 LEU 44 2HD2 LEU 44 -14.263 1.143 -18.550 327 HD23 LEU 44 3HD2 LEU 44 -12.553 1.556 -18.682 328 H LEU 45 H LEU 45 -11.757 5.403 -17.207 329 HA LEU 45 HA LEU 45 -14.010 5.113 -15.565 330 HB2 LEU 45 1HB LEU 45 -11.231 6.128 -15.107 331 HB3 LEU 45 2HB LEU 45 -12.432 6.190 -13.818 332 HG LEU 45 HG LEU 45 -11.970 3.583 -15.174 333 HD11 LEU 45 1HD1 LEU 45 -10.173 3.267 -13.303 334 HD12 LEU 45 2HD1 LEU 45 -9.992 5.014 -13.464 335 HD13 LEU 45 3HD1 LEU 45 -9.729 3.968 -14.859 336 HD21 LEU 45 1HD2 LEU 45 -12.053 3.255 -12.443 337 HD22 LEU 45 2HD2 LEU 45 -13.417 3.087 -13.549 338 HD23 LEU 45 3HD2 LEU 45 -13.138 4.618 -12.718 339 H ARG 46 H ARG 46 -12.584 7.912 -17.059 340 HA ARG 46 HA ARG 46 -14.606 9.602 -15.739 341 HB2 ARG 46 1HB ARG 46 -13.080 11.496 -15.985 342 HB3 ARG 46 2HB ARG 46 -12.335 10.209 -15.046 343 HG2 ARG 46 1HG ARG 46 -11.378 9.508 -17.397 344 HG3 ARG 46 2HG ARG 46 -11.670 11.210 -17.761 345 HD2 ARG 46 1HD ARG 46 -10.062 10.185 -15.424 346 HD3 ARG 46 2HD ARG 46 -9.381 10.777 -16.938 347 HE ARG 46 HE ARG 46 -10.450 12.352 -14.780 348 HH11 ARG 46 1HH1 ARG 46 -9.704 12.268 -18.180 349 HH12 ARG 46 2HH1 ARG 46 -9.577 13.989 -18.328 350 HH21 ARG 46 1HH2 ARG 46 -10.286 14.620 -14.963 351 HH22 ARG 46 2HH2 ARG 46 -9.907 15.326 -16.497 352 H ILE 47 H ILE 47 -14.891 8.045 -18.183 353 HA ILE 47 HA ILE 47 -14.656 9.748 -20.448 354 HB ILE 47 HB ILE 47 -14.760 7.315 -20.688 355 HG12 ILE 47 1HG1 ILE 47 -17.167 7.727 -22.163 356 HG13 ILE 47 2HG1 ILE 47 -16.249 9.229 -22.187 357 HG21 ILE 47 1HG2 ILE 47 -16.744 7.392 -18.836 358 HG22 ILE 47 2HG2 ILE 47 -17.664 7.136 -20.318 359 HG23 ILE 47 3HG2 ILE 47 -16.388 6.006 -19.866 360 HD11 ILE 47 1HD1 ILE 47 -15.905 7.191 -23.922 361 HD12 ILE 47 2HD1 ILE 47 -14.665 8.380 -23.521 362 HD13 ILE 47 3HD1 ILE 47 -14.677 6.811 -22.715 363 H THR 48 H THR 48 -15.962 11.301 -21.170 364 HA THR 48 HA THR 48 -18.587 11.619 -19.868 365 HB THR 48 HB THR 48 -16.970 13.448 -19.403 366 HG1 THR 48 HG1 THR 48 -18.467 15.105 -19.936 367 HG21 THR 48 1HG2 THR 48 -16.089 13.194 -21.901 368 HG22 THR 48 2HG2 THR 48 -15.969 14.717 -21.018 369 HG23 THR 48 3HG2 THR 48 -17.275 14.469 -22.177 370 H HIS 49 H HIS 49 -20.184 12.862 -21.250 371 HA HIS 49 HA HIS 49 -20.847 11.434 -23.518 372 HB2 HIS 49 1HB HIS 49 -21.617 14.177 -22.562 373 HB3 HIS 49 2HB HIS 49 -22.229 13.555 -24.092 374 HD1 HIS 49 HD1 HIS 49 -23.225 13.833 -20.734 375 HD2 HIS 49 HD2 HIS 49 -23.414 10.771 -23.536 376 HE1 HIS 49 HE1 HIS 49 -25.014 12.272 -19.905 377 H GLN 50 H GLN 50 -19.101 14.514 -23.296 378 HA GLN 50 HA GLN 50 -18.870 15.071 -26.008 379 HB2 GLN 50 1HB GLN 50 -17.787 16.075 -23.589 380 HB3 GLN 50 2HB GLN 50 -16.437 15.799 -24.681 381 HG2 GLN 50 1HG GLN 50 -17.552 17.156 -26.389 382 HG3 GLN 50 2HG GLN 50 -18.881 17.452 -25.270 383 HE21 GLN 50 2HE2 GLN 50 -18.761 19.492 -24.660 384 HE22 GLN 50 1HE2 GLN 50 -17.338 20.306 -24.116 385 H GLU 51 H GLU 51 -16.914 12.977 -23.952 386 HA GLU 51 HA GLU 51 -14.907 12.441 -25.885 387 HB2 GLU 51 1HB GLU 51 -15.771 11.063 -23.355 388 HB3 GLU 51 2HB GLU 51 -14.512 10.388 -24.380 389 HG2 GLU 51 1HG GLU 51 -14.235 13.227 -23.601 390 HG3 GLU 51 2HG GLU 51 -14.000 12.016 -22.342 391 H LEU 52 H LEU 52 -17.821 10.680 -24.878 392 HA LEU 52 HA LEU 52 -17.490 8.468 -26.575 393 HB2 LEU 52 1HB LEU 52 -19.818 9.717 -25.185 394 HB3 LEU 52 2HB LEU 52 -20.097 8.432 -26.359 395 HG LEU 52 HG LEU 52 -18.167 7.987 -24.122 396 HD11 LEU 52 1HD1 LEU 52 -19.710 7.819 -22.513 397 HD12 LEU 52 2HD1 LEU 52 -20.901 7.100 -23.596 398 HD13 LEU 52 3HD1 LEU 52 -20.693 8.851 -23.552 399 HD21 LEU 52 1HD2 LEU 52 -18.950 5.678 -24.388 400 HD22 LEU 52 2HD2 LEU 52 -18.316 6.334 -25.898 401 HD23 LEU 52 3HD2 LEU 52 -20.058 6.206 -25.655 402 H GLU 53 H GLU 53 -19.116 11.571 -27.060 403 HA GLU 53 HA GLU 53 -20.351 11.070 -29.495 404 HB2 GLU 53 1HB GLU 53 -20.024 13.268 -27.862 405 HB3 GLU 53 2HB GLU 53 -19.164 13.739 -29.322 406 HG2 GLU 53 1HG GLU 53 -21.201 13.156 -30.628 407 HG3 GLU 53 2HG GLU 53 -22.041 12.892 -29.100 408 H ASP 54 H ASP 54 -17.035 12.113 -28.830 409 HA ASP 54 HA ASP 54 -16.195 12.583 -31.442 410 HB2 ASP 54 1HB ASP 54 -14.971 12.957 -29.175 411 HB3 ASP 54 2HB ASP 54 -14.371 11.318 -29.419 412 H LEU 55 H LEU 55 -16.035 9.575 -29.550 413 HA LEU 55 HA LEU 55 -14.820 7.974 -31.481 414 HB2 LEU 55 1HB LEU 55 -16.824 7.219 -29.359 415 HB3 LEU 55 2HB LEU 55 -15.852 6.071 -30.277 416 HG LEU 55 HG LEU 55 -14.262 8.105 -28.909 417 HD11 LEU 55 1HD1 LEU 55 -16.338 6.633 -27.442 418 HD12 LEU 55 2HD1 LEU 55 -15.467 8.104 -27.013 419 HD13 LEU 55 3HD1 LEU 55 -14.715 6.529 -26.759 420 HD21 LEU 55 1HD2 LEU 55 -12.938 6.409 -29.603 421 HD22 LEU 55 2HD2 LEU 55 -14.226 5.209 -29.493 422 HD23 LEU 55 3HD2 LEU 55 -13.379 5.730 -28.036 423 H GLY 56 H GLY 56 -18.132 9.025 -31.150 424 HA2 GLY 56 1HA GLY 56 -19.189 9.042 -33.482 425 HA3 GLY 56 2HA GLY 56 -18.900 7.310 -33.422 426 H VAL 57 H VAL 57 -19.512 7.530 -30.417 427 HA VAL 57 HA VAL 57 -22.182 6.659 -30.553 428 HB VAL 57 HB VAL 57 -20.797 7.734 -28.096 429 HG11 VAL 57 1HG1 VAL 57 -22.828 5.531 -28.222 430 HG12 VAL 57 2HG1 VAL 57 -22.337 6.509 -26.838 431 HG13 VAL 57 3HG1 VAL 57 -23.313 7.223 -28.122 432 HG21 VAL 57 1HG2 VAL 57 -19.332 6.074 -28.270 433 HG22 VAL 57 2HG2 VAL 57 -20.666 4.928 -28.143 434 HG23 VAL 57 3HG2 VAL 57 -20.122 5.475 -29.729 435 H SER 58 H SER 58 -23.526 8.139 -31.529 436 HA SER 58 HA SER 58 -23.719 10.824 -30.396 437 HB2 SER 58 1HB SER 58 -24.206 9.663 -32.984 438 HB3 SER 58 2HB SER 58 -25.661 10.484 -32.419 439 HG SER 58 HG SER 58 -24.152 12.282 -31.918 440 H ARG 59 H ARG 59 -25.397 7.793 -30.455 441 HA ARG 59 HA ARG 59 -27.977 8.619 -29.760 442 HB2 ARG 59 1HB ARG 59 -26.422 6.108 -29.575 443 HB3 ARG 59 2HB ARG 59 -27.803 6.236 -28.495 444 HG2 ARG 59 1HG ARG 59 -28.177 6.906 -31.368 445 HG3 ARG 59 2HG ARG 59 -28.041 5.211 -30.896 446 HD2 ARG 59 1HD ARG 59 -30.238 5.320 -30.496 447 HD3 ARG 59 2HD ARG 59 -29.793 6.208 -29.040 448 HE ARG 59 HE ARG 59 -29.939 8.158 -30.887 449 HH11 ARG 59 1HH1 ARG 59 -32.110 5.582 -30.010 450 HH12 ARG 59 2HH1 ARG 59 -33.538 6.465 -30.437 451 HH21 ARG 59 1HH2 ARG 59 -31.812 9.331 -31.451 452 HH22 ARG 59 2HH2 ARG 59 -33.368 8.597 -31.257 453 H ILE 60 H ILE 60 -29.030 8.229 -27.616 454 HA ILE 60 HA ILE 60 -27.368 9.416 -25.512 455 HB ILE 60 HB ILE 60 -30.375 9.180 -25.683 456 HG12 ILE 60 1HG1 ILE 60 -29.434 10.738 -27.335 457 HG13 ILE 60 2HG1 ILE 60 -30.330 11.598 -26.087 458 HG21 ILE 60 1HG2 ILE 60 -28.611 9.772 -23.489 459 HG22 ILE 60 2HG2 ILE 60 -29.646 11.154 -23.845 460 HG23 ILE 60 3HG2 ILE 60 -30.364 9.581 -23.498 461 HD11 ILE 60 1HD1 ILE 60 -27.596 11.395 -25.304 462 HD12 ILE 60 2HD1 ILE 60 -27.695 12.035 -26.944 463 HD13 ILE 60 3HD1 ILE 60 -28.560 12.834 -25.632 464 H GLY 61 H GLY 61 -29.896 6.919 -25.868 465 HA2 GLY 61 1HA GLY 61 -29.624 5.786 -23.328 466 HA3 GLY 61 2HA GLY 61 -30.238 4.948 -24.745 467 H HIS 62 H HIS 62 -27.592 5.506 -26.111 468 HA HIS 62 HA HIS 62 -26.302 3.081 -25.214 469 HB2 HIS 62 1HB HIS 62 -25.576 5.005 -27.433 470 HB3 HIS 62 2HB HIS 62 -24.793 3.455 -27.140 471 HD1 HIS 62 HD1 HIS 62 -26.273 4.148 -29.801 472 HD2 HIS 62 HD2 HIS 62 -27.918 2.028 -26.629 473 HE1 HIS 62 HE1 HIS 62 -28.134 2.781 -30.799 474 H GLN 63 H GLN 63 -25.532 6.535 -25.359 475 HA GLN 63 HA GLN 63 -22.899 6.412 -24.453 476 HB2 GLN 63 1HB GLN 63 -25.021 8.533 -24.226 477 HB3 GLN 63 2HB GLN 63 -23.406 8.773 -23.573 478 HG2 GLN 63 1HG GLN 63 -22.428 8.532 -25.749 479 HG3 GLN 63 2HG GLN 63 -23.988 8.099 -26.446 480 HE21 GLN 63 2HE2 GLN 63 -22.065 10.325 -26.966 481 HE22 GLN 63 1HE2 GLN 63 -23.017 11.762 -26.863 482 H GLU 64 H GLU 64 -25.934 6.343 -22.690 483 HA GLU 64 HA GLU 64 -24.652 6.551 -20.112 484 HB2 GLU 64 1HB GLU 64 -27.469 6.184 -21.062 485 HB3 GLU 64 2HB GLU 64 -27.069 5.839 -19.385 486 HG2 GLU 64 1HG GLU 64 -25.989 8.382 -20.225 487 HG3 GLU 64 2HG GLU 64 -27.732 8.300 -20.474 488 H LEU 65 H LEU 65 -25.824 4.024 -22.221 489 HA LEU 65 HA LEU 65 -26.051 1.886 -20.492 490 HB2 LEU 65 1HB LEU 65 -25.505 2.244 -23.348 491 HB3 LEU 65 2HB LEU 65 -24.902 0.728 -22.681 492 HG LEU 65 HG LEU 65 -27.765 1.679 -22.569 493 HD11 LEU 65 1HD1 LEU 65 -26.482 0.747 -24.764 494 HD12 LEU 65 2HD1 LEU 65 -28.201 0.525 -24.444 495 HD13 LEU 65 3HD1 LEU 65 -27.058 -0.758 -24.046 496 HD21 LEU 65 1HD2 LEU 65 -28.192 0.030 -21.139 497 HD22 LEU 65 2HD2 LEU 65 -26.449 -0.112 -20.908 498 HD23 LEU 65 3HD2 LEU 65 -27.267 -1.131 -22.092 499 H ILE 66 H ILE 66 -23.124 2.844 -22.294 500 HA ILE 66 HA ILE 66 -21.392 0.975 -21.161 501 HB ILE 66 HB ILE 66 -20.683 3.757 -22.099 502 HG12 ILE 66 1HG1 ILE 66 -20.064 1.650 -23.958 503 HG13 ILE 66 2HG1 ILE 66 -21.773 1.590 -23.543 504 HG21 ILE 66 1HG2 ILE 66 -19.091 1.354 -21.365 505 HG22 ILE 66 2HG2 ILE 66 -18.521 2.372 -22.686 506 HG23 ILE 66 3HG2 ILE 66 -18.756 3.062 -21.081 507 HD11 ILE 66 1HD1 ILE 66 -20.365 3.415 -25.255 508 HD12 ILE 66 2HD1 ILE 66 -22.101 3.176 -25.047 509 HD13 ILE 66 3HD1 ILE 66 -21.229 4.283 -23.986 510 H LEU 67 H LEU 67 -21.926 4.370 -20.216 511 HA LEU 67 HA LEU 67 -20.191 4.508 -18.076 512 HB2 LEU 67 1HB LEU 67 -22.913 5.784 -18.294 513 HB3 LEU 67 2HB LEU 67 -21.627 6.284 -17.198 514 HG LEU 67 HG LEU 67 -21.360 6.357 -20.197 515 HD11 LEU 67 1HD1 LEU 67 -23.230 7.792 -19.356 516 HD12 LEU 67 2HD1 LEU 67 -21.923 8.669 -20.151 517 HD13 LEU 67 3HD1 LEU 67 -22.040 8.668 -18.392 518 HD21 LEU 67 1HD2 LEU 67 -19.633 8.131 -19.449 519 HD22 LEU 67 2HD2 LEU 67 -19.224 6.421 -19.299 520 HD23 LEU 67 3HD2 LEU 67 -19.738 7.334 -17.879 521 H GLU 68 H GLU 68 -23.605 3.504 -18.037 522 HA GLU 68 HA GLU 68 -23.898 3.029 -15.331 523 HB2 GLU 68 1HB GLU 68 -25.691 2.913 -17.097 524 HB3 GLU 68 2HB GLU 68 -25.091 1.313 -17.511 525 HG2 GLU 68 1HG GLU 68 -26.425 0.465 -15.971 526 HG3 GLU 68 2HG GLU 68 -25.475 1.292 -14.738 527 H ALA 69 H ALA 69 -22.220 1.149 -17.733 528 HA ALA 69 HA ALA 69 -21.964 -1.188 -16.060 529 HB1 ALA 69 1HB ALA 69 -20.660 -2.121 -17.845 530 HB2 ALA 69 2HB ALA 69 -22.064 -1.311 -18.541 531 HB3 ALA 69 3HB ALA 69 -20.481 -0.538 -18.602 532 H VAL 70 H VAL 70 -19.980 1.576 -16.976 533 HA VAL 70 HA VAL 70 -17.546 0.685 -15.879 534 HB VAL 70 HB VAL 70 -18.536 3.520 -16.213 535 HG11 VAL 70 1HG1 VAL 70 -15.835 3.625 -16.456 536 HG12 VAL 70 2HG1 VAL 70 -16.720 3.984 -14.972 537 HG13 VAL 70 3HG1 VAL 70 -16.019 2.384 -15.217 538 HG21 VAL 70 1HG2 VAL 70 -17.311 3.505 -18.308 539 HG22 VAL 70 2HG2 VAL 70 -16.813 1.836 -18.031 540 HG23 VAL 70 3HG2 VAL 70 -18.514 2.216 -18.300 541 H ASP 71 H ASP 71 -20.389 2.065 -14.441 542 HA ASP 71 HA ASP 71 -19.304 3.026 -12.040 543 HB2 ASP 71 1HB ASP 71 -21.743 3.151 -13.081 544 HB3 ASP 71 2HB ASP 71 -22.006 1.759 -12.034 545 H LEU 72 H LEU 72 -20.164 -0.200 -13.079 546 HA LEU 72 HA LEU 72 -19.991 -1.370 -10.467 547 HB2 LEU 72 1HB LEU 72 -20.341 -2.359 -13.245 548 HB3 LEU 72 2HB LEU 72 -19.753 -3.498 -12.035 549 HG LEU 72 HG LEU 72 -22.203 -1.940 -11.396 550 HD11 LEU 72 1HD1 LEU 72 -23.642 -3.341 -12.650 551 HD12 LEU 72 2HD1 LEU 72 -22.307 -4.374 -13.161 552 HD13 LEU 72 3HD1 LEU 72 -22.431 -2.726 -13.776 553 HD21 LEU 72 1HD2 LEU 72 -20.917 -4.500 -10.663 554 HD22 LEU 72 2HD2 LEU 72 -22.680 -4.473 -10.680 555 HD23 LEU 72 3HD2 LEU 72 -21.790 -3.338 -9.664 556 H LEU 73 H LEU 73 -17.773 -0.649 -13.028 557 HA LEU 73 HA LEU 73 -15.722 -2.471 -12.323 558 HB2 LEU 73 1HB LEU 73 -15.989 -0.092 -14.045 559 HB3 LEU 73 2HB LEU 73 -14.360 -0.450 -13.476 560 HG LEU 73 HG LEU 73 -16.092 -2.432 -14.946 561 HD11 LEU 73 1HD1 LEU 73 -14.511 -1.915 -16.854 562 HD12 LEU 73 2HD1 LEU 73 -14.069 -0.457 -15.966 563 HD13 LEU 73 3HD1 LEU 73 -15.734 -0.695 -16.497 564 HD21 LEU 73 1HD2 LEU 73 -14.138 -3.146 -13.422 565 HD22 LEU 73 2HD2 LEU 73 -13.107 -2.463 -14.680 566 HD23 LEU 73 3HD2 LEU 73 -14.207 -3.788 -15.063 567 H CYS 74 H CYS 74 -16.499 0.812 -11.314 568 HA CYS 74 HA CYS 74 -14.101 1.129 -9.765 569 HB2 CYS 74 1HB CYS 74 -15.644 2.953 -10.837 570 HB3 CYS 74 2HB CYS 74 -16.563 2.787 -9.346 571 HG CYS 74 HG CYS 74 -14.902 4.015 -7.746 572 H ALA 75 H ALA 75 -17.355 0.011 -9.194 573 HA ALA 75 HA ALA 75 -17.314 0.163 -6.363 574 HB1 ALA 75 1HB ALA 75 -19.040 -1.070 -8.413 575 HB2 ALA 75 2HB ALA 75 -19.093 -1.801 -6.808 576 HB3 ALA 75 3HB ALA 75 -19.462 -0.089 -7.009 577 H LEU 76 H LEU 76 -16.695 -2.513 -8.625 578 HA LEU 76 HA LEU 76 -16.199 -4.516 -6.765 579 HB2 LEU 76 1HB LEU 76 -15.356 -4.012 -9.572 580 HB3 LEU 76 2HB LEU 76 -14.552 -5.301 -8.679 581 HG LEU 76 HG LEU 76 -17.504 -5.343 -8.629 582 HD11 LEU 76 1HD1 LEU 76 -16.778 -6.680 -10.998 583 HD12 LEU 76 2HD1 LEU 76 -16.112 -5.051 -11.106 584 HD13 LEU 76 3HD1 LEU 76 -17.837 -5.281 -10.818 585 HD21 LEU 76 1HD2 LEU 76 -15.613 -7.562 -9.326 586 HD22 LEU 76 2HD2 LEU 76 -17.202 -7.652 -8.566 587 HD23 LEU 76 3HD2 LEU 76 -15.824 -7.031 -7.657 588 H ASN 77 H ASN 77 -14.091 -1.977 -7.974 589 HA ASN 77 HA ASN 77 -11.772 -3.030 -6.603 590 HB2 ASN 77 1HB ASN 77 -12.328 -0.742 -8.424 591 HB3 ASN 77 2HB ASN 77 -10.950 -0.595 -7.337 592 HD21 ASN 77 2HD2 ASN 77 -12.361 -2.460 -9.935 593 HD22 ASN 77 1HD2 ASN 77 -10.892 -3.205 -10.455 594 H SER 78 H SER 78 -12.569 -3.045 -4.443 595 HA SER 78 HA SER 78 -12.945 -0.394 -3.229 596 HB2 SER 78 1HB SER 78 -13.933 -1.619 -1.317 597 HB3 SER 78 2HB SER 78 -14.783 -1.951 -2.826 598 HG SER 78 HG SER 78 -14.322 -3.844 -1.558 599 H GLY 79 H GLY 79 -11.271 -3.491 -2.716 600 HA2 GLY 79 1HA GLY 79 -9.054 -2.028 -1.496 601 HA3 GLY 79 2HA GLY 79 -9.839 -3.254 -0.512 602 HA PRO 80 HA PRO 80 -6.409 -5.072 -3.210 603 HB2 PRO 80 1HB PRO 80 -4.718 -5.744 -1.196 604 HB3 PRO 80 2HB PRO 80 -4.662 -4.179 -2.016 605 HG2 PRO 80 1HG PRO 80 -5.914 -4.900 0.606 606 HG3 PRO 80 2HG PRO 80 -4.947 -3.475 0.182 607 HD2 PRO 80 1HD PRO 80 -7.651 -3.412 0.325 608 HD3 PRO 80 2HD PRO 80 -6.731 -2.405 -0.811 609 H SER 81 H SER 81 -7.759 -6.808 -3.670 610 HA SER 81 HA SER 81 -7.285 -9.191 -2.159 611 HB2 SER 81 1HB SER 81 -9.759 -9.650 -1.794 612 HB3 SER 81 2HB SER 81 -9.045 -8.430 -0.741 613 HG SER 81 HG SER 81 -10.243 -7.647 -3.156 614 H SER 82 H SER 82 -8.044 -11.095 -3.231 615 HA SER 82 HA SER 82 -8.504 -10.640 -6.094 616 HB2 SER 82 1HB SER 82 -7.246 -12.870 -4.526 617 HB3 SER 82 2HB SER 82 -7.872 -13.177 -6.146 618 HG SER 82 HG SER 82 -5.714 -11.602 -5.333 619 H GLY 83 H GLY 83 -9.393 -13.170 -3.732 620 HA2 GLY 83 1HA GLY 83 -11.976 -13.423 -5.119 621 HA3 GLY 83 2HA GLY 83 -11.241 -14.653 -4.102 Start of MODEL 7 1 H1 GLY 1 H GLY 1 0.029 9.178 -4.543 2 HA2 GLY 1 1HA GLY 1 -1.213 7.880 -2.758 3 HA3 GLY 1 2HA GLY 1 -1.216 6.571 -3.931 4 H SER 2 H SER 2 0.097 5.055 -3.139 5 HA SER 2 HA SER 2 2.862 5.828 -2.539 6 HB2 SER 2 1HB SER 2 1.644 5.595 -0.388 7 HB3 SER 2 2HB SER 2 1.232 3.937 -0.825 8 HG SER 2 HG SER 2 3.045 3.590 0.235 9 H SER 3 H SER 3 0.832 2.893 -2.597 10 HA SER 3 HA SER 3 2.603 1.779 -4.652 11 HB2 SER 3 1HB SER 3 3.303 0.959 -2.375 12 HB3 SER 3 2HB SER 3 1.719 0.198 -2.229 13 HG SER 3 HG SER 3 2.957 -1.372 -3.066 14 H GLY 4 H GLY 4 0.588 2.547 -5.812 15 HA2 GLY 4 1HA GLY 4 -1.063 1.663 -7.214 16 HA3 GLY 4 2HA GLY 4 -1.147 0.242 -6.182 17 H SER 5 H SER 5 -3.500 1.029 -6.925 18 HA SER 5 HA SER 5 -4.853 1.705 -4.558 19 HB2 SER 5 1HB SER 5 -5.775 3.914 -5.942 20 HB3 SER 5 2HB SER 5 -4.654 3.949 -4.580 21 HG SER 5 HG SER 5 -3.592 5.009 -6.148 22 H SER 6 H SER 6 -5.017 1.955 -8.095 23 HA SER 6 HA SER 6 -7.456 0.343 -8.043 24 HB2 SER 6 1HB SER 6 -7.318 3.162 -8.786 25 HB3 SER 6 2HB SER 6 -7.978 2.157 -10.076 26 HG SER 6 HG SER 6 -9.278 1.242 -8.187 27 H GLY 7 H GLY 7 -7.857 -0.822 -9.961 28 HA2 GLY 7 1HA GLY 7 -5.445 -1.219 -11.573 29 HA3 GLY 7 2HA GLY 7 -6.810 -2.321 -11.462 30 H VAL 8 H VAL 8 -8.894 -0.522 -11.988 31 HA VAL 8 HA VAL 8 -8.967 -0.555 -14.781 32 HB VAL 8 HB VAL 8 -10.605 1.263 -13.014 33 HG11 VAL 8 1HG1 VAL 8 -10.726 0.411 -15.839 34 HG12 VAL 8 2HG1 VAL 8 -12.260 0.467 -14.969 35 HG13 VAL 8 3HG1 VAL 8 -11.256 1.913 -15.081 36 HG21 VAL 8 1HG2 VAL 8 -10.802 -0.917 -12.079 37 HG22 VAL 8 2HG2 VAL 8 -12.256 -0.630 -13.035 38 HG23 VAL 8 3HG2 VAL 8 -10.970 -1.653 -13.673 39 H SER 9 H SER 9 -7.690 1.784 -12.576 40 HA SER 9 HA SER 9 -7.720 4.020 -14.339 41 HB2 SER 9 1HB SER 9 -6.121 5.019 -12.722 42 HB3 SER 9 2HB SER 9 -7.547 4.347 -11.931 43 HG SER 9 HG SER 9 -5.116 3.823 -11.304 44 H LYS 10 H LYS 10 -5.616 1.303 -13.897 45 HA LYS 10 HA LYS 10 -3.647 2.495 -15.731 46 HB2 LYS 10 1HB LYS 10 -3.322 0.101 -13.913 47 HB3 LYS 10 2HB LYS 10 -2.065 0.833 -14.902 48 HG2 LYS 10 1HG LYS 10 -3.152 2.879 -13.289 49 HG3 LYS 10 2HG LYS 10 -2.863 1.482 -12.249 50 HD2 LYS 10 1HD LYS 10 -0.837 2.631 -12.189 51 HD3 LYS 10 2HD LYS 10 -0.559 1.377 -13.399 52 HE2 LYS 10 1HE LYS 10 0.225 3.147 -14.581 53 HE3 LYS 10 2HE LYS 10 -1.480 3.300 -15.002 54 HZ1 LYS 10 1HZ LYS 10 -0.358 4.696 -12.655 55 HZ2 LYS 10 2HZ LYS 10 -1.768 5.048 -13.520 56 HZ3 LYS 10 3HZ LYS 10 -0.255 5.372 -14.203 57 H TRP 11 H TRP 11 -6.267 1.179 -16.373 58 HA TRP 11 HA TRP 11 -5.667 -1.341 -17.574 59 HB2 TRP 11 1HB TRP 11 -7.998 0.441 -17.360 60 HB3 TRP 11 2HB TRP 11 -7.928 -0.485 -18.857 61 HD1 TRP 11 HD1 TRP 11 -6.602 -2.044 -15.640 62 HE1 TRP 11 HE1 TRP 11 -8.150 -3.985 -14.959 63 HE3 TRP 11 HE3 TRP 11 -10.364 -1.308 -19.023 64 HZ2 TRP 11 HZ2 TRP 11 -10.636 -5.061 -15.751 65 HZ3 TRP 11 HZ3 TRP 11 -12.291 -2.838 -18.995 66 HH2 TRP 11 HH2 TRP 11 -12.422 -4.675 -17.392 67 H SER 12 H SER 12 -4.792 -1.763 -19.495 68 HA SER 12 HA SER 12 -3.650 0.228 -21.099 69 HB2 SER 12 1HB SER 12 -4.014 -2.059 -22.719 70 HB3 SER 12 2HB SER 12 -2.567 -1.594 -21.824 71 HG SER 12 HG SER 12 -2.957 -3.142 -20.467 72 HA PRO 13 HA PRO 13 -6.784 1.566 -23.860 73 HB2 PRO 13 1HB PRO 13 -5.456 1.734 -26.222 74 HB3 PRO 13 2HB PRO 13 -5.193 2.865 -24.889 75 HG2 PRO 13 1HG PRO 13 -3.576 0.477 -25.695 76 HG3 PRO 13 2HG PRO 13 -3.023 2.086 -25.195 77 HD2 PRO 13 1HD PRO 13 -3.028 -0.039 -23.517 78 HD3 PRO 13 2HD PRO 13 -3.299 1.623 -22.954 79 H SER 14 H SER 14 -5.130 -1.405 -24.523 80 HA SER 14 HA SER 14 -7.047 -2.174 -26.587 81 HB2 SER 14 1HB SER 14 -4.577 -2.658 -26.815 82 HB3 SER 14 2HB SER 14 -4.752 -3.812 -25.493 83 HG SER 14 HG SER 14 -4.961 -4.601 -27.764 84 H GLN 15 H GLN 15 -6.339 -2.704 -23.238 85 HA GLN 15 HA GLN 15 -7.732 -5.134 -22.877 86 HB2 GLN 15 1HB GLN 15 -6.820 -2.934 -21.065 87 HB3 GLN 15 2HB GLN 15 -7.920 -4.157 -20.443 88 HG2 GLN 15 1HG GLN 15 -5.423 -4.975 -21.859 89 HG3 GLN 15 2HG GLN 15 -5.362 -4.459 -20.174 90 HE21 GLN 15 2HE2 GLN 15 -6.963 -5.563 -18.727 91 HE22 GLN 15 1HE2 GLN 15 -7.201 -7.257 -18.966 92 H VAL 16 H VAL 16 -8.723 -1.747 -22.472 93 HA VAL 16 HA VAL 16 -11.278 -2.106 -21.497 94 HB VAL 16 HB VAL 16 -10.380 -0.017 -23.486 95 HG11 VAL 16 1HG1 VAL 16 -12.664 0.214 -23.537 96 HG12 VAL 16 2HG1 VAL 16 -12.869 -0.365 -21.882 97 HG13 VAL 16 3HG1 VAL 16 -12.257 1.263 -22.179 98 HG21 VAL 16 1HG2 VAL 16 -10.516 0.137 -20.478 99 HG22 VAL 16 2HG2 VAL 16 -9.038 -0.137 -21.400 100 HG23 VAL 16 3HG2 VAL 16 -9.920 1.379 -21.580 101 H VAL 17 H VAL 17 -10.093 -2.491 -24.772 102 HA VAL 17 HA VAL 17 -12.549 -2.544 -26.128 103 HB VAL 17 HB VAL 17 -10.004 -4.027 -26.801 104 HG11 VAL 17 1HG1 VAL 17 -11.491 -3.308 -29.101 105 HG12 VAL 17 2HG1 VAL 17 -11.099 -4.924 -28.510 106 HG13 VAL 17 3HG1 VAL 17 -12.586 -4.130 -27.991 107 HG21 VAL 17 1HG2 VAL 17 -9.163 -2.129 -27.644 108 HG22 VAL 17 2HG2 VAL 17 -10.712 -1.635 -28.329 109 HG23 VAL 17 3HG2 VAL 17 -10.359 -1.322 -26.630 110 H ASP 18 H ASP 18 -10.784 -5.039 -24.387 111 HA ASP 18 HA ASP 18 -12.412 -7.212 -25.237 112 HB2 ASP 18 1HB ASP 18 -10.095 -7.429 -24.299 113 HB3 ASP 18 2HB ASP 18 -10.754 -7.030 -22.715 114 H TRP 19 H TRP 19 -12.704 -4.791 -22.779 115 HA TRP 19 HA TRP 19 -14.574 -6.154 -21.126 116 HB2 TRP 19 1HB TRP 19 -13.345 -4.313 -20.195 117 HB3 TRP 19 2HB TRP 19 -13.923 -3.221 -21.451 118 HD1 TRP 19 HD1 TRP 19 -15.557 -5.404 -18.672 119 HE1 TRP 19 HE1 TRP 19 -17.487 -4.046 -17.645 120 HE3 TRP 19 HE3 TRP 19 -15.241 -1.213 -21.583 121 HZ2 TRP 19 HZ2 TRP 19 -18.714 -1.532 -18.019 122 HZ3 TRP 19 HZ3 TRP 19 -16.831 0.622 -21.184 123 HH2 TRP 19 HH2 TRP 19 -18.531 0.464 -19.439 124 H MET 20 H MET 20 -14.898 -3.822 -23.777 125 HA MET 20 HA MET 20 -17.685 -3.523 -23.654 126 HB2 MET 20 1HB MET 20 -15.903 -3.342 -26.089 127 HB3 MET 20 2HB MET 20 -17.521 -2.670 -25.940 128 HG2 MET 20 1HG MET 20 -15.560 -1.820 -23.909 129 HG3 MET 20 2HG MET 20 -15.287 -1.253 -25.555 130 HE1 MET 20 1HE MET 20 -17.476 1.002 -26.582 131 HE2 MET 20 2HE MET 20 -17.247 -0.702 -26.973 132 HE3 MET 20 3HE MET 20 -18.821 -0.127 -26.421 133 H LYS 21 H LYS 21 -15.711 -6.091 -24.831 134 HA LYS 21 HA LYS 21 -17.529 -7.259 -26.655 135 HB2 LYS 21 1HB LYS 21 -15.300 -8.501 -25.034 136 HB3 LYS 21 2HB LYS 21 -16.161 -9.319 -26.331 137 HG2 LYS 21 1HG LYS 21 -15.393 -7.115 -27.642 138 HG3 LYS 21 2HG LYS 21 -14.092 -7.220 -26.453 139 HD2 LYS 21 1HD LYS 21 -13.464 -9.378 -27.191 140 HD3 LYS 21 2HD LYS 21 -14.945 -9.567 -28.133 141 HE2 LYS 21 1HE LYS 21 -14.152 -7.600 -29.516 142 HE3 LYS 21 2HE LYS 21 -12.601 -7.764 -28.695 143 HZ1 LYS 21 1HZ LYS 21 -12.457 -8.958 -30.714 144 HZ2 LYS 21 2HZ LYS 21 -13.930 -9.747 -30.452 145 HZ3 LYS 21 3HZ LYS 21 -12.588 -10.118 -29.490 146 H GLY 22 H GLY 22 -17.596 -6.991 -23.282 147 HA2 GLY 22 1HA GLY 22 -19.512 -9.234 -23.096 148 HA3 GLY 22 2HA GLY 22 -18.498 -8.704 -21.761 149 H LEU 23 H LEU 23 -19.932 -6.320 -23.816 150 HA LEU 23 HA LEU 23 -21.828 -5.660 -21.660 151 HB2 LEU 23 1HB LEU 23 -20.644 -3.762 -23.676 152 HB3 LEU 23 2HB LEU 23 -21.622 -3.350 -22.270 153 HG LEU 23 HG LEU 23 -18.801 -4.418 -22.259 154 HD11 LEU 23 1HD1 LEU 23 -18.091 -2.314 -21.952 155 HD12 LEU 23 2HD1 LEU 23 -19.469 -1.886 -20.939 156 HD13 LEU 23 3HD1 LEU 23 -19.628 -1.871 -22.695 157 HD21 LEU 23 1HD2 LEU 23 -20.127 -5.327 -20.400 158 HD22 LEU 23 2HD2 LEU 23 -20.575 -3.687 -19.931 159 HD23 LEU 23 3HD2 LEU 23 -18.889 -4.200 -19.845 160 H ASP 24 H ASP 24 -23.401 -3.828 -22.901 161 HA ASP 24 HA ASP 24 -25.316 -5.327 -24.204 162 HB2 ASP 24 1HB ASP 24 -25.063 -2.680 -23.388 163 HB3 ASP 24 2HB ASP 24 -25.316 -2.567 -25.127 164 H ASP 25 H ASP 25 -25.946 -5.580 -26.357 165 HA ASP 25 HA ASP 25 -23.853 -5.939 -28.214 166 HB2 ASP 25 1HB ASP 25 -26.180 -7.084 -28.085 167 HB3 ASP 25 2HB ASP 25 -26.735 -5.705 -29.031 168 H CYS 26 H CYS 26 -25.916 -3.253 -27.501 169 HA CYS 26 HA CYS 26 -25.610 -1.876 -29.971 170 HB2 CYS 26 1HB CYS 26 -26.517 -1.087 -27.219 171 HB3 CYS 26 2HB CYS 26 -26.264 0.139 -28.456 172 HG CYS 26 HG CYS 26 -28.456 -0.237 -29.770 173 H LEU 27 H LEU 27 -23.622 -2.266 -27.188 174 HA LEU 27 HA LEU 27 -21.945 0.022 -27.885 175 HB2 LEU 27 1HB LEU 27 -21.391 -1.909 -25.664 176 HB3 LEU 27 2HB LEU 27 -20.912 -0.219 -25.808 177 HG LEU 27 HG LEU 27 -23.732 -1.177 -25.320 178 HD11 LEU 27 1HD1 LEU 27 -21.482 -0.699 -23.522 179 HD12 LEU 27 2HD1 LEU 27 -22.999 -1.554 -23.243 180 HD13 LEU 27 3HD1 LEU 27 -22.937 0.203 -23.099 181 HD21 LEU 27 1HD2 LEU 27 -22.465 1.490 -25.704 182 HD22 LEU 27 2HD2 LEU 27 -23.806 1.341 -24.568 183 HD23 LEU 27 3HD2 LEU 27 -24.028 0.890 -26.260 184 H GLN 28 H GLN 28 -22.206 -2.537 -29.474 185 HA GLN 28 HA GLN 28 -19.515 -3.638 -29.274 186 HB2 GLN 28 1HB GLN 28 -21.837 -4.393 -31.057 187 HB3 GLN 28 2HB GLN 28 -20.295 -5.236 -30.998 188 HG2 GLN 28 1HG GLN 28 -22.183 -4.942 -28.673 189 HG3 GLN 28 2HG GLN 28 -22.074 -6.358 -29.717 190 HE21 GLN 28 2HE2 GLN 28 -21.438 -5.637 -26.781 191 HE22 GLN 28 1HE2 GLN 28 -19.898 -6.378 -26.526 192 H GLN 29 H GLN 29 -21.573 -2.027 -31.682 193 HA GLN 29 HA GLN 29 -19.744 -1.909 -33.771 194 HB2 GLN 29 1HB GLN 29 -21.091 -0.135 -34.685 195 HB3 GLN 29 2HB GLN 29 -22.156 -1.311 -33.926 196 HG2 GLN 29 1HG GLN 29 -22.043 0.237 -31.873 197 HG3 GLN 29 2HG GLN 29 -21.431 1.439 -33.007 198 HE21 GLN 29 2HE2 GLN 29 -24.059 0.793 -31.441 199 HE22 GLN 29 1HE2 GLN 29 -25.281 1.147 -32.610 200 H TYR 30 H TYR 30 -19.890 -0.091 -30.828 201 HA TYR 30 HA TYR 30 -18.201 2.053 -31.704 202 HB2 TYR 30 1HB TYR 30 -18.867 1.173 -28.888 203 HB3 TYR 30 2HB TYR 30 -18.164 2.717 -29.356 204 HD1 TYR 30 HD2 TYR 30 -19.823 3.399 -31.711 205 HD2 TYR 30 HD1 TYR 30 -20.925 1.747 -27.948 206 HE1 TYR 30 HE2 TYR 30 -22.077 4.353 -31.958 207 HE2 TYR 30 HE1 TYR 30 -23.182 2.696 -28.186 208 HH TYR 30 HH TYR 30 -24.145 4.432 -31.121 209 H ILE 31 H ILE 31 -17.720 -1.117 -30.401 210 HA ILE 31 HA ILE 31 -15.232 -0.945 -29.223 211 HB ILE 31 HB ILE 31 -16.219 -3.195 -30.980 212 HG12 ILE 31 1HG1 ILE 31 -16.486 -2.770 -27.996 213 HG13 ILE 31 2HG1 ILE 31 -17.790 -2.633 -29.170 214 HG21 ILE 31 1HG2 ILE 31 -14.086 -3.125 -28.851 215 HG22 ILE 31 2HG2 ILE 31 -14.696 -4.588 -29.622 216 HG23 ILE 31 3HG2 ILE 31 -13.845 -3.376 -30.579 217 HD11 ILE 31 1HD1 ILE 31 -16.312 -5.099 -28.317 218 HD12 ILE 31 2HD1 ILE 31 -18.031 -4.739 -28.162 219 HD13 ILE 31 3HD1 ILE 31 -17.335 -5.048 -29.752 220 H LYS 32 H LYS 32 -15.997 -1.355 -32.664 221 HA LYS 32 HA LYS 32 -13.397 -1.626 -33.632 222 HB2 LYS 32 1HB LYS 32 -15.778 -0.322 -34.964 223 HB3 LYS 32 2HB LYS 32 -14.311 -0.831 -35.789 224 HG2 LYS 32 1HG LYS 32 -14.897 -3.004 -35.780 225 HG3 LYS 32 2HG LYS 32 -15.664 -2.903 -34.193 226 HD2 LYS 32 1HD LYS 32 -17.687 -2.573 -35.086 227 HD3 LYS 32 2HD LYS 32 -17.077 -1.364 -36.218 228 HE2 LYS 32 1HE LYS 32 -16.491 -4.253 -36.690 229 HE3 LYS 32 2HE LYS 32 -18.085 -3.615 -37.092 230 HZ1 LYS 32 1HZ LYS 32 -16.585 -3.539 -38.986 231 HZ2 LYS 32 2HZ LYS 32 -15.502 -2.570 -38.121 232 HZ3 LYS 32 3HZ LYS 32 -17.036 -1.977 -38.517 233 H ASN 33 H ASN 33 -15.132 1.191 -32.559 234 HA ASN 33 HA ASN 33 -13.197 3.034 -33.686 235 HB2 ASN 33 1HB ASN 33 -15.685 3.374 -32.021 236 HB3 ASN 33 2HB ASN 33 -14.595 4.721 -32.336 237 HD21 ASN 33 2HD2 ASN 33 -17.382 4.248 -33.148 238 HD22 ASN 33 1HD2 ASN 33 -17.393 4.389 -34.870 239 H PHE 34 H PHE 34 -13.905 1.494 -30.638 240 HA PHE 34 HA PHE 34 -12.282 3.188 -29.023 241 HB2 PHE 34 1HB PHE 34 -13.665 0.573 -28.668 242 HB3 PHE 34 2HB PHE 34 -12.373 0.973 -27.541 243 HD1 PHE 34 HD2 PHE 34 -15.168 2.873 -29.131 244 HD2 PHE 34 HD1 PHE 34 -13.165 1.755 -25.545 245 HE1 PHE 34 HE2 PHE 34 -16.736 4.251 -27.829 246 HE2 PHE 34 HE1 PHE 34 -14.731 3.131 -24.238 247 HZ PHE 34 HZ PHE 34 -16.519 4.382 -25.379 248 H GLU 35 H GLU 35 -11.676 0.420 -31.029 249 HA GLU 35 HA GLU 35 -9.173 -0.315 -29.896 250 HB2 GLU 35 1HB GLU 35 -10.843 -1.161 -32.096 251 HB3 GLU 35 2HB GLU 35 -9.161 -1.072 -32.600 252 HG2 GLU 35 1HG GLU 35 -9.952 -2.486 -30.083 253 HG3 GLU 35 2HG GLU 35 -10.041 -3.283 -31.653 254 H ARG 36 H ARG 36 -10.099 1.685 -32.677 255 HA ARG 36 HA ARG 36 -7.413 2.305 -33.410 256 HB2 ARG 36 1HB ARG 36 -9.645 2.427 -34.796 257 HB3 ARG 36 2HB ARG 36 -9.718 4.061 -34.150 258 HG2 ARG 36 1HG ARG 36 -7.678 4.662 -35.198 259 HG3 ARG 36 2HG ARG 36 -7.331 2.985 -35.624 260 HD2 ARG 36 1HD ARG 36 -9.667 3.216 -36.861 261 HD3 ARG 36 2HD ARG 36 -9.211 4.919 -36.867 262 HE ARG 36 HE ARG 36 -7.003 3.579 -37.788 263 HH11 ARG 36 1HH1 ARG 36 -10.341 3.847 -38.737 264 HH12 ARG 36 2HH1 ARG 36 -10.017 3.605 -40.422 265 HH21 ARG 36 1HH2 ARG 36 -6.563 3.259 -40.003 266 HH22 ARG 36 2HH2 ARG 36 -7.868 3.270 -41.141 267 H GLU 37 H GLU 37 -9.865 3.849 -31.415 268 HA GLU 37 HA GLU 37 -8.405 6.281 -31.053 269 HB2 GLU 37 1HB GLU 37 -10.906 5.097 -30.006 270 HB3 GLU 37 2HB GLU 37 -10.111 6.262 -28.957 271 HG2 GLU 37 1HG GLU 37 -10.199 7.269 -31.636 272 HG3 GLU 37 2HG GLU 37 -11.810 6.773 -31.123 273 H LYS 38 H LYS 38 -8.314 3.160 -29.628 274 HA LYS 38 HA LYS 38 -7.084 2.245 -27.948 275 HB2 LYS 38 1HB LYS 38 -5.448 4.766 -28.280 276 HB3 LYS 38 2HB LYS 38 -4.935 3.332 -27.401 277 HG2 LYS 38 1HG LYS 38 -5.776 2.908 -30.195 278 HG3 LYS 38 2HG LYS 38 -4.286 3.823 -29.953 279 HD2 LYS 38 1HD LYS 38 -3.428 1.999 -28.533 280 HD3 LYS 38 2HD LYS 38 -4.902 1.081 -28.850 281 HE2 LYS 38 1HE LYS 38 -3.825 0.209 -30.598 282 HE3 LYS 38 2HE LYS 38 -4.016 1.783 -31.370 283 HZ1 LYS 38 1HZ LYS 38 -1.869 2.398 -30.840 284 HZ2 LYS 38 2HZ LYS 38 -1.682 0.757 -31.203 285 HZ3 LYS 38 3HZ LYS 38 -1.724 1.267 -29.590 286 H ILE 39 H ILE 39 -9.357 3.455 -27.076 287 HA ILE 39 HA ILE 39 -9.079 5.405 -25.090 288 HB ILE 39 HB ILE 39 -11.109 3.170 -25.182 289 HG12 ILE 39 1HG1 ILE 39 -11.115 4.439 -27.261 290 HG13 ILE 39 2HG1 ILE 39 -12.547 4.834 -26.317 291 HG21 ILE 39 1HG2 ILE 39 -11.762 3.991 -23.219 292 HG22 ILE 39 2HG2 ILE 39 -10.668 5.367 -23.351 293 HG23 ILE 39 3HG2 ILE 39 -12.268 5.438 -24.090 294 HD11 ILE 39 1HD1 ILE 39 -10.092 6.496 -26.757 295 HD12 ILE 39 2HD1 ILE 39 -11.765 6.867 -27.178 296 HD13 ILE 39 3HD1 ILE 39 -11.264 6.851 -25.487 297 H SER 40 H SER 40 -7.753 5.270 -23.403 298 HA SER 40 HA SER 40 -7.103 2.721 -22.200 299 HB2 SER 40 1HB SER 40 -5.262 3.762 -21.391 300 HB3 SER 40 2HB SER 40 -5.693 5.043 -22.524 301 HG SER 40 HG SER 40 -5.704 5.065 -19.814 302 H GLY 41 H GLY 41 -7.159 2.487 -19.797 303 HA2 GLY 41 1HA GLY 41 -9.783 2.701 -18.838 304 HA3 GLY 41 2HA GLY 41 -8.371 2.342 -17.855 305 H ASP 42 H ASP 42 -6.921 4.660 -18.058 306 HA ASP 42 HA ASP 42 -8.005 6.280 -16.103 307 HB2 ASP 42 1HB ASP 42 -5.598 6.200 -17.008 308 HB3 ASP 42 2HB ASP 42 -6.149 7.358 -18.216 309 H GLN 43 H GLN 43 -8.502 6.358 -19.553 310 HA GLN 43 HA GLN 43 -9.901 8.908 -19.422 311 HB2 GLN 43 1HB GLN 43 -9.007 7.098 -21.631 312 HB3 GLN 43 2HB GLN 43 -10.279 8.272 -21.941 313 HG2 GLN 43 1HG GLN 43 -8.514 9.896 -20.796 314 HG3 GLN 43 2HG GLN 43 -7.397 8.684 -21.421 315 HE21 GLN 43 2HE2 GLN 43 -10.373 10.217 -22.606 316 HE22 GLN 43 1HE2 GLN 43 -9.724 10.684 -24.138 317 H LEU 44 H LEU 44 -10.569 5.506 -19.551 318 HA LEU 44 HA LEU 44 -13.284 5.715 -20.395 319 HB2 LEU 44 1HB LEU 44 -12.007 3.659 -20.662 320 HB3 LEU 44 2HB LEU 44 -11.850 3.515 -18.912 321 HG LEU 44 HG LEU 44 -14.403 3.365 -18.875 322 HD11 LEU 44 1HD1 LEU 44 -13.908 2.827 -21.799 323 HD12 LEU 44 2HD1 LEU 44 -14.839 4.160 -21.118 324 HD13 LEU 44 3HD1 LEU 44 -15.415 2.503 -20.943 325 HD21 LEU 44 1HD2 LEU 44 -14.073 0.910 -19.986 326 HD22 LEU 44 2HD2 LEU 44 -13.601 1.337 -18.341 327 HD23 LEU 44 3HD2 LEU 44 -12.403 1.357 -19.637 328 H LEU 45 H LEU 45 -11.670 5.550 -17.260 329 HA LEU 45 HA LEU 45 -14.007 5.325 -15.689 330 HB2 LEU 45 1HB LEU 45 -11.211 6.249 -15.129 331 HB3 LEU 45 2HB LEU 45 -12.462 6.327 -13.891 332 HG LEU 45 HG LEU 45 -12.126 3.708 -15.206 333 HD11 LEU 45 1HD1 LEU 45 -9.983 4.953 -13.506 334 HD12 LEU 45 2HD1 LEU 45 -9.821 4.187 -15.086 335 HD13 LEU 45 3HD1 LEU 45 -10.185 3.208 -13.665 336 HD21 LEU 45 1HD2 LEU 45 -13.216 3.072 -13.381 337 HD22 LEU 45 2HD2 LEU 45 -13.309 4.765 -12.893 338 HD23 LEU 45 3HD2 LEU 45 -11.967 3.760 -12.341 339 H ARG 46 H ARG 46 -12.350 8.040 -17.125 340 HA ARG 46 HA ARG 46 -14.245 9.877 -15.822 341 HB2 ARG 46 1HB ARG 46 -12.673 11.660 -16.271 342 HB3 ARG 46 2HB ARG 46 -11.845 10.352 -15.437 343 HG2 ARG 46 1HG ARG 46 -10.318 10.366 -17.036 344 HG3 ARG 46 2HG ARG 46 -11.554 9.824 -18.173 345 HD2 ARG 46 1HD ARG 46 -11.835 11.891 -19.064 346 HD3 ARG 46 2HD ARG 46 -11.512 12.710 -17.536 347 HE ARG 46 HE ARG 46 -9.136 11.538 -18.458 348 HH11 ARG 46 1HH1 ARG 46 -11.335 14.114 -19.264 349 HH12 ARG 46 2HH1 ARG 46 -10.120 15.090 -20.019 350 HH21 ARG 46 1HH2 ARG 46 -7.527 12.814 -19.450 351 HH22 ARG 46 2HH2 ARG 46 -7.954 14.350 -20.125 352 H ILE 47 H ILE 47 -14.716 8.160 -18.200 353 HA ILE 47 HA ILE 47 -14.698 9.768 -20.534 354 HB ILE 47 HB ILE 47 -14.853 7.303 -20.597 355 HG12 ILE 47 1HG1 ILE 47 -17.365 8.037 -21.940 356 HG13 ILE 47 2HG1 ILE 47 -16.019 9.120 -22.282 357 HG21 ILE 47 1HG2 ILE 47 -16.499 6.109 -19.647 358 HG22 ILE 47 2HG2 ILE 47 -16.772 7.566 -18.693 359 HG23 ILE 47 3HG2 ILE 47 -17.747 7.258 -20.129 360 HD11 ILE 47 1HD1 ILE 47 -14.995 7.617 -23.570 361 HD12 ILE 47 2HD1 ILE 47 -15.331 6.290 -22.458 362 HD13 ILE 47 3HD1 ILE 47 -16.562 6.809 -23.609 363 H THR 48 H THR 48 -16.115 11.222 -21.294 364 HA THR 48 HA THR 48 -18.616 11.619 -19.784 365 HB THR 48 HB THR 48 -17.050 13.456 -19.366 366 HG1 THR 48 HG1 THR 48 -18.499 15.107 -19.917 367 HG21 THR 48 1HG2 THR 48 -15.799 14.428 -20.949 368 HG22 THR 48 2HG2 THR 48 -17.182 14.632 -22.025 369 HG23 THR 48 3HG2 THR 48 -16.299 13.106 -22.004 370 H HIS 49 H HIS 49 -20.321 12.770 -21.054 371 HA HIS 49 HA HIS 49 -21.046 11.360 -23.317 372 HB2 HIS 49 1HB HIS 49 -21.936 13.896 -22.056 373 HB3 HIS 49 2HB HIS 49 -22.436 13.625 -23.723 374 HD1 HIS 49 HD1 HIS 49 -22.785 12.142 -20.277 375 HD2 HIS 49 HD2 HIS 49 -24.457 11.780 -24.063 376 HE1 HIS 49 HE1 HIS 49 -24.806 10.675 -19.982 377 H GLN 50 H GLN 50 -19.052 14.208 -23.030 378 HA GLN 50 HA GLN 50 -19.123 14.993 -25.751 379 HB2 GLN 50 1HB GLN 50 -18.074 16.047 -23.439 380 HB3 GLN 50 2HB GLN 50 -16.630 15.571 -24.323 381 HG2 GLN 50 1HG GLN 50 -18.791 17.190 -25.618 382 HG3 GLN 50 2HG GLN 50 -17.525 17.942 -24.648 383 HE21 GLN 50 2HE2 GLN 50 -18.257 16.213 -27.571 384 HE22 GLN 50 1HE2 GLN 50 -16.756 16.519 -28.370 385 H GLU 51 H GLU 51 -16.904 12.948 -23.890 386 HA GLU 51 HA GLU 51 -15.078 12.462 -25.980 387 HB2 GLU 51 1HB GLU 51 -15.732 11.077 -23.405 388 HB3 GLU 51 2HB GLU 51 -14.639 10.314 -24.552 389 HG2 GLU 51 1HG GLU 51 -14.123 13.138 -23.803 390 HG3 GLU 51 2HG GLU 51 -13.768 11.881 -22.619 391 H LEU 52 H LEU 52 -17.847 10.565 -24.806 392 HA LEU 52 HA LEU 52 -17.649 8.396 -26.514 393 HB2 LEU 52 1HB LEU 52 -19.974 9.760 -25.214 394 HB3 LEU 52 2HB LEU 52 -20.232 8.400 -26.305 395 HG LEU 52 HG LEU 52 -18.271 7.924 -24.164 396 HD11 LEU 52 1HD1 LEU 52 -19.823 9.249 -22.889 397 HD12 LEU 52 2HD1 LEU 52 -20.041 7.549 -22.476 398 HD13 LEU 52 3HD1 LEU 52 -21.190 8.350 -23.547 399 HD21 LEU 52 1HD2 LEU 52 -18.870 5.796 -24.512 400 HD22 LEU 52 2HD2 LEU 52 -19.662 6.410 -25.964 401 HD23 LEU 52 3HD2 LEU 52 -20.592 6.175 -24.483 402 H GLU 53 H GLU 53 -19.098 11.564 -27.083 403 HA GLU 53 HA GLU 53 -20.321 11.015 -29.542 404 HB2 GLU 53 1HB GLU 53 -20.460 13.117 -28.018 405 HB3 GLU 53 2HB GLU 53 -19.071 13.677 -28.940 406 HG2 GLU 53 1HG GLU 53 -20.677 12.988 -30.961 407 HG3 GLU 53 2HG GLU 53 -21.893 13.382 -29.747 408 H ASP 54 H ASP 54 -17.022 11.959 -28.745 409 HA ASP 54 HA ASP 54 -16.139 12.422 -31.387 410 HB2 ASP 54 1HB ASP 54 -14.944 13.171 -29.326 411 HB3 ASP 54 2HB ASP 54 -14.483 11.497 -29.032 412 H LEU 55 H LEU 55 -16.323 9.528 -29.400 413 HA LEU 55 HA LEU 55 -14.807 7.856 -31.118 414 HB2 LEU 55 1HB LEU 55 -16.818 7.313 -28.955 415 HB3 LEU 55 2HB LEU 55 -16.064 6.013 -29.875 416 HG LEU 55 HG LEU 55 -14.250 7.965 -28.580 417 HD11 LEU 55 1HD1 LEU 55 -14.521 6.251 -26.543 418 HD12 LEU 55 2HD1 LEU 55 -16.190 6.290 -27.112 419 HD13 LEU 55 3HD1 LEU 55 -15.386 7.786 -26.635 420 HD21 LEU 55 1HD2 LEU 55 -14.226 5.232 -29.588 421 HD22 LEU 55 2HD2 LEU 55 -13.455 5.397 -28.010 422 HD23 LEU 55 3HD2 LEU 55 -12.899 6.373 -29.370 423 H GLY 56 H GLY 56 -18.098 8.946 -31.128 424 HA2 GLY 56 1HA GLY 56 -19.029 8.762 -33.482 425 HA3 GLY 56 2HA GLY 56 -18.721 7.042 -33.296 426 H VAL 57 H VAL 57 -19.522 7.438 -30.353 427 HA VAL 57 HA VAL 57 -22.165 6.513 -30.598 428 HB VAL 57 HB VAL 57 -20.953 7.764 -28.133 429 HG11 VAL 57 1HG1 VAL 57 -23.439 7.242 -28.232 430 HG12 VAL 57 2HG1 VAL 57 -22.971 5.541 -28.291 431 HG13 VAL 57 3HG1 VAL 57 -22.532 6.531 -26.898 432 HG21 VAL 57 1HG2 VAL 57 -20.146 5.419 -29.575 433 HG22 VAL 57 2HG2 VAL 57 -19.452 6.124 -28.116 434 HG23 VAL 57 3HG2 VAL 57 -20.775 4.965 -27.991 435 H SER 58 H SER 58 -23.466 7.906 -31.746 436 HA SER 58 HA SER 58 -23.721 10.674 -30.906 437 HB2 SER 58 1HB SER 58 -25.373 10.797 -32.793 438 HB3 SER 58 2HB SER 58 -23.760 10.280 -33.283 439 HG SER 58 HG SER 58 -24.686 8.570 -34.050 440 H ARG 59 H ARG 59 -25.600 7.692 -30.859 441 HA ARG 59 HA ARG 59 -28.047 8.709 -30.001 442 HB2 ARG 59 1HB ARG 59 -26.783 6.122 -30.197 443 HB3 ARG 59 2HB ARG 59 -27.718 6.233 -28.712 444 HG2 ARG 59 1HG ARG 59 -28.985 7.145 -31.238 445 HG3 ARG 59 2HG ARG 59 -28.795 5.411 -30.968 446 HD2 ARG 59 1HD ARG 59 -30.603 5.439 -29.681 447 HD3 ARG 59 2HD ARG 59 -29.765 6.514 -28.562 448 HE ARG 59 HE ARG 59 -30.685 8.181 -30.500 449 HH11 ARG 59 1HH1 ARG 59 -32.167 5.789 -28.450 450 HH12 ARG 59 2HH1 ARG 59 -33.700 6.593 -28.399 451 HH21 ARG 59 1HH2 ARG 59 -32.699 9.250 -30.441 452 HH22 ARG 59 2HH2 ARG 59 -34.002 8.561 -29.532 453 H ILE 60 H ILE 60 -29.004 8.253 -27.778 454 HA ILE 60 HA ILE 60 -27.139 9.285 -25.752 455 HB ILE 60 HB ILE 60 -30.157 9.400 -25.796 456 HG12 ILE 60 1HG1 ILE 60 -29.068 10.865 -27.466 457 HG13 ILE 60 2HG1 ILE 60 -29.873 11.786 -26.201 458 HG21 ILE 60 1HG2 ILE 60 -28.292 9.676 -23.656 459 HG22 ILE 60 2HG2 ILE 60 -29.045 11.239 -23.968 460 HG23 ILE 60 3HG2 ILE 60 -30.049 9.831 -23.622 461 HD11 ILE 60 1HD1 ILE 60 -27.188 11.941 -27.062 462 HD12 ILE 60 2HD1 ILE 60 -27.993 12.866 -25.794 463 HD13 ILE 60 3HD1 ILE 60 -27.189 11.347 -25.402 464 H GLY 61 H GLY 61 -29.756 6.934 -26.238 465 HA2 GLY 61 1HA GLY 61 -29.752 5.787 -23.693 466 HA3 GLY 61 2HA GLY 61 -30.235 4.962 -25.168 467 H HIS 62 H HIS 62 -27.470 5.460 -26.278 468 HA HIS 62 HA HIS 62 -26.294 3.044 -25.187 469 HB2 HIS 62 1HB HIS 62 -25.263 4.803 -27.420 470 HB3 HIS 62 2HB HIS 62 -24.762 3.154 -27.056 471 HD1 HIS 62 HD1 HIS 62 -26.125 4.311 -29.758 472 HD2 HIS 62 HD2 HIS 62 -27.901 1.964 -26.825 473 HE1 HIS 62 HE1 HIS 62 -28.056 3.166 -30.891 474 H GLN 63 H GLN 63 -25.484 6.476 -25.478 475 HA GLN 63 HA GLN 63 -22.903 6.419 -24.455 476 HB2 GLN 63 1HB GLN 63 -25.067 8.495 -24.444 477 HB3 GLN 63 2HB GLN 63 -23.554 8.794 -23.600 478 HG2 GLN 63 1HG GLN 63 -22.401 8.222 -25.791 479 HG3 GLN 63 2HG GLN 63 -23.996 8.354 -26.532 480 HE21 GLN 63 2HE2 GLN 63 -24.542 10.271 -27.274 481 HE22 GLN 63 1HE2 GLN 63 -23.852 11.782 -26.798 482 H GLU 64 H GLU 64 -25.945 6.044 -22.843 483 HA GLU 64 HA GLU 64 -24.763 6.416 -20.206 484 HB2 GLU 64 1HB GLU 64 -27.530 6.123 -21.269 485 HB3 GLU 64 2HB GLU 64 -27.233 5.632 -19.608 486 HG2 GLU 64 1HG GLU 64 -26.026 8.177 -20.061 487 HG3 GLU 64 2HG GLU 64 -27.702 8.219 -20.603 488 H LEU 65 H LEU 65 -25.822 3.872 -22.342 489 HA LEU 65 HA LEU 65 -26.036 1.758 -20.531 490 HB2 LEU 65 1HB LEU 65 -25.513 2.011 -23.438 491 HB3 LEU 65 2HB LEU 65 -25.143 0.462 -22.683 492 HG LEU 65 HG LEU 65 -27.842 1.746 -22.392 493 HD11 LEU 65 1HD1 LEU 65 -28.525 1.121 -24.427 494 HD12 LEU 65 2HD1 LEU 65 -27.605 -0.382 -24.381 495 HD13 LEU 65 3HD1 LEU 65 -26.810 1.124 -24.840 496 HD21 LEU 65 1HD2 LEU 65 -28.517 -0.612 -22.067 497 HD22 LEU 65 2HD2 LEU 65 -27.365 -0.048 -20.857 498 HD23 LEU 65 3HD2 LEU 65 -26.821 -1.083 -22.179 499 H ILE 66 H ILE 66 -23.218 3.105 -22.173 500 HA ILE 66 HA ILE 66 -21.403 1.106 -21.245 501 HB ILE 66 HB ILE 66 -20.758 3.891 -22.217 502 HG12 ILE 66 1HG1 ILE 66 -20.867 1.320 -23.805 503 HG13 ILE 66 2HG1 ILE 66 -22.132 2.545 -23.818 504 HG21 ILE 66 1HG2 ILE 66 -18.777 2.001 -22.905 505 HG22 ILE 66 2HG2 ILE 66 -18.648 3.360 -21.789 506 HG23 ILE 66 3HG2 ILE 66 -19.144 1.775 -21.195 507 HD11 ILE 66 1HD1 ILE 66 -20.852 4.039 -25.005 508 HD12 ILE 66 2HD1 ILE 66 -19.331 3.304 -24.498 509 HD13 ILE 66 3HD1 ILE 66 -20.345 2.497 -25.694 510 H LEU 67 H LEU 67 -22.234 4.385 -20.192 511 HA LEU 67 HA LEU 67 -20.317 4.590 -18.144 512 HB2 LEU 67 1HB LEU 67 -23.025 5.889 -18.391 513 HB3 LEU 67 2HB LEU 67 -21.779 6.363 -17.238 514 HG LEU 67 HG LEU 67 -21.307 6.441 -20.205 515 HD11 LEU 67 1HD1 LEU 67 -21.929 8.968 -18.850 516 HD12 LEU 67 2HD1 LEU 67 -23.300 7.879 -19.060 517 HD13 LEU 67 3HD1 LEU 67 -22.366 8.402 -20.462 518 HD21 LEU 67 1HD2 LEU 67 -20.068 7.994 -17.938 519 HD22 LEU 67 2HD2 LEU 67 -19.556 7.976 -19.625 520 HD23 LEU 67 3HD2 LEU 67 -19.380 6.527 -18.635 521 H GLU 68 H GLU 68 -23.730 3.593 -18.047 522 HA GLU 68 HA GLU 68 -24.002 3.160 -15.334 523 HB2 GLU 68 1HB GLU 68 -25.915 3.012 -16.772 524 HB3 GLU 68 2HB GLU 68 -25.212 1.670 -17.663 525 HG2 GLU 68 1HG GLU 68 -25.495 0.191 -15.834 526 HG3 GLU 68 2HG GLU 68 -25.910 1.514 -14.746 527 H ALA 69 H ALA 69 -22.339 1.236 -17.717 528 HA ALA 69 HA ALA 69 -22.037 -1.048 -15.972 529 HB1 ALA 69 1HB ALA 69 -22.220 -1.281 -18.432 530 HB2 ALA 69 2HB ALA 69 -20.656 -0.482 -18.591 531 HB3 ALA 69 3HB ALA 69 -20.772 -2.036 -17.765 532 H VAL 70 H VAL 70 -20.191 1.772 -16.902 533 HA VAL 70 HA VAL 70 -17.662 0.939 -15.975 534 HB VAL 70 HB VAL 70 -18.780 3.741 -16.150 535 HG11 VAL 70 1HG1 VAL 70 -15.946 2.750 -15.877 536 HG12 VAL 70 2HG1 VAL 70 -16.394 4.412 -16.262 537 HG13 VAL 70 3HG1 VAL 70 -16.852 3.711 -14.709 538 HG21 VAL 70 1HG2 VAL 70 -17.867 1.840 -18.149 539 HG22 VAL 70 2HG2 VAL 70 -18.737 3.361 -18.350 540 HG23 VAL 70 3HG2 VAL 70 -16.979 3.363 -18.209 541 H ASP 71 H ASP 71 -20.435 2.345 -14.362 542 HA ASP 71 HA ASP 71 -19.265 3.188 -11.984 543 HB2 ASP 71 1HB ASP 71 -21.725 3.375 -12.849 544 HB3 ASP 71 2HB ASP 71 -21.954 1.859 -11.982 545 H LEU 72 H LEU 72 -20.222 -0.027 -13.028 546 HA LEU 72 HA LEU 72 -19.868 -1.272 -10.488 547 HB2 LEU 72 1HB LEU 72 -20.168 -2.249 -13.298 548 HB3 LEU 72 2HB LEU 72 -19.707 -3.368 -12.017 549 HG LEU 72 HG LEU 72 -22.193 -1.685 -11.850 550 HD11 LEU 72 1HD1 LEU 72 -23.425 -3.168 -13.044 551 HD12 LEU 72 2HD1 LEU 72 -22.370 -4.528 -12.660 552 HD13 LEU 72 3HD1 LEU 72 -21.891 -3.362 -13.893 553 HD21 LEU 72 1HD2 LEU 72 -22.083 -2.544 -9.783 554 HD22 LEU 72 2HD2 LEU 72 -20.907 -3.773 -10.249 555 HD23 LEU 72 3HD2 LEU 72 -22.625 -4.039 -10.546 556 H LEU 73 H LEU 73 -17.802 -0.679 -13.265 557 HA LEU 73 HA LEU 73 -15.681 -2.382 -12.627 558 HB2 LEU 73 1HB LEU 73 -16.062 0.023 -14.285 559 HB3 LEU 73 2HB LEU 73 -14.404 -0.298 -13.782 560 HG LEU 73 HG LEU 73 -16.116 -2.329 -15.201 561 HD11 LEU 73 1HD1 LEU 73 -15.958 -0.577 -16.756 562 HD12 LEU 73 2HD1 LEU 73 -14.664 -1.694 -17.187 563 HD13 LEU 73 3HD1 LEU 73 -14.293 -0.213 -16.304 564 HD21 LEU 73 1HD2 LEU 73 -13.167 -2.311 -15.355 565 HD22 LEU 73 2HD2 LEU 73 -14.292 -3.664 -15.236 566 HD23 LEU 73 3HD2 LEU 73 -13.869 -2.739 -13.794 567 H CYS 74 H CYS 74 -16.508 0.817 -11.444 568 HA CYS 74 HA CYS 74 -14.032 1.123 -9.994 569 HB2 CYS 74 1HB CYS 74 -16.150 2.828 -10.815 570 HB3 CYS 74 2HB CYS 74 -16.053 2.919 -9.061 571 HG CYS 74 HG CYS 74 -14.583 4.976 -10.528 572 H ALA 75 H ALA 75 -17.254 -0.033 -9.371 573 HA ALA 75 HA ALA 75 -17.258 0.121 -6.563 574 HB1 ALA 75 1HB ALA 75 -19.353 -0.301 -7.368 575 HB2 ALA 75 2HB ALA 75 -18.777 -1.435 -8.590 576 HB3 ALA 75 3HB ALA 75 -18.876 -1.934 -6.902 577 H LEU 76 H LEU 76 -16.467 -2.619 -8.703 578 HA LEU 76 HA LEU 76 -15.665 -4.352 -6.623 579 HB2 LEU 76 1HB LEU 76 -15.271 -4.291 -9.583 580 HB3 LEU 76 2HB LEU 76 -14.381 -5.459 -8.608 581 HG LEU 76 HG LEU 76 -17.377 -5.258 -8.494 582 HD11 LEU 76 1HD1 LEU 76 -15.737 -6.197 -10.687 583 HD12 LEU 76 2HD1 LEU 76 -17.484 -5.973 -10.597 584 HD13 LEU 76 3HD1 LEU 76 -16.758 -7.477 -10.030 585 HD21 LEU 76 1HD2 LEU 76 -16.178 -6.468 -6.704 586 HD22 LEU 76 2HD2 LEU 76 -15.475 -7.529 -7.925 587 HD23 LEU 76 3HD2 LEU 76 -17.220 -7.518 -7.664 588 H ASN 77 H ASN 77 -13.919 -2.034 -8.617 589 HA ASN 77 HA ASN 77 -11.384 -2.752 -7.373 590 HB2 ASN 77 1HB ASN 77 -12.174 -0.949 -9.643 591 HB3 ASN 77 2HB ASN 77 -10.581 -0.808 -8.905 592 HD21 ASN 77 2HD2 ASN 77 -12.771 -3.014 -10.543 593 HD22 ASN 77 1HD2 ASN 77 -11.544 -4.050 -11.182 594 H SER 78 H SER 78 -12.647 -2.004 -5.309 595 HA SER 78 HA SER 78 -12.998 0.742 -4.804 596 HB2 SER 78 1HB SER 78 -12.651 -1.667 -3.041 597 HB3 SER 78 2HB SER 78 -12.730 -0.050 -2.342 598 HG SER 78 HG SER 78 -14.750 -1.533 -2.954 599 H GLY 79 H GLY 79 -10.390 -1.403 -3.634 600 HA2 GLY 79 1HA GLY 79 -8.551 0.892 -3.836 601 HA3 GLY 79 2HA GLY 79 -8.628 -0.047 -2.353 602 HA PRO 80 HA PRO 80 -5.291 -1.819 -5.049 603 HB2 PRO 80 1HB PRO 80 -3.432 -1.946 -3.074 604 HB3 PRO 80 2HB PRO 80 -3.683 -0.505 -4.066 605 HG2 PRO 80 1HG PRO 80 -4.689 -1.107 -1.311 606 HG3 PRO 80 2HG PRO 80 -4.004 0.400 -1.947 607 HD2 PRO 80 1HD PRO 80 -6.669 0.020 -1.655 608 HD3 PRO 80 2HD PRO 80 -5.984 1.024 -2.949 609 H SER 81 H SER 81 -4.735 -3.957 -5.168 610 HA SER 81 HA SER 81 -5.796 -5.695 -3.040 611 HB2 SER 81 1HB SER 81 -5.735 -5.925 -6.009 612 HB3 SER 81 2HB SER 81 -5.572 -7.412 -5.074 613 HG SER 81 HG SER 81 -7.677 -7.291 -5.028 614 H SER 82 H SER 82 -4.485 -7.108 -2.037 615 HA SER 82 HA SER 82 -1.864 -7.713 -3.178 616 HB2 SER 82 1HB SER 82 -2.349 -6.246 -0.610 617 HB3 SER 82 2HB SER 82 -0.960 -7.324 -0.742 618 HG SER 82 HG SER 82 -0.015 -5.951 -2.037 619 H GLY 83 H GLY 83 -2.174 -9.863 -3.383 620 HA2 GLY 83 1HA GLY 83 -2.627 -11.366 -0.896 621 HA3 GLY 83 2HA GLY 83 -3.604 -11.734 -2.310 Start of MODEL 8 1 H1 GLY 1 H GLY 1 -10.258 5.540 4.378 2 HA2 GLY 1 1HA GLY 1 -9.018 4.806 2.489 3 HA3 GLY 1 2HA GLY 1 -10.098 3.426 2.352 4 H SER 2 H SER 2 -9.416 6.593 1.303 5 HA SER 2 HA SER 2 -11.684 6.473 -0.534 6 HB2 SER 2 1HB SER 2 -11.150 9.159 0.609 7 HB3 SER 2 2HB SER 2 -12.673 8.432 0.099 8 HG SER 2 HG SER 2 -12.773 7.321 2.019 9 H SER 3 H SER 3 -11.143 7.051 -2.546 10 HA SER 3 HA SER 3 -9.898 7.726 -4.326 11 HB2 SER 3 1HB SER 3 -10.268 9.956 -3.199 12 HB3 SER 3 2HB SER 3 -8.681 9.765 -2.454 13 HG SER 3 HG SER 3 -7.824 10.391 -4.257 14 H GLY 4 H GLY 4 -8.896 5.510 -3.428 15 HA2 GLY 4 1HA GLY 4 -6.021 5.938 -2.945 16 HA3 GLY 4 2HA GLY 4 -6.901 4.463 -2.572 17 H SER 5 H SER 5 -5.414 3.196 -3.722 18 HA SER 5 HA SER 5 -4.704 3.671 -6.418 19 HB2 SER 5 1HB SER 5 -3.606 2.110 -4.636 20 HB3 SER 5 2HB SER 5 -4.756 0.912 -5.231 21 HG SER 5 HG SER 5 -2.907 0.706 -6.436 22 H SER 6 H SER 6 -5.249 2.210 -8.239 23 HA SER 6 HA SER 6 -7.733 0.775 -8.164 24 HB2 SER 6 1HB SER 6 -8.150 3.404 -8.427 25 HB3 SER 6 2HB SER 6 -7.826 3.020 -10.117 26 HG SER 6 HG SER 6 -10.020 2.787 -9.724 27 H GLY 7 H GLY 7 -7.900 -0.659 -9.828 28 HA2 GLY 7 1HA GLY 7 -5.569 -0.915 -11.539 29 HA3 GLY 7 2HA GLY 7 -6.877 -2.078 -11.373 30 H VAL 8 H VAL 8 -9.039 -0.344 -11.926 31 HA VAL 8 HA VAL 8 -9.145 -0.505 -14.721 32 HB VAL 8 HB VAL 8 -10.838 1.291 -12.980 33 HG11 VAL 8 1HG1 VAL 8 -11.372 0.011 -15.659 34 HG12 VAL 8 2HG1 VAL 8 -12.522 0.975 -14.731 35 HG13 VAL 8 3HG1 VAL 8 -11.056 1.721 -15.368 36 HG21 VAL 8 1HG2 VAL 8 -12.409 -0.633 -12.907 37 HG22 VAL 8 2HG2 VAL 8 -11.156 -1.635 -13.641 38 HG23 VAL 8 3HG2 VAL 8 -10.896 -0.924 -12.048 39 H SER 9 H SER 9 -7.947 1.969 -12.619 40 HA SER 9 HA SER 9 -8.084 4.126 -14.479 41 HB2 SER 9 1HB SER 9 -6.579 5.288 -12.906 42 HB3 SER 9 2HB SER 9 -7.931 4.530 -12.065 43 HG SER 9 HG SER 9 -5.344 4.170 -11.645 44 H LYS 10 H LYS 10 -5.855 1.535 -13.905 45 HA LYS 10 HA LYS 10 -3.922 2.738 -15.767 46 HB2 LYS 10 1HB LYS 10 -3.556 0.426 -13.852 47 HB3 LYS 10 2HB LYS 10 -2.309 1.104 -14.891 48 HG2 LYS 10 1HG LYS 10 -3.478 3.188 -13.319 49 HG3 LYS 10 2HG LYS 10 -2.978 1.858 -12.272 50 HD2 LYS 10 1HD LYS 10 -1.029 2.543 -14.348 51 HD3 LYS 10 2HD LYS 10 -1.339 3.842 -13.193 52 HE2 LYS 10 1HE LYS 10 -1.000 1.182 -11.997 53 HE3 LYS 10 2HE LYS 10 0.431 1.810 -12.813 54 HZ1 LYS 10 1HZ LYS 10 -1.027 2.950 -10.514 55 HZ2 LYS 10 2HZ LYS 10 -0.032 3.922 -11.477 56 HZ3 LYS 10 3HZ LYS 10 0.622 2.596 -10.654 57 H TRP 11 H TRP 11 -6.491 1.319 -16.401 58 HA TRP 11 HA TRP 11 -5.801 -1.208 -17.531 59 HB2 TRP 11 1HB TRP 11 -8.184 0.508 -17.391 60 HB3 TRP 11 2HB TRP 11 -8.066 -0.443 -18.868 61 HD1 TRP 11 HD1 TRP 11 -6.750 -1.896 -15.596 62 HE1 TRP 11 HE1 TRP 11 -8.250 -3.869 -14.902 63 HE3 TRP 11 HE3 TRP 11 -10.466 -1.349 -19.064 64 HZ2 TRP 11 HZ2 TRP 11 -10.685 -5.040 -15.718 65 HZ3 TRP 11 HZ3 TRP 11 -12.345 -2.938 -19.040 66 HH2 TRP 11 HH2 TRP 11 -12.450 -4.745 -17.401 67 H SER 12 H SER 12 -4.934 -1.672 -19.451 68 HA SER 12 HA SER 12 -3.783 0.291 -21.079 69 HB2 SER 12 1HB SER 12 -4.335 -2.211 -22.483 70 HB3 SER 12 2HB SER 12 -2.789 -1.466 -22.078 71 HG SER 12 HG SER 12 -2.845 -2.431 -20.094 72 HA PRO 13 HA PRO 13 -6.898 1.594 -23.878 73 HB2 PRO 13 1HB PRO 13 -5.556 1.725 -26.234 74 HB3 PRO 13 2HB PRO 13 -5.299 2.875 -24.917 75 HG2 PRO 13 1HG PRO 13 -3.681 0.473 -25.678 76 HG3 PRO 13 2HG PRO 13 -3.128 2.088 -25.198 77 HD2 PRO 13 1HD PRO 13 -3.148 -0.012 -23.489 78 HD3 PRO 13 2HD PRO 13 -3.418 1.658 -22.952 79 H SER 14 H SER 14 -5.235 -1.384 -24.504 80 HA SER 14 HA SER 14 -7.152 -2.182 -26.556 81 HB2 SER 14 1HB SER 14 -5.025 -2.884 -27.198 82 HB3 SER 14 2HB SER 14 -4.557 -3.305 -25.550 83 HG SER 14 HG SER 14 -4.969 -5.162 -26.813 84 H GLN 15 H GLN 15 -6.438 -2.672 -23.203 85 HA GLN 15 HA GLN 15 -7.815 -5.104 -22.808 86 HB2 GLN 15 1HB GLN 15 -6.976 -2.857 -21.009 87 HB3 GLN 15 2HB GLN 15 -8.005 -4.142 -20.391 88 HG2 GLN 15 1HG GLN 15 -5.543 -4.924 -21.844 89 HG3 GLN 15 2HG GLN 15 -5.368 -4.239 -20.229 90 HE21 GLN 15 2HE2 GLN 15 -5.109 -7.012 -21.519 91 HE22 GLN 15 1HE2 GLN 15 -5.958 -8.041 -20.421 92 H VAL 16 H VAL 16 -8.838 -1.723 -22.407 93 HA VAL 16 HA VAL 16 -11.401 -2.117 -21.463 94 HB VAL 16 HB VAL 16 -10.506 0.005 -23.420 95 HG11 VAL 16 1HG1 VAL 16 -13.056 -0.538 -22.119 96 HG12 VAL 16 2HG1 VAL 16 -12.454 1.093 -21.814 97 HG13 VAL 16 3HG1 VAL 16 -12.678 0.529 -23.471 98 HG21 VAL 16 1HG2 VAL 16 -10.067 1.381 -21.494 99 HG22 VAL 16 2HG2 VAL 16 -10.651 0.119 -20.409 100 HG23 VAL 16 3HG2 VAL 16 -9.169 -0.129 -21.333 101 H VAL 17 H VAL 17 -10.161 -2.521 -24.704 102 HA VAL 17 HA VAL 17 -12.597 -2.549 -26.109 103 HB VAL 17 HB VAL 17 -10.124 -4.139 -26.794 104 HG11 VAL 17 1HG1 VAL 17 -10.909 -4.184 -29.003 105 HG12 VAL 17 2HG1 VAL 17 -12.327 -4.552 -28.019 106 HG13 VAL 17 3HG1 VAL 17 -12.114 -2.935 -28.692 107 HG21 VAL 17 1HG2 VAL 17 -9.479 -2.162 -28.142 108 HG22 VAL 17 2HG2 VAL 17 -10.805 -1.264 -27.403 109 HG23 VAL 17 3HG2 VAL 17 -9.474 -1.850 -26.406 110 H ASP 18 H ASP 18 -10.820 -5.089 -24.422 111 HA ASP 18 HA ASP 18 -12.472 -7.233 -25.279 112 HB2 ASP 18 1HB ASP 18 -10.146 -7.454 -24.340 113 HB3 ASP 18 2HB ASP 18 -10.822 -7.110 -22.750 114 H TRP 19 H TRP 19 -12.752 -4.837 -22.800 115 HA TRP 19 HA TRP 19 -14.615 -6.212 -21.148 116 HB2 TRP 19 1HB TRP 19 -13.381 -4.376 -20.211 117 HB3 TRP 19 2HB TRP 19 -13.968 -3.277 -21.455 118 HD1 TRP 19 HD1 TRP 19 -15.585 -5.483 -18.685 119 HE1 TRP 19 HE1 TRP 19 -17.510 -4.135 -17.636 120 HE3 TRP 19 HE3 TRP 19 -15.287 -1.267 -21.562 121 HZ2 TRP 19 HZ2 TRP 19 -18.741 -1.618 -17.982 122 HZ3 TRP 19 HZ3 TRP 19 -16.875 0.564 -21.139 123 HH2 TRP 19 HH2 TRP 19 -18.566 0.390 -19.386 124 H MET 20 H MET 20 -14.952 -3.858 -23.778 125 HA MET 20 HA MET 20 -17.740 -3.566 -23.641 126 HB2 MET 20 1HB MET 20 -15.968 -3.353 -26.081 127 HB3 MET 20 2HB MET 20 -17.587 -2.686 -25.916 128 HG2 MET 20 1HG MET 20 -15.648 -1.850 -23.868 129 HG3 MET 20 2HG MET 20 -15.327 -1.290 -25.508 130 HE1 MET 20 1HE MET 20 -17.071 0.691 -26.754 131 HE2 MET 20 2HE MET 20 -17.716 -0.944 -26.898 132 HE3 MET 20 3HE MET 20 -18.766 0.377 -26.381 133 H LYS 21 H LYS 21 -15.764 -6.117 -24.848 134 HA LYS 21 HA LYS 21 -17.575 -7.270 -26.687 135 HB2 LYS 21 1HB LYS 21 -15.365 -8.538 -25.059 136 HB3 LYS 21 2HB LYS 21 -16.212 -9.331 -26.381 137 HG2 LYS 21 1HG LYS 21 -15.437 -7.383 -27.827 138 HG3 LYS 21 2HG LYS 21 -14.342 -6.990 -26.499 139 HD2 LYS 21 1HD LYS 21 -13.693 -9.522 -26.690 140 HD3 LYS 21 2HD LYS 21 -14.353 -9.358 -28.319 141 HE2 LYS 21 1HE LYS 21 -12.675 -7.986 -29.006 142 HE3 LYS 21 2HE LYS 21 -12.464 -7.264 -27.412 143 HZ1 LYS 21 1HZ LYS 21 -11.483 -9.470 -26.739 144 HZ2 LYS 21 2HZ LYS 21 -10.552 -8.541 -27.802 145 HZ3 LYS 21 3HZ LYS 21 -11.432 -9.863 -28.384 146 H GLY 22 H GLY 22 -17.652 -7.038 -23.308 147 HA2 GLY 22 1HA GLY 22 -19.584 -9.270 -23.156 148 HA3 GLY 22 2HA GLY 22 -18.570 -8.765 -21.812 149 H LEU 23 H LEU 23 -19.999 -6.358 -23.851 150 HA LEU 23 HA LEU 23 -21.894 -5.711 -21.689 151 HB2 LEU 23 1HB LEU 23 -20.687 -3.789 -23.668 152 HB3 LEU 23 2HB LEU 23 -21.667 -3.394 -22.258 153 HG LEU 23 HG LEU 23 -18.853 -4.481 -22.256 154 HD11 LEU 23 1HD1 LEU 23 -19.669 -1.919 -22.642 155 HD12 LEU 23 2HD1 LEU 23 -18.131 -2.387 -21.917 156 HD13 LEU 23 3HD1 LEU 23 -19.502 -1.972 -20.887 157 HD21 LEU 23 1HD2 LEU 23 -19.554 -5.414 -20.318 158 HD22 LEU 23 2HD2 LEU 23 -20.920 -4.312 -20.150 159 HD23 LEU 23 3HD2 LEU 23 -19.297 -3.779 -19.710 160 H ASP 24 H ASP 24 -23.445 -3.847 -22.910 161 HA ASP 24 HA ASP 24 -25.363 -5.312 -24.248 162 HB2 ASP 24 1HB ASP 24 -25.037 -2.636 -23.444 163 HB3 ASP 24 2HB ASP 24 -25.415 -2.577 -25.164 164 H ASP 25 H ASP 25 -25.976 -5.538 -26.406 165 HA ASP 25 HA ASP 25 -23.878 -5.882 -28.256 166 HB2 ASP 25 1HB ASP 25 -26.245 -6.981 -28.147 167 HB3 ASP 25 2HB ASP 25 -26.735 -5.599 -29.124 168 H CYS 26 H CYS 26 -25.931 -3.191 -27.523 169 HA CYS 26 HA CYS 26 -25.588 -1.777 -29.966 170 HB2 CYS 26 1HB CYS 26 -26.277 -0.717 -27.217 171 HB3 CYS 26 2HB CYS 26 -26.473 0.154 -28.733 172 HG CYS 26 HG CYS 26 -29.000 -0.625 -27.922 173 H LEU 27 H LEU 27 -23.628 -2.230 -27.174 174 HA LEU 27 HA LEU 27 -21.928 0.057 -27.815 175 HB2 LEU 27 1HB LEU 27 -21.405 -1.918 -25.626 176 HB3 LEU 27 2HB LEU 27 -20.917 -0.228 -25.734 177 HG LEU 27 HG LEU 27 -23.753 -1.163 -25.305 178 HD11 LEU 27 1HD1 LEU 27 -21.520 -0.726 -23.448 179 HD12 LEU 27 2HD1 LEU 27 -22.997 -1.668 -23.252 180 HD13 LEU 27 3HD1 LEU 27 -23.029 0.079 -23.013 181 HD21 LEU 27 1HD2 LEU 27 -24.110 0.933 -26.060 182 HD22 LEU 27 2HD2 LEU 27 -22.459 1.454 -25.722 183 HD23 LEU 27 3HD2 LEU 27 -23.644 1.374 -24.417 184 H GLN 28 H GLN 28 -22.194 -2.469 -29.453 185 HA GLN 28 HA GLN 28 -19.515 -3.598 -29.250 186 HB2 GLN 28 1HB GLN 28 -21.822 -4.293 -31.076 187 HB3 GLN 28 2HB GLN 28 -20.290 -5.155 -31.011 188 HG2 GLN 28 1HG GLN 28 -22.207 -4.881 -28.707 189 HG3 GLN 28 2HG GLN 28 -22.102 -6.279 -29.777 190 HE21 GLN 28 2HE2 GLN 28 -21.479 -5.590 -26.818 191 HE22 GLN 28 1HE2 GLN 28 -19.959 -6.369 -26.558 192 H GLN 29 H GLN 29 -21.530 -1.887 -31.623 193 HA GLN 29 HA GLN 29 -19.691 -1.753 -33.704 194 HB2 GLN 29 1HB GLN 29 -20.970 0.197 -34.491 195 HB3 GLN 29 2HB GLN 29 -22.023 -1.120 -33.990 196 HG2 GLN 29 1HG GLN 29 -21.727 0.392 -31.699 197 HG3 GLN 29 2HG GLN 29 -21.830 1.589 -32.989 198 HE21 GLN 29 2HE2 GLN 29 -23.416 -1.308 -31.731 199 HE22 GLN 29 1HE2 GLN 29 -25.017 -0.842 -32.181 200 H TYR 30 H TYR 30 -19.801 -0.025 -30.710 201 HA TYR 30 HA TYR 30 -18.068 2.111 -31.526 202 HB2 TYR 30 1HB TYR 30 -18.762 1.179 -28.733 203 HB3 TYR 30 2HB TYR 30 -18.036 2.723 -29.167 204 HD1 TYR 30 HD2 TYR 30 -19.680 3.478 -31.511 205 HD2 TYR 30 HD1 TYR 30 -20.814 1.763 -27.786 206 HE1 TYR 30 HE2 TYR 30 -21.919 4.470 -31.743 207 HE2 TYR 30 HE1 TYR 30 -23.057 2.749 -28.009 208 HH TYR 30 HH TYR 30 -23.838 4.967 -30.621 209 H ILE 31 H ILE 31 -17.660 -1.106 -30.336 210 HA ILE 31 HA ILE 31 -15.187 -1.031 -29.118 211 HB ILE 31 HB ILE 31 -16.204 -3.182 -30.979 212 HG12 ILE 31 1HG1 ILE 31 -16.449 -2.904 -27.975 213 HG13 ILE 31 2HG1 ILE 31 -17.754 -2.659 -29.130 214 HG21 ILE 31 1HG2 ILE 31 -13.809 -3.371 -30.559 215 HG22 ILE 31 2HG2 ILE 31 -14.099 -3.297 -28.822 216 HG23 ILE 31 3HG2 ILE 31 -14.694 -4.669 -29.757 217 HD11 ILE 31 1HD1 ILE 31 -17.634 -4.988 -29.788 218 HD12 ILE 31 2HD1 ILE 31 -16.282 -5.245 -28.685 219 HD13 ILE 31 3HD1 ILE 31 -17.876 -4.842 -28.048 220 H LYS 32 H LYS 32 -15.789 -1.667 -32.578 221 HA LYS 32 HA LYS 32 -13.165 -1.748 -33.439 222 HB2 LYS 32 1HB LYS 32 -14.071 -1.017 -35.661 223 HB3 LYS 32 2HB LYS 32 -14.924 -2.374 -34.935 224 HG2 LYS 32 1HG LYS 32 -16.784 -1.067 -34.397 225 HG3 LYS 32 2HG LYS 32 -15.895 0.443 -34.607 226 HD2 LYS 32 1HD LYS 32 -17.127 0.369 -36.553 227 HD3 LYS 32 2HD LYS 32 -15.625 -0.403 -37.068 228 HE2 LYS 32 1HE LYS 32 -17.023 -1.994 -37.842 229 HE3 LYS 32 2HE LYS 32 -16.982 -2.551 -36.170 230 HZ1 LYS 32 1HZ LYS 32 -19.201 -1.779 -37.615 231 HZ2 LYS 32 2HZ LYS 32 -18.945 -0.535 -36.499 232 HZ3 LYS 32 3HZ LYS 32 -19.133 -2.128 -35.961 233 H ASN 33 H ASN 33 -15.154 1.017 -32.655 234 HA ASN 33 HA ASN 33 -13.357 2.944 -33.802 235 HB2 ASN 33 1HB ASN 33 -15.757 3.171 -31.989 236 HB3 ASN 33 2HB ASN 33 -14.801 4.572 -32.464 237 HD21 ASN 33 2HD2 ASN 33 -17.162 4.964 -33.203 238 HD22 ASN 33 1HD2 ASN 33 -17.483 4.566 -34.854 239 H PHE 34 H PHE 34 -13.838 1.459 -30.676 240 HA PHE 34 HA PHE 34 -12.207 3.293 -29.217 241 HB2 PHE 34 1HB PHE 34 -13.511 0.674 -28.661 242 HB3 PHE 34 2HB PHE 34 -12.180 1.161 -27.616 243 HD1 PHE 34 HD2 PHE 34 -14.972 3.059 -29.202 244 HD2 PHE 34 HD1 PHE 34 -13.017 1.888 -25.607 245 HE1 PHE 34 HE2 PHE 34 -16.513 4.474 -27.908 246 HE2 PHE 34 HE1 PHE 34 -14.556 3.300 -24.307 247 HZ PHE 34 HZ PHE 34 -16.306 4.596 -25.457 248 H GLU 35 H GLU 35 -11.638 0.361 -31.019 249 HA GLU 35 HA GLU 35 -9.106 -0.302 -29.991 250 HB2 GLU 35 1HB GLU 35 -10.823 -1.237 -32.043 251 HB3 GLU 35 2HB GLU 35 -9.253 -0.946 -32.779 252 HG2 GLU 35 1HG GLU 35 -9.664 -2.590 -30.295 253 HG3 GLU 35 2HG GLU 35 -9.597 -3.258 -31.924 254 H ARG 36 H ARG 36 -10.070 1.752 -32.714 255 HA ARG 36 HA ARG 36 -7.384 2.380 -33.468 256 HB2 ARG 36 1HB ARG 36 -9.720 2.544 -34.773 257 HB3 ARG 36 2HB ARG 36 -9.605 4.207 -34.212 258 HG2 ARG 36 1HG ARG 36 -7.111 3.816 -35.207 259 HG3 ARG 36 2HG ARG 36 -8.080 2.804 -36.280 260 HD2 ARG 36 1HD ARG 36 -9.606 4.780 -36.589 261 HD3 ARG 36 2HD ARG 36 -8.410 5.745 -35.725 262 HE ARG 36 HE ARG 36 -7.141 5.782 -37.622 263 HH11 ARG 36 1HH1 ARG 36 -9.437 3.176 -37.860 264 HH12 ARG 36 2HH1 ARG 36 -9.032 2.795 -39.501 265 HH21 ARG 36 1HH2 ARG 36 -6.599 5.291 -39.782 266 HH22 ARG 36 2HH2 ARG 36 -7.417 3.998 -40.593 267 H GLU 37 H GLU 37 -9.884 3.975 -31.547 268 HA GLU 37 HA GLU 37 -8.426 6.384 -31.142 269 HB2 GLU 37 1HB GLU 37 -10.826 5.138 -29.841 270 HB3 GLU 37 2HB GLU 37 -10.089 6.577 -29.152 271 HG2 GLU 37 1HG GLU 37 -10.521 6.852 -31.998 272 HG3 GLU 37 2HG GLU 37 -12.013 6.483 -31.135 273 H LYS 38 H LYS 38 -8.298 3.260 -29.726 274 HA LYS 38 HA LYS 38 -7.062 2.353 -28.045 275 HB2 LYS 38 1HB LYS 38 -5.428 4.871 -28.412 276 HB3 LYS 38 2HB LYS 38 -4.908 3.446 -27.522 277 HG2 LYS 38 1HG LYS 38 -5.673 3.338 -30.423 278 HG3 LYS 38 2HG LYS 38 -4.033 3.705 -29.882 279 HD2 LYS 38 1HD LYS 38 -4.272 1.531 -28.490 280 HD3 LYS 38 2HD LYS 38 -5.600 1.167 -29.595 281 HE2 LYS 38 1HE LYS 38 -4.214 0.893 -31.386 282 HE3 LYS 38 2HE LYS 38 -3.024 2.043 -30.780 283 HZ1 LYS 38 1HZ LYS 38 -2.360 -0.377 -30.785 284 HZ2 LYS 38 2HZ LYS 38 -3.453 -0.597 -29.513 285 HZ3 LYS 38 3HZ LYS 38 -2.138 0.451 -29.326 286 H ILE 39 H ILE 39 -9.330 3.610 -27.178 287 HA ILE 39 HA ILE 39 -9.009 5.551 -25.189 288 HB ILE 39 HB ILE 39 -11.088 3.364 -25.327 289 HG12 ILE 39 1HG1 ILE 39 -11.025 4.761 -27.348 290 HG13 ILE 39 2HG1 ILE 39 -12.489 5.057 -26.417 291 HG21 ILE 39 1HG2 ILE 39 -10.633 5.571 -23.462 292 HG22 ILE 39 2HG2 ILE 39 -12.266 5.509 -24.123 293 HG23 ILE 39 3HG2 ILE 39 -11.603 4.110 -23.278 294 HD11 ILE 39 1HD1 ILE 39 -11.528 7.098 -25.525 295 HD12 ILE 39 2HD1 ILE 39 -10.033 6.794 -26.410 296 HD13 ILE 39 3HD1 ILE 39 -11.527 7.119 -27.288 297 H SER 40 H SER 40 -7.689 5.386 -23.501 298 HA SER 40 HA SER 40 -7.065 2.828 -22.313 299 HB2 SER 40 1HB SER 40 -5.290 4.483 -22.547 300 HB3 SER 40 2HB SER 40 -6.202 5.635 -21.571 301 HG SER 40 HG SER 40 -5.294 4.749 -19.910 302 H GLY 41 H GLY 41 -7.150 2.559 -19.916 303 HA2 GLY 41 1HA GLY 41 -9.776 2.722 -18.980 304 HA3 GLY 41 2HA GLY 41 -8.368 2.405 -17.977 305 H ASP 42 H ASP 42 -6.990 4.793 -18.236 306 HA ASP 42 HA ASP 42 -8.106 6.377 -16.269 307 HB2 ASP 42 1HB ASP 42 -5.721 6.421 -17.127 308 HB3 ASP 42 2HB ASP 42 -6.300 7.435 -18.445 309 H GLN 43 H GLN 43 -8.672 6.410 -19.708 310 HA GLN 43 HA GLN 43 -10.105 8.926 -19.631 311 HB2 GLN 43 1HB GLN 43 -9.240 7.018 -21.731 312 HB3 GLN 43 2HB GLN 43 -10.684 7.963 -22.071 313 HG2 GLN 43 1HG GLN 43 -9.158 9.955 -21.280 314 HG3 GLN 43 2HG GLN 43 -7.868 8.847 -21.744 315 HE21 GLN 43 2HE2 GLN 43 -8.463 7.707 -23.942 316 HE22 GLN 43 1HE2 GLN 43 -8.901 8.801 -25.204 317 H LEU 44 H LEU 44 -10.803 5.513 -19.564 318 HA LEU 44 HA LEU 44 -13.576 5.724 -20.175 319 HB2 LEU 44 1HB LEU 44 -12.435 3.637 -20.501 320 HB3 LEU 44 2HB LEU 44 -11.972 3.575 -18.802 321 HG LEU 44 HG LEU 44 -14.713 3.662 -18.670 322 HD11 LEU 44 1HD1 LEU 44 -14.518 3.296 -21.245 323 HD12 LEU 44 2HD1 LEU 44 -15.691 2.375 -20.305 324 HD13 LEU 44 3HD1 LEU 44 -14.167 1.630 -20.785 325 HD21 LEU 44 1HD2 LEU 44 -12.989 1.192 -18.809 326 HD22 LEU 44 2HD2 LEU 44 -14.549 1.349 -18.002 327 HD23 LEU 44 3HD2 LEU 44 -13.149 2.235 -17.395 328 H LEU 45 H LEU 45 -11.747 5.451 -17.145 329 HA LEU 45 HA LEU 45 -13.913 5.359 -15.386 330 HB2 LEU 45 1HB LEU 45 -11.123 5.506 -15.200 331 HB3 LEU 45 2HB LEU 45 -11.733 6.882 -14.284 332 HG LEU 45 HG LEU 45 -13.032 5.400 -12.868 333 HD11 LEU 45 1HD1 LEU 45 -12.394 3.472 -14.968 334 HD12 LEU 45 2HD1 LEU 45 -13.735 3.506 -13.824 335 HD13 LEU 45 3HD1 LEU 45 -12.173 2.850 -13.333 336 HD21 LEU 45 1HD2 LEU 45 -10.374 5.762 -12.742 337 HD22 LEU 45 2HD2 LEU 45 -10.431 4.002 -12.853 338 HD23 LEU 45 3HD2 LEU 45 -11.286 4.832 -11.552 339 H ARG 46 H ARG 46 -12.471 8.028 -17.093 340 HA ARG 46 HA ARG 46 -14.353 9.859 -15.754 341 HB2 ARG 46 1HB ARG 46 -12.817 11.651 -16.048 342 HB3 ARG 46 2HB ARG 46 -11.896 10.309 -15.383 343 HG2 ARG 46 1HG ARG 46 -11.171 9.766 -17.717 344 HG3 ARG 46 2HG ARG 46 -11.930 11.274 -18.229 345 HD2 ARG 46 1HD ARG 46 -10.437 12.184 -16.191 346 HD3 ARG 46 2HD ARG 46 -9.447 10.815 -16.694 347 HE ARG 46 HE ARG 46 -8.868 11.979 -18.575 348 HH11 ARG 46 1HH1 ARG 46 -11.694 13.443 -17.163 349 HH12 ARG 46 2HH1 ARG 46 -11.687 14.801 -18.239 350 HH21 ARG 46 1HH2 ARG 46 -8.849 13.763 -19.996 351 HH22 ARG 46 2HH2 ARG 46 -10.069 14.982 -19.850 352 H ILE 47 H ILE 47 -14.730 8.126 -18.138 353 HA ILE 47 HA ILE 47 -14.678 9.697 -20.486 354 HB ILE 47 HB ILE 47 -14.856 7.227 -20.496 355 HG12 ILE 47 1HG1 ILE 47 -17.281 7.775 -21.971 356 HG13 ILE 47 2HG1 ILE 47 -16.122 9.082 -22.184 357 HG21 ILE 47 1HG2 ILE 47 -16.805 7.533 -18.648 358 HG22 ILE 47 2HG2 ILE 47 -17.769 7.266 -20.099 359 HG23 ILE 47 3HG2 ILE 47 -16.570 6.071 -19.606 360 HD11 ILE 47 1HD1 ILE 47 -14.870 7.855 -23.539 361 HD12 ILE 47 2HD1 ILE 47 -14.872 6.487 -22.425 362 HD13 ILE 47 3HD1 ILE 47 -16.199 6.697 -23.568 363 H THR 48 H THR 48 -16.091 11.116 -21.331 364 HA THR 48 HA THR 48 -18.644 11.527 -19.916 365 HB THR 48 HB THR 48 -17.029 13.323 -19.362 366 HG1 THR 48 HG1 THR 48 -18.635 14.728 -19.426 367 HG21 THR 48 1HG2 THR 48 -17.197 14.632 -21.965 368 HG22 THR 48 2HG2 THR 48 -16.271 13.131 -22.003 369 HG23 THR 48 3HG2 THR 48 -15.814 14.422 -20.892 370 H HIS 49 H HIS 49 -20.234 12.792 -21.258 371 HA HIS 49 HA HIS 49 -20.845 11.462 -23.605 372 HB2 HIS 49 1HB HIS 49 -21.668 14.223 -22.693 373 HB3 HIS 49 2HB HIS 49 -22.387 13.392 -24.069 374 HD1 HIS 49 HD1 HIS 49 -23.158 14.076 -20.742 375 HD2 HIS 49 HD2 HIS 49 -23.261 10.599 -23.014 376 HE1 HIS 49 HE1 HIS 49 -24.743 12.535 -19.542 377 H GLN 50 H GLN 50 -18.865 14.305 -23.111 378 HA GLN 50 HA GLN 50 -18.724 15.164 -25.792 379 HB2 GLN 50 1HB GLN 50 -17.839 16.162 -23.434 380 HB3 GLN 50 2HB GLN 50 -16.329 15.565 -24.110 381 HG2 GLN 50 1HG GLN 50 -16.568 17.856 -24.713 382 HG3 GLN 50 2HG GLN 50 -16.793 16.878 -26.162 383 HE21 GLN 50 2HE2 GLN 50 -18.211 17.873 -27.402 384 HE22 GLN 50 1HE2 GLN 50 -19.724 18.531 -26.889 385 H GLU 51 H GLU 51 -16.698 12.959 -23.899 386 HA GLU 51 HA GLU 51 -14.796 12.492 -25.949 387 HB2 GLU 51 1HB GLU 51 -15.539 10.807 -23.552 388 HB3 GLU 51 2HB GLU 51 -14.136 10.532 -24.575 389 HG2 GLU 51 1HG GLU 51 -14.568 13.143 -23.172 390 HG3 GLU 51 2HG GLU 51 -13.791 11.776 -22.376 391 H LEU 52 H LEU 52 -17.547 10.551 -24.785 392 HA LEU 52 HA LEU 52 -17.355 8.422 -26.530 393 HB2 LEU 52 1HB LEU 52 -19.556 9.711 -25.033 394 HB3 LEU 52 2HB LEU 52 -20.021 8.622 -26.338 395 HG LEU 52 HG LEU 52 -18.120 7.747 -24.186 396 HD11 LEU 52 1HD1 LEU 52 -19.712 7.753 -22.647 397 HD12 LEU 52 2HD1 LEU 52 -20.725 6.749 -23.684 398 HD13 LEU 52 3HD1 LEU 52 -20.827 8.507 -23.788 399 HD21 LEU 52 1HD2 LEU 52 -20.079 6.213 -25.889 400 HD22 LEU 52 2HD2 LEU 52 -18.848 5.547 -24.815 401 HD23 LEU 52 3HD2 LEU 52 -18.369 6.419 -26.272 402 H GLU 53 H GLU 53 -19.080 11.492 -27.017 403 HA GLU 53 HA GLU 53 -20.194 10.978 -29.501 404 HB2 GLU 53 1HB GLU 53 -20.253 13.090 -27.868 405 HB3 GLU 53 2HB GLU 53 -19.074 13.693 -29.024 406 HG2 GLU 53 1HG GLU 53 -21.286 12.556 -30.429 407 HG3 GLU 53 2HG GLU 53 -21.873 13.709 -29.233 408 H ASP 54 H ASP 54 -16.920 11.940 -28.667 409 HA ASP 54 HA ASP 54 -16.020 12.583 -31.254 410 HB2 ASP 54 1HB ASP 54 -14.919 12.779 -28.812 411 HB3 ASP 54 2HB ASP 54 -14.105 11.320 -29.368 412 H LEU 55 H LEU 55 -15.985 9.532 -29.448 413 HA LEU 55 HA LEU 55 -14.606 8.018 -31.380 414 HB2 LEU 55 1HB LEU 55 -16.600 7.152 -29.292 415 HB3 LEU 55 2HB LEU 55 -15.578 6.057 -30.222 416 HG LEU 55 HG LEU 55 -14.076 8.121 -28.801 417 HD11 LEU 55 1HD1 LEU 55 -15.259 8.042 -26.901 418 HD12 LEU 55 2HD1 LEU 55 -14.514 6.457 -26.695 419 HD13 LEU 55 3HD1 LEU 55 -16.131 6.588 -27.386 420 HD21 LEU 55 1HD2 LEU 55 -13.666 5.584 -29.862 421 HD22 LEU 55 2HD2 LEU 55 -13.553 5.363 -28.116 422 HD23 LEU 55 3HD2 LEU 55 -12.517 6.540 -28.926 423 H GLY 56 H GLY 56 -17.941 8.979 -31.087 424 HA2 GLY 56 1HA GLY 56 -18.942 8.965 -33.458 425 HA3 GLY 56 2HA GLY 56 -18.661 7.233 -33.348 426 H VAL 57 H VAL 57 -19.330 7.532 -30.362 427 HA VAL 57 HA VAL 57 -21.972 6.627 -30.495 428 HB VAL 57 HB VAL 57 -20.688 7.916 -28.087 429 HG11 VAL 57 1HG1 VAL 57 -22.773 5.745 -28.263 430 HG12 VAL 57 2HG1 VAL 57 -22.175 6.532 -26.800 431 HG13 VAL 57 3HG1 VAL 57 -23.124 7.449 -27.971 432 HG21 VAL 57 1HG2 VAL 57 -20.482 5.120 -27.924 433 HG22 VAL 57 2HG2 VAL 57 -19.907 5.564 -29.531 434 HG23 VAL 57 3HG2 VAL 57 -19.173 6.289 -28.101 435 H SER 58 H SER 58 -23.397 7.946 -31.540 436 HA SER 58 HA SER 58 -23.767 10.659 -30.461 437 HB2 SER 58 1HB SER 58 -25.141 10.915 -32.657 438 HB3 SER 58 2HB SER 58 -23.380 10.923 -32.751 439 HG SER 58 HG SER 58 -24.330 9.536 -34.311 440 H ARG 59 H ARG 59 -24.785 8.255 -29.204 441 HA ARG 59 HA ARG 59 -27.673 8.792 -29.441 442 HB2 ARG 59 1HB ARG 59 -26.186 6.239 -29.410 443 HB3 ARG 59 2HB ARG 59 -27.626 6.289 -28.402 444 HG2 ARG 59 1HG ARG 59 -28.308 7.425 -30.898 445 HG3 ARG 59 2HG ARG 59 -27.425 5.930 -31.213 446 HD2 ARG 59 1HD ARG 59 -29.009 5.015 -29.306 447 HD3 ARG 59 2HD ARG 59 -30.027 6.354 -29.835 448 HE ARG 59 HE ARG 59 -29.481 3.918 -31.265 449 HH11 ARG 59 1HH1 ARG 59 -30.470 7.245 -31.532 450 HH12 ARG 59 2HH1 ARG 59 -31.305 7.013 -33.032 451 HH21 ARG 59 1HH2 ARG 59 -30.577 3.599 -33.240 452 HH22 ARG 59 2HH2 ARG 59 -31.366 4.938 -34.002 453 H ILE 60 H ILE 60 -28.911 8.457 -27.472 454 HA ILE 60 HA ILE 60 -27.389 9.313 -25.133 455 HB ILE 60 HB ILE 60 -30.377 9.168 -25.548 456 HG12 ILE 60 1HG1 ILE 60 -29.355 10.840 -26.991 457 HG13 ILE 60 2HG1 ILE 60 -30.225 11.637 -25.685 458 HG21 ILE 60 1HG2 ILE 60 -30.368 9.205 -23.300 459 HG22 ILE 60 2HG2 ILE 60 -28.695 9.756 -23.213 460 HG23 ILE 60 3HG2 ILE 60 -29.991 10.914 -23.516 461 HD11 ILE 60 1HD1 ILE 60 -28.382 12.816 -25.345 462 HD12 ILE 60 2HD1 ILE 60 -27.657 11.342 -24.704 463 HD13 ILE 60 3HD1 ILE 60 -27.433 11.770 -26.400 464 H GLY 61 H GLY 61 -29.809 6.848 -26.003 465 HA2 GLY 61 1HA GLY 61 -29.824 5.513 -23.530 466 HA3 GLY 61 2HA GLY 61 -30.297 4.810 -25.069 467 H HIS 62 H HIS 62 -27.497 5.508 -26.071 468 HA HIS 62 HA HIS 62 -26.298 3.001 -25.223 469 HB2 HIS 62 1HB HIS 62 -25.448 5.000 -27.328 470 HB3 HIS 62 2HB HIS 62 -24.658 3.454 -27.029 471 HD1 HIS 62 HD1 HIS 62 -26.081 4.318 -29.733 472 HD2 HIS 62 HD2 HIS 62 -27.677 1.850 -26.796 473 HE1 HIS 62 HE1 HIS 62 -27.821 2.925 -30.898 474 H GLN 63 H GLN 63 -25.456 6.450 -25.288 475 HA GLN 63 HA GLN 63 -22.916 6.329 -24.211 476 HB2 GLN 63 1HB GLN 63 -25.092 8.383 -24.084 477 HB3 GLN 63 2HB GLN 63 -23.612 8.624 -23.166 478 HG2 GLN 63 1HG GLN 63 -22.294 8.546 -25.175 479 HG3 GLN 63 2HG GLN 63 -23.717 8.142 -26.134 480 HE21 GLN 63 2HE2 GLN 63 -22.102 10.291 -26.746 481 HE22 GLN 63 1HE2 GLN 63 -22.976 11.756 -26.476 482 H GLU 64 H GLU 64 -26.028 6.153 -22.584 483 HA GLU 64 HA GLU 64 -24.863 6.222 -19.948 484 HB2 GLU 64 1HB GLU 64 -27.647 5.749 -20.989 485 HB3 GLU 64 2HB GLU 64 -27.250 5.537 -19.289 486 HG2 GLU 64 1HG GLU 64 -26.506 8.090 -20.617 487 HG3 GLU 64 2HG GLU 64 -28.196 7.807 -20.201 488 H LEU 65 H LEU 65 -25.912 3.797 -22.236 489 HA LEU 65 HA LEU 65 -26.139 1.573 -20.595 490 HB2 LEU 65 1HB LEU 65 -25.696 2.088 -23.427 491 HB3 LEU 65 2HB LEU 65 -24.962 0.582 -22.880 492 HG LEU 65 HG LEU 65 -27.870 1.285 -22.497 493 HD11 LEU 65 1HD1 LEU 65 -27.880 -0.725 -24.281 494 HD12 LEU 65 2HD1 LEU 65 -26.412 0.116 -24.777 495 HD13 LEU 65 3HD1 LEU 65 -27.949 0.979 -24.729 496 HD21 LEU 65 1HD2 LEU 65 -27.350 -0.308 -20.891 497 HD22 LEU 65 2HD2 LEU 65 -26.186 -1.126 -21.933 498 HD23 LEU 65 3HD2 LEU 65 -27.915 -1.285 -22.246 499 H ILE 66 H ILE 66 -23.254 3.022 -22.030 500 HA ILE 66 HA ILE 66 -21.482 0.990 -21.064 501 HB ILE 66 HB ILE 66 -20.779 3.780 -21.980 502 HG12 ILE 66 1HG1 ILE 66 -20.880 1.231 -23.605 503 HG13 ILE 66 2HG1 ILE 66 -22.107 2.492 -23.655 504 HG21 ILE 66 1HG2 ILE 66 -18.837 1.766 -22.581 505 HG22 ILE 66 2HG2 ILE 66 -18.664 3.225 -21.606 506 HG23 ILE 66 3HG2 ILE 66 -19.219 1.727 -20.860 507 HD11 ILE 66 1HD1 ILE 66 -19.371 2.455 -24.783 508 HD12 ILE 66 2HD1 ILE 66 -20.870 3.101 -25.452 509 HD13 ILE 66 3HD1 ILE 66 -20.002 3.997 -24.204 510 H LEU 67 H LEU 67 -22.017 4.396 -20.151 511 HA LEU 67 HA LEU 67 -20.294 4.543 -18.002 512 HB2 LEU 67 1HB LEU 67 -23.006 5.836 -18.242 513 HB3 LEU 67 2HB LEU 67 -21.717 6.340 -17.152 514 HG LEU 67 HG LEU 67 -21.316 6.331 -20.125 515 HD11 LEU 67 1HD1 LEU 67 -23.373 7.635 -19.526 516 HD12 LEU 67 2HD1 LEU 67 -22.086 8.573 -20.281 517 HD13 LEU 67 3HD1 LEU 67 -22.345 8.674 -18.540 518 HD21 LEU 67 1HD2 LEU 67 -20.089 7.901 -17.860 519 HD22 LEU 67 2HD2 LEU 67 -19.675 8.064 -19.567 520 HD23 LEU 67 3HD2 LEU 67 -19.343 6.553 -18.719 521 H GLU 68 H GLU 68 -23.717 3.570 -17.968 522 HA GLU 68 HA GLU 68 -24.027 3.123 -15.260 523 HB2 GLU 68 1HB GLU 68 -25.741 2.951 -17.194 524 HB3 GLU 68 2HB GLU 68 -25.234 1.270 -17.295 525 HG2 GLU 68 1HG GLU 68 -25.754 1.190 -14.775 526 HG3 GLU 68 2HG GLU 68 -26.655 2.675 -15.073 527 H ALA 69 H ALA 69 -22.356 1.202 -17.636 528 HA ALA 69 HA ALA 69 -22.120 -1.114 -15.929 529 HB1 ALA 69 1HB ALA 69 -22.234 -1.348 -18.368 530 HB2 ALA 69 2HB ALA 69 -20.705 -0.481 -18.516 531 HB3 ALA 69 3HB ALA 69 -20.756 -2.047 -17.707 532 H VAL 70 H VAL 70 -19.976 1.470 -17.081 533 HA VAL 70 HA VAL 70 -17.596 0.626 -15.936 534 HB VAL 70 HB VAL 70 -18.565 3.471 -16.251 535 HG11 VAL 70 1HG1 VAL 70 -16.095 3.955 -16.366 536 HG12 VAL 70 2HG1 VAL 70 -16.706 3.495 -14.776 537 HG13 VAL 70 3HG1 VAL 70 -15.827 2.322 -15.758 538 HG21 VAL 70 1HG2 VAL 70 -18.587 2.132 -18.332 539 HG22 VAL 70 2HG2 VAL 70 -17.419 3.453 -18.377 540 HG23 VAL 70 3HG2 VAL 70 -16.869 1.800 -18.104 541 H ASP 71 H ASP 71 -20.333 2.264 -14.476 542 HA ASP 71 HA ASP 71 -19.201 3.124 -12.091 543 HB2 ASP 71 1HB ASP 71 -21.620 3.402 -13.051 544 HB3 ASP 71 2HB ASP 71 -21.957 1.944 -12.122 545 H LEU 72 H LEU 72 -19.995 -0.077 -13.151 546 HA LEU 72 HA LEU 72 -19.855 -1.234 -10.506 547 HB2 LEU 72 1HB LEU 72 -20.196 -2.331 -13.272 548 HB3 LEU 72 2HB LEU 72 -19.857 -3.399 -11.913 549 HG LEU 72 HG LEU 72 -22.133 -1.532 -11.599 550 HD11 LEU 72 1HD1 LEU 72 -22.840 -2.091 -13.697 551 HD12 LEU 72 2HD1 LEU 72 -23.489 -3.454 -12.787 552 HD13 LEU 72 3HD1 LEU 72 -21.989 -3.636 -13.696 553 HD21 LEU 72 1HD2 LEU 72 -21.107 -3.715 -10.246 554 HD22 LEU 72 2HD2 LEU 72 -22.525 -4.359 -11.074 555 HD23 LEU 72 3HD2 LEU 72 -22.688 -2.974 -9.994 556 H LEU 73 H LEU 73 -17.722 -0.627 -13.170 557 HA LEU 73 HA LEU 73 -15.709 -2.509 -12.540 558 HB2 LEU 73 1HB LEU 73 -16.006 -0.177 -14.287 559 HB3 LEU 73 2HB LEU 73 -14.359 -0.448 -13.720 560 HG LEU 73 HG LEU 73 -16.029 -2.509 -15.158 561 HD11 LEU 73 1HD1 LEU 73 -14.782 -2.015 -17.127 562 HD12 LEU 73 2HD1 LEU 73 -13.761 -0.865 -16.263 563 HD13 LEU 73 3HD1 LEU 73 -15.465 -0.500 -16.535 564 HD21 LEU 73 1HD2 LEU 73 -14.486 -3.878 -14.299 565 HD22 LEU 73 2HD2 LEU 73 -13.449 -2.543 -13.795 566 HD23 LEU 73 3HD2 LEU 73 -13.377 -3.138 -15.455 567 H CYS 74 H CYS 74 -16.194 0.878 -11.622 568 HA CYS 74 HA CYS 74 -13.775 1.057 -10.119 569 HB2 CYS 74 1HB CYS 74 -15.737 2.847 -11.021 570 HB3 CYS 74 2HB CYS 74 -15.802 2.937 -9.265 571 HG CYS 74 HG CYS 74 -13.904 4.648 -9.148 572 H ALA 75 H ALA 75 -17.074 0.149 -9.404 573 HA ALA 75 HA ALA 75 -16.904 0.302 -6.582 574 HB1 ALA 75 1HB ALA 75 -18.837 -0.518 -8.535 575 HB2 ALA 75 2HB ALA 75 -18.759 -1.701 -7.229 576 HB3 ALA 75 3HB ALA 75 -19.083 -0.006 -6.865 577 H LEU 76 H LEU 76 -16.537 -2.419 -8.845 578 HA LEU 76 HA LEU 76 -16.029 -4.397 -6.926 579 HB2 LEU 76 1HB LEU 76 -15.595 -4.085 -9.834 580 HB3 LEU 76 2HB LEU 76 -14.632 -5.319 -9.024 581 HG LEU 76 HG LEU 76 -17.557 -5.338 -8.526 582 HD11 LEU 76 1HD1 LEU 76 -16.592 -6.678 -10.998 583 HD12 LEU 76 2HD1 LEU 76 -16.978 -4.959 -11.067 584 HD13 LEU 76 3HD1 LEU 76 -18.209 -6.120 -10.569 585 HD21 LEU 76 1HD2 LEU 76 -17.150 -7.774 -8.640 586 HD22 LEU 76 2HD2 LEU 76 -16.146 -6.963 -7.437 587 HD23 LEU 76 3HD2 LEU 76 -15.451 -7.447 -8.985 588 H ASN 77 H ASN 77 -13.822 -2.268 -8.703 589 HA ASN 77 HA ASN 77 -11.421 -3.357 -7.731 590 HB2 ASN 77 1HB ASN 77 -12.095 -1.372 -9.515 591 HB3 ASN 77 2HB ASN 77 -11.362 -0.462 -8.197 592 HD21 ASN 77 2HD2 ASN 77 -10.857 -2.925 -10.609 593 HD22 ASN 77 1HD2 ASN 77 -9.130 -2.893 -10.564 594 H SER 78 H SER 78 -13.619 -0.958 -6.414 595 HA SER 78 HA SER 78 -12.031 0.160 -4.432 596 HB2 SER 78 1HB SER 78 -14.819 0.088 -5.081 597 HB3 SER 78 2HB SER 78 -14.636 -0.167 -3.346 598 HG SER 78 HG SER 78 -14.122 1.852 -3.151 599 H GLY 79 H GLY 79 -11.695 -0.306 -2.241 600 HA2 GLY 79 1HA GLY 79 -12.122 -1.731 -0.312 601 HA3 GLY 79 2HA GLY 79 -12.340 -3.070 -1.428 602 HA PRO 80 HA PRO 80 -7.590 -2.096 -1.272 603 HB2 PRO 80 1HB PRO 80 -6.781 -0.498 0.769 604 HB3 PRO 80 2HB PRO 80 -7.223 0.128 -0.824 605 HG2 PRO 80 1HG PRO 80 -8.848 0.024 1.688 606 HG3 PRO 80 2HG PRO 80 -8.692 1.340 0.510 607 HD2 PRO 80 1HD PRO 80 -10.816 -0.339 0.546 608 HD3 PRO 80 2HD PRO 80 -10.189 0.376 -0.953 609 H SER 81 H SER 81 -9.337 -2.144 1.810 610 HA SER 81 HA SER 81 -9.144 -3.445 3.668 611 HB2 SER 81 1HB SER 81 -7.772 -5.542 2.009 612 HB3 SER 81 2HB SER 81 -8.938 -5.748 3.317 613 HG SER 81 HG SER 81 -10.536 -5.469 1.952 614 H SER 82 H SER 82 -7.499 -1.825 4.329 615 HA SER 82 HA SER 82 -4.855 -3.096 4.625 616 HB2 SER 82 1HB SER 82 -4.672 -1.150 3.170 617 HB3 SER 82 2HB SER 82 -5.494 -0.147 4.365 618 HG SER 82 HG SER 82 -3.736 -0.151 5.610 619 H GLY 83 H GLY 83 -5.934 -4.044 6.554 620 HA2 GLY 83 1HA GLY 83 -5.972 -4.159 8.855 621 HA3 GLY 83 2HA GLY 83 -5.180 -2.590 8.891 Start of MODEL 9 1 H1 GLY 1 H GLY 1 0.015 -2.177 -3.055 2 HA2 GLY 1 1HA GLY 1 -2.040 -2.124 -1.924 3 HA3 GLY 1 2HA GLY 1 -2.703 -3.223 -3.124 4 H SER 2 H SER 2 -3.556 -4.075 -0.961 5 HA SER 2 HA SER 2 -1.638 -6.045 0.101 6 HB2 SER 2 1HB SER 2 -2.477 -4.209 1.689 7 HB3 SER 2 2HB SER 2 -4.036 -5.031 1.623 8 HG SER 2 HG SER 2 -1.638 -5.838 2.791 9 H SER 3 H SER 3 -4.964 -5.425 -0.874 10 HA SER 3 HA SER 3 -5.424 -8.335 -0.950 11 HB2 SER 3 1HB SER 3 -7.106 -6.094 -0.048 12 HB3 SER 3 2HB SER 3 -7.932 -7.249 -1.094 13 HG SER 3 HG SER 3 -7.903 -7.683 1.263 14 H GLY 4 H GLY 4 -5.759 -5.285 -2.662 15 HA2 GLY 4 1HA GLY 4 -5.239 -5.717 -5.140 16 HA3 GLY 4 2HA GLY 4 -6.661 -6.746 -5.055 17 H SER 5 H SER 5 -5.505 -3.617 -5.599 18 HA SER 5 HA SER 5 -8.143 -2.665 -6.225 19 HB2 SER 5 1HB SER 5 -6.957 -2.011 -3.661 20 HB3 SER 5 2HB SER 5 -7.241 -0.558 -4.619 21 HG SER 5 HG SER 5 -9.408 -1.231 -4.860 22 H SER 6 H SER 6 -8.076 -0.450 -7.159 23 HA SER 6 HA SER 6 -7.240 1.053 -8.647 24 HB2 SER 6 1HB SER 6 -5.651 1.388 -6.617 25 HB3 SER 6 2HB SER 6 -4.466 0.535 -7.606 26 HG SER 6 HG SER 6 -4.381 2.820 -7.878 27 H GLY 7 H GLY 7 -7.725 -0.333 -10.404 28 HA2 GLY 7 1HA GLY 7 -5.310 -1.353 -11.737 29 HA3 GLY 7 2HA GLY 7 -6.711 -2.403 -11.583 30 H VAL 8 H VAL 8 -8.762 -0.598 -12.077 31 HA VAL 8 HA VAL 8 -8.876 -0.596 -14.869 32 HB VAL 8 HB VAL 8 -10.474 1.213 -13.056 33 HG11 VAL 8 1HG1 VAL 8 -10.950 0.094 -15.811 34 HG12 VAL 8 2HG1 VAL 8 -12.209 0.856 -14.836 35 HG13 VAL 8 3HG1 VAL 8 -10.799 1.787 -15.342 36 HG21 VAL 8 1HG2 VAL 8 -12.145 -0.706 -13.157 37 HG22 VAL 8 2HG2 VAL 8 -10.796 -1.707 -13.694 38 HG23 VAL 8 3HG2 VAL 8 -10.740 -0.927 -12.114 39 H SER 9 H SER 9 -7.550 1.709 -12.656 40 HA SER 9 HA SER 9 -7.590 3.964 -14.394 41 HB2 SER 9 1HB SER 9 -5.905 4.899 -12.787 42 HB3 SER 9 2HB SER 9 -7.384 4.325 -12.017 43 HG SER 9 HG SER 9 -4.820 3.157 -12.033 44 H LYS 10 H LYS 10 -5.488 1.235 -13.996 45 HA LYS 10 HA LYS 10 -3.540 2.431 -15.850 46 HB2 LYS 10 1HB LYS 10 -3.170 -0.016 -14.118 47 HB3 LYS 10 2HB LYS 10 -1.931 0.827 -15.038 48 HG2 LYS 10 1HG LYS 10 -3.155 2.704 -13.301 49 HG3 LYS 10 2HG LYS 10 -2.757 1.263 -12.364 50 HD2 LYS 10 1HD LYS 10 -0.725 2.227 -12.215 51 HD3 LYS 10 2HD LYS 10 -0.499 1.549 -13.829 52 HE2 LYS 10 1HE LYS 10 -1.861 4.111 -13.893 53 HE3 LYS 10 2HE LYS 10 -0.286 4.216 -13.109 54 HZ1 LYS 10 1HZ LYS 10 -0.606 2.847 -15.705 55 HZ2 LYS 10 2HZ LYS 10 0.797 3.494 -15.015 56 HZ3 LYS 10 3HZ LYS 10 -0.398 4.525 -15.625 57 H TRP 11 H TRP 11 -6.176 1.132 -16.468 58 HA TRP 11 HA TRP 11 -5.606 -1.381 -17.696 59 HB2 TRP 11 1HB TRP 11 -7.921 0.414 -17.439 60 HB3 TRP 11 2HB TRP 11 -7.875 -0.495 -18.947 61 HD1 TRP 11 HD1 TRP 11 -6.529 -2.096 -15.758 62 HE1 TRP 11 HE1 TRP 11 -8.081 -4.036 -15.085 63 HE3 TRP 11 HE3 TRP 11 -10.312 -1.306 -19.104 64 HZ2 TRP 11 HZ2 TRP 11 -10.578 -5.092 -15.869 65 HZ3 TRP 11 HZ3 TRP 11 -12.246 -2.827 -19.078 66 HH2 TRP 11 HH2 TRP 11 -12.375 -4.680 -17.494 67 H SER 12 H SER 12 -4.722 -1.783 -19.613 68 HA SER 12 HA SER 12 -3.604 0.215 -21.221 69 HB2 SER 12 1HB SER 12 -3.975 -2.075 -22.841 70 HB3 SER 12 2HB SER 12 -2.519 -1.596 -21.968 71 HG SER 12 HG SER 12 -2.988 -3.546 -21.144 72 HA PRO 13 HA PRO 13 -6.763 1.546 -23.957 73 HB2 PRO 13 1HB PRO 13 -5.452 1.728 -26.327 74 HB3 PRO 13 2HB PRO 13 -5.185 2.856 -24.993 75 HG2 PRO 13 1HG PRO 13 -3.563 0.479 -25.816 76 HG3 PRO 13 2HG PRO 13 -3.014 2.089 -25.315 77 HD2 PRO 13 1HD PRO 13 -2.998 -0.041 -23.644 78 HD3 PRO 13 2HD PRO 13 -3.273 1.618 -23.074 79 H SER 14 H SER 14 -5.103 -1.416 -24.634 80 HA SER 14 HA SER 14 -7.025 -2.188 -26.691 81 HB2 SER 14 1HB SER 14 -4.545 -2.662 -26.912 82 HB3 SER 14 2HB SER 14 -4.734 -3.837 -25.611 83 HG SER 14 HG SER 14 -5.785 -5.146 -26.922 84 H GLN 15 H GLN 15 -6.302 -2.722 -23.347 85 HA GLN 15 HA GLN 15 -7.696 -5.155 -22.989 86 HB2 GLN 15 1HB GLN 15 -6.729 -2.980 -21.185 87 HB3 GLN 15 2HB GLN 15 -7.865 -4.162 -20.547 88 HG2 GLN 15 1HG GLN 15 -5.461 -5.141 -21.992 89 HG3 GLN 15 2HG GLN 15 -5.270 -4.508 -20.358 90 HE21 GLN 15 2HE2 GLN 15 -6.553 -7.049 -22.317 91 HE22 GLN 15 1HE2 GLN 15 -6.988 -8.112 -21.027 92 H VAL 16 H VAL 16 -8.670 -1.768 -22.551 93 HA VAL 16 HA VAL 16 -11.218 -2.125 -21.556 94 HB VAL 16 HB VAL 16 -10.329 -0.024 -23.537 95 HG11 VAL 16 1HG1 VAL 16 -12.185 1.267 -22.248 96 HG12 VAL 16 2HG1 VAL 16 -12.631 0.170 -23.556 97 HG13 VAL 16 3HG1 VAL 16 -12.793 -0.346 -21.878 98 HG21 VAL 16 1HG2 VAL 16 -10.471 0.166 -20.534 99 HG22 VAL 16 2HG2 VAL 16 -8.994 -0.212 -21.421 100 HG23 VAL 16 3HG2 VAL 16 -9.792 1.343 -21.658 101 H VAL 17 H VAL 17 -10.047 -2.575 -24.814 102 HA VAL 17 HA VAL 17 -12.512 -2.574 -26.171 103 HB VAL 17 HB VAL 17 -10.087 -4.216 -26.904 104 HG11 VAL 17 1HG1 VAL 17 -12.411 -4.444 -28.069 105 HG12 VAL 17 2HG1 VAL 17 -11.957 -2.923 -28.839 106 HG13 VAL 17 3HG1 VAL 17 -10.942 -4.351 -29.039 107 HG21 VAL 17 1HG2 VAL 17 -9.298 -1.998 -26.556 108 HG22 VAL 17 2HG2 VAL 17 -9.476 -2.214 -28.297 109 HG23 VAL 17 3HG2 VAL 17 -10.687 -1.305 -27.393 110 H ASP 18 H ASP 18 -10.724 -5.137 -24.525 111 HA ASP 18 HA ASP 18 -12.399 -7.270 -25.332 112 HB2 ASP 18 1HB ASP 18 -10.076 -7.487 -24.380 113 HB3 ASP 18 2HB ASP 18 -10.760 -7.125 -22.797 114 H TRP 19 H TRP 19 -12.654 -4.856 -22.859 115 HA TRP 19 HA TRP 19 -14.542 -6.197 -21.212 116 HB2 TRP 19 1HB TRP 19 -13.292 -4.369 -20.281 117 HB3 TRP 19 2HB TRP 19 -13.861 -3.271 -21.535 118 HD1 TRP 19 HD1 TRP 19 -15.535 -5.453 -18.779 119 HE1 TRP 19 HE1 TRP 19 -17.441 -4.072 -17.738 120 HE3 TRP 19 HE3 TRP 19 -15.128 -1.230 -21.631 121 HZ2 TRP 19 HZ2 TRP 19 -18.617 -1.529 -18.081 122 HZ3 TRP 19 HZ3 TRP 19 -16.682 0.631 -21.211 123 HH2 TRP 19 HH2 TRP 19 -18.390 0.482 -19.473 124 H MET 20 H MET 20 -14.844 -3.855 -23.857 125 HA MET 20 HA MET 20 -17.633 -3.539 -23.730 126 HB2 MET 20 1HB MET 20 -15.847 -3.339 -26.162 127 HB3 MET 20 2HB MET 20 -17.462 -2.660 -26.004 128 HG2 MET 20 1HG MET 20 -15.526 -1.838 -23.948 129 HG3 MET 20 2HG MET 20 -15.195 -1.280 -25.586 130 HE1 MET 20 1HE MET 20 -18.729 0.008 -26.501 131 HE2 MET 20 2HE MET 20 -17.234 0.911 -26.748 132 HE3 MET 20 3HE MET 20 -17.271 -0.828 -27.037 133 H LYS 21 H LYS 21 -15.668 -6.103 -24.929 134 HA LYS 21 HA LYS 21 -17.496 -7.243 -26.766 135 HB2 LYS 21 1HB LYS 21 -15.260 -8.512 -25.175 136 HB3 LYS 21 2HB LYS 21 -16.126 -9.305 -26.484 137 HG2 LYS 21 1HG LYS 21 -15.382 -7.309 -27.916 138 HG3 LYS 21 2HG LYS 21 -14.230 -6.992 -26.617 139 HD2 LYS 21 1HD LYS 21 -13.141 -9.056 -26.940 140 HD3 LYS 21 2HD LYS 21 -14.462 -9.690 -27.924 141 HE2 LYS 21 1HE LYS 21 -13.791 -8.562 -29.793 142 HE3 LYS 21 2HE LYS 21 -13.081 -7.238 -28.871 143 HZ1 LYS 21 1HZ LYS 21 -11.155 -8.450 -28.471 144 HZ2 LYS 21 2HZ LYS 21 -11.516 -8.822 -30.081 145 HZ3 LYS 21 3HZ LYS 21 -11.873 -9.933 -28.856 146 H GLY 22 H GLY 22 -17.554 -7.010 -23.394 147 HA2 GLY 22 1HA GLY 22 -19.455 -9.266 -23.220 148 HA3 GLY 22 2HA GLY 22 -18.446 -8.735 -21.883 149 H LEU 23 H LEU 23 -19.875 -6.333 -23.909 150 HA LEU 23 HA LEU 23 -21.781 -5.703 -21.754 151 HB2 LEU 23 1HB LEU 23 -20.615 -3.790 -23.765 152 HB3 LEU 23 2HB LEU 23 -21.592 -3.390 -22.354 153 HG LEU 23 HG LEU 23 -18.765 -4.442 -22.354 154 HD11 LEU 23 1HD1 LEU 23 -18.244 -2.269 -21.354 155 HD12 LEU 23 2HD1 LEU 23 -19.928 -1.781 -21.543 156 HD13 LEU 23 3HD1 LEU 23 -18.937 -2.097 -22.967 157 HD21 LEU 23 1HD2 LEU 23 -19.487 -3.537 -19.807 158 HD22 LEU 23 2HD2 LEU 23 -19.165 -5.198 -20.305 159 HD23 LEU 23 3HD2 LEU 23 -20.813 -4.570 -20.340 160 H ASP 24 H ASP 24 -23.369 -3.877 -22.983 161 HA ASP 24 HA ASP 24 -25.278 -5.384 -24.287 162 HB2 ASP 24 1HB ASP 24 -25.104 -2.784 -23.412 163 HB3 ASP 24 2HB ASP 24 -25.225 -2.582 -25.157 164 H ASP 25 H ASP 25 -25.905 -5.646 -26.437 165 HA ASP 25 HA ASP 25 -23.817 -5.982 -28.300 166 HB2 ASP 25 1HB ASP 25 -26.398 -6.879 -28.095 167 HB3 ASP 25 2HB ASP 25 -26.517 -5.745 -29.437 168 H CYS 26 H CYS 26 -25.893 -3.309 -27.575 169 HA CYS 26 HA CYS 26 -25.598 -1.922 -30.041 170 HB2 CYS 26 1HB CYS 26 -26.232 -0.777 -27.314 171 HB3 CYS 26 2HB CYS 26 -26.541 -0.013 -28.868 172 HG CYS 26 HG CYS 26 -28.337 -2.298 -27.220 173 H LEU 27 H LEU 27 -23.603 -2.311 -27.263 174 HA LEU 27 HA LEU 27 -21.939 -0.013 -27.956 175 HB2 LEU 27 1HB LEU 27 -21.384 -1.951 -25.739 176 HB3 LEU 27 2HB LEU 27 -20.894 -0.264 -25.881 177 HG LEU 27 HG LEU 27 -23.715 -1.210 -25.382 178 HD11 LEU 27 1HD1 LEU 27 -23.113 -1.460 -23.263 179 HD12 LEU 27 2HD1 LEU 27 -22.746 0.264 -23.211 180 HD13 LEU 27 3HD1 LEU 27 -21.478 -0.896 -23.608 181 HD21 LEU 27 1HD2 LEU 27 -23.953 1.245 -24.731 182 HD22 LEU 27 2HD2 LEU 27 -23.858 0.871 -26.452 183 HD23 LEU 27 3HD2 LEU 27 -22.443 1.501 -25.606 184 H GLN 28 H GLN 28 -22.190 -2.568 -29.551 185 HA GLN 28 HA GLN 28 -19.493 -3.656 -29.359 186 HB2 GLN 28 1HB GLN 28 -21.815 -4.418 -31.138 187 HB3 GLN 28 2HB GLN 28 -20.268 -5.253 -31.087 188 HG2 GLN 28 1HG GLN 28 -22.150 -4.977 -28.755 189 HG3 GLN 28 2HG GLN 28 -22.036 -6.389 -29.804 190 HE21 GLN 28 2HE2 GLN 28 -21.384 -5.649 -26.867 191 HE22 GLN 28 1HE2 GLN 28 -19.844 -6.392 -26.619 192 H GLN 29 H GLN 29 -21.567 -2.072 -31.775 193 HA GLN 29 HA GLN 29 -19.729 -1.930 -33.855 194 HB2 GLN 29 1HB GLN 29 -21.069 0.005 -34.659 195 HB3 GLN 29 2HB GLN 29 -22.048 -1.390 -34.223 196 HG2 GLN 29 1HG GLN 29 -22.264 -0.199 -31.930 197 HG3 GLN 29 2HG GLN 29 -21.768 1.233 -32.829 198 HE21 GLN 29 2HE2 GLN 29 -24.337 -0.724 -31.934 199 HE22 GLN 29 1HE2 GLN 29 -25.537 -0.078 -32.996 200 H TYR 30 H TYR 30 -19.920 -0.107 -30.917 201 HA TYR 30 HA TYR 30 -18.261 2.061 -31.791 202 HB2 TYR 30 1HB TYR 30 -18.958 1.174 -28.984 203 HB3 TYR 30 2HB TYR 30 -18.234 2.715 -29.428 204 HD1 TYR 30 HD2 TYR 30 -19.846 3.424 -31.810 205 HD2 TYR 30 HD1 TYR 30 -21.027 1.762 -28.076 206 HE1 TYR 30 HE2 TYR 30 -22.086 4.398 -32.092 207 HE2 TYR 30 HE1 TYR 30 -23.271 2.730 -28.348 208 HH TYR 30 HH TYR 30 -24.297 4.183 -31.325 209 H ILE 31 H ILE 31 -17.737 -1.097 -30.478 210 HA ILE 31 HA ILE 31 -15.260 -0.881 -29.283 211 HB ILE 31 HB ILE 31 -16.201 -3.150 -31.042 212 HG12 ILE 31 1HG1 ILE 31 -16.488 -2.720 -28.060 213 HG13 ILE 31 2HG1 ILE 31 -17.789 -2.616 -29.241 214 HG21 ILE 31 1HG2 ILE 31 -14.082 -3.048 -28.899 215 HG22 ILE 31 2HG2 ILE 31 -14.660 -4.517 -29.684 216 HG23 ILE 31 3HG2 ILE 31 -13.823 -3.285 -30.628 217 HD11 ILE 31 1HD1 ILE 31 -18.010 -4.720 -28.247 218 HD12 ILE 31 2HD1 ILE 31 -17.253 -5.029 -29.810 219 HD13 ILE 31 3HD1 ILE 31 -16.279 -5.041 -28.340 220 H LYS 32 H LYS 32 -15.987 -1.337 -32.729 221 HA LYS 32 HA LYS 32 -13.390 -1.570 -33.687 222 HB2 LYS 32 1HB LYS 32 -15.822 -0.327 -34.979 223 HB3 LYS 32 2HB LYS 32 -14.324 -0.667 -35.835 224 HG2 LYS 32 1HG LYS 32 -14.846 -3.080 -34.704 225 HG3 LYS 32 2HG LYS 32 -16.476 -2.472 -35.005 226 HD2 LYS 32 1HD LYS 32 -14.917 -1.897 -37.297 227 HD3 LYS 32 2HD LYS 32 -14.605 -3.577 -36.855 228 HE2 LYS 32 1HE LYS 32 -17.407 -2.530 -36.945 229 HE3 LYS 32 2HE LYS 32 -16.591 -3.010 -38.431 230 HZ1 LYS 32 1HZ LYS 32 -17.187 -4.704 -36.073 231 HZ2 LYS 32 2HZ LYS 32 -16.150 -5.188 -37.318 232 HZ3 LYS 32 3HZ LYS 32 -17.780 -4.880 -37.647 233 H ASN 33 H ASN 33 -15.120 1.228 -32.573 234 HA ASN 33 HA ASN 33 -13.231 3.104 -33.708 235 HB2 ASN 33 1HB ASN 33 -15.456 3.582 -31.713 236 HB3 ASN 33 2HB ASN 33 -14.573 4.818 -32.604 237 HD21 ASN 33 2HD2 ASN 33 -17.347 4.561 -32.647 238 HD22 ASN 33 1HD2 ASN 33 -17.834 4.123 -34.246 239 H PHE 34 H PHE 34 -13.813 1.496 -30.667 240 HA PHE 34 HA PHE 34 -12.104 3.157 -29.099 241 HB2 PHE 34 1HB PHE 34 -13.528 0.571 -28.706 242 HB3 PHE 34 2HB PHE 34 -12.180 0.929 -27.632 243 HD1 PHE 34 HD2 PHE 34 -15.167 2.679 -29.033 244 HD2 PHE 34 HD1 PHE 34 -12.695 1.941 -25.647 245 HE1 PHE 34 HE2 PHE 34 -16.644 4.081 -27.653 246 HE2 PHE 34 HE1 PHE 34 -14.170 3.340 -24.262 247 HZ PHE 34 HZ PHE 34 -16.147 4.414 -25.264 248 H GLU 35 H GLU 35 -11.627 0.429 -31.178 249 HA GLU 35 HA GLU 35 -9.085 -0.355 -30.142 250 HB2 GLU 35 1HB GLU 35 -10.901 -1.276 -32.141 251 HB3 GLU 35 2HB GLU 35 -9.318 -1.089 -32.882 252 HG2 GLU 35 1HG GLU 35 -9.821 -2.631 -30.350 253 HG3 GLU 35 2HG GLU 35 -9.770 -3.351 -31.958 254 H ARG 36 H ARG 36 -10.173 1.796 -32.710 255 HA ARG 36 HA ARG 36 -7.495 2.328 -33.637 256 HB2 ARG 36 1HB ARG 36 -9.759 2.414 -34.959 257 HB3 ARG 36 2HB ARG 36 -9.846 4.050 -34.321 258 HG2 ARG 36 1HG ARG 36 -7.248 3.697 -35.372 259 HG3 ARG 36 2HG ARG 36 -8.394 3.078 -36.563 260 HD2 ARG 36 1HD ARG 36 -9.506 5.137 -36.726 261 HD3 ARG 36 2HD ARG 36 -8.787 5.739 -35.232 262 HE ARG 36 HE ARG 36 -6.815 5.188 -37.214 263 HH11 ARG 36 1HH1 ARG 36 -9.199 7.518 -36.211 264 HH12 ARG 36 2HH1 ARG 36 -8.391 8.859 -36.953 265 HH21 ARG 36 1HH2 ARG 36 -5.741 6.945 -38.195 266 HH22 ARG 36 2HH2 ARG 36 -6.424 8.532 -38.081 267 H GLU 37 H GLU 37 -9.792 3.764 -31.439 268 HA GLU 37 HA GLU 37 -8.322 6.240 -31.197 269 HB2 GLU 37 1HB GLU 37 -10.837 5.121 -30.091 270 HB3 GLU 37 2HB GLU 37 -10.011 6.321 -29.107 271 HG2 GLU 37 1HG GLU 37 -10.349 6.992 -31.956 272 HG3 GLU 37 2HG GLU 37 -11.820 6.925 -30.988 273 H LYS 38 H LYS 38 -8.302 3.134 -29.736 274 HA LYS 38 HA LYS 38 -7.080 2.206 -28.057 275 HB2 LYS 38 1HB LYS 38 -5.391 4.697 -28.355 276 HB3 LYS 38 2HB LYS 38 -4.906 3.212 -27.546 277 HG2 LYS 38 1HG LYS 38 -5.767 3.067 -30.388 278 HG3 LYS 38 2HG LYS 38 -4.173 3.725 -30.011 279 HD2 LYS 38 1HD LYS 38 -3.596 1.687 -28.812 280 HD3 LYS 38 2HD LYS 38 -5.207 1.034 -29.117 281 HE2 LYS 38 1HE LYS 38 -4.801 0.850 -31.434 282 HE3 LYS 38 2HE LYS 38 -3.361 1.862 -31.340 283 HZ1 LYS 38 1HZ LYS 38 -2.939 -0.279 -29.634 284 HZ2 LYS 38 2HZ LYS 38 -2.182 0.018 -31.117 285 HZ3 LYS 38 3HZ LYS 38 -3.577 -0.938 -31.055 286 H ILE 39 H ILE 39 -9.322 3.400 -27.160 287 HA ILE 39 HA ILE 39 -9.014 5.379 -25.196 288 HB ILE 39 HB ILE 39 -11.074 3.172 -25.300 289 HG12 ILE 39 1HG1 ILE 39 -11.016 4.543 -27.346 290 HG13 ILE 39 2HG1 ILE 39 -12.492 4.818 -26.426 291 HG21 ILE 39 1HG2 ILE 39 -12.274 5.320 -24.132 292 HG22 ILE 39 2HG2 ILE 39 -11.583 3.951 -23.262 293 HG23 ILE 39 3HG2 ILE 39 -10.638 5.423 -23.481 294 HD11 ILE 39 1HD1 ILE 39 -10.074 6.608 -26.384 295 HD12 ILE 39 2HD1 ILE 39 -11.534 6.884 -27.336 296 HD13 ILE 39 3HD1 ILE 39 -11.614 6.895 -25.574 297 H SER 40 H SER 40 -7.690 5.238 -23.510 298 HA SER 40 HA SER 40 -7.044 2.692 -22.305 299 HB2 SER 40 1HB SER 40 -6.087 4.968 -20.804 300 HB3 SER 40 2HB SER 40 -5.166 3.745 -21.679 301 HG SER 40 HG SER 40 -4.816 5.182 -23.155 302 H GLY 41 H GLY 41 -7.086 2.485 -19.884 303 HA2 GLY 41 1HA GLY 41 -9.733 2.690 -18.948 304 HA3 GLY 41 2HA GLY 41 -8.331 2.292 -17.966 305 H ASP 42 H ASP 42 -6.858 4.635 -18.210 306 HA ASP 42 HA ASP 42 -7.875 6.219 -16.191 307 HB2 ASP 42 1HB ASP 42 -5.575 6.439 -16.671 308 HB3 ASP 42 2HB ASP 42 -5.878 6.797 -18.369 309 H GLN 43 H GLN 43 -8.507 6.342 -19.616 310 HA GLN 43 HA GLN 43 -9.919 8.879 -19.391 311 HB2 GLN 43 1HB GLN 43 -8.797 7.274 -21.566 312 HB3 GLN 43 2HB GLN 43 -10.378 7.945 -21.942 313 HG2 GLN 43 1HG GLN 43 -8.802 9.977 -20.730 314 HG3 GLN 43 2HG GLN 43 -7.861 9.220 -22.014 315 HE21 GLN 43 2HE2 GLN 43 -8.978 8.989 -24.117 316 HE22 GLN 43 1HE2 GLN 43 -10.030 10.264 -24.618 317 H LEU 44 H LEU 44 -10.562 5.466 -19.635 318 HA LEU 44 HA LEU 44 -13.307 5.675 -20.351 319 HB2 LEU 44 1HB LEU 44 -12.126 3.632 -20.764 320 HB3 LEU 44 2HB LEU 44 -11.718 3.468 -19.057 321 HG LEU 44 HG LEU 44 -14.266 3.295 -18.691 322 HD11 LEU 44 1HD1 LEU 44 -15.063 2.023 -20.938 323 HD12 LEU 44 2HD1 LEU 44 -14.057 3.299 -21.622 324 HD13 LEU 44 3HD1 LEU 44 -15.415 3.713 -20.575 325 HD21 LEU 44 1HD2 LEU 44 -14.051 1.027 -18.615 326 HD22 LEU 44 2HD2 LEU 44 -12.350 1.470 -18.770 327 HD23 LEU 44 3HD2 LEU 44 -13.256 0.936 -20.187 328 H LEU 45 H LEU 45 -11.585 5.395 -17.277 329 HA LEU 45 HA LEU 45 -13.834 5.092 -15.619 330 HB2 LEU 45 1HB LEU 45 -11.088 6.207 -15.116 331 HB3 LEU 45 2HB LEU 45 -12.296 6.047 -13.843 332 HG LEU 45 HG LEU 45 -11.323 3.711 -15.475 333 HD11 LEU 45 1HD1 LEU 45 -10.305 4.640 -12.794 334 HD12 LEU 45 2HD1 LEU 45 -9.426 4.759 -14.318 335 HD13 LEU 45 3HD1 LEU 45 -9.823 3.175 -13.651 336 HD21 LEU 45 1HD2 LEU 45 -12.068 2.730 -13.093 337 HD22 LEU 45 2HD2 LEU 45 -13.170 2.893 -14.460 338 HD23 LEU 45 3HD2 LEU 45 -13.151 4.118 -13.192 339 H ARG 46 H ARG 46 -12.235 7.940 -16.922 340 HA ARG 46 HA ARG 46 -14.266 9.631 -15.626 341 HB2 ARG 46 1HB ARG 46 -12.744 11.491 -15.884 342 HB3 ARG 46 2HB ARG 46 -11.906 10.167 -15.087 343 HG2 ARG 46 1HG ARG 46 -11.046 9.553 -17.417 344 HG3 ARG 46 2HG ARG 46 -11.593 11.162 -17.894 345 HD2 ARG 46 1HD ARG 46 -10.222 11.774 -15.660 346 HD3 ARG 46 2HD ARG 46 -9.325 10.351 -16.188 347 HE ARG 46 HE ARG 46 -9.683 12.067 -18.379 348 HH11 ARG 46 1HH1 ARG 46 -7.955 11.903 -15.361 349 HH12 ARG 46 2HH1 ARG 46 -6.647 12.899 -15.906 350 HH21 ARG 46 1HH2 ARG 46 -7.966 13.380 -19.108 351 HH22 ARG 46 2HH2 ARG 46 -6.655 13.740 -18.038 352 H ILE 47 H ILE 47 -14.758 8.081 -18.008 353 HA ILE 47 HA ILE 47 -14.635 9.844 -20.272 354 HB ILE 47 HB ILE 47 -14.598 7.360 -20.482 355 HG12 ILE 47 1HG1 ILE 47 -16.855 7.674 -22.142 356 HG13 ILE 47 2HG1 ILE 47 -16.112 9.265 -22.027 357 HG21 ILE 47 1HG2 ILE 47 -17.562 7.437 -20.009 358 HG22 ILE 47 2HG2 ILE 47 -16.502 6.034 -20.136 359 HG23 ILE 47 3HG2 ILE 47 -16.416 7.078 -18.717 360 HD11 ILE 47 1HD1 ILE 47 -14.962 8.450 -23.797 361 HD12 ILE 47 2HD1 ILE 47 -13.922 7.854 -22.503 362 HD13 ILE 47 3HD1 ILE 47 -15.096 6.776 -23.258 363 H THR 48 H THR 48 -16.170 11.177 -21.060 364 HA THR 48 HA THR 48 -18.743 11.286 -19.625 365 HB THR 48 HB THR 48 -17.373 13.216 -19.019 366 HG1 THR 48 HG1 THR 48 -18.962 14.695 -19.403 367 HG21 THR 48 1HG2 THR 48 -16.497 14.756 -20.572 368 HG22 THR 48 2HG2 THR 48 -17.438 14.078 -21.901 369 HG23 THR 48 3HG2 THR 48 -16.085 13.171 -21.225 370 H HIS 49 H HIS 49 -20.488 12.372 -20.899 371 HA HIS 49 HA HIS 49 -21.006 11.054 -23.269 372 HB2 HIS 49 1HB HIS 49 -22.140 13.442 -21.915 373 HB3 HIS 49 2HB HIS 49 -22.556 13.218 -23.611 374 HD1 HIS 49 HD1 HIS 49 -22.576 11.107 -20.439 375 HD2 HIS 49 HD2 HIS 49 -24.745 11.675 -23.937 376 HE1 HIS 49 HE1 HIS 49 -24.568 9.584 -20.249 377 H GLN 50 H GLN 50 -19.417 14.149 -22.755 378 HA GLN 50 HA GLN 50 -19.388 15.022 -25.429 379 HB2 GLN 50 1HB GLN 50 -18.274 15.862 -22.924 380 HB3 GLN 50 2HB GLN 50 -17.029 15.939 -24.163 381 HG2 GLN 50 1HG GLN 50 -17.862 17.873 -24.824 382 HG3 GLN 50 2HG GLN 50 -19.337 17.039 -25.312 383 HE21 GLN 50 2HE2 GLN 50 -21.051 16.866 -23.762 384 HE22 GLN 50 1HE2 GLN 50 -21.223 18.062 -22.527 385 H GLU 51 H GLU 51 -17.265 12.889 -23.618 386 HA GLU 51 HA GLU 51 -15.266 12.748 -25.669 387 HB2 GLU 51 1HB GLU 51 -15.775 11.062 -23.216 388 HB3 GLU 51 2HB GLU 51 -14.409 10.821 -24.297 389 HG2 GLU 51 1HG GLU 51 -14.881 13.505 -23.087 390 HG3 GLU 51 2HG GLU 51 -14.134 12.226 -22.131 391 H LEU 52 H LEU 52 -17.813 10.553 -24.510 392 HA LEU 52 HA LEU 52 -17.381 8.416 -26.200 393 HB2 LEU 52 1HB LEU 52 -19.803 9.549 -24.886 394 HB3 LEU 52 2HB LEU 52 -20.002 8.253 -26.063 395 HG LEU 52 HG LEU 52 -18.232 8.021 -23.637 396 HD11 LEU 52 1HD1 LEU 52 -20.022 7.762 -22.359 397 HD12 LEU 52 2HD1 LEU 52 -20.571 6.444 -23.394 398 HD13 LEU 52 3HD1 LEU 52 -21.072 8.100 -23.736 399 HD21 LEU 52 1HD2 LEU 52 -18.135 5.734 -24.125 400 HD22 LEU 52 2HD2 LEU 52 -17.936 6.525 -25.690 401 HD23 LEU 52 3HD2 LEU 52 -19.494 5.824 -25.247 402 H GLU 53 H GLU 53 -19.184 11.395 -26.823 403 HA GLU 53 HA GLU 53 -20.287 10.731 -29.291 404 HB2 GLU 53 1HB GLU 53 -20.662 12.822 -27.838 405 HB3 GLU 53 2HB GLU 53 -19.254 13.485 -28.655 406 HG2 GLU 53 1HG GLU 53 -20.527 12.872 -30.822 407 HG3 GLU 53 2HG GLU 53 -21.940 12.814 -29.769 408 H ASP 54 H ASP 54 -17.042 11.691 -28.440 409 HA ASP 54 HA ASP 54 -16.144 12.323 -31.054 410 HB2 ASP 54 1HB ASP 54 -15.067 12.801 -28.709 411 HB3 ASP 54 2HB ASP 54 -14.298 11.236 -28.960 412 H LEU 55 H LEU 55 -16.390 9.343 -29.232 413 HA LEU 55 HA LEU 55 -14.785 7.772 -30.985 414 HB2 LEU 55 1HB LEU 55 -16.690 7.217 -28.763 415 HB3 LEU 55 2HB LEU 55 -16.222 5.894 -29.829 416 HG LEU 55 HG LEU 55 -14.905 6.009 -27.731 417 HD11 LEU 55 1HD1 LEU 55 -13.799 6.029 -30.452 418 HD12 LEU 55 2HD1 LEU 55 -13.632 4.838 -29.163 419 HD13 LEU 55 3HD1 LEU 55 -12.626 6.286 -29.161 420 HD21 LEU 55 1HD2 LEU 55 -13.630 7.794 -27.121 421 HD22 LEU 55 2HD2 LEU 55 -14.928 8.650 -27.954 422 HD23 LEU 55 3HD2 LEU 55 -13.400 8.343 -28.781 423 H GLY 56 H GLY 56 -18.138 8.725 -30.920 424 HA2 GLY 56 1HA GLY 56 -18.989 8.631 -33.349 425 HA3 GLY 56 2HA GLY 56 -18.718 6.904 -33.160 426 H VAL 57 H VAL 57 -19.568 7.309 -30.233 427 HA VAL 57 HA VAL 57 -22.222 6.435 -30.529 428 HB VAL 57 HB VAL 57 -21.037 7.667 -28.041 429 HG11 VAL 57 1HG1 VAL 57 -23.508 7.231 -28.124 430 HG12 VAL 57 2HG1 VAL 57 -23.129 5.516 -28.298 431 HG13 VAL 57 3HG1 VAL 57 -22.642 6.385 -26.842 432 HG21 VAL 57 1HG2 VAL 57 -20.243 5.307 -29.465 433 HG22 VAL 57 2HG2 VAL 57 -19.565 6.002 -27.993 434 HG23 VAL 57 3HG2 VAL 57 -20.911 4.866 -27.893 435 H SER 58 H SER 58 -23.481 7.846 -31.698 436 HA SER 58 HA SER 58 -23.680 10.628 -30.922 437 HB2 SER 58 1HB SER 58 -24.707 10.971 -32.933 438 HB3 SER 58 2HB SER 58 -23.938 9.432 -33.320 439 HG SER 58 HG SER 58 -26.044 9.173 -33.860 440 H ARG 59 H ARG 59 -25.726 7.737 -30.857 441 HA ARG 59 HA ARG 59 -28.056 8.911 -29.861 442 HB2 ARG 59 1HB ARG 59 -27.095 6.280 -30.359 443 HB3 ARG 59 2HB ARG 59 -27.761 6.306 -28.731 444 HG2 ARG 59 1HG ARG 59 -29.650 5.806 -29.872 445 HG3 ARG 59 2HG ARG 59 -29.738 7.566 -29.974 446 HD2 ARG 59 1HD ARG 59 -29.652 7.468 -32.191 447 HD3 ARG 59 2HD ARG 59 -28.124 6.593 -32.115 448 HE ARG 59 HE ARG 59 -29.252 4.667 -32.598 449 HH11 ARG 59 1HH1 ARG 59 -31.530 7.066 -31.513 450 HH12 ARG 59 2HH1 ARG 59 -32.920 6.099 -31.876 451 HH21 ARG 59 1HH2 ARG 59 -31.075 3.384 -33.081 452 HH22 ARG 59 2HH2 ARG 59 -32.661 4.004 -32.767 453 H ILE 60 H ILE 60 -28.972 8.683 -27.679 454 HA ILE 60 HA ILE 60 -26.955 9.362 -25.668 455 HB ILE 60 HB ILE 60 -29.955 9.698 -25.560 456 HG12 ILE 60 1HG1 ILE 60 -28.923 11.140 -27.252 457 HG13 ILE 60 2HG1 ILE 60 -29.484 12.091 -25.882 458 HG21 ILE 60 1HG2 ILE 60 -27.853 9.950 -23.567 459 HG22 ILE 60 2HG2 ILE 60 -28.813 11.419 -23.739 460 HG23 ILE 60 3HG2 ILE 60 -29.604 9.888 -23.365 461 HD11 ILE 60 1HD1 ILE 60 -27.322 12.862 -26.654 462 HD12 ILE 60 2HD1 ILE 60 -27.199 12.193 -25.026 463 HD13 ILE 60 3HD1 ILE 60 -26.643 11.253 -26.411 464 H GLY 61 H GLY 61 -29.623 7.131 -26.270 465 HA2 GLY 61 1HA GLY 61 -29.730 5.913 -23.748 466 HA3 GLY 61 2HA GLY 61 -30.212 5.157 -25.260 467 H HIS 62 H HIS 62 -27.397 5.614 -26.284 468 HA HIS 62 HA HIS 62 -26.332 3.114 -25.266 469 HB2 HIS 62 1HB HIS 62 -25.223 4.922 -27.422 470 HB3 HIS 62 2HB HIS 62 -24.738 3.261 -27.094 471 HD1 HIS 62 HD1 HIS 62 -26.109 4.575 -29.759 472 HD2 HIS 62 HD2 HIS 62 -27.824 2.008 -26.979 473 HE1 HIS 62 HE1 HIS 62 -28.010 3.452 -30.963 474 H GLN 63 H GLN 63 -25.338 6.512 -25.483 475 HA GLN 63 HA GLN 63 -22.806 6.334 -24.395 476 HB2 GLN 63 1HB GLN 63 -24.896 8.493 -24.247 477 HB3 GLN 63 2HB GLN 63 -23.316 8.693 -23.502 478 HG2 GLN 63 1HG GLN 63 -22.290 8.244 -25.728 479 HG3 GLN 63 2HG GLN 63 -23.913 8.263 -26.417 480 HE21 GLN 63 2HE2 GLN 63 -24.605 10.129 -27.169 481 HE22 GLN 63 1HE2 GLN 63 -23.994 11.688 -26.745 482 H GLU 64 H GLU 64 -25.914 6.199 -22.802 483 HA GLU 64 HA GLU 64 -24.759 6.381 -20.153 484 HB2 GLU 64 1HB GLU 64 -27.517 6.144 -21.267 485 HB3 GLU 64 2HB GLU 64 -27.245 5.650 -19.601 486 HG2 GLU 64 1HG GLU 64 -25.978 8.099 -19.778 487 HG3 GLU 64 2HG GLU 64 -27.437 8.302 -20.746 488 H LEU 65 H LEU 65 -25.829 3.915 -22.374 489 HA LEU 65 HA LEU 65 -26.154 1.753 -20.661 490 HB2 LEU 65 1HB LEU 65 -25.758 2.177 -23.489 491 HB3 LEU 65 2HB LEU 65 -24.923 0.724 -22.944 492 HG LEU 65 HG LEU 65 -27.812 1.173 -22.281 493 HD11 LEU 65 1HD1 LEU 65 -27.269 1.381 -24.798 494 HD12 LEU 65 2HD1 LEU 65 -28.548 0.280 -24.288 495 HD13 LEU 65 3HD1 LEU 65 -26.957 -0.352 -24.709 496 HD21 LEU 65 1HD2 LEU 65 -27.754 -1.343 -22.378 497 HD22 LEU 65 2HD2 LEU 65 -26.816 -0.609 -21.077 498 HD23 LEU 65 3HD2 LEU 65 -26.000 -1.218 -22.518 499 H ILE 66 H ILE 66 -23.203 2.984 -22.193 500 HA ILE 66 HA ILE 66 -21.501 0.966 -21.137 501 HB ILE 66 HB ILE 66 -20.763 3.733 -22.099 502 HG12 ILE 66 1HG1 ILE 66 -20.654 1.137 -23.639 503 HG13 ILE 66 2HG1 ILE 66 -22.015 2.249 -23.732 504 HG21 ILE 66 1HG2 ILE 66 -18.682 3.234 -21.521 505 HG22 ILE 66 2HG2 ILE 66 -19.221 1.685 -20.875 506 HG23 ILE 66 3HG2 ILE 66 -18.732 1.814 -22.564 507 HD11 ILE 66 1HD1 ILE 66 -20.935 3.615 -25.117 508 HD12 ILE 66 2HD1 ILE 66 -19.441 3.533 -24.184 509 HD13 ILE 66 3HD1 ILE 66 -19.820 2.270 -25.354 510 H LEU 67 H LEU 67 -22.040 4.366 -20.217 511 HA LEU 67 HA LEU 67 -20.319 4.511 -18.062 512 HB2 LEU 67 1HB LEU 67 -23.033 5.800 -18.306 513 HB3 LEU 67 2HB LEU 67 -21.744 6.305 -17.216 514 HG LEU 67 HG LEU 67 -21.344 6.300 -20.189 515 HD11 LEU 67 1HD1 LEU 67 -22.019 8.871 -18.979 516 HD12 LEU 67 2HD1 LEU 67 -23.364 7.732 -19.037 517 HD13 LEU 67 3HD1 LEU 67 -22.518 8.173 -20.520 518 HD21 LEU 67 1HD2 LEU 67 -19.324 6.576 -19.025 519 HD22 LEU 67 2HD2 LEU 67 -20.060 7.644 -17.829 520 HD23 LEU 67 3HD2 LEU 67 -19.813 8.208 -19.482 521 H GLU 68 H GLU 68 -23.708 3.447 -18.096 522 HA GLU 68 HA GLU 68 -24.066 3.023 -15.382 523 HB2 GLU 68 1HB GLU 68 -25.815 2.859 -17.185 524 HB3 GLU 68 2HB GLU 68 -25.184 1.263 -17.565 525 HG2 GLU 68 1HG GLU 68 -27.044 0.899 -16.189 526 HG3 GLU 68 2HG GLU 68 -25.637 0.651 -15.158 527 H ALA 69 H ALA 69 -22.267 1.164 -17.698 528 HA ALA 69 HA ALA 69 -22.020 -1.143 -15.965 529 HB1 ALA 69 1HB ALA 69 -20.400 -0.661 -18.442 530 HB2 ALA 69 2HB ALA 69 -20.891 -2.193 -17.720 531 HB3 ALA 69 3HB ALA 69 -22.085 -1.175 -18.526 532 H VAL 70 H VAL 70 -19.982 1.524 -17.090 533 HA VAL 70 HA VAL 70 -17.565 0.729 -15.948 534 HB VAL 70 HB VAL 70 -18.597 3.545 -16.325 535 HG11 VAL 70 1HG1 VAL 70 -15.796 2.508 -15.903 536 HG12 VAL 70 2HG1 VAL 70 -16.205 4.163 -16.358 537 HG13 VAL 70 3HG1 VAL 70 -16.723 3.522 -14.799 538 HG21 VAL 70 1HG2 VAL 70 -16.939 1.785 -18.128 539 HG22 VAL 70 2HG2 VAL 70 -18.608 2.284 -18.401 540 HG23 VAL 70 3HG2 VAL 70 -17.315 3.482 -18.423 541 H ASP 71 H ASP 71 -20.344 2.342 -14.535 542 HA ASP 71 HA ASP 71 -19.233 3.259 -12.157 543 HB2 ASP 71 1HB ASP 71 -21.668 3.448 -13.169 544 HB3 ASP 71 2HB ASP 71 -21.971 2.062 -12.125 545 H LEU 72 H LEU 72 -20.065 0.033 -13.151 546 HA LEU 72 HA LEU 72 -19.953 -1.090 -10.504 547 HB2 LEU 72 1HB LEU 72 -19.988 -2.346 -13.241 548 HB3 LEU 72 2HB LEU 72 -19.992 -3.266 -11.738 549 HG LEU 72 HG LEU 72 -22.151 -1.378 -12.677 550 HD11 LEU 72 1HD1 LEU 72 -21.810 -3.712 -13.759 551 HD12 LEU 72 2HD1 LEU 72 -23.421 -3.222 -13.237 552 HD13 LEU 72 3HD1 LEU 72 -22.466 -4.317 -12.238 553 HD21 LEU 72 1HD2 LEU 72 -22.442 -1.194 -10.437 554 HD22 LEU 72 2HD2 LEU 72 -21.609 -2.709 -10.089 555 HD23 LEU 72 3HD2 LEU 72 -23.275 -2.731 -10.669 556 H LEU 73 H LEU 73 -17.748 -0.620 -13.176 557 HA LEU 73 HA LEU 73 -15.720 -2.395 -12.368 558 HB2 LEU 73 1HB LEU 73 -15.997 -0.157 -14.237 559 HB3 LEU 73 2HB LEU 73 -14.365 -0.375 -13.607 560 HG LEU 73 HG LEU 73 -15.956 -2.539 -14.979 561 HD11 LEU 73 1HD1 LEU 73 -14.216 -0.388 -16.032 562 HD12 LEU 73 2HD1 LEU 73 -15.585 -1.212 -16.778 563 HD13 LEU 73 3HD1 LEU 73 -14.010 -2.002 -16.714 564 HD21 LEU 73 1HD2 LEU 73 -14.185 -3.909 -14.684 565 HD22 LEU 73 2HD2 LEU 73 -13.886 -2.861 -13.296 566 HD23 LEU 73 3HD2 LEU 73 -13.011 -2.598 -14.806 567 H CYS 74 H CYS 74 -16.259 1.038 -11.662 568 HA CYS 74 HA CYS 74 -13.911 1.257 -10.030 569 HB2 CYS 74 1HB CYS 74 -15.403 3.083 -11.326 570 HB3 CYS 74 2HB CYS 74 -16.108 3.227 -9.721 571 HG CYS 74 HG CYS 74 -13.840 5.037 -10.594 572 H ALA 75 H ALA 75 -17.248 0.440 -9.523 573 HA ALA 75 HA ALA 75 -17.362 0.909 -6.732 574 HB1 ALA 75 1HB ALA 75 -19.387 0.704 -8.029 575 HB2 ALA 75 2HB ALA 75 -18.978 -0.956 -8.464 576 HB3 ALA 75 3HB ALA 75 -19.353 -0.551 -6.789 577 H LEU 76 H LEU 76 -16.938 -2.116 -8.576 578 HA LEU 76 HA LEU 76 -16.500 -3.774 -6.361 579 HB2 LEU 76 1HB LEU 76 -15.860 -3.947 -9.269 580 HB3 LEU 76 2HB LEU 76 -15.181 -5.142 -8.166 581 HG LEU 76 HG LEU 76 -18.056 -4.797 -7.833 582 HD11 LEU 76 1HD1 LEU 76 -16.950 -5.133 -10.532 583 HD12 LEU 76 2HD1 LEU 76 -18.547 -4.596 -10.014 584 HD13 LEU 76 3HD1 LEU 76 -18.172 -6.318 -10.069 585 HD21 LEU 76 1HD2 LEU 76 -16.468 -6.622 -6.979 586 HD22 LEU 76 2HD2 LEU 76 -16.562 -7.279 -8.614 587 HD23 LEU 76 3HD2 LEU 76 -18.025 -7.123 -7.639 588 H ASN 77 H ASN 77 -14.412 -1.562 -8.019 589 HA ASN 77 HA ASN 77 -11.924 -2.630 -7.208 590 HB2 ASN 77 1HB ASN 77 -12.872 -0.305 -8.609 591 HB3 ASN 77 2HB ASN 77 -11.667 0.178 -7.419 592 HD21 ASN 77 2HD2 ASN 77 -12.088 -2.617 -9.568 593 HD22 ASN 77 1HD2 ASN 77 -10.512 -2.528 -10.270 594 H SER 78 H SER 78 -14.245 -0.520 -5.661 595 HA SER 78 HA SER 78 -12.476 -0.352 -3.310 596 HB2 SER 78 1HB SER 78 -13.411 1.742 -2.758 597 HB3 SER 78 2HB SER 78 -13.192 1.813 -4.506 598 HG SER 78 HG SER 78 -15.252 2.133 -4.650 599 H GLY 79 H GLY 79 -14.164 0.325 -1.345 600 HA2 GLY 79 1HA GLY 79 -16.103 -0.311 -0.155 601 HA3 GLY 79 2HA GLY 79 -16.416 -1.543 -1.369 602 HA PRO 80 HA PRO 80 -12.967 -3.306 1.543 603 HB2 PRO 80 1HB PRO 80 -12.526 -1.931 3.842 604 HB3 PRO 80 2HB PRO 80 -11.631 -1.620 2.350 605 HG2 PRO 80 1HG PRO 80 -13.967 -0.143 3.501 606 HG3 PRO 80 2HG PRO 80 -12.492 0.502 2.756 607 HD2 PRO 80 1HD PRO 80 -14.844 0.335 1.425 608 HD3 PRO 80 2HD PRO 80 -13.274 0.160 0.615 609 H SER 81 H SER 81 -14.236 -4.988 2.119 610 HA SER 81 HA SER 81 -15.880 -4.666 4.538 611 HB2 SER 81 1HB SER 81 -16.723 -5.515 1.870 612 HB3 SER 81 2HB SER 81 -17.153 -6.675 3.126 613 HG SER 81 HG SER 81 -17.651 -3.932 3.503 614 H SER 82 H SER 82 -15.325 -6.027 6.097 615 HA SER 82 HA SER 82 -13.467 -8.178 5.533 616 HB2 SER 82 1HB SER 82 -13.132 -6.692 7.489 617 HB3 SER 82 2HB SER 82 -14.644 -7.285 8.178 618 HG SER 82 HG SER 82 -13.447 -8.791 9.009 619 H GLY 83 H GLY 83 -16.669 -7.858 7.064 620 HA2 GLY 83 1HA GLY 83 -18.471 -9.334 6.815 621 HA3 GLY 83 2HA GLY 83 -17.391 -10.489 6.047 Start of MODEL 10 1 H1 GLY 1 H GLY 1 7.612 1.897 -9.820 2 HA2 GLY 1 1HA GLY 1 6.009 3.034 -11.212 3 HA3 GLY 1 2HA GLY 1 5.896 1.326 -11.608 4 H SER 2 H SER 2 4.677 0.728 -8.964 5 HA SER 2 HA SER 2 2.001 1.855 -9.475 6 HB2 SER 2 1HB SER 2 1.657 -0.346 -10.082 7 HB3 SER 2 2HB SER 2 2.880 -0.956 -8.967 8 HG SER 2 HG SER 2 0.214 -0.227 -8.469 9 H SER 3 H SER 3 1.263 3.047 -7.861 10 HA SER 3 HA SER 3 1.765 2.241 -5.104 11 HB2 SER 3 1HB SER 3 2.112 5.134 -5.492 12 HB3 SER 3 2HB SER 3 3.032 4.011 -4.490 13 HG SER 3 HG SER 3 3.280 4.287 -7.306 14 H GLY 4 H GLY 4 -0.585 2.154 -6.700 15 HA2 GLY 4 1HA GLY 4 -2.300 3.845 -5.042 16 HA3 GLY 4 2HA GLY 4 -2.436 4.031 -6.785 17 H SER 5 H SER 5 -4.681 3.361 -5.555 18 HA SER 5 HA SER 5 -4.981 0.485 -6.122 19 HB2 SER 5 1HB SER 5 -6.604 2.032 -4.093 20 HB3 SER 5 2HB SER 5 -6.603 0.289 -4.361 21 HG SER 5 HG SER 5 -5.086 1.653 -2.704 22 H SER 6 H SER 6 -6.024 0.305 -7.991 23 HA SER 6 HA SER 6 -8.658 1.296 -8.327 24 HB2 SER 6 1HB SER 6 -7.949 2.612 -10.494 25 HB3 SER 6 2HB SER 6 -7.906 3.406 -8.920 26 HG SER 6 HG SER 6 -5.824 3.584 -9.102 27 H GLY 7 H GLY 7 -5.901 0.655 -10.507 28 HA2 GLY 7 1HA GLY 7 -5.533 -1.214 -11.850 29 HA3 GLY 7 2HA GLY 7 -7.064 -1.879 -11.300 30 H VAL 8 H VAL 8 -8.998 -0.385 -12.056 31 HA VAL 8 HA VAL 8 -9.191 -0.667 -14.832 32 HB VAL 8 HB VAL 8 -10.846 1.156 -13.081 33 HG11 VAL 8 1HG1 VAL 8 -12.569 0.862 -14.785 34 HG12 VAL 8 2HG1 VAL 8 -11.112 1.581 -15.474 35 HG13 VAL 8 3HG1 VAL 8 -11.465 -0.127 -15.740 36 HG21 VAL 8 1HG2 VAL 8 -12.386 -0.732 -12.877 37 HG22 VAL 8 2HG2 VAL 8 -11.268 -1.748 -13.788 38 HG23 VAL 8 3HG2 VAL 8 -10.803 -1.124 -12.206 39 H SER 9 H SER 9 -7.957 1.919 -12.892 40 HA SER 9 HA SER 9 -8.170 3.963 -14.882 41 HB2 SER 9 1HB SER 9 -7.629 3.935 -12.179 42 HB3 SER 9 2HB SER 9 -6.060 4.328 -12.881 43 HG SER 9 HG SER 9 -7.710 6.087 -12.410 44 H LYS 10 H LYS 10 -5.802 1.544 -14.034 45 HA LYS 10 HA LYS 10 -3.891 2.659 -15.957 46 HB2 LYS 10 1HB LYS 10 -3.495 0.324 -14.081 47 HB3 LYS 10 2HB LYS 10 -2.254 1.182 -14.985 48 HG2 LYS 10 1HG LYS 10 -3.594 3.111 -13.438 49 HG3 LYS 10 2HG LYS 10 -3.294 1.727 -12.383 50 HD2 LYS 10 1HD LYS 10 -0.942 1.780 -12.901 51 HD3 LYS 10 2HD LYS 10 -1.197 3.046 -14.106 52 HE2 LYS 10 1HE LYS 10 -2.297 4.204 -11.925 53 HE3 LYS 10 2HE LYS 10 -1.046 3.219 -11.168 54 HZ1 LYS 10 1HZ LYS 10 -0.774 5.644 -12.596 55 HZ2 LYS 10 2HZ LYS 10 0.136 4.435 -13.352 56 HZ3 LYS 10 3HZ LYS 10 0.394 4.790 -11.719 57 H TRP 11 H TRP 11 -6.441 1.216 -16.611 58 HA TRP 11 HA TRP 11 -5.711 -1.333 -17.671 59 HB2 TRP 11 1HB TRP 11 -8.113 0.364 -17.607 60 HB3 TRP 11 2HB TRP 11 -7.964 -0.627 -19.055 61 HD1 TRP 11 HD1 TRP 11 -6.673 -1.985 -15.735 62 HE1 TRP 11 HE1 TRP 11 -8.166 -3.950 -15.004 63 HE3 TRP 11 HE3 TRP 11 -10.364 -1.548 -19.245 64 HZ2 TRP 11 HZ2 TRP 11 -10.588 -5.156 -15.809 65 HZ3 TRP 11 HZ3 TRP 11 -12.234 -3.148 -19.196 66 HH2 TRP 11 HH2 TRP 11 -12.341 -4.914 -17.513 67 H SER 12 H SER 12 -4.839 -1.836 -19.582 68 HA SER 12 HA SER 12 -3.644 0.079 -21.223 69 HB2 SER 12 1HB SER 12 -4.077 -2.839 -21.325 70 HB3 SER 12 2HB SER 12 -3.833 -2.066 -22.891 71 HG SER 12 HG SER 12 -1.902 -2.799 -21.653 72 HA PRO 13 HA PRO 13 -6.706 1.453 -24.047 73 HB2 PRO 13 1HB PRO 13 -5.348 1.532 -26.396 74 HB3 PRO 13 2HB PRO 13 -5.065 2.682 -25.084 75 HG2 PRO 13 1HG PRO 13 -3.514 0.231 -25.823 76 HG3 PRO 13 2HG PRO 13 -2.917 1.832 -25.349 77 HD2 PRO 13 1HD PRO 13 -3.005 -0.257 -23.629 78 HD3 PRO 13 2HD PRO 13 -3.231 1.424 -23.103 79 H SER 14 H SER 14 -5.107 -1.566 -24.674 80 HA SER 14 HA SER 14 -7.056 -2.323 -26.712 81 HB2 SER 14 1HB SER 14 -5.011 -4.251 -25.721 82 HB3 SER 14 2HB SER 14 -5.596 -3.975 -27.362 83 HG SER 14 HG SER 14 -4.045 -2.591 -27.657 84 H GLN 15 H GLN 15 -6.329 -2.827 -23.366 85 HA GLN 15 HA GLN 15 -7.749 -5.234 -22.963 86 HB2 GLN 15 1HB GLN 15 -6.912 -2.994 -21.140 87 HB3 GLN 15 2HB GLN 15 -7.876 -4.339 -20.545 88 HG2 GLN 15 1HG GLN 15 -5.465 -5.063 -22.071 89 HG3 GLN 15 2HG GLN 15 -5.194 -4.285 -20.513 90 HE21 GLN 15 2HE2 GLN 15 -6.842 -5.214 -18.800 91 HE22 GLN 15 1HE2 GLN 15 -6.845 -6.939 -18.699 92 H VAL 16 H VAL 16 -8.699 -1.834 -22.522 93 HA VAL 16 HA VAL 16 -11.263 -2.186 -21.569 94 HB VAL 16 HB VAL 16 -10.329 -0.061 -23.503 95 HG11 VAL 16 1HG1 VAL 16 -12.739 -0.135 -23.438 96 HG12 VAL 16 2HG1 VAL 16 -12.725 -0.151 -21.673 97 HG13 VAL 16 3HG1 VAL 16 -12.176 1.279 -22.548 98 HG21 VAL 16 1HG2 VAL 16 -9.008 -0.259 -21.404 99 HG22 VAL 16 2HG2 VAL 16 -9.849 1.282 -21.571 100 HG23 VAL 16 3HG2 VAL 16 -10.489 0.040 -20.494 101 H VAL 17 H VAL 17 -10.047 -2.614 -24.810 102 HA VAL 17 HA VAL 17 -12.496 -2.567 -26.202 103 HB VAL 17 HB VAL 17 -10.069 -4.206 -26.931 104 HG11 VAL 17 1HG1 VAL 17 -11.903 -2.873 -28.872 105 HG12 VAL 17 2HG1 VAL 17 -10.900 -4.311 -29.076 106 HG13 VAL 17 3HG1 VAL 17 -12.385 -4.398 -28.128 107 HG21 VAL 17 1HG2 VAL 17 -9.328 -1.961 -26.501 108 HG22 VAL 17 2HG2 VAL 17 -9.376 -2.213 -28.246 109 HG23 VAL 17 3HG2 VAL 17 -10.656 -1.295 -27.452 110 H ASP 18 H ASP 18 -10.723 -5.182 -24.616 111 HA ASP 18 HA ASP 18 -12.421 -7.279 -25.466 112 HB2 ASP 18 1HB ASP 18 -10.108 -7.573 -24.551 113 HB3 ASP 18 2HB ASP 18 -10.741 -7.189 -22.953 114 H TRP 19 H TRP 19 -12.646 -4.923 -22.936 115 HA TRP 19 HA TRP 19 -14.522 -6.282 -21.296 116 HB2 TRP 19 1HB TRP 19 -13.271 -4.456 -20.361 117 HB3 TRP 19 2HB TRP 19 -13.860 -3.349 -21.597 118 HD1 TRP 19 HD1 TRP 19 -15.490 -5.569 -18.845 119 HE1 TRP 19 HE1 TRP 19 -17.395 -4.211 -17.771 120 HE3 TRP 19 HE3 TRP 19 -15.142 -1.316 -21.661 121 HZ2 TRP 19 HZ2 TRP 19 -18.592 -1.673 -18.078 122 HZ3 TRP 19 HZ3 TRP 19 -16.705 0.530 -21.207 123 HH2 TRP 19 HH2 TRP 19 -18.393 0.353 -19.453 124 H MET 20 H MET 20 -14.862 -3.900 -23.903 125 HA MET 20 HA MET 20 -17.648 -3.603 -23.754 126 HB2 MET 20 1HB MET 20 -15.887 -3.375 -26.201 127 HB3 MET 20 2HB MET 20 -17.502 -2.701 -26.020 128 HG2 MET 20 1HG MET 20 -15.557 -1.892 -23.970 129 HG3 MET 20 2HG MET 20 -15.225 -1.327 -25.606 130 HE1 MET 20 1HE MET 20 -17.159 0.875 -26.757 131 HE2 MET 20 2HE MET 20 -17.319 -0.855 -27.056 132 HE3 MET 20 3HE MET 20 -18.717 0.080 -26.524 133 H LYS 21 H LYS 21 -15.683 -6.146 -25.001 134 HA LYS 21 HA LYS 21 -17.519 -7.277 -26.832 135 HB2 LYS 21 1HB LYS 21 -15.308 -8.604 -25.252 136 HB3 LYS 21 2HB LYS 21 -16.142 -9.316 -26.627 137 HG2 LYS 21 1HG LYS 21 -15.337 -7.278 -27.941 138 HG3 LYS 21 2HG LYS 21 -14.243 -6.999 -26.585 139 HD2 LYS 21 1HD LYS 21 -13.144 -9.067 -26.925 140 HD3 LYS 21 2HD LYS 21 -14.399 -9.635 -28.029 141 HE2 LYS 21 1HE LYS 21 -13.752 -7.790 -29.584 142 HE3 LYS 21 2HE LYS 21 -12.401 -7.429 -28.511 143 HZ1 LYS 21 1HZ LYS 21 -12.614 -9.435 -30.503 144 HZ2 LYS 21 2HZ LYS 21 -12.270 -10.138 -29.004 145 HZ3 LYS 21 3HZ LYS 21 -11.252 -8.940 -29.630 146 H GLY 22 H GLY 22 -17.552 -7.080 -23.454 147 HA2 GLY 22 1HA GLY 22 -19.461 -9.330 -23.294 148 HA3 GLY 22 2HA GLY 22 -18.437 -8.823 -21.959 149 H LEU 23 H LEU 23 -19.892 -6.401 -23.952 150 HA LEU 23 HA LEU 23 -21.773 -5.791 -21.768 151 HB2 LEU 23 1HB LEU 23 -20.613 -3.848 -23.754 152 HB3 LEU 23 2HB LEU 23 -21.576 -3.469 -22.328 153 HG LEU 23 HG LEU 23 -18.753 -4.531 -22.371 154 HD11 LEU 23 1HD1 LEU 23 -18.038 -2.433 -21.913 155 HD12 LEU 23 2HD1 LEU 23 -19.509 -2.000 -21.042 156 HD13 LEU 23 3HD1 LEU 23 -19.497 -2.004 -22.805 157 HD21 LEU 23 1HD2 LEU 23 -19.406 -5.472 -20.423 158 HD22 LEU 23 2HD2 LEU 23 -20.793 -4.398 -20.240 159 HD23 LEU 23 3HD2 LEU 23 -19.176 -3.832 -19.816 160 H ASP 24 H ASP 24 -23.358 -3.936 -22.960 161 HA ASP 24 HA ASP 24 -25.281 -5.412 -24.278 162 HB2 ASP 24 1HB ASP 24 -25.071 -2.814 -23.375 163 HB3 ASP 24 2HB ASP 24 -25.240 -2.607 -25.116 164 H ASP 25 H ASP 25 -25.827 -5.802 -26.389 165 HA ASP 25 HA ASP 25 -23.782 -6.064 -28.274 166 HB2 ASP 25 1HB ASP 25 -26.197 -7.130 -28.113 167 HB3 ASP 25 2HB ASP 25 -26.613 -5.801 -29.192 168 H CYS 26 H CYS 26 -25.848 -3.388 -27.530 169 HA CYS 26 HA CYS 26 -25.550 -1.981 -29.981 170 HB2 CYS 26 1HB CYS 26 -26.519 -1.308 -27.239 171 HB3 CYS 26 2HB CYS 26 -26.128 0.014 -28.332 172 HG CYS 26 HG CYS 26 -28.964 -1.010 -28.104 173 H LEU 27 H LEU 27 -23.531 -2.427 -27.236 174 HA LEU 27 HA LEU 27 -21.862 -0.124 -27.901 175 HB2 LEU 27 1HB LEU 27 -21.343 -2.124 -25.724 176 HB3 LEU 27 2HB LEU 27 -20.757 -0.467 -25.852 177 HG LEU 27 HG LEU 27 -23.602 -1.298 -25.280 178 HD11 LEU 27 1HD1 LEU 27 -22.767 -1.609 -23.225 179 HD12 LEU 27 2HD1 LEU 27 -22.738 0.152 -23.151 180 HD13 LEU 27 3HD1 LEU 27 -21.278 -0.736 -23.587 181 HD21 LEU 27 1HD2 LEU 27 -23.611 1.252 -24.652 182 HD22 LEU 27 2HD2 LEU 27 -23.891 0.728 -26.313 183 HD23 LEU 27 3HD2 LEU 27 -22.302 1.325 -25.832 184 H GLN 28 H GLN 28 -22.148 -2.642 -29.548 185 HA GLN 28 HA GLN 28 -19.456 -3.751 -29.413 186 HB2 GLN 28 1HB GLN 28 -21.781 -4.458 -31.211 187 HB3 GLN 28 2HB GLN 28 -20.251 -5.322 -31.135 188 HG2 GLN 28 1HG GLN 28 -22.173 -5.024 -28.839 189 HG3 GLN 28 2HG GLN 28 -22.063 -6.433 -29.893 190 HE21 GLN 28 2HE2 GLN 28 -21.368 -5.557 -26.942 191 HE22 GLN 28 1HE2 GLN 28 -19.880 -6.391 -26.668 192 H GLN 29 H GLN 29 -21.551 -2.137 -31.795 193 HA GLN 29 HA GLN 29 -19.713 -1.944 -33.871 194 HB2 GLN 29 1HB GLN 29 -21.080 -0.030 -34.661 195 HB3 GLN 29 2HB GLN 29 -22.045 -1.432 -34.223 196 HG2 GLN 29 1HG GLN 29 -22.301 -0.272 -31.941 197 HG3 GLN 29 2HG GLN 29 -21.754 1.174 -32.788 198 HE21 GLN 29 2HE2 GLN 29 -24.328 0.603 -31.552 199 HE22 GLN 29 1HE2 GLN 29 -25.510 0.781 -32.799 200 H TYR 30 H TYR 30 -19.928 -0.168 -30.908 201 HA TYR 30 HA TYR 30 -18.297 2.035 -31.753 202 HB2 TYR 30 1HB TYR 30 -19.057 1.095 -28.980 203 HB3 TYR 30 2HB TYR 30 -18.255 2.618 -29.348 204 HD1 TYR 30 HD2 TYR 30 -19.752 3.494 -31.740 205 HD2 TYR 30 HD1 TYR 30 -21.134 1.724 -28.126 206 HE1 TYR 30 HE2 TYR 30 -21.939 4.573 -32.054 207 HE2 TYR 30 HE1 TYR 30 -23.325 2.798 -28.431 208 HH TYR 30 HH TYR 30 -24.470 3.904 -31.135 209 H ILE 31 H ILE 31 -17.737 -1.134 -30.489 210 HA ILE 31 HA ILE 31 -15.274 -0.908 -29.271 211 HB ILE 31 HB ILE 31 -16.178 -3.154 -31.077 212 HG12 ILE 31 1HG1 ILE 31 -16.469 -2.783 -28.088 213 HG13 ILE 31 2HG1 ILE 31 -17.772 -2.682 -29.267 214 HG21 ILE 31 1HG2 ILE 31 -13.710 -2.706 -29.748 215 HG22 ILE 31 2HG2 ILE 31 -14.539 -4.034 -28.937 216 HG23 ILE 31 3HG2 ILE 31 -14.223 -4.119 -30.670 217 HD11 ILE 31 1HD1 ILE 31 -17.893 -4.808 -28.222 218 HD12 ILE 31 2HD1 ILE 31 -17.299 -5.058 -29.864 219 HD13 ILE 31 3HD1 ILE 31 -16.178 -5.111 -28.504 220 H LYS 32 H LYS 32 -16.004 -1.168 -32.724 221 HA LYS 32 HA LYS 32 -13.404 -1.414 -33.697 222 HB2 LYS 32 1HB LYS 32 -14.267 -0.697 -35.817 223 HB3 LYS 32 2HB LYS 32 -15.505 -1.668 -35.031 224 HG2 LYS 32 1HG LYS 32 -16.877 0.003 -35.579 225 HG3 LYS 32 2HG LYS 32 -16.164 0.840 -34.198 226 HD2 LYS 32 1HD LYS 32 -15.038 2.291 -35.503 227 HD3 LYS 32 2HD LYS 32 -14.638 1.058 -36.701 228 HE2 LYS 32 1HE LYS 32 -16.079 2.275 -37.959 229 HE3 LYS 32 2HE LYS 32 -17.261 1.243 -37.155 230 HZ1 LYS 32 1HZ LYS 32 -17.891 2.935 -35.730 231 HZ2 LYS 32 2HZ LYS 32 -17.652 3.761 -37.187 232 HZ3 LYS 32 3HZ LYS 32 -16.475 3.829 -35.974 233 H ASN 33 H ASN 33 -15.140 1.380 -32.533 234 HA ASN 33 HA ASN 33 -13.242 3.284 -33.562 235 HB2 ASN 33 1HB ASN 33 -15.512 3.547 -31.582 236 HB3 ASN 33 2HB ASN 33 -14.518 4.899 -32.116 237 HD21 ASN 33 2HD2 ASN 33 -17.412 3.665 -32.516 238 HD22 ASN 33 1HD2 ASN 33 -17.710 4.019 -34.181 239 H PHE 34 H PHE 34 -13.710 1.484 -30.615 240 HA PHE 34 HA PHE 34 -11.905 3.052 -29.036 241 HB2 PHE 34 1HB PHE 34 -13.372 0.474 -28.674 242 HB3 PHE 34 2HB PHE 34 -12.020 0.832 -27.605 243 HD1 PHE 34 HD2 PHE 34 -15.048 2.536 -28.968 244 HD2 PHE 34 HD1 PHE 34 -12.502 1.870 -25.623 245 HE1 PHE 34 HE2 PHE 34 -16.525 3.923 -27.572 246 HE2 PHE 34 HE1 PHE 34 -13.976 3.255 -24.221 247 HZ PHE 34 HZ PHE 34 -15.989 4.285 -25.196 248 H GLU 35 H GLU 35 -11.632 0.340 -31.188 249 HA GLU 35 HA GLU 35 -9.074 -0.549 -30.284 250 HB2 GLU 35 1HB GLU 35 -11.015 -1.371 -32.210 251 HB3 GLU 35 2HB GLU 35 -9.458 -1.241 -33.016 252 HG2 GLU 35 1HG GLU 35 -9.822 -2.747 -30.446 253 HG3 GLU 35 2HG GLU 35 -10.050 -3.491 -32.028 254 H ARG 36 H ARG 36 -10.192 1.893 -32.484 255 HA ARG 36 HA ARG 36 -7.500 2.302 -33.553 256 HB2 ARG 36 1HB ARG 36 -9.772 2.342 -34.895 257 HB3 ARG 36 2HB ARG 36 -9.833 4.004 -34.322 258 HG2 ARG 36 1HG ARG 36 -7.522 4.292 -35.300 259 HG3 ARG 36 2HG ARG 36 -7.760 2.726 -36.078 260 HD2 ARG 36 1HD ARG 36 -9.611 3.532 -37.326 261 HD3 ARG 36 2HD ARG 36 -9.688 5.016 -36.377 262 HE ARG 36 HE ARG 36 -7.202 4.651 -37.779 263 HH11 ARG 36 1HH1 ARG 36 -10.455 5.876 -37.970 264 HH12 ARG 36 2HH1 ARG 36 -10.096 7.004 -39.235 265 HH21 ARG 36 1HH2 ARG 36 -6.716 6.133 -39.444 266 HH22 ARG 36 2HH2 ARG 36 -7.968 7.148 -40.074 267 H GLU 37 H GLU 37 -9.785 3.669 -31.334 268 HA GLU 37 HA GLU 37 -8.427 6.216 -31.156 269 HB2 GLU 37 1HB GLU 37 -10.778 4.977 -29.760 270 HB3 GLU 37 2HB GLU 37 -10.040 6.443 -29.131 271 HG2 GLU 37 1HG GLU 37 -10.508 6.704 -31.949 272 HG3 GLU 37 2HG GLU 37 -11.988 6.223 -31.123 273 H LYS 38 H LYS 38 -8.231 3.126 -29.676 274 HA LYS 38 HA LYS 38 -6.910 2.266 -28.036 275 HB2 LYS 38 1HB LYS 38 -5.373 4.852 -28.340 276 HB3 LYS 38 2HB LYS 38 -4.786 3.382 -27.573 277 HG2 LYS 38 1HG LYS 38 -5.710 3.233 -30.394 278 HG3 LYS 38 2HG LYS 38 -4.152 3.988 -30.050 279 HD2 LYS 38 1HD LYS 38 -3.410 1.975 -28.902 280 HD3 LYS 38 2HD LYS 38 -4.983 1.221 -29.173 281 HE2 LYS 38 1HE LYS 38 -4.630 1.087 -31.498 282 HE3 LYS 38 2HE LYS 38 -3.271 2.207 -31.437 283 HZ1 LYS 38 1HZ LYS 38 -2.422 0.016 -31.702 284 HZ2 LYS 38 2HZ LYS 38 -3.340 -0.575 -30.411 285 HZ3 LYS 38 3HZ LYS 38 -2.068 0.502 -30.121 286 H ILE 39 H ILE 39 -9.229 3.514 -27.179 287 HA ILE 39 HA ILE 39 -8.991 5.438 -25.194 288 HB ILE 39 HB ILE 39 -10.913 3.108 -25.253 289 HG12 ILE 39 1HG1 ILE 39 -11.044 4.430 -27.293 290 HG13 ILE 39 2HG1 ILE 39 -12.461 4.738 -26.295 291 HG21 ILE 39 1HG2 ILE 39 -12.026 5.430 -24.068 292 HG22 ILE 39 2HG2 ILE 39 -11.717 3.860 -23.329 293 HG23 ILE 39 3HG2 ILE 39 -10.476 5.112 -23.288 294 HD11 ILE 39 1HD1 ILE 39 -11.414 6.818 -25.504 295 HD12 ILE 39 2HD1 ILE 39 -10.054 6.517 -26.587 296 HD13 ILE 39 3HD1 ILE 39 -11.665 6.794 -27.249 297 H SER 40 H SER 40 -7.596 5.382 -23.556 298 HA SER 40 HA SER 40 -6.793 2.891 -22.336 299 HB2 SER 40 1HB SER 40 -5.581 4.662 -20.774 300 HB3 SER 40 2HB SER 40 -4.977 4.308 -22.392 301 HG SER 40 HG SER 40 -5.226 6.361 -22.728 302 H GLY 41 H GLY 41 -6.919 2.493 -20.030 303 HA2 GLY 41 1HA GLY 41 -9.501 2.680 -19.004 304 HA3 GLY 41 2HA GLY 41 -8.071 2.303 -18.054 305 H ASP 42 H ASP 42 -6.657 4.666 -18.244 306 HA ASP 42 HA ASP 42 -7.701 6.197 -16.198 307 HB2 ASP 42 1HB ASP 42 -6.146 8.032 -17.180 308 HB3 ASP 42 2HB ASP 42 -5.430 6.530 -16.602 309 H GLN 43 H GLN 43 -8.328 6.375 -19.623 310 HA GLN 43 HA GLN 43 -9.720 8.910 -19.408 311 HB2 GLN 43 1HB GLN 43 -9.155 7.019 -21.678 312 HB3 GLN 43 2HB GLN 43 -10.277 8.361 -21.862 313 HG2 GLN 43 1HG GLN 43 -7.990 9.471 -20.719 314 HG3 GLN 43 2HG GLN 43 -7.404 8.346 -21.943 315 HE21 GLN 43 2HE2 GLN 43 -9.307 8.508 -23.862 316 HE22 GLN 43 1HE2 GLN 43 -9.357 10.103 -24.524 317 H LEU 44 H LEU 44 -10.478 5.492 -19.742 318 HA LEU 44 HA LEU 44 -13.243 5.784 -20.239 319 HB2 LEU 44 1HB LEU 44 -12.158 3.711 -20.725 320 HB3 LEU 44 2HB LEU 44 -11.641 3.530 -19.049 321 HG LEU 44 HG LEU 44 -14.418 3.662 -18.916 322 HD11 LEU 44 1HD1 LEU 44 -13.943 1.510 -20.873 323 HD12 LEU 44 2HD1 LEU 44 -13.985 3.151 -21.517 324 HD13 LEU 44 3HD1 LEU 44 -15.364 2.522 -20.615 325 HD21 LEU 44 1HD2 LEU 44 -13.448 2.215 -17.443 326 HD22 LEU 44 2HD2 LEU 44 -12.322 1.573 -18.640 327 HD23 LEU 44 3HD2 LEU 44 -14.011 1.064 -18.655 328 H LEU 45 H LEU 45 -11.430 5.194 -17.238 329 HA LEU 45 HA LEU 45 -13.582 5.031 -15.486 330 HB2 LEU 45 1HB LEU 45 -10.904 4.869 -15.227 331 HB3 LEU 45 2HB LEU 45 -11.189 6.452 -14.506 332 HG LEU 45 HG LEU 45 -12.754 5.413 -12.908 333 HD11 LEU 45 1HD1 LEU 45 -12.143 2.738 -12.947 334 HD12 LEU 45 2HD1 LEU 45 -12.339 3.121 -14.657 335 HD13 LEU 45 3HD1 LEU 45 -13.645 3.462 -13.522 336 HD21 LEU 45 1HD2 LEU 45 -11.032 5.156 -11.527 337 HD22 LEU 45 2HD2 LEU 45 -9.971 5.310 -12.928 338 HD23 LEU 45 3HD2 LEU 45 -10.483 3.713 -12.380 339 H ARG 46 H ARG 46 -12.189 7.782 -17.063 340 HA ARG 46 HA ARG 46 -14.015 9.539 -15.558 341 HB2 ARG 46 1HB ARG 46 -12.464 11.349 -15.798 342 HB3 ARG 46 2HB ARG 46 -11.586 9.973 -15.143 343 HG2 ARG 46 1HG ARG 46 -10.901 9.483 -17.552 344 HG3 ARG 46 2HG ARG 46 -11.481 11.110 -17.914 345 HD2 ARG 46 1HD ARG 46 -9.712 10.938 -15.582 346 HD3 ARG 46 2HD ARG 46 -8.952 10.490 -17.108 347 HE ARG 46 HE ARG 46 -10.253 12.832 -17.645 348 HH11 ARG 46 1HH1 ARG 46 -7.859 11.807 -15.335 349 HH12 ARG 46 2HH1 ARG 46 -7.109 13.365 -15.224 350 HH21 ARG 46 1HH2 ARG 46 -9.275 14.888 -17.509 351 HH22 ARG 46 2HH2 ARG 46 -7.916 15.117 -16.460 352 H ILE 47 H ILE 47 -14.497 7.990 -18.015 353 HA ILE 47 HA ILE 47 -14.443 9.745 -20.252 354 HB ILE 47 HB ILE 47 -14.571 7.280 -20.464 355 HG12 ILE 47 1HG1 ILE 47 -16.955 7.758 -21.936 356 HG13 ILE 47 2HG1 ILE 47 -16.030 9.255 -21.933 357 HG21 ILE 47 1HG2 ILE 47 -16.239 6.025 -19.638 358 HG22 ILE 47 2HG2 ILE 47 -16.545 7.419 -18.603 359 HG23 ILE 47 3HG2 ILE 47 -17.477 7.199 -20.083 360 HD11 ILE 47 1HD1 ILE 47 -14.048 7.805 -22.643 361 HD12 ILE 47 2HD1 ILE 47 -15.257 6.574 -23.009 362 HD13 ILE 47 3HD1 ILE 47 -15.307 8.133 -23.833 363 H THR 48 H THR 48 -15.885 11.210 -20.954 364 HA THR 48 HA THR 48 -18.378 11.515 -19.408 365 HB THR 48 HB THR 48 -16.813 13.362 -18.986 366 HG1 THR 48 HG1 THR 48 -18.305 15.028 -19.523 367 HG21 THR 48 1HG2 THR 48 -17.122 14.226 -21.841 368 HG22 THR 48 2HG2 THR 48 -15.811 13.146 -21.365 369 HG23 THR 48 3HG2 THR 48 -15.941 14.749 -20.642 370 H HIS 49 H HIS 49 -20.096 12.738 -20.638 371 HA HIS 49 HA HIS 49 -20.851 11.349 -22.918 372 HB2 HIS 49 1HB HIS 49 -21.802 13.704 -21.458 373 HB3 HIS 49 2HB HIS 49 -22.185 13.746 -23.176 374 HD1 HIS 49 HD1 HIS 49 -22.808 11.697 -20.079 375 HD2 HIS 49 HD2 HIS 49 -24.191 12.030 -23.982 376 HE1 HIS 49 HE1 HIS 49 -24.861 10.250 -20.190 377 H GLN 50 H GLN 50 -18.972 14.289 -22.593 378 HA GLN 50 HA GLN 50 -19.070 15.070 -25.316 379 HB2 GLN 50 1HB GLN 50 -17.901 16.034 -22.914 380 HB3 GLN 50 2HB GLN 50 -16.617 15.906 -24.109 381 HG2 GLN 50 1HG GLN 50 -17.289 17.780 -25.060 382 HG3 GLN 50 2HG GLN 50 -18.878 17.077 -25.362 383 HE21 GLN 50 2HE2 GLN 50 -20.580 17.787 -24.229 384 HE22 GLN 50 1HE2 GLN 50 -20.500 18.945 -22.950 385 H GLU 51 H GLU 51 -17.070 12.846 -23.513 386 HA GLU 51 HA GLU 51 -15.085 12.560 -25.565 387 HB2 GLU 51 1HB GLU 51 -15.705 11.044 -23.039 388 HB3 GLU 51 2HB GLU 51 -14.468 10.499 -24.162 389 HG2 GLU 51 1HG GLU 51 -14.414 13.297 -23.129 390 HG3 GLU 51 2HG GLU 51 -13.816 11.971 -22.133 391 H LEU 52 H LEU 52 -17.832 10.618 -24.431 392 HA LEU 52 HA LEU 52 -17.541 8.423 -26.098 393 HB2 LEU 52 1HB LEU 52 -19.945 9.756 -24.904 394 HB3 LEU 52 2HB LEU 52 -20.112 8.340 -25.940 395 HG LEU 52 HG LEU 52 -18.521 8.415 -23.377 396 HD11 LEU 52 1HD1 LEU 52 -20.356 7.914 -22.222 397 HD12 LEU 52 2HD1 LEU 52 -20.893 6.746 -23.429 398 HD13 LEU 52 3HD1 LEU 52 -21.271 8.457 -23.629 399 HD21 LEU 52 1HD2 LEU 52 -19.360 6.122 -25.149 400 HD22 LEU 52 2HD2 LEU 52 -18.502 5.985 -23.614 401 HD23 LEU 52 3HD2 LEU 52 -17.726 6.766 -24.992 402 H GLU 53 H GLU 53 -19.212 11.489 -26.720 403 HA GLU 53 HA GLU 53 -20.336 10.923 -29.181 404 HB2 GLU 53 1HB GLU 53 -20.179 13.138 -27.619 405 HB3 GLU 53 2HB GLU 53 -19.121 13.602 -28.943 406 HG2 GLU 53 1HG GLU 53 -21.053 12.866 -30.468 407 HG3 GLU 53 2HG GLU 53 -22.039 12.950 -29.010 408 H ASP 54 H ASP 54 -17.012 11.603 -28.366 409 HA ASP 54 HA ASP 54 -16.117 12.075 -31.033 410 HB2 ASP 54 1HB ASP 54 -14.961 12.759 -28.849 411 HB3 ASP 54 2HB ASP 54 -14.389 11.095 -28.767 412 H LEU 55 H LEU 55 -16.320 9.241 -28.950 413 HA LEU 55 HA LEU 55 -14.863 7.491 -30.633 414 HB2 LEU 55 1HB LEU 55 -16.737 7.171 -28.342 415 HB3 LEU 55 2HB LEU 55 -16.353 5.757 -29.321 416 HG LEU 55 HG LEU 55 -14.985 5.986 -27.252 417 HD11 LEU 55 1HD1 LEU 55 -14.236 5.200 -29.794 418 HD12 LEU 55 2HD1 LEU 55 -13.387 4.839 -28.291 419 HD13 LEU 55 3HD1 LEU 55 -12.909 6.232 -29.260 420 HD21 LEU 55 1HD2 LEU 55 -13.396 8.124 -28.574 421 HD22 LEU 55 2HD2 LEU 55 -13.565 7.732 -26.862 422 HD23 LEU 55 3HD2 LEU 55 -14.860 8.584 -27.704 423 H GLY 56 H GLY 56 -18.176 8.569 -30.586 424 HA2 GLY 56 1HA GLY 56 -19.105 8.355 -32.963 425 HA3 GLY 56 2HA GLY 56 -18.839 6.637 -32.712 426 H VAL 57 H VAL 57 -19.610 7.157 -29.784 427 HA VAL 57 HA VAL 57 -22.302 6.333 -30.014 428 HB VAL 57 HB VAL 57 -20.994 7.488 -27.551 429 HG11 VAL 57 1HG1 VAL 57 -23.564 6.949 -27.803 430 HG12 VAL 57 2HG1 VAL 57 -23.009 5.299 -27.514 431 HG13 VAL 57 3HG1 VAL 57 -22.687 6.561 -26.324 432 HG21 VAL 57 1HG2 VAL 57 -19.511 5.819 -27.847 433 HG22 VAL 57 2HG2 VAL 57 -20.817 4.809 -27.227 434 HG23 VAL 57 3HG2 VAL 57 -20.557 4.944 -28.966 435 H SER 58 H SER 58 -23.507 7.826 -31.159 436 HA SER 58 HA SER 58 -23.646 10.572 -30.194 437 HB2 SER 58 1HB SER 58 -24.453 11.129 -32.250 438 HB3 SER 58 2HB SER 58 -23.732 9.587 -32.710 439 HG SER 58 HG SER 58 -25.970 9.903 -33.363 440 H ARG 59 H ARG 59 -25.691 7.708 -30.492 441 HA ARG 59 HA ARG 59 -28.131 8.763 -29.723 442 HB2 ARG 59 1HB ARG 59 -27.008 6.179 -30.062 443 HB3 ARG 59 2HB ARG 59 -27.817 6.196 -28.501 444 HG2 ARG 59 1HG ARG 59 -29.659 5.708 -29.654 445 HG3 ARG 59 2HG ARG 59 -29.656 7.411 -30.117 446 HD2 ARG 59 1HD ARG 59 -28.094 5.403 -31.693 447 HD3 ARG 59 2HD ARG 59 -29.827 5.590 -31.955 448 HE ARG 59 HE ARG 59 -27.745 7.424 -32.725 449 HH11 ARG 59 1HH1 ARG 59 -31.133 7.043 -32.024 450 HH12 ARG 59 2HH1 ARG 59 -31.614 8.426 -32.950 451 HH21 ARG 59 1HH2 ARG 59 -28.365 9.247 -33.948 452 HH22 ARG 59 2HH2 ARG 59 -30.039 9.678 -34.045 453 H ILE 60 H ILE 60 -29.237 8.159 -27.565 454 HA ILE 60 HA ILE 60 -27.556 9.239 -25.419 455 HB ILE 60 HB ILE 60 -30.563 8.969 -25.505 456 HG12 ILE 60 1HG1 ILE 60 -29.749 10.548 -27.197 457 HG13 ILE 60 2HG1 ILE 60 -30.579 11.394 -25.896 458 HG21 ILE 60 1HG2 ILE 60 -29.702 10.963 -23.704 459 HG22 ILE 60 2HG2 ILE 60 -30.501 9.435 -23.338 460 HG23 ILE 60 3HG2 ILE 60 -28.740 9.520 -23.381 461 HD11 ILE 60 1HD1 ILE 60 -27.893 11.321 -25.145 462 HD12 ILE 60 2HD1 ILE 60 -27.903 11.715 -26.864 463 HD13 ILE 60 3HD1 ILE 60 -28.813 12.709 -25.726 464 H GLY 61 H GLY 61 -29.976 6.685 -25.982 465 HA2 GLY 61 1HA GLY 61 -29.817 5.429 -23.502 466 HA3 GLY 61 2HA GLY 61 -30.249 4.626 -25.005 467 H HIS 62 H HIS 62 -27.617 5.298 -26.204 468 HA HIS 62 HA HIS 62 -26.217 2.970 -25.262 469 HB2 HIS 62 1HB HIS 62 -25.415 5.020 -27.338 470 HB3 HIS 62 2HB HIS 62 -24.618 3.474 -27.062 471 HD1 HIS 62 HD1 HIS 62 -26.085 4.443 -29.741 472 HD2 HIS 62 HD2 HIS 62 -27.562 1.784 -26.912 473 HE1 HIS 62 HE1 HIS 62 -27.787 3.046 -30.956 474 H GLN 63 H GLN 63 -25.547 6.460 -25.352 475 HA GLN 63 HA GLN 63 -23.027 6.475 -24.229 476 HB2 GLN 63 1HB GLN 63 -25.294 8.445 -23.964 477 HB3 GLN 63 2HB GLN 63 -23.686 8.755 -23.324 478 HG2 GLN 63 1HG GLN 63 -22.727 8.677 -25.510 479 HG3 GLN 63 2HG GLN 63 -24.252 8.139 -26.212 480 HE21 GLN 63 2HE2 GLN 63 -22.408 10.598 -26.427 481 HE22 GLN 63 1HE2 GLN 63 -23.516 11.923 -26.371 482 H GLU 64 H GLU 64 -26.136 6.052 -22.675 483 HA GLU 64 HA GLU 64 -25.016 6.232 -20.012 484 HB2 GLU 64 1HB GLU 64 -27.749 5.785 -21.143 485 HB3 GLU 64 2HB GLU 64 -27.431 5.342 -19.472 486 HG2 GLU 64 1HG GLU 64 -26.379 7.925 -19.835 487 HG3 GLU 64 2HG GLU 64 -27.974 7.911 -20.587 488 H LEU 65 H LEU 65 -25.779 3.783 -22.347 489 HA LEU 65 HA LEU 65 -25.964 1.547 -20.661 490 HB2 LEU 65 1HB LEU 65 -25.562 2.056 -23.513 491 HB3 LEU 65 2HB LEU 65 -24.822 0.560 -22.945 492 HG LEU 65 HG LEU 65 -27.729 1.257 -22.552 493 HD11 LEU 65 1HD1 LEU 65 -26.378 0.453 -24.924 494 HD12 LEU 65 2HD1 LEU 65 -28.105 0.695 -24.661 495 HD13 LEU 65 3HD1 LEU 65 -27.381 -0.885 -24.363 496 HD21 LEU 65 1HD2 LEU 65 -26.724 -0.347 -20.952 497 HD22 LEU 65 2HD2 LEU 65 -26.279 -1.376 -22.313 498 HD23 LEU 65 3HD2 LEU 65 -27.980 -1.062 -21.964 499 H ILE 66 H ILE 66 -23.165 2.945 -22.349 500 HA ILE 66 HA ILE 66 -21.294 1.059 -21.362 501 HB ILE 66 HB ILE 66 -20.735 3.873 -22.302 502 HG12 ILE 66 1HG1 ILE 66 -20.757 1.315 -23.917 503 HG13 ILE 66 2HG1 ILE 66 -22.050 2.509 -23.933 504 HG21 ILE 66 1HG2 ILE 66 -18.627 3.393 -21.799 505 HG22 ILE 66 2HG2 ILE 66 -19.065 1.751 -21.333 506 HG23 ILE 66 3HG2 ILE 66 -18.672 2.115 -23.013 507 HD11 ILE 66 1HD1 ILE 66 -20.987 3.695 -25.462 508 HD12 ILE 66 2HD1 ILE 66 -19.545 3.789 -24.451 509 HD13 ILE 66 3HD1 ILE 66 -19.767 2.424 -25.545 510 H LEU 67 H LEU 67 -22.051 4.397 -20.382 511 HA LEU 67 HA LEU 67 -20.229 4.593 -18.281 512 HB2 LEU 67 1HB LEU 67 -22.946 5.866 -18.568 513 HB3 LEU 67 2HB LEU 67 -21.721 6.354 -17.398 514 HG LEU 67 HG LEU 67 -21.307 6.466 -20.381 515 HD11 LEU 67 1HD1 LEU 67 -22.872 8.185 -18.666 516 HD12 LEU 67 2HD1 LEU 67 -22.691 8.203 -20.420 517 HD13 LEU 67 3HD1 LEU 67 -21.528 9.056 -19.405 518 HD21 LEU 67 1HD2 LEU 67 -19.534 8.096 -19.671 519 HD22 LEU 67 2HD2 LEU 67 -19.237 6.419 -19.210 520 HD23 LEU 67 3HD2 LEU 67 -19.817 7.575 -18.010 521 H GLU 68 H GLU 68 -23.633 3.561 -18.226 522 HA GLU 68 HA GLU 68 -23.938 3.136 -15.516 523 HB2 GLU 68 1HB GLU 68 -25.730 2.952 -17.251 524 HB3 GLU 68 2HB GLU 68 -25.077 1.382 -17.696 525 HG2 GLU 68 1HG GLU 68 -26.502 0.534 -16.223 526 HG3 GLU 68 2HG GLU 68 -25.413 1.154 -14.982 527 H ALA 69 H ALA 69 -22.223 1.218 -17.866 528 HA ALA 69 HA ALA 69 -21.912 -1.048 -16.097 529 HB1 ALA 69 1HB ALA 69 -20.426 -0.551 -18.665 530 HB2 ALA 69 2HB ALA 69 -20.736 -2.092 -17.864 531 HB3 ALA 69 3HB ALA 69 -22.064 -1.204 -18.612 532 H VAL 70 H VAL 70 -20.097 1.787 -17.036 533 HA VAL 70 HA VAL 70 -17.562 0.989 -16.090 534 HB VAL 70 HB VAL 70 -18.710 3.776 -16.299 535 HG11 VAL 70 1HG1 VAL 70 -16.280 4.416 -16.464 536 HG12 VAL 70 2HG1 VAL 70 -16.814 3.873 -14.872 537 HG13 VAL 70 3HG1 VAL 70 -15.893 2.787 -15.913 538 HG21 VAL 70 1HG2 VAL 70 -18.621 3.420 -18.496 539 HG22 VAL 70 2HG2 VAL 70 -16.866 3.353 -18.337 540 HG23 VAL 70 3HG2 VAL 70 -17.814 1.867 -18.279 541 H ASP 71 H ASP 71 -20.288 2.599 -14.528 542 HA ASP 71 HA ASP 71 -19.127 3.373 -12.144 543 HB2 ASP 71 1HB ASP 71 -21.593 3.586 -13.068 544 HB3 ASP 71 2HB ASP 71 -21.854 2.152 -12.081 545 H LEU 72 H LEU 72 -20.175 0.185 -13.169 546 HA LEU 72 HA LEU 72 -19.929 -1.051 -10.615 547 HB2 LEU 72 1HB LEU 72 -20.182 -2.028 -13.427 548 HB3 LEU 72 2HB LEU 72 -19.761 -3.159 -12.143 549 HG LEU 72 HG LEU 72 -22.207 -1.434 -11.946 550 HD11 LEU 72 1HD1 LEU 72 -21.806 -3.920 -13.553 551 HD12 LEU 72 2HD1 LEU 72 -22.709 -2.459 -13.952 552 HD13 LEU 72 3HD1 LEU 72 -23.359 -3.605 -12.779 553 HD21 LEU 72 1HD2 LEU 72 -21.244 -3.986 -10.689 554 HD22 LEU 72 2HD2 LEU 72 -22.936 -3.491 -10.630 555 HD23 LEU 72 3HD2 LEU 72 -21.692 -2.472 -9.904 556 H LEU 73 H LEU 73 -17.770 -0.607 -13.362 557 HA LEU 73 HA LEU 73 -15.715 -2.335 -12.582 558 HB2 LEU 73 1HB LEU 73 -15.970 0.007 -14.360 559 HB3 LEU 73 2HB LEU 73 -14.338 -0.384 -13.820 560 HG LEU 73 HG LEU 73 -16.155 -2.356 -15.196 561 HD11 LEU 73 1HD1 LEU 73 -14.658 -1.923 -17.171 562 HD12 LEU 73 2HD1 LEU 73 -14.098 -0.478 -16.332 563 HD13 LEU 73 3HD1 LEU 73 -15.796 -0.633 -16.781 564 HD21 LEU 73 1HD2 LEU 73 -13.982 -2.868 -13.699 565 HD22 LEU 73 2HD2 LEU 73 -13.213 -2.577 -15.259 566 HD23 LEU 73 3HD2 LEU 73 -14.447 -3.829 -15.104 567 H CYS 74 H CYS 74 -16.445 0.971 -11.631 568 HA CYS 74 HA CYS 74 -14.008 1.270 -10.120 569 HB2 CYS 74 1HB CYS 74 -15.013 3.232 -11.151 570 HB3 CYS 74 2HB CYS 74 -16.502 2.976 -10.250 571 HG CYS 74 HG CYS 74 -13.591 3.485 -8.566 572 H ALA 75 H ALA 75 -17.458 0.894 -9.351 573 HA ALA 75 HA ALA 75 -17.317 0.973 -6.590 574 HB1 ALA 75 1HB ALA 75 -19.144 -0.991 -7.893 575 HB2 ALA 75 2HB ALA 75 -19.454 0.130 -6.567 576 HB3 ALA 75 3HB ALA 75 -19.347 0.730 -8.221 577 H LEU 76 H LEU 76 -17.110 -1.911 -8.678 578 HA LEU 76 HA LEU 76 -16.709 -3.807 -6.692 579 HB2 LEU 76 1HB LEU 76 -16.320 -3.626 -9.568 580 HB3 LEU 76 2HB LEU 76 -15.151 -4.694 -8.793 581 HG LEU 76 HG LEU 76 -18.088 -5.008 -8.279 582 HD11 LEU 76 1HD1 LEU 76 -16.542 -6.195 -10.579 583 HD12 LEU 76 2HD1 LEU 76 -17.838 -5.005 -10.700 584 HD13 LEU 76 3HD1 LEU 76 -18.185 -6.628 -10.104 585 HD21 LEU 76 1HD2 LEU 76 -16.145 -6.159 -6.996 586 HD22 LEU 76 2HD2 LEU 76 -16.024 -7.166 -8.439 587 HD23 LEU 76 3HD2 LEU 76 -17.529 -7.118 -7.520 588 H ASN 77 H ASN 77 -14.503 -1.481 -8.042 589 HA ASN 77 HA ASN 77 -12.306 -2.648 -6.469 590 HB2 ASN 77 1HB ASN 77 -12.381 -1.095 -9.021 591 HB3 ASN 77 2HB ASN 77 -10.966 -0.941 -7.983 592 HD21 ASN 77 2HD2 ASN 77 -12.079 -2.496 -10.575 593 HD22 ASN 77 1HD2 ASN 77 -11.194 -3.976 -10.463 594 H SER 78 H SER 78 -13.572 -1.560 -4.661 595 HA SER 78 HA SER 78 -12.170 0.714 -3.792 596 HB2 SER 78 1HB SER 78 -14.145 2.306 -3.735 597 HB3 SER 78 2HB SER 78 -13.443 2.026 -5.329 598 HG SER 78 HG SER 78 -15.602 0.463 -4.421 599 H GLY 79 H GLY 79 -12.966 1.523 -1.693 600 HA2 GLY 79 1HA GLY 79 -14.450 1.279 0.189 601 HA3 GLY 79 2HA GLY 79 -14.817 -0.347 -0.367 602 HA PRO 80 HA PRO 80 -10.395 -0.485 1.623 603 HB2 PRO 80 1HB PRO 80 -9.705 1.676 3.114 604 HB3 PRO 80 2HB PRO 80 -9.329 1.537 1.393 605 HG2 PRO 80 1HG PRO 80 -11.562 3.015 2.731 606 HG3 PRO 80 2HG PRO 80 -10.527 3.531 1.387 607 HD2 PRO 80 1HD PRO 80 -13.038 2.588 1.013 608 HD3 PRO 80 2HD PRO 80 -11.737 2.336 -0.169 609 H SER 81 H SER 81 -12.000 -1.885 2.749 610 HA SER 81 HA SER 81 -12.805 -2.827 4.657 611 HB2 SER 81 1HB SER 81 -10.443 -1.600 5.402 612 HB3 SER 81 2HB SER 81 -11.604 -0.964 6.568 613 HG SER 81 HG SER 81 -11.470 -2.814 7.529 614 H SER 82 H SER 82 -13.811 -2.049 6.954 615 HA SER 82 HA SER 82 -15.915 -0.179 6.174 616 HB2 SER 82 1HB SER 82 -16.587 -1.152 8.675 617 HB3 SER 82 2HB SER 82 -17.147 -1.801 7.134 618 HG SER 82 HG SER 82 -15.493 -2.911 8.958 619 H GLY 83 H GLY 83 -13.862 -0.797 9.029 620 HA2 GLY 83 1HA GLY 83 -12.679 0.811 10.259 621 HA3 GLY 83 2HA GLY 83 -13.539 2.075 9.393 Start of MODEL 11 1 H1 GLY 1 H GLY 1 6.491 5.194 -8.752 2 HA2 GLY 1 1HA GLY 1 5.893 2.659 -8.722 3 HA3 GLY 1 2HA GLY 1 6.163 3.458 -7.180 4 H SER 2 H SER 2 4.277 4.302 -6.045 5 HA SER 2 HA SER 2 1.697 3.229 -6.864 6 HB2 SER 2 1HB SER 2 3.086 2.436 -4.297 7 HB3 SER 2 2HB SER 2 1.362 2.203 -4.585 8 HG SER 2 HG SER 2 3.474 0.741 -5.464 9 H SER 3 H SER 3 0.458 4.980 -6.791 10 HA SER 3 HA SER 3 0.702 6.770 -4.460 11 HB2 SER 3 1HB SER 3 1.343 7.694 -6.771 12 HB3 SER 3 2HB SER 3 -0.380 7.622 -7.143 13 HG SER 3 HG SER 3 -0.682 8.932 -5.216 14 H GLY 4 H GLY 4 -1.630 5.779 -6.978 15 HA2 GLY 4 1HA GLY 4 -3.830 6.304 -5.133 16 HA3 GLY 4 2HA GLY 4 -3.974 5.912 -6.840 17 H SER 5 H SER 5 -5.586 4.367 -6.373 18 HA SER 5 HA SER 5 -4.526 1.752 -5.806 19 HB2 SER 5 1HB SER 5 -6.619 2.930 -3.961 20 HB3 SER 5 2HB SER 5 -6.085 1.249 -3.958 21 HG SER 5 HG SER 5 -4.065 1.908 -3.296 22 H SER 6 H SER 6 -5.272 1.799 -8.080 23 HA SER 6 HA SER 6 -7.836 0.549 -8.296 24 HB2 SER 6 1HB SER 6 -7.512 3.399 -9.056 25 HB3 SER 6 2HB SER 6 -8.382 2.377 -10.200 26 HG SER 6 HG SER 6 -10.020 2.422 -8.901 27 H GLY 7 H GLY 7 -7.783 -0.894 -9.908 28 HA2 GLY 7 1HA GLY 7 -5.430 -0.979 -11.601 29 HA3 GLY 7 2HA GLY 7 -6.675 -2.213 -11.478 30 H VAL 8 H VAL 8 -8.930 -0.637 -12.032 31 HA VAL 8 HA VAL 8 -9.036 -0.743 -14.808 32 HB VAL 8 HB VAL 8 -10.744 1.031 -13.061 33 HG11 VAL 8 1HG1 VAL 8 -10.997 1.474 -15.433 34 HG12 VAL 8 2HG1 VAL 8 -11.256 -0.243 -15.747 35 HG13 VAL 8 3HG1 VAL 8 -12.436 0.670 -14.807 36 HG21 VAL 8 1HG2 VAL 8 -10.857 -1.917 -13.608 37 HG22 VAL 8 2HG2 VAL 8 -10.926 -1.076 -12.060 38 HG23 VAL 8 3HG2 VAL 8 -12.300 -1.006 -13.163 39 H SER 9 H SER 9 -7.861 1.752 -12.719 40 HA SER 9 HA SER 9 -8.035 3.898 -14.591 41 HB2 SER 9 1HB SER 9 -6.737 5.161 -13.016 42 HB3 SER 9 2HB SER 9 -7.847 4.153 -12.086 43 HG SER 9 HG SER 9 -5.877 2.629 -12.192 44 H LYS 10 H LYS 10 -5.762 1.350 -13.991 45 HA LYS 10 HA LYS 10 -3.834 2.576 -15.841 46 HB2 LYS 10 1HB LYS 10 -3.429 0.200 -14.017 47 HB3 LYS 10 2HB LYS 10 -2.192 1.027 -14.955 48 HG2 LYS 10 1HG LYS 10 -3.328 3.036 -13.429 49 HG3 LYS 10 2HG LYS 10 -3.262 1.648 -12.341 50 HD2 LYS 10 1HD LYS 10 -1.211 2.848 -12.108 51 HD3 LYS 10 2HD LYS 10 -0.860 1.362 -12.993 52 HE2 LYS 10 1HE LYS 10 -0.946 2.623 -15.102 53 HE3 LYS 10 2HE LYS 10 -1.250 4.102 -14.193 54 HZ1 LYS 10 1HZ LYS 10 1.220 2.779 -14.712 55 HZ2 LYS 10 2HZ LYS 10 0.996 3.026 -13.054 56 HZ3 LYS 10 3HZ LYS 10 0.942 4.339 -14.119 57 H TRP 11 H TRP 11 -6.390 1.150 -16.510 58 HA TRP 11 HA TRP 11 -5.676 -1.360 -17.664 59 HB2 TRP 11 1HB TRP 11 -8.072 0.342 -17.524 60 HB3 TRP 11 2HB TRP 11 -7.939 -0.604 -19.004 61 HD1 TRP 11 HD1 TRP 11 -6.623 -2.071 -15.741 62 HE1 TRP 11 HE1 TRP 11 -8.117 -4.053 -15.060 63 HE3 TRP 11 HE3 TRP 11 -10.344 -1.509 -19.202 64 HZ2 TRP 11 HZ2 TRP 11 -10.550 -5.224 -15.882 65 HZ3 TRP 11 HZ3 TRP 11 -12.219 -3.103 -19.187 66 HH2 TRP 11 HH2 TRP 11 -12.318 -4.922 -17.561 67 H SER 12 H SER 12 -4.793 -1.794 -19.583 68 HA SER 12 HA SER 12 -3.633 0.184 -21.178 69 HB2 SER 12 1HB SER 12 -2.687 -1.554 -22.274 70 HB3 SER 12 2HB SER 12 -3.436 -2.544 -21.021 71 HG SER 12 HG SER 12 -4.116 -3.420 -22.901 72 HA PRO 13 HA PRO 13 -6.729 1.570 -23.959 73 HB2 PRO 13 1HB PRO 13 -5.380 1.731 -26.310 74 HB3 PRO 13 2HB PRO 13 -5.114 2.853 -24.971 75 HG2 PRO 13 1HG PRO 13 -3.520 0.450 -25.773 76 HG3 PRO 13 2HG PRO 13 -2.951 2.050 -25.262 77 HD2 PRO 13 1HD PRO 13 -2.996 -0.081 -23.593 78 HD3 PRO 13 2HD PRO 13 -3.251 1.582 -23.025 79 H SER 14 H SER 14 -5.085 -1.408 -24.651 80 HA SER 14 HA SER 14 -7.016 -2.149 -26.711 81 HB2 SER 14 1HB SER 14 -5.187 -4.265 -25.971 82 HB3 SER 14 2HB SER 14 -5.375 -3.447 -27.522 83 HG SER 14 HG SER 14 -3.654 -2.858 -25.388 84 H GLN 15 H GLN 15 -6.291 -2.716 -23.374 85 HA GLN 15 HA GLN 15 -7.685 -5.148 -23.031 86 HB2 GLN 15 1HB GLN 15 -6.833 -2.952 -21.170 87 HB3 GLN 15 2HB GLN 15 -7.834 -4.276 -20.589 88 HG2 GLN 15 1HG GLN 15 -5.378 -4.964 -22.099 89 HG3 GLN 15 2HG GLN 15 -5.195 -4.337 -20.462 90 HE21 GLN 15 2HE2 GLN 15 -4.878 -7.051 -21.829 91 HE22 GLN 15 1HE2 GLN 15 -5.710 -8.135 -20.772 92 H VAL 16 H VAL 16 -8.669 -1.765 -22.599 93 HA VAL 16 HA VAL 16 -11.217 -2.125 -21.605 94 HB VAL 16 HB VAL 16 -10.337 -0.029 -23.596 95 HG11 VAL 16 1HG1 VAL 16 -12.236 1.126 -22.018 96 HG12 VAL 16 2HG1 VAL 16 -12.527 0.458 -23.625 97 HG13 VAL 16 3HG1 VAL 16 -12.861 -0.514 -22.191 98 HG21 VAL 16 1HG2 VAL 16 -9.840 1.356 -21.699 99 HG22 VAL 16 2HG2 VAL 16 -10.441 0.127 -20.586 100 HG23 VAL 16 3HG2 VAL 16 -8.974 -0.170 -21.518 101 H VAL 17 H VAL 17 -10.049 -2.545 -24.875 102 HA VAL 17 HA VAL 17 -12.514 -2.572 -26.223 103 HB VAL 17 HB VAL 17 -10.073 -4.186 -26.964 104 HG11 VAL 17 1HG1 VAL 17 -12.369 -4.482 -28.129 105 HG12 VAL 17 2HG1 VAL 17 -12.004 -2.922 -28.868 106 HG13 VAL 17 3HG1 VAL 17 -10.921 -4.292 -29.117 107 HG21 VAL 17 1HG2 VAL 17 -10.717 -1.291 -27.499 108 HG22 VAL 17 2HG2 VAL 17 -9.347 -1.932 -26.593 109 HG23 VAL 17 3HG2 VAL 17 -9.454 -2.195 -28.334 110 H ASP 18 H ASP 18 -10.703 -5.119 -24.581 111 HA ASP 18 HA ASP 18 -12.362 -7.266 -25.392 112 HB2 ASP 18 1HB ASP 18 -9.995 -7.337 -24.359 113 HB3 ASP 18 2HB ASP 18 -10.821 -7.224 -22.808 114 H TRP 19 H TRP 19 -12.620 -4.865 -22.903 115 HA TRP 19 HA TRP 19 -14.495 -6.228 -21.258 116 HB2 TRP 19 1HB TRP 19 -13.247 -4.402 -20.320 117 HB3 TRP 19 2HB TRP 19 -13.830 -3.296 -21.561 118 HD1 TRP 19 HD1 TRP 19 -15.444 -5.493 -18.782 119 HE1 TRP 19 HE1 TRP 19 -17.364 -4.140 -17.730 120 HE3 TRP 19 HE3 TRP 19 -15.151 -1.288 -21.674 121 HZ2 TRP 19 HZ2 TRP 19 -18.592 -1.622 -18.080 122 HZ3 TRP 19 HZ3 TRP 19 -16.735 0.547 -21.251 123 HH2 TRP 19 HH2 TRP 19 -18.419 0.381 -19.491 124 H MET 20 H MET 20 -14.817 -3.872 -23.887 125 HA MET 20 HA MET 20 -17.601 -3.554 -23.747 126 HB2 MET 20 1HB MET 20 -15.829 -3.366 -26.189 127 HB3 MET 20 2HB MET 20 -17.443 -2.686 -26.028 128 HG2 MET 20 1HG MET 20 -15.408 -1.876 -24.034 129 HG3 MET 20 2HG MET 20 -15.249 -1.249 -25.673 130 HE1 MET 20 1HE MET 20 -18.226 -0.447 -26.731 131 HE2 MET 20 2HE MET 20 -17.968 1.203 -26.166 132 HE3 MET 20 3HE MET 20 -16.614 0.266 -26.799 133 H LYS 21 H LYS 21 -15.651 -6.125 -24.957 134 HA LYS 21 HA LYS 21 -17.497 -7.266 -26.775 135 HB2 LYS 21 1HB LYS 21 -15.251 -8.537 -25.200 136 HB3 LYS 21 2HB LYS 21 -16.129 -9.330 -26.501 137 HG2 LYS 21 1HG LYS 21 -15.391 -7.347 -27.947 138 HG3 LYS 21 2HG LYS 21 -14.237 -7.014 -26.654 139 HD2 LYS 21 1HD LYS 21 -13.124 -9.057 -26.973 140 HD3 LYS 21 2HD LYS 21 -14.455 -9.732 -27.915 141 HE2 LYS 21 1HE LYS 21 -13.973 -7.932 -29.629 142 HE3 LYS 21 2HE LYS 21 -12.490 -7.605 -28.734 143 HZ1 LYS 21 1HZ LYS 21 -12.992 -9.628 -30.628 144 HZ2 LYS 21 2HZ LYS 21 -12.605 -10.349 -29.147 145 HZ3 LYS 21 3HZ LYS 21 -11.538 -9.242 -29.853 146 H GLY 22 H GLY 22 -17.524 -7.027 -23.402 147 HA2 GLY 22 1HA GLY 22 -19.430 -9.277 -23.207 148 HA3 GLY 22 2HA GLY 22 -18.406 -8.747 -21.881 149 H LEU 23 H LEU 23 -19.847 -6.344 -23.897 150 HA LEU 23 HA LEU 23 -21.733 -5.707 -21.726 151 HB2 LEU 23 1HB LEU 23 -20.580 -3.796 -23.747 152 HB3 LEU 23 2HB LEU 23 -21.541 -3.394 -22.325 153 HG LEU 23 HG LEU 23 -18.717 -4.455 -22.355 154 HD11 LEU 23 1HD1 LEU 23 -18.006 -2.350 -22.047 155 HD12 LEU 23 2HD1 LEU 23 -19.377 -1.926 -21.023 156 HD13 LEU 23 3HD1 LEU 23 -19.550 -1.910 -22.778 157 HD21 LEU 23 1HD2 LEU 23 -19.174 -5.266 -20.331 158 HD22 LEU 23 2HD2 LEU 23 -20.758 -4.490 -20.292 159 HD23 LEU 23 3HD2 LEU 23 -19.322 -3.591 -19.800 160 H ASP 24 H ASP 24 -23.324 -3.875 -22.944 161 HA ASP 24 HA ASP 24 -25.248 -5.376 -24.232 162 HB2 ASP 24 1HB ASP 24 -25.146 -2.838 -23.304 163 HB3 ASP 24 2HB ASP 24 -25.103 -2.532 -25.038 164 H ASP 25 H ASP 25 -25.928 -5.563 -26.394 165 HA ASP 25 HA ASP 25 -23.849 -5.938 -28.271 166 HB2 ASP 25 1HB ASP 25 -26.428 -6.817 -28.051 167 HB3 ASP 25 2HB ASP 25 -26.564 -5.658 -29.370 168 H CYS 26 H CYS 26 -25.891 -3.246 -27.519 169 HA CYS 26 HA CYS 26 -25.600 -1.847 -29.977 170 HB2 CYS 26 1HB CYS 26 -26.308 -0.888 -27.199 171 HB3 CYS 26 2HB CYS 26 -26.358 0.132 -28.631 172 HG CYS 26 HG CYS 26 -28.816 -0.402 -29.099 173 H LEU 27 H LEU 27 -23.569 -2.296 -27.240 174 HA LEU 27 HA LEU 27 -21.888 -0.008 -27.924 175 HB2 LEU 27 1HB LEU 27 -21.332 -1.993 -25.748 176 HB3 LEU 27 2HB LEU 27 -20.800 -0.318 -25.875 177 HG LEU 27 HG LEU 27 -23.633 -1.206 -25.331 178 HD11 LEU 27 1HD1 LEU 27 -22.884 -1.568 -23.262 179 HD12 LEU 27 2HD1 LEU 27 -22.721 0.184 -23.143 180 HD13 LEU 27 3HD1 LEU 27 -21.331 -0.802 -23.595 181 HD21 LEU 27 1HD2 LEU 27 -22.313 1.472 -25.611 182 HD22 LEU 27 2HD2 LEU 27 -23.772 1.266 -24.641 183 HD23 LEU 27 3HD2 LEU 27 -23.794 0.878 -26.362 184 H GLN 28 H GLN 28 -22.199 -2.530 -29.559 185 HA GLN 28 HA GLN 28 -19.521 -3.669 -29.429 186 HB2 GLN 28 1HB GLN 28 -21.857 -4.333 -31.229 187 HB3 GLN 28 2HB GLN 28 -20.336 -5.214 -31.170 188 HG2 GLN 28 1HG GLN 28 -22.235 -4.916 -28.855 189 HG3 GLN 28 2HG GLN 28 -22.163 -6.312 -29.929 190 HE21 GLN 28 2HE2 GLN 28 -21.188 -5.147 -27.028 191 HE22 GLN 28 1HE2 GLN 28 -19.803 -6.144 -26.760 192 H GLN 29 H GLN 29 -21.584 -2.004 -31.802 193 HA GLN 29 HA GLN 29 -19.746 -1.832 -33.878 194 HB2 GLN 29 1HB GLN 29 -21.113 -0.095 -34.788 195 HB3 GLN 29 2HB GLN 29 -22.181 -1.242 -33.990 196 HG2 GLN 29 1HG GLN 29 -21.914 0.392 -31.962 197 HG3 GLN 29 2HG GLN 29 -21.475 1.543 -33.223 198 HE21 GLN 29 2HE2 GLN 29 -23.964 -0.821 -32.365 199 HE22 GLN 29 1HE2 GLN 29 -25.285 0.062 -33.043 200 H TYR 30 H TYR 30 -19.919 -0.073 -30.902 201 HA TYR 30 HA TYR 30 -18.243 2.101 -31.730 202 HB2 TYR 30 1HB TYR 30 -18.994 1.150 -28.958 203 HB3 TYR 30 2HB TYR 30 -18.185 2.669 -29.327 204 HD1 TYR 30 HD2 TYR 30 -19.709 3.552 -31.707 205 HD2 TYR 30 HD1 TYR 30 -21.050 1.803 -28.068 206 HE1 TYR 30 HE2 TYR 30 -21.892 4.648 -31.992 207 HE2 TYR 30 HE1 TYR 30 -23.238 2.893 -28.343 208 HH TYR 30 HH TYR 30 -23.990 4.799 -31.233 209 H ILE 31 H ILE 31 -17.746 -1.087 -30.473 210 HA ILE 31 HA ILE 31 -15.265 -0.913 -29.281 211 HB ILE 31 HB ILE 31 -16.225 -3.147 -31.073 212 HG12 ILE 31 1HG1 ILE 31 -16.527 -2.748 -28.088 213 HG13 ILE 31 2HG1 ILE 31 -17.819 -2.631 -29.277 214 HG21 ILE 31 1HG2 ILE 31 -14.701 -4.549 -29.741 215 HG22 ILE 31 2HG2 ILE 31 -13.848 -3.300 -30.646 216 HG23 ILE 31 3HG2 ILE 31 -14.120 -3.104 -28.915 217 HD11 ILE 31 1HD1 ILE 31 -16.257 -5.096 -28.551 218 HD12 ILE 31 2HD1 ILE 31 -17.942 -4.749 -28.162 219 HD13 ILE 31 3HD1 ILE 31 -17.459 -5.007 -29.838 220 H LYS 32 H LYS 32 -16.010 -1.295 -32.731 221 HA LYS 32 HA LYS 32 -13.399 -1.524 -33.683 222 HB2 LYS 32 1HB LYS 32 -15.766 -0.223 -35.043 223 HB3 LYS 32 2HB LYS 32 -14.301 -0.775 -35.844 224 HG2 LYS 32 1HG LYS 32 -15.165 -3.006 -34.471 225 HG3 LYS 32 2HG LYS 32 -16.658 -2.261 -35.045 226 HD2 LYS 32 1HD LYS 32 -16.152 -2.614 -37.236 227 HD3 LYS 32 2HD LYS 32 -14.414 -2.451 -36.972 228 HE2 LYS 32 1HE LYS 32 -14.306 -4.672 -37.126 229 HE3 LYS 32 2HE LYS 32 -15.094 -4.726 -35.550 230 HZ1 LYS 32 1HZ LYS 32 -16.078 -5.619 -38.018 231 HZ2 LYS 32 2HZ LYS 32 -17.071 -4.357 -37.486 232 HZ3 LYS 32 3HZ LYS 32 -16.817 -5.707 -36.499 233 H ASN 33 H ASN 33 -15.178 1.254 -32.591 234 HA ASN 33 HA ASN 33 -13.296 3.147 -33.717 235 HB2 ASN 33 1HB ASN 33 -15.751 3.411 -31.991 236 HB3 ASN 33 2HB ASN 33 -14.693 4.784 -32.303 237 HD21 ASN 33 2HD2 ASN 33 -17.464 4.398 -33.054 238 HD22 ASN 33 1HD2 ASN 33 -17.524 4.523 -34.776 239 H PHE 34 H PHE 34 -13.859 1.501 -30.707 240 HA PHE 34 HA PHE 34 -12.228 3.215 -29.101 241 HB2 PHE 34 1HB PHE 34 -13.595 0.595 -28.735 242 HB3 PHE 34 2HB PHE 34 -12.271 0.983 -27.640 243 HD1 PHE 34 HD2 PHE 34 -15.150 2.847 -29.122 244 HD2 PHE 34 HD1 PHE 34 -12.969 1.793 -25.622 245 HE1 PHE 34 HE2 PHE 34 -16.682 4.209 -27.761 246 HE2 PHE 34 HE1 PHE 34 -14.498 3.153 -24.255 247 HZ PHE 34 HZ PHE 34 -16.356 4.364 -25.325 248 H GLU 35 H GLU 35 -11.662 0.477 -31.156 249 HA GLU 35 HA GLU 35 -9.131 -0.268 -30.093 250 HB2 GLU 35 1HB GLU 35 -10.878 -1.185 -32.133 251 HB3 GLU 35 2HB GLU 35 -9.311 -0.901 -32.878 252 HG2 GLU 35 1HG GLU 35 -9.743 -2.569 -30.412 253 HG3 GLU 35 2HG GLU 35 -9.633 -3.211 -32.050 254 H ARG 36 H ARG 36 -10.149 1.840 -32.749 255 HA ARG 36 HA ARG 36 -7.451 2.476 -33.512 256 HB2 ARG 36 1HB ARG 36 -9.666 2.517 -34.930 257 HB3 ARG 36 2HB ARG 36 -9.798 4.154 -34.301 258 HG2 ARG 36 1HG ARG 36 -7.438 4.512 -35.177 259 HG3 ARG 36 2HG ARG 36 -7.658 2.998 -36.055 260 HD2 ARG 36 1HD ARG 36 -9.468 3.879 -37.303 261 HD3 ARG 36 2HD ARG 36 -9.592 5.292 -36.255 262 HE ARG 36 HE ARG 36 -7.062 5.387 -37.327 263 HH11 ARG 36 1HH1 ARG 36 -10.319 5.350 -38.555 264 HH12 ARG 36 2HH1 ARG 36 -9.935 6.275 -39.969 265 HH21 ARG 36 1HH2 ARG 36 -6.544 6.605 -39.185 266 HH22 ARG 36 2HH2 ARG 36 -7.787 6.987 -40.327 267 H GLU 37 H GLU 37 -9.835 3.771 -31.346 268 HA GLU 37 HA GLU 37 -8.530 6.329 -31.060 269 HB2 GLU 37 1HB GLU 37 -10.848 4.996 -29.681 270 HB3 GLU 37 2HB GLU 37 -10.179 6.510 -29.090 271 HG2 GLU 37 1HG GLU 37 -10.690 6.620 -31.930 272 HG3 GLU 37 2HG GLU 37 -12.139 6.192 -31.022 273 H LYS 38 H LYS 38 -8.280 3.206 -29.660 274 HA LYS 38 HA LYS 38 -6.987 2.335 -28.003 275 HB2 LYS 38 1HB LYS 38 -5.456 4.929 -28.274 276 HB3 LYS 38 2HB LYS 38 -4.870 3.455 -27.513 277 HG2 LYS 38 1HG LYS 38 -5.779 3.282 -30.330 278 HG3 LYS 38 2HG LYS 38 -4.252 4.103 -30.002 279 HD2 LYS 38 1HD LYS 38 -3.427 2.129 -28.834 280 HD3 LYS 38 2HD LYS 38 -4.965 1.309 -29.108 281 HE2 LYS 38 1HE LYS 38 -4.477 0.842 -31.260 282 HE3 LYS 38 2HE LYS 38 -3.659 2.382 -31.517 283 HZ1 LYS 38 1HZ LYS 38 -2.197 0.722 -29.731 284 HZ2 LYS 38 2HZ LYS 38 -1.699 1.430 -31.184 285 HZ3 LYS 38 3HZ LYS 38 -2.474 -0.074 -31.198 286 H ILE 39 H ILE 39 -9.310 3.513 -27.126 287 HA ILE 39 HA ILE 39 -9.055 5.428 -25.105 288 HB ILE 39 HB ILE 39 -11.055 3.171 -25.275 289 HG12 ILE 39 1HG1 ILE 39 -11.077 4.569 -27.277 290 HG13 ILE 39 2HG1 ILE 39 -12.520 4.866 -26.313 291 HG21 ILE 39 1HG2 ILE 39 -10.613 5.202 -23.290 292 HG22 ILE 39 2HG2 ILE 39 -12.191 5.413 -24.048 293 HG23 ILE 39 3HG2 ILE 39 -11.773 3.874 -23.294 294 HD11 ILE 39 1HD1 ILE 39 -10.066 6.605 -26.393 295 HD12 ILE 39 2HD1 ILE 39 -11.603 6.931 -27.196 296 HD13 ILE 39 3HD1 ILE 39 -11.517 6.905 -25.435 297 H SER 40 H SER 40 -7.728 5.284 -23.420 298 HA SER 40 HA SER 40 -7.054 2.720 -22.255 299 HB2 SER 40 1HB SER 40 -5.319 3.818 -21.151 300 HB3 SER 40 2HB SER 40 -5.485 4.776 -22.623 301 HG SER 40 HG SER 40 -5.424 6.185 -20.907 302 H GLY 41 H GLY 41 -7.130 2.414 -19.881 303 HA2 GLY 41 1HA GLY 41 -9.726 2.603 -18.890 304 HA3 GLY 41 2HA GLY 41 -8.301 2.283 -17.912 305 H ASP 42 H ASP 42 -6.915 4.649 -18.159 306 HA ASP 42 HA ASP 42 -8.018 6.244 -16.192 307 HB2 ASP 42 1HB ASP 42 -5.624 6.240 -17.097 308 HB3 ASP 42 2HB ASP 42 -6.212 7.334 -18.346 309 H GLN 43 H GLN 43 -8.573 6.284 -19.632 310 HA GLN 43 HA GLN 43 -9.992 8.813 -19.539 311 HB2 GLN 43 1HB GLN 43 -9.446 6.842 -21.757 312 HB3 GLN 43 2HB GLN 43 -10.442 8.275 -21.976 313 HG2 GLN 43 1HG GLN 43 -8.071 9.164 -20.782 314 HG3 GLN 43 2HG GLN 43 -7.591 8.014 -22.029 315 HE21 GLN 43 2HE2 GLN 43 -8.173 8.425 -24.189 316 HE22 GLN 43 1HE2 GLN 43 -8.573 10.018 -24.723 317 H LEU 44 H LEU 44 -10.684 5.408 -19.495 318 HA LEU 44 HA LEU 44 -13.450 5.627 -20.169 319 HB2 LEU 44 1HB LEU 44 -12.215 3.555 -20.492 320 HB3 LEU 44 2HB LEU 44 -11.933 3.437 -18.756 321 HG LEU 44 HG LEU 44 -14.586 3.447 -18.703 322 HD11 LEU 44 1HD1 LEU 44 -14.578 3.709 -21.243 323 HD12 LEU 44 2HD1 LEU 44 -15.621 2.465 -20.556 324 HD13 LEU 44 3HD1 LEU 44 -14.083 2.016 -21.292 325 HD21 LEU 44 1HD2 LEU 44 -13.270 0.896 -19.537 326 HD22 LEU 44 2HD2 LEU 44 -14.477 1.178 -18.282 327 HD23 LEU 44 3HD2 LEU 44 -12.805 1.679 -18.027 328 H LEU 45 H LEU 45 -11.674 5.256 -17.115 329 HA LEU 45 HA LEU 45 -13.845 5.122 -15.384 330 HB2 LEU 45 1HB LEU 45 -11.052 5.362 -15.174 331 HB3 LEU 45 2HB LEU 45 -11.734 6.672 -14.212 332 HG LEU 45 HG LEU 45 -12.973 5.085 -12.867 333 HD11 LEU 45 1HD1 LEU 45 -13.603 3.316 -14.186 334 HD12 LEU 45 2HD1 LEU 45 -12.279 2.597 -13.272 335 HD13 LEU 45 3HD1 LEU 45 -12.009 3.154 -14.923 336 HD21 LEU 45 1HD2 LEU 45 -11.177 4.174 -11.655 337 HD22 LEU 45 2HD2 LEU 45 -10.529 5.625 -12.421 338 HD23 LEU 45 3HD2 LEU 45 -10.167 4.034 -13.094 339 H ARG 46 H ARG 46 -12.378 7.875 -16.962 340 HA ARG 46 HA ARG 46 -14.319 9.640 -15.622 341 HB2 ARG 46 1HB ARG 46 -12.817 11.480 -16.001 342 HB3 ARG 46 2HB ARG 46 -11.917 10.179 -15.231 343 HG2 ARG 46 1HG ARG 46 -10.441 10.206 -16.875 344 HG3 ARG 46 2HG ARG 46 -11.713 9.861 -18.048 345 HD2 ARG 46 1HD ARG 46 -10.690 11.877 -18.746 346 HD3 ARG 46 2HD ARG 46 -12.236 12.326 -18.029 347 HE ARG 46 HE ARG 46 -11.096 13.516 -16.454 348 HH11 ARG 46 1HH1 ARG 46 -8.930 11.189 -17.874 349 HH12 ARG 46 2HH1 ARG 46 -7.536 11.778 -17.032 350 HH21 ARG 46 1HH2 ARG 46 -9.268 14.301 -15.339 351 HH22 ARG 46 2HH2 ARG 46 -7.729 13.548 -15.589 352 H ILE 47 H ILE 47 -14.760 7.937 -17.986 353 HA ILE 47 HA ILE 47 -14.746 9.518 -20.335 354 HB ILE 47 HB ILE 47 -14.914 7.043 -20.342 355 HG12 ILE 47 1HG1 ILE 47 -17.318 7.495 -21.824 356 HG13 ILE 47 2HG1 ILE 47 -16.290 8.916 -21.980 357 HG21 ILE 47 1HG2 ILE 47 -16.582 7.004 -18.437 358 HG22 ILE 47 2HG2 ILE 47 -17.812 7.403 -19.634 359 HG23 ILE 47 3HG2 ILE 47 -16.900 5.901 -19.775 360 HD11 ILE 47 1HD1 ILE 47 -15.334 7.788 -23.646 361 HD12 ILE 47 2HD1 ILE 47 -14.515 6.885 -22.371 362 HD13 ILE 47 3HD1 ILE 47 -15.986 6.243 -23.101 363 H THR 48 H THR 48 -16.208 10.901 -21.174 364 HA THR 48 HA THR 48 -18.738 11.286 -19.716 365 HB THR 48 HB THR 48 -17.132 13.081 -19.127 366 HG1 THR 48 HG1 THR 48 -18.802 14.383 -19.082 367 HG21 THR 48 1HG2 THR 48 -17.358 14.023 -21.975 368 HG22 THR 48 2HG2 THR 48 -16.020 13.012 -21.429 369 HG23 THR 48 3HG2 THR 48 -16.276 14.600 -20.708 370 H HIS 49 H HIS 49 -20.292 12.676 -21.047 371 HA HIS 49 HA HIS 49 -20.981 11.368 -23.381 372 HB2 HIS 49 1HB HIS 49 -21.669 14.116 -22.357 373 HB3 HIS 49 2HB HIS 49 -22.336 13.499 -23.865 374 HD1 HIS 49 HD1 HIS 49 -23.321 13.878 -20.550 375 HD2 HIS 49 HD2 HIS 49 -23.471 10.677 -23.193 376 HE1 HIS 49 HE1 HIS 49 -25.094 12.342 -19.645 377 H GLN 50 H GLN 50 -19.124 14.362 -22.995 378 HA GLN 50 HA GLN 50 -18.869 15.078 -25.663 379 HB2 GLN 50 1HB GLN 50 -17.905 16.041 -23.288 380 HB3 GLN 50 2HB GLN 50 -16.435 15.471 -24.067 381 HG2 GLN 50 1HG GLN 50 -16.758 17.787 -24.583 382 HG3 GLN 50 2HG GLN 50 -16.993 16.831 -26.045 383 HE21 GLN 50 2HE2 GLN 50 -18.905 16.909 -27.083 384 HE22 GLN 50 1HE2 GLN 50 -20.255 17.857 -26.572 385 H GLU 51 H GLU 51 -16.596 13.127 -23.725 386 HA GLU 51 HA GLU 51 -14.827 12.500 -25.783 387 HB2 GLU 51 1HB GLU 51 -15.567 10.922 -23.316 388 HB3 GLU 51 2HB GLU 51 -14.217 10.521 -24.369 389 HG2 GLU 51 1HG GLU 51 -14.198 13.295 -23.482 390 HG3 GLU 51 2HG GLU 51 -14.109 12.133 -22.160 391 H LEU 52 H LEU 52 -17.654 10.685 -24.620 392 HA LEU 52 HA LEU 52 -17.483 8.469 -26.256 393 HB2 LEU 52 1HB LEU 52 -19.720 9.930 -24.960 394 HB3 LEU 52 2HB LEU 52 -20.123 8.714 -26.171 395 HG LEU 52 HG LEU 52 -18.319 8.017 -23.887 396 HD11 LEU 52 1HD1 LEU 52 -21.244 8.527 -23.792 397 HD12 LEU 52 2HD1 LEU 52 -20.012 8.756 -22.551 398 HD13 LEU 52 3HD1 LEU 52 -20.608 7.136 -22.913 399 HD21 LEU 52 1HD2 LEU 52 -18.992 6.610 -26.039 400 HD22 LEU 52 2HD2 LEU 52 -20.385 6.221 -25.029 401 HD23 LEU 52 3HD2 LEU 52 -18.754 5.861 -24.461 402 H GLU 53 H GLU 53 -18.993 11.602 -26.958 403 HA GLU 53 HA GLU 53 -20.082 11.030 -29.440 404 HB2 GLU 53 1HB GLU 53 -19.628 13.335 -27.882 405 HB3 GLU 53 2HB GLU 53 -18.937 13.670 -29.463 406 HG2 GLU 53 1HG GLU 53 -21.102 12.987 -30.481 407 HG3 GLU 53 2HG GLU 53 -21.768 12.859 -28.854 408 H ASP 54 H ASP 54 -16.793 12.064 -28.633 409 HA ASP 54 HA ASP 54 -15.792 12.400 -31.204 410 HB2 ASP 54 1HB ASP 54 -14.643 12.949 -29.011 411 HB3 ASP 54 2HB ASP 54 -14.215 11.244 -28.904 412 H LEU 55 H LEU 55 -16.157 9.467 -29.281 413 HA LEU 55 HA LEU 55 -14.770 7.766 -31.091 414 HB2 LEU 55 1HB LEU 55 -16.765 7.195 -28.909 415 HB3 LEU 55 2HB LEU 55 -15.936 5.939 -29.826 416 HG LEU 55 HG LEU 55 -14.213 7.940 -28.497 417 HD11 LEU 55 1HD1 LEU 55 -16.205 6.355 -27.049 418 HD12 LEU 55 2HD1 LEU 55 -15.281 7.766 -26.536 419 HD13 LEU 55 3HD1 LEU 55 -14.550 6.163 -26.468 420 HD21 LEU 55 1HD2 LEU 55 -13.960 5.413 -29.691 421 HD22 LEU 55 2HD2 LEU 55 -13.646 5.179 -27.971 422 HD23 LEU 55 3HD2 LEU 55 -12.707 6.358 -28.887 423 H GLY 56 H GLY 56 -18.005 9.000 -30.923 424 HA2 GLY 56 1HA GLY 56 -19.061 8.913 -33.227 425 HA3 GLY 56 2HA GLY 56 -18.808 7.178 -33.104 426 H VAL 57 H VAL 57 -19.450 7.510 -30.116 427 HA VAL 57 HA VAL 57 -22.148 6.711 -30.272 428 HB VAL 57 HB VAL 57 -20.745 7.761 -27.814 429 HG11 VAL 57 1HG1 VAL 57 -22.341 6.623 -26.556 430 HG12 VAL 57 2HG1 VAL 57 -23.284 7.327 -27.872 431 HG13 VAL 57 3HG1 VAL 57 -22.840 5.621 -27.918 432 HG21 VAL 57 1HG2 VAL 57 -20.715 4.953 -27.833 433 HG22 VAL 57 2HG2 VAL 57 -20.138 5.463 -29.419 434 HG23 VAL 57 3HG2 VAL 57 -19.338 6.047 -27.961 435 H SER 58 H SER 58 -23.390 8.255 -31.310 436 HA SER 58 HA SER 58 -23.519 10.940 -30.169 437 HB2 SER 58 1HB SER 58 -23.872 9.865 -32.778 438 HB3 SER 58 2HB SER 58 -25.408 10.575 -32.284 439 HG SER 58 HG SER 58 -24.137 12.160 -33.233 440 H ARG 59 H ARG 59 -25.306 7.974 -30.296 441 HA ARG 59 HA ARG 59 -27.872 8.908 -29.667 442 HB2 ARG 59 1HB ARG 59 -26.460 6.342 -29.624 443 HB3 ARG 59 2HB ARG 59 -27.719 6.468 -28.403 444 HG2 ARG 59 1HG ARG 59 -28.413 7.321 -31.150 445 HG3 ARG 59 2HG ARG 59 -28.189 5.594 -30.865 446 HD2 ARG 59 1HD ARG 59 -30.410 5.775 -30.377 447 HD3 ARG 59 2HD ARG 59 -29.731 6.098 -28.783 448 HE ARG 59 HE ARG 59 -29.942 8.551 -30.008 449 HH11 ARG 59 1HH1 ARG 59 -32.112 5.970 -29.142 450 HH12 ARG 59 2HH1 ARG 59 -33.474 7.016 -28.913 451 HH21 ARG 59 1HH2 ARG 59 -31.728 9.939 -29.710 452 HH22 ARG 59 2HH2 ARG 59 -33.254 9.273 -29.237 453 H ILE 60 H ILE 60 -28.950 8.259 -27.495 454 HA ILE 60 HA ILE 60 -27.329 9.449 -25.350 455 HB ILE 60 HB ILE 60 -30.335 9.226 -25.545 456 HG12 ILE 60 1HG1 ILE 60 -29.376 10.800 -27.183 457 HG13 ILE 60 2HG1 ILE 60 -30.301 11.638 -25.942 458 HG21 ILE 60 1HG2 ILE 60 -29.944 11.086 -23.678 459 HG22 ILE 60 2HG2 ILE 60 -30.069 9.369 -23.296 460 HG23 ILE 60 3HG2 ILE 60 -28.484 10.131 -23.420 461 HD11 ILE 60 1HD1 ILE 60 -27.308 11.431 -26.135 462 HD12 ILE 60 2HD1 ILE 60 -28.300 12.866 -26.397 463 HD13 ILE 60 3HD1 ILE 60 -28.178 12.160 -24.786 464 H GLY 61 H GLY 61 -29.773 6.916 -25.907 465 HA2 GLY 61 1HA GLY 61 -29.652 5.719 -23.387 466 HA3 GLY 61 2HA GLY 61 -30.121 4.900 -24.870 467 H HIS 62 H HIS 62 -27.677 5.143 -26.265 468 HA HIS 62 HA HIS 62 -26.285 2.909 -25.209 469 HB2 HIS 62 1HB HIS 62 -25.376 4.830 -27.361 470 HB3 HIS 62 2HB HIS 62 -24.756 3.205 -27.078 471 HD1 HIS 62 HD1 HIS 62 -26.241 4.381 -29.707 472 HD2 HIS 62 HD2 HIS 62 -27.801 1.791 -26.858 473 HE1 HIS 62 HE1 HIS 62 -28.106 3.154 -30.864 474 H GLN 63 H GLN 63 -25.622 6.378 -25.265 475 HA GLN 63 HA GLN 63 -23.014 6.347 -24.292 476 HB2 GLN 63 1HB GLN 63 -25.245 8.348 -24.080 477 HB3 GLN 63 2HB GLN 63 -23.692 8.643 -23.310 478 HG2 GLN 63 1HG GLN 63 -22.575 8.461 -25.466 479 HG3 GLN 63 2HG GLN 63 -24.123 8.137 -26.245 480 HE21 GLN 63 2HE2 GLN 63 -22.053 10.351 -26.401 481 HE22 GLN 63 1HE2 GLN 63 -22.984 11.800 -26.266 482 H GLU 64 H GLU 64 -26.089 6.191 -22.574 483 HA GLU 64 HA GLU 64 -24.852 6.300 -19.977 484 HB2 GLU 64 1HB GLU 64 -27.617 6.057 -21.031 485 HB3 GLU 64 2HB GLU 64 -27.321 5.409 -19.423 486 HG2 GLU 64 1HG GLU 64 -26.243 8.097 -19.906 487 HG3 GLU 64 2HG GLU 64 -28.001 7.968 -19.940 488 H LEU 65 H LEU 65 -25.939 3.827 -22.192 489 HA LEU 65 HA LEU 65 -26.128 1.626 -20.529 490 HB2 LEU 65 1HB LEU 65 -25.539 2.072 -23.380 491 HB3 LEU 65 2HB LEU 65 -25.017 0.519 -22.730 492 HG LEU 65 HG LEU 65 -27.842 1.521 -22.458 493 HD11 LEU 65 1HD1 LEU 65 -27.459 -0.554 -24.432 494 HD12 LEU 65 2HD1 LEU 65 -26.599 0.923 -24.867 495 HD13 LEU 65 3HD1 LEU 65 -28.334 0.972 -24.554 496 HD21 LEU 65 1HD2 LEU 65 -28.354 -0.785 -22.023 497 HD22 LEU 65 2HD2 LEU 65 -27.052 -0.281 -20.945 498 HD23 LEU 65 3HD2 LEU 65 -26.691 -1.264 -22.365 499 H ILE 66 H ILE 66 -23.236 2.902 -22.157 500 HA ILE 66 HA ILE 66 -21.450 0.965 -21.142 501 HB ILE 66 HB ILE 66 -20.816 3.789 -22.004 502 HG12 ILE 66 1HG1 ILE 66 -20.699 1.258 -23.651 503 HG13 ILE 66 2HG1 ILE 66 -22.056 2.379 -23.689 504 HG21 ILE 66 1HG2 ILE 66 -18.585 2.738 -22.546 505 HG22 ILE 66 2HG2 ILE 66 -18.955 2.920 -20.832 506 HG23 ILE 66 3HG2 ILE 66 -19.112 1.343 -21.605 507 HD11 ILE 66 1HD1 ILE 66 -19.607 3.804 -24.094 508 HD12 ILE 66 2HD1 ILE 66 -19.724 2.456 -25.226 509 HD13 ILE 66 3HD1 ILE 66 -21.011 3.660 -25.152 510 H LEU 67 H LEU 67 -22.106 4.308 -20.099 511 HA LEU 67 HA LEU 67 -20.366 4.456 -17.964 512 HB2 LEU 67 1HB LEU 67 -23.145 5.618 -18.092 513 HB3 LEU 67 2HB LEU 67 -21.838 6.160 -17.042 514 HG LEU 67 HG LEU 67 -21.574 6.249 -20.030 515 HD11 LEU 67 1HD1 LEU 67 -23.259 7.712 -20.088 516 HD12 LEU 67 2HD1 LEU 67 -22.151 8.818 -19.275 517 HD13 LEU 67 3HD1 LEU 67 -23.303 7.872 -18.332 518 HD21 LEU 67 1HD2 LEU 67 -19.659 6.545 -18.294 519 HD22 LEU 67 2HD2 LEU 67 -20.374 8.138 -18.049 520 HD23 LEU 67 3HD2 LEU 67 -19.794 7.668 -19.648 521 H GLU 68 H GLU 68 -23.746 3.336 -17.922 522 HA GLU 68 HA GLU 68 -23.966 2.750 -15.225 523 HB2 GLU 68 1HB GLU 68 -25.910 2.671 -16.618 524 HB3 GLU 68 2HB GLU 68 -25.212 1.411 -17.625 525 HG2 GLU 68 1HG GLU 68 -25.762 -0.235 -16.191 526 HG3 GLU 68 2HG GLU 68 -25.490 0.766 -14.765 527 H ALA 69 H ALA 69 -22.289 1.031 -17.737 528 HA ALA 69 HA ALA 69 -21.964 -1.385 -16.189 529 HB1 ALA 69 1HB ALA 69 -22.083 -1.245 -18.728 530 HB2 ALA 69 2HB ALA 69 -20.419 -0.661 -18.661 531 HB3 ALA 69 3HB ALA 69 -20.817 -2.263 -18.041 532 H VAL 70 H VAL 70 -19.990 1.408 -17.089 533 HA VAL 70 HA VAL 70 -17.565 0.491 -15.977 534 HB VAL 70 HB VAL 70 -18.506 3.335 -16.378 535 HG11 VAL 70 1HG1 VAL 70 -16.680 3.372 -14.858 536 HG12 VAL 70 2HG1 VAL 70 -15.783 2.183 -15.805 537 HG13 VAL 70 3HG1 VAL 70 -16.038 3.809 -16.440 538 HG21 VAL 70 1HG2 VAL 70 -17.171 3.222 -18.449 539 HG22 VAL 70 2HG2 VAL 70 -16.887 1.507 -18.151 540 HG23 VAL 70 3HG2 VAL 70 -18.523 2.090 -18.455 541 H ASP 71 H ASP 71 -20.303 2.225 -14.619 542 HA ASP 71 HA ASP 71 -19.244 3.138 -12.239 543 HB2 ASP 71 1HB ASP 71 -21.667 3.293 -13.258 544 HB3 ASP 71 2HB ASP 71 -21.965 1.891 -12.235 545 H LEU 72 H LEU 72 -20.294 -0.110 -13.094 546 HA LEU 72 HA LEU 72 -20.106 -1.193 -10.474 547 HB2 LEU 72 1HB LEU 72 -20.473 -2.222 -13.211 548 HB3 LEU 72 2HB LEU 72 -19.754 -3.348 -12.062 549 HG LEU 72 HG LEU 72 -22.376 -1.937 -11.595 550 HD11 LEU 72 1HD1 LEU 72 -23.488 -3.495 -12.747 551 HD12 LEU 72 2HD1 LEU 72 -22.445 -4.797 -12.176 552 HD13 LEU 72 3HD1 LEU 72 -21.947 -3.806 -13.547 553 HD21 LEU 72 1HD2 LEU 72 -21.190 -4.385 -10.296 554 HD22 LEU 72 2HD2 LEU 72 -22.684 -3.560 -9.852 555 HD23 LEU 72 3HD2 LEU 72 -21.130 -2.761 -9.610 556 H LEU 73 H LEU 73 -17.856 -0.873 -13.158 557 HA LEU 73 HA LEU 73 -15.823 -2.548 -12.175 558 HB2 LEU 73 1HB LEU 73 -16.021 -0.371 -14.168 559 HB3 LEU 73 2HB LEU 73 -14.408 -0.747 -13.565 560 HG LEU 73 HG LEU 73 -16.266 -2.738 -14.865 561 HD11 LEU 73 1HD1 LEU 73 -13.824 -1.408 -16.022 562 HD12 LEU 73 2HD1 LEU 73 -15.484 -0.947 -16.398 563 HD13 LEU 73 3HD1 LEU 73 -14.898 -2.555 -16.823 564 HD21 LEU 73 1HD2 LEU 73 -13.613 -2.901 -13.567 565 HD22 LEU 73 2HD2 LEU 73 -13.822 -3.802 -15.069 566 HD23 LEU 73 3HD2 LEU 73 -14.890 -4.110 -13.699 567 H CYS 74 H CYS 74 -16.296 0.963 -11.855 568 HA CYS 74 HA CYS 74 -14.004 1.356 -10.220 569 HB2 CYS 74 1HB CYS 74 -14.907 3.208 -11.483 570 HB3 CYS 74 2HB CYS 74 -16.458 3.063 -10.665 571 HG CYS 74 HG CYS 74 -15.631 5.199 -9.371 572 H ALA 75 H ALA 75 -17.339 0.547 -9.590 573 HA ALA 75 HA ALA 75 -17.350 1.150 -6.818 574 HB1 ALA 75 1HB ALA 75 -19.244 -0.769 -7.040 575 HB2 ALA 75 2HB ALA 75 -19.500 0.930 -7.440 576 HB3 ALA 75 3HB ALA 75 -19.123 -0.229 -8.715 577 H LEU 76 H LEU 76 -16.243 -1.569 -8.682 578 HA LEU 76 HA LEU 76 -16.093 -3.373 -6.445 579 HB2 LEU 76 1HB LEU 76 -15.414 -3.447 -9.322 580 HB3 LEU 76 2HB LEU 76 -14.501 -4.525 -8.268 581 HG LEU 76 HG LEU 76 -17.484 -4.535 -8.137 582 HD11 LEU 76 1HD1 LEU 76 -16.991 -6.555 -9.864 583 HD12 LEU 76 2HD1 LEU 76 -15.845 -5.345 -10.437 584 HD13 LEU 76 3HD1 LEU 76 -17.562 -4.957 -10.342 585 HD21 LEU 76 1HD2 LEU 76 -16.406 -5.847 -6.491 586 HD22 LEU 76 2HD2 LEU 76 -15.274 -6.522 -7.663 587 HD23 LEU 76 3HD2 LEU 76 -16.978 -6.975 -7.720 588 H ASN 77 H ASN 77 -13.975 -1.104 -8.040 589 HA ASN 77 HA ASN 77 -11.694 -2.005 -6.443 590 HB2 ASN 77 1HB ASN 77 -11.995 -0.264 -8.864 591 HB3 ASN 77 2HB ASN 77 -10.557 -0.115 -7.860 592 HD21 ASN 77 2HD2 ASN 77 -12.534 -2.526 -9.531 593 HD22 ASN 77 1HD2 ASN 77 -11.216 -3.546 -9.986 594 H SER 78 H SER 78 -13.138 -1.152 -4.590 595 HA SER 78 HA SER 78 -12.926 1.741 -4.251 596 HB2 SER 78 1HB SER 78 -14.050 0.640 -1.933 597 HB3 SER 78 2HB SER 78 -14.911 1.427 -3.255 598 HG SER 78 HG SER 78 -15.789 -0.587 -3.039 599 H GLY 79 H GLY 79 -12.123 -1.198 -2.390 600 HA2 GLY 79 1HA GLY 79 -10.218 -1.651 -1.150 601 HA3 GLY 79 2HA GLY 79 -9.581 -0.081 -1.617 602 HA PRO 80 HA PRO 80 -11.100 -0.164 2.875 603 HB2 PRO 80 1HB PRO 80 -8.670 -0.031 4.078 604 HB3 PRO 80 2HB PRO 80 -9.466 -1.560 3.689 605 HG2 PRO 80 1HG PRO 80 -7.307 -0.117 2.200 606 HG3 PRO 80 2HG PRO 80 -7.459 -1.848 2.552 607 HD2 PRO 80 1HD PRO 80 -8.106 -0.788 0.146 608 HD3 PRO 80 2HD PRO 80 -8.946 -2.197 0.826 609 H SER 81 H SER 81 -11.858 1.856 3.088 610 HA SER 81 HA SER 81 -10.234 4.154 2.418 611 HB2 SER 81 1HB SER 81 -13.054 3.602 2.766 612 HB3 SER 81 2HB SER 81 -12.584 5.043 3.668 613 HG SER 81 HG SER 81 -13.196 5.195 1.300 614 H SER 82 H SER 82 -9.134 5.405 3.792 615 HA SER 82 HA SER 82 -8.525 4.608 6.383 616 HB2 SER 82 1HB SER 82 -7.653 6.984 6.645 617 HB3 SER 82 2HB SER 82 -7.014 6.078 5.274 618 HG SER 82 HG SER 82 -7.659 8.204 4.697 619 H GLY 83 H GLY 83 -9.000 5.609 8.434 620 HA2 GLY 83 1HA GLY 83 -10.327 6.889 9.899 621 HA3 GLY 83 2HA GLY 83 -11.422 7.236 8.569 Start of MODEL 12 1 H1 GLY 1 H GLY 1 -2.251 8.903 1.087 2 HA2 GLY 1 1HA GLY 1 -2.372 11.738 0.829 3 HA3 GLY 1 2HA GLY 1 -1.380 10.651 -0.132 4 H SER 2 H SER 2 -1.785 10.774 -2.225 5 HA SER 2 HA SER 2 -4.458 11.614 -3.102 6 HB2 SER 2 1HB SER 2 -3.463 12.753 -4.783 7 HB3 SER 2 2HB SER 2 -1.990 12.562 -3.833 8 HG SER 2 HG SER 2 -1.245 11.386 -5.391 9 H SER 3 H SER 3 -5.790 10.201 -4.011 10 HA SER 3 HA SER 3 -6.615 8.324 -4.996 11 HB2 SER 3 1HB SER 3 -4.810 9.092 -6.725 12 HB3 SER 3 2HB SER 3 -3.913 7.691 -6.139 13 HG SER 3 HG SER 3 -5.531 7.518 -8.006 14 H GLY 4 H GLY 4 -5.700 5.820 -5.450 15 HA2 GLY 4 1HA GLY 4 -4.304 4.923 -3.040 16 HA3 GLY 4 2HA GLY 4 -5.950 4.354 -3.278 17 H SER 5 H SER 5 -6.226 2.530 -4.385 18 HA SER 5 HA SER 5 -4.066 1.643 -6.178 19 HB2 SER 5 1HB SER 5 -4.623 -0.715 -5.385 20 HB3 SER 5 2HB SER 5 -3.770 0.310 -4.232 21 HG SER 5 HG SER 5 -5.639 0.599 -3.103 22 H SER 6 H SER 6 -5.529 2.630 -7.780 23 HA SER 6 HA SER 6 -7.924 1.039 -8.350 24 HB2 SER 6 1HB SER 6 -6.981 3.728 -9.353 25 HB3 SER 6 2HB SER 6 -8.362 2.880 -10.049 26 HG SER 6 HG SER 6 -9.128 4.249 -8.472 27 H GLY 7 H GLY 7 -7.817 -0.533 -9.802 28 HA2 GLY 7 1HA GLY 7 -5.495 -0.774 -11.520 29 HA3 GLY 7 2HA GLY 7 -6.788 -1.950 -11.339 30 H VAL 8 H VAL 8 -9.000 -0.406 -11.954 31 HA VAL 8 HA VAL 8 -9.087 -0.549 -14.730 32 HB VAL 8 HB VAL 8 -10.822 1.240 -13.027 33 HG11 VAL 8 1HG1 VAL 8 -11.075 1.629 -15.404 34 HG12 VAL 8 2HG1 VAL 8 -11.295 -0.099 -15.688 35 HG13 VAL 8 3HG1 VAL 8 -12.502 0.806 -14.775 36 HG21 VAL 8 1HG2 VAL 8 -12.357 -0.774 -13.016 37 HG22 VAL 8 2HG2 VAL 8 -10.968 -1.719 -13.552 38 HG23 VAL 8 3HG2 VAL 8 -10.921 -0.886 -11.998 39 H SER 9 H SER 9 -7.946 1.980 -12.663 40 HA SER 9 HA SER 9 -8.125 4.104 -14.559 41 HB2 SER 9 1HB SER 9 -6.674 5.335 -12.998 42 HB3 SER 9 2HB SER 9 -7.995 4.538 -12.143 43 HG SER 9 HG SER 9 -5.306 4.165 -11.921 44 H LYS 10 H LYS 10 -5.845 1.572 -13.933 45 HA LYS 10 HA LYS 10 -3.917 2.794 -15.786 46 HB2 LYS 10 1HB LYS 10 -3.483 0.431 -13.954 47 HB3 LYS 10 2HB LYS 10 -2.257 1.299 -14.869 48 HG2 LYS 10 1HG LYS 10 -3.632 3.172 -13.239 49 HG3 LYS 10 2HG LYS 10 -3.178 1.790 -12.239 50 HD2 LYS 10 1HD LYS 10 -1.188 3.003 -14.115 51 HD3 LYS 10 2HD LYS 10 -1.507 3.761 -12.553 52 HE2 LYS 10 1HE LYS 10 -1.197 1.198 -11.785 53 HE3 LYS 10 2HE LYS 10 -0.140 1.225 -13.196 54 HZ1 LYS 10 1HZ LYS 10 0.013 3.091 -10.889 55 HZ2 LYS 10 2HZ LYS 10 1.031 3.108 -12.240 56 HZ3 LYS 10 3HZ LYS 10 1.059 1.793 -11.177 57 H TRP 11 H TRP 11 -6.459 1.339 -16.445 58 HA TRP 11 HA TRP 11 -5.720 -1.180 -17.564 59 HB2 TRP 11 1HB TRP 11 -8.131 0.502 -17.452 60 HB3 TRP 11 2HB TRP 11 -7.985 -0.459 -18.921 61 HD1 TRP 11 HD1 TRP 11 -6.668 -1.876 -15.636 62 HE1 TRP 11 HE1 TRP 11 -8.146 -3.864 -14.938 63 HE3 TRP 11 HE3 TRP 11 -10.380 -1.390 -19.118 64 HZ2 TRP 11 HZ2 TRP 11 -10.565 -5.068 -15.756 65 HZ3 TRP 11 HZ3 TRP 11 -12.239 -3.001 -19.092 66 HH2 TRP 11 HH2 TRP 11 -12.328 -4.801 -17.446 67 H SER 12 H SER 12 -4.810 -1.625 -19.466 68 HA SER 12 HA SER 12 -3.679 0.349 -21.088 69 HB2 SER 12 1HB SER 12 -3.910 -2.565 -21.127 70 HB3 SER 12 2HB SER 12 -3.873 -1.861 -22.743 71 HG SER 12 HG SER 12 -1.982 -0.649 -21.908 72 HA PRO 13 HA PRO 13 -6.784 1.618 -23.914 73 HB2 PRO 13 1HB PRO 13 -5.423 1.766 -26.258 74 HB3 PRO 13 2HB PRO 13 -5.190 2.918 -24.938 75 HG2 PRO 13 1HG PRO 13 -3.540 0.535 -25.686 76 HG3 PRO 13 2HG PRO 13 -3.009 2.156 -25.201 77 HD2 PRO 13 1HD PRO 13 -3.019 0.054 -23.493 78 HD3 PRO 13 2HD PRO 13 -3.313 1.721 -22.958 79 H SER 14 H SER 14 -5.080 -1.339 -24.531 80 HA SER 14 HA SER 14 -6.974 -2.157 -26.597 81 HB2 SER 14 1HB SER 14 -4.260 -2.737 -26.087 82 HB3 SER 14 2HB SER 14 -5.141 -4.242 -25.822 83 HG SER 14 HG SER 14 -6.196 -3.539 -27.950 84 H GLN 15 H GLN 15 -6.277 -2.642 -23.240 85 HA GLN 15 HA GLN 15 -7.641 -5.091 -22.869 86 HB2 GLN 15 1HB GLN 15 -6.793 -2.865 -21.048 87 HB3 GLN 15 2HB GLN 15 -7.821 -4.156 -20.440 88 HG2 GLN 15 1HG GLN 15 -5.371 -4.932 -21.913 89 HG3 GLN 15 2HG GLN 15 -5.180 -4.253 -20.297 90 HE21 GLN 15 2HE2 GLN 15 -6.729 -6.810 -22.144 91 HE22 GLN 15 1HE2 GLN 15 -6.877 -7.923 -20.832 92 H VAL 16 H VAL 16 -8.662 -1.711 -22.488 93 HA VAL 16 HA VAL 16 -11.212 -2.086 -21.505 94 HB VAL 16 HB VAL 16 -10.352 -0.005 -23.520 95 HG11 VAL 16 1HG1 VAL 16 -12.201 1.321 -22.419 96 HG12 VAL 16 2HG1 VAL 16 -12.718 -0.010 -23.456 97 HG13 VAL 16 3HG1 VAL 16 -12.742 -0.196 -21.702 98 HG21 VAL 16 1HG2 VAL 16 -9.417 -0.429 -20.938 99 HG22 VAL 16 2HG2 VAL 16 -9.250 1.045 -21.892 100 HG23 VAL 16 3HG2 VAL 16 -10.602 0.867 -20.773 101 H VAL 17 H VAL 17 -10.032 -2.471 -24.784 102 HA VAL 17 HA VAL 17 -12.485 -2.559 -26.137 103 HB VAL 17 HB VAL 17 -10.020 -4.149 -26.849 104 HG11 VAL 17 1HG1 VAL 17 -12.280 -4.523 -28.027 105 HG12 VAL 17 2HG1 VAL 17 -11.993 -2.940 -28.754 106 HG13 VAL 17 3HG1 VAL 17 -10.849 -4.256 -29.022 107 HG21 VAL 17 1HG2 VAL 17 -8.941 -2.232 -27.149 108 HG22 VAL 17 2HG2 VAL 17 -10.146 -1.771 -28.351 109 HG23 VAL 17 3HG2 VAL 17 -10.367 -1.314 -26.662 110 H ASP 18 H ASP 18 -10.681 -5.052 -24.419 111 HA ASP 18 HA ASP 18 -12.303 -7.232 -25.236 112 HB2 ASP 18 1HB ASP 18 -9.943 -7.263 -24.180 113 HB3 ASP 18 2HB ASP 18 -10.788 -7.151 -22.639 114 H TRP 19 H TRP 19 -12.592 -4.817 -22.759 115 HA TRP 19 HA TRP 19 -14.475 -6.180 -21.124 116 HB2 TRP 19 1HB TRP 19 -13.245 -4.343 -20.184 117 HB3 TRP 19 2HB TRP 19 -13.820 -3.246 -21.436 118 HD1 TRP 19 HD1 TRP 19 -15.448 -5.430 -18.656 119 HE1 TRP 19 HE1 TRP 19 -17.385 -4.079 -17.633 120 HE3 TRP 19 HE3 TRP 19 -15.154 -1.248 -21.582 121 HZ2 TRP 19 HZ2 TRP 19 -18.625 -1.572 -18.016 122 HZ3 TRP 19 HZ3 TRP 19 -16.753 0.580 -21.190 123 HH2 TRP 19 HH2 TRP 19 -18.452 0.420 -19.444 124 H MET 20 H MET 20 -14.786 -3.841 -23.770 125 HA MET 20 HA MET 20 -17.572 -3.531 -23.655 126 HB2 MET 20 1HB MET 20 -15.785 -3.362 -26.087 127 HB3 MET 20 2HB MET 20 -17.400 -2.682 -25.941 128 HG2 MET 20 1HG MET 20 -15.339 -1.860 -23.967 129 HG3 MET 20 2HG MET 20 -15.244 -1.216 -25.605 130 HE1 MET 20 1HE MET 20 -18.238 -0.592 -26.567 131 HE2 MET 20 2HE MET 20 -18.187 1.078 -26.000 132 HE3 MET 20 3HE MET 20 -16.737 0.330 -26.671 133 H LYS 21 H LYS 21 -15.605 -6.107 -24.833 134 HA LYS 21 HA LYS 21 -17.449 -7.268 -26.644 135 HB2 LYS 21 1HB LYS 21 -15.182 -8.509 -25.075 136 HB3 LYS 21 2HB LYS 21 -16.062 -9.321 -26.363 137 HG2 LYS 21 1HG LYS 21 -15.302 -7.017 -27.593 138 HG3 LYS 21 2HG LYS 21 -13.944 -7.308 -26.504 139 HD2 LYS 21 1HD LYS 21 -13.273 -9.151 -27.626 140 HD3 LYS 21 2HD LYS 21 -14.924 -9.665 -27.977 141 HE2 LYS 21 1HE LYS 21 -14.407 -7.251 -29.394 142 HE3 LYS 21 2HE LYS 21 -13.073 -8.366 -29.689 143 HZ1 LYS 21 1HZ LYS 21 -14.455 -9.901 -30.667 144 HZ2 LYS 21 2HZ LYS 21 -15.165 -8.454 -31.180 145 HZ3 LYS 21 3HZ LYS 21 -15.847 -9.323 -29.899 146 H GLY 22 H GLY 22 -17.474 -7.001 -23.278 147 HA2 GLY 22 1HA GLY 22 -19.347 -9.276 -23.056 148 HA3 GLY 22 2HA GLY 22 -18.333 -8.715 -21.736 149 H LEU 23 H LEU 23 -19.786 -6.339 -23.765 150 HA LEU 23 HA LEU 23 -21.688 -5.709 -21.607 151 HB2 LEU 23 1HB LEU 23 -20.568 -3.811 -23.659 152 HB3 LEU 23 2HB LEU 23 -21.531 -3.403 -22.241 153 HG LEU 23 HG LEU 23 -18.693 -4.424 -22.261 154 HD11 LEU 23 1HD1 LEU 23 -18.008 -2.305 -21.976 155 HD12 LEU 23 2HD1 LEU 23 -19.397 -1.877 -20.978 156 HD13 LEU 23 3HD1 LEU 23 -19.549 -1.901 -22.734 157 HD21 LEU 23 1HD2 LEU 23 -20.721 -4.508 -20.211 158 HD22 LEU 23 2HD2 LEU 23 -19.361 -3.498 -19.719 159 HD23 LEU 23 3HD2 LEU 23 -19.087 -5.172 -20.205 160 H ASP 24 H ASP 24 -23.309 -3.918 -22.847 161 HA ASP 24 HA ASP 24 -25.214 -5.467 -24.108 162 HB2 ASP 24 1HB ASP 24 -25.051 -2.846 -23.280 163 HB3 ASP 24 2HB ASP 24 -25.214 -2.684 -25.027 164 H ASP 25 H ASP 25 -25.881 -5.727 -26.257 165 HA ASP 25 HA ASP 25 -23.798 -6.071 -28.136 166 HB2 ASP 25 1HB ASP 25 -26.448 -6.911 -27.888 167 HB3 ASP 25 2HB ASP 25 -26.430 -5.932 -29.353 168 H CYS 26 H CYS 26 -25.932 -3.436 -27.430 169 HA CYS 26 HA CYS 26 -25.693 -2.080 -29.918 170 HB2 CYS 26 1HB CYS 26 -26.543 -1.227 -27.158 171 HB3 CYS 26 2HB CYS 26 -26.428 -0.072 -28.481 172 HG CYS 26 HG CYS 26 -28.603 -0.742 -29.745 173 H LEU 27 H LEU 27 -23.659 -2.384 -27.159 174 HA LEU 27 HA LEU 27 -22.059 -0.055 -27.899 175 HB2 LEU 27 1HB LEU 27 -21.392 -1.940 -25.675 176 HB3 LEU 27 2HB LEU 27 -21.012 -0.227 -25.831 177 HG LEU 27 HG LEU 27 -23.785 -1.305 -25.338 178 HD11 LEU 27 1HD1 LEU 27 -23.374 -1.419 -23.157 179 HD12 LEU 27 2HD1 LEU 27 -22.567 0.149 -23.156 180 HD13 LEU 27 3HD1 LEU 27 -21.659 -1.309 -23.554 181 HD21 LEU 27 1HD2 LEU 27 -24.018 0.811 -26.281 182 HD22 LEU 27 2HD2 LEU 27 -22.577 1.435 -25.478 183 HD23 LEU 27 3HD2 LEU 27 -24.043 1.128 -24.546 184 H GLN 28 H GLN 28 -22.267 -2.633 -29.463 185 HA GLN 28 HA GLN 28 -19.554 -3.675 -29.284 186 HB2 GLN 28 1HB GLN 28 -21.864 -4.456 -31.070 187 HB3 GLN 28 2HB GLN 28 -20.307 -5.274 -31.019 188 HG2 GLN 28 1HG GLN 28 -22.186 -5.024 -28.681 189 HG3 GLN 28 2HG GLN 28 -22.079 -6.426 -29.743 190 HE21 GLN 28 2HE2 GLN 28 -21.250 -5.424 -26.821 191 HE22 GLN 28 1HE2 GLN 28 -19.769 -6.280 -26.584 192 H GLN 29 H GLN 29 -21.641 -2.083 -31.681 193 HA GLN 29 HA GLN 29 -19.816 -1.920 -33.769 194 HB2 GLN 29 1HB GLN 29 -21.169 -0.045 -34.597 195 HB3 GLN 29 2HB GLN 29 -22.177 -1.376 -34.044 196 HG2 GLN 29 1HG GLN 29 -22.544 -0.179 -31.923 197 HG3 GLN 29 2HG GLN 29 -21.599 1.171 -32.549 198 HE21 GLN 29 2HE2 GLN 29 -24.652 -0.150 -32.252 199 HE22 GLN 29 1HE2 GLN 29 -25.484 0.848 -33.391 200 H TYR 30 H TYR 30 -19.987 -0.126 -30.813 201 HA TYR 30 HA TYR 30 -18.336 2.052 -31.675 202 HB2 TYR 30 1HB TYR 30 -19.020 1.131 -28.876 203 HB3 TYR 30 2HB TYR 30 -18.285 2.673 -29.300 204 HD1 TYR 30 HD2 TYR 30 -19.897 3.437 -31.662 205 HD2 TYR 30 HD1 TYR 30 -21.084 1.716 -27.956 206 HE1 TYR 30 HE2 TYR 30 -22.130 4.433 -31.921 207 HE2 TYR 30 HE1 TYR 30 -23.321 2.707 -28.206 208 HH TYR 30 HH TYR 30 -24.156 4.664 -31.053 209 H ILE 31 H ILE 31 -17.800 -1.117 -30.390 210 HA ILE 31 HA ILE 31 -15.311 -0.909 -29.219 211 HB ILE 31 HB ILE 31 -16.264 -3.170 -30.980 212 HG12 ILE 31 1HG1 ILE 31 -16.543 -2.753 -27.996 213 HG13 ILE 31 2HG1 ILE 31 -17.847 -2.639 -29.172 214 HG21 ILE 31 1HG2 ILE 31 -14.720 -4.542 -29.626 215 HG22 ILE 31 2HG2 ILE 31 -13.889 -3.312 -30.577 216 HG23 ILE 31 3HG2 ILE 31 -14.136 -3.071 -28.847 217 HD11 ILE 31 1HD1 ILE 31 -16.284 -5.099 -28.434 218 HD12 ILE 31 2HD1 ILE 31 -17.974 -4.753 -28.068 219 HD13 ILE 31 3HD1 ILE 31 -17.470 -5.021 -29.737 220 H LYS 32 H LYS 32 -16.078 -1.338 -32.659 221 HA LYS 32 HA LYS 32 -13.490 -1.570 -33.646 222 HB2 LYS 32 1HB LYS 32 -15.829 -0.200 -34.985 223 HB3 LYS 32 2HB LYS 32 -14.400 -0.835 -35.790 224 HG2 LYS 32 1HG LYS 32 -15.395 -2.987 -34.347 225 HG3 LYS 32 2HG LYS 32 -16.825 -2.184 -34.998 226 HD2 LYS 32 1HD LYS 32 -15.060 -2.175 -37.120 227 HD3 LYS 32 2HD LYS 32 -14.775 -3.741 -36.357 228 HE2 LYS 32 1HE LYS 32 -16.488 -4.008 -38.010 229 HE3 LYS 32 2HE LYS 32 -17.230 -4.144 -36.416 230 HZ1 LYS 32 1HZ LYS 32 -18.075 -1.939 -36.595 231 HZ2 LYS 32 2HZ LYS 32 -18.498 -2.761 -38.012 232 HZ3 LYS 32 3HZ LYS 32 -17.221 -1.652 -38.027 233 H ASN 33 H ASN 33 -15.209 1.221 -32.501 234 HA ASN 33 HA ASN 33 -13.309 3.093 -33.636 235 HB2 ASN 33 1HB ASN 33 -15.680 3.464 -31.797 236 HB3 ASN 33 2HB ASN 33 -14.662 4.787 -32.359 237 HD21 ASN 33 2HD2 ASN 33 -17.442 4.520 -32.813 238 HD22 ASN 33 1HD2 ASN 33 -17.686 4.383 -34.518 239 H PHE 34 H PHE 34 -13.872 1.427 -30.643 240 HA PHE 34 HA PHE 34 -12.214 3.116 -29.033 241 HB2 PHE 34 1HB PHE 34 -13.635 0.525 -28.666 242 HB3 PHE 34 2HB PHE 34 -12.297 0.879 -27.577 243 HD1 PHE 34 HD2 PHE 34 -15.174 2.770 -29.030 244 HD2 PHE 34 HD1 PHE 34 -12.932 1.743 -25.561 245 HE1 PHE 34 HE2 PHE 34 -16.667 4.162 -27.657 246 HE2 PHE 34 HE1 PHE 34 -14.422 3.133 -24.182 247 HZ PHE 34 HZ PHE 34 -16.292 4.346 -25.230 248 H GLU 35 H GLU 35 -11.703 0.388 -31.108 249 HA GLU 35 HA GLU 35 -9.185 -0.413 -30.050 250 HB2 GLU 35 1HB GLU 35 -10.935 -1.215 -32.191 251 HB3 GLU 35 2HB GLU 35 -9.281 -1.111 -32.778 252 HG2 GLU 35 1HG GLU 35 -9.931 -2.574 -30.251 253 HG3 GLU 35 2HG GLU 35 -10.116 -3.341 -31.827 254 H ARG 36 H ARG 36 -10.179 1.726 -32.686 255 HA ARG 36 HA ARG 36 -7.464 2.315 -33.448 256 HB2 ARG 36 1HB ARG 36 -9.674 2.363 -34.882 257 HB3 ARG 36 2HB ARG 36 -9.781 4.011 -34.279 258 HG2 ARG 36 1HG ARG 36 -7.341 4.216 -35.125 259 HG3 ARG 36 2HG ARG 36 -7.741 2.789 -36.084 260 HD2 ARG 36 1HD ARG 36 -9.868 4.229 -36.692 261 HD3 ARG 36 2HD ARG 36 -8.801 5.564 -36.261 262 HE ARG 36 HE ARG 36 -7.498 3.794 -38.041 263 HH11 ARG 36 1HH1 ARG 36 -9.964 6.249 -37.933 264 HH12 ARG 36 2HH1 ARG 36 -9.744 6.727 -39.584 265 HH21 ARG 36 1HH2 ARG 36 -7.198 4.415 -40.216 266 HH22 ARG 36 2HH2 ARG 36 -8.171 5.683 -40.881 267 H GLU 37 H GLU 37 -9.902 3.706 -31.380 268 HA GLU 37 HA GLU 37 -8.574 6.240 -31.092 269 HB2 GLU 37 1HB GLU 37 -10.926 4.922 -29.777 270 HB3 GLU 37 2HB GLU 37 -10.230 6.379 -29.083 271 HG2 GLU 37 1HG GLU 37 -10.621 6.748 -31.891 272 HG3 GLU 37 2HG GLU 37 -12.115 6.177 -31.149 273 H LYS 38 H LYS 38 -8.327 3.135 -29.650 274 HA LYS 38 HA LYS 38 -7.043 2.287 -27.975 275 HB2 LYS 38 1HB LYS 38 -5.521 4.863 -28.411 276 HB3 LYS 38 2HB LYS 38 -4.941 3.512 -27.446 277 HG2 LYS 38 1HG LYS 38 -5.754 2.907 -30.222 278 HG3 LYS 38 2HG LYS 38 -4.285 3.863 -30.005 279 HD2 LYS 38 1HD LYS 38 -3.406 2.130 -28.494 280 HD3 LYS 38 2HD LYS 38 -4.861 1.169 -28.769 281 HE2 LYS 38 1HE LYS 38 -4.318 1.088 -31.172 282 HE3 LYS 38 2HE LYS 38 -2.838 1.990 -30.851 283 HZ1 LYS 38 1HZ LYS 38 -3.178 -0.380 -29.235 284 HZ2 LYS 38 2HZ LYS 38 -1.813 0.180 -30.062 285 HZ3 LYS 38 3HZ LYS 38 -3.007 -0.685 -30.890 286 H ILE 39 H ILE 39 -9.359 3.478 -27.113 287 HA ILE 39 HA ILE 39 -9.134 5.439 -25.148 288 HB ILE 39 HB ILE 39 -11.062 3.115 -25.213 289 HG12 ILE 39 1HG1 ILE 39 -11.093 4.508 -27.258 290 HG13 ILE 39 2HG1 ILE 39 -12.584 4.651 -26.334 291 HG21 ILE 39 1HG2 ILE 39 -12.302 5.294 -24.039 292 HG22 ILE 39 2HG2 ILE 39 -11.702 3.856 -23.214 293 HG23 ILE 39 3HG2 ILE 39 -10.684 5.290 -23.339 294 HD11 ILE 39 1HD1 ILE 39 -10.820 6.671 -25.438 295 HD12 ILE 39 2HD1 ILE 39 -10.830 6.696 -27.201 296 HD13 ILE 39 3HD1 ILE 39 -12.344 6.843 -26.308 297 H SER 40 H SER 40 -7.762 5.389 -23.492 298 HA SER 40 HA SER 40 -6.997 2.890 -22.249 299 HB2 SER 40 1HB SER 40 -5.851 4.845 -20.711 300 HB3 SER 40 2HB SER 40 -5.113 4.138 -22.148 301 HG SER 40 HG SER 40 -5.241 6.031 -23.021 302 H GLY 41 H GLY 41 -7.116 2.547 -19.928 303 HA2 GLY 41 1HA GLY 41 -9.687 2.794 -18.896 304 HA3 GLY 41 2HA GLY 41 -8.257 2.436 -17.940 305 H ASP 42 H ASP 42 -6.831 4.794 -18.233 306 HA ASP 42 HA ASP 42 -7.871 6.393 -16.226 307 HB2 ASP 42 1HB ASP 42 -5.504 6.410 -16.969 308 HB3 ASP 42 2HB ASP 42 -5.990 7.270 -18.427 309 H GLN 43 H GLN 43 -8.510 6.426 -19.642 310 HA GLN 43 HA GLN 43 -9.892 8.986 -19.496 311 HB2 GLN 43 1HB GLN 43 -9.339 7.096 -21.783 312 HB3 GLN 43 2HB GLN 43 -10.295 8.562 -21.951 313 HG2 GLN 43 1HG GLN 43 -8.275 9.802 -21.045 314 HG3 GLN 43 2HG GLN 43 -7.378 8.307 -21.303 315 HE21 GLN 43 2HE2 GLN 43 -9.840 10.074 -23.153 316 HE22 GLN 43 1HE2 GLN 43 -8.931 10.144 -24.621 317 H LEU 44 H LEU 44 -10.568 5.588 -19.515 318 HA LEU 44 HA LEU 44 -13.329 5.817 -20.238 319 HB2 LEU 44 1HB LEU 44 -12.138 3.759 -20.644 320 HB3 LEU 44 2HB LEU 44 -11.772 3.594 -18.928 321 HG LEU 44 HG LEU 44 -14.437 3.594 -18.778 322 HD11 LEU 44 1HD1 LEU 44 -13.808 2.514 -21.519 323 HD12 LEU 44 2HD1 LEU 44 -14.867 3.865 -21.120 324 HD13 LEU 44 3HD1 LEU 44 -15.318 2.225 -20.655 325 HD21 LEU 44 1HD2 LEU 44 -12.950 1.879 -17.894 326 HD22 LEU 44 2HD2 LEU 44 -12.737 1.212 -19.512 327 HD23 LEU 44 3HD2 LEU 44 -14.319 1.150 -18.733 328 H LEU 45 H LEU 45 -11.597 5.287 -17.177 329 HA LEU 45 HA LEU 45 -13.749 5.076 -15.462 330 HB2 LEU 45 1HB LEU 45 -11.045 5.191 -15.178 331 HB3 LEU 45 2HB LEU 45 -11.539 6.711 -14.436 332 HG LEU 45 HG LEU 45 -13.084 5.368 -12.969 333 HD11 LEU 45 1HD1 LEU 45 -12.955 3.363 -14.560 334 HD12 LEU 45 2HD1 LEU 45 -12.914 3.047 -12.826 335 HD13 LEU 45 3HD1 LEU 45 -11.422 3.003 -13.765 336 HD21 LEU 45 1HD2 LEU 45 -10.303 5.830 -12.797 337 HD22 LEU 45 2HD2 LEU 45 -10.610 4.227 -12.128 338 HD23 LEU 45 3HD2 LEU 45 -11.461 5.632 -11.482 339 H ARG 46 H ARG 46 -12.329 7.953 -16.889 340 HA ARG 46 HA ARG 46 -14.398 9.580 -15.567 341 HB2 ARG 46 1HB ARG 46 -12.947 11.502 -15.857 342 HB3 ARG 46 2HB ARG 46 -12.078 10.225 -15.017 343 HG2 ARG 46 1HG ARG 46 -11.088 9.588 -17.242 344 HG3 ARG 46 2HG ARG 46 -11.787 11.077 -17.883 345 HD2 ARG 46 1HD ARG 46 -10.330 11.528 -15.417 346 HD3 ARG 46 2HD ARG 46 -9.315 10.796 -16.659 347 HE ARG 46 HE ARG 46 -10.605 12.824 -17.947 348 HH11 ARG 46 1HH1 ARG 46 -8.613 12.596 -15.101 349 HH12 ARG 46 2HH1 ARG 46 -7.973 14.198 -15.261 350 HH21 ARG 46 1HH2 ARG 46 -9.769 14.935 -18.169 351 HH22 ARG 46 2HH2 ARG 46 -8.631 15.528 -17.007 352 H ILE 47 H ILE 47 -14.760 7.983 -17.975 353 HA ILE 47 HA ILE 47 -14.650 9.589 -20.295 354 HB ILE 47 HB ILE 47 -14.885 7.142 -20.383 355 HG12 ILE 47 1HG1 ILE 47 -17.305 7.629 -21.812 356 HG13 ILE 47 2HG1 ILE 47 -16.300 9.068 -21.939 357 HG21 ILE 47 1HG2 ILE 47 -17.791 7.238 -19.875 358 HG22 ILE 47 2HG2 ILE 47 -16.616 5.973 -19.519 359 HG23 ILE 47 3HG2 ILE 47 -16.744 7.380 -18.463 360 HD11 ILE 47 1HD1 ILE 47 -14.648 7.972 -23.093 361 HD12 ILE 47 2HD1 ILE 47 -15.097 6.392 -22.450 362 HD13 ILE 47 3HD1 ILE 47 -16.094 7.157 -23.687 363 H THR 48 H THR 48 -15.964 11.124 -21.062 364 HA THR 48 HA THR 48 -18.490 11.619 -19.623 365 HB THR 48 HB THR 48 -16.769 13.383 -19.270 366 HG1 THR 48 HG1 THR 48 -18.268 14.962 -19.447 367 HG21 THR 48 1HG2 THR 48 -17.153 14.464 -21.987 368 HG22 THR 48 2HG2 THR 48 -16.118 13.041 -21.872 369 HG23 THR 48 3HG2 THR 48 -15.730 14.491 -20.946 370 H HIS 49 H HIS 49 -20.032 13.000 -21.004 371 HA HIS 49 HA HIS 49 -20.899 11.531 -23.182 372 HB2 HIS 49 1HB HIS 49 -21.465 14.269 -22.156 373 HB3 HIS 49 2HB HIS 49 -22.023 13.873 -23.779 374 HD1 HIS 49 HD1 HIS 49 -22.891 13.503 -20.260 375 HD2 HIS 49 HD2 HIS 49 -23.835 11.583 -23.821 376 HE1 HIS 49 HE1 HIS 49 -24.957 12.156 -19.770 377 H GLN 50 H GLN 50 -18.897 14.457 -23.139 378 HA GLN 50 HA GLN 50 -18.734 14.878 -25.890 379 HB2 GLN 50 1HB GLN 50 -17.503 15.918 -23.549 380 HB3 GLN 50 2HB GLN 50 -16.225 15.532 -24.692 381 HG2 GLN 50 1HG GLN 50 -16.743 17.724 -25.200 382 HG3 GLN 50 2HG GLN 50 -17.653 16.811 -26.401 383 HE21 GLN 50 2HE2 GLN 50 -18.376 19.353 -25.914 384 HE22 GLN 50 1HE2 GLN 50 -19.869 19.410 -25.047 385 H GLU 51 H GLU 51 -16.655 12.938 -23.763 386 HA GLU 51 HA GLU 51 -14.779 12.146 -25.672 387 HB2 GLU 51 1HB GLU 51 -15.693 11.100 -23.045 388 HB3 GLU 51 2HB GLU 51 -14.774 10.003 -24.067 389 HG2 GLU 51 1HG GLU 51 -13.730 12.749 -23.587 390 HG3 GLU 51 2HG GLU 51 -13.578 11.533 -22.319 391 H LEU 52 H LEU 52 -17.741 10.482 -24.608 392 HA LEU 52 HA LEU 52 -17.533 8.286 -26.333 393 HB2 LEU 52 1HB LEU 52 -19.861 9.620 -24.991 394 HB3 LEU 52 2HB LEU 52 -20.081 8.222 -26.041 395 HG LEU 52 HG LEU 52 -18.267 8.157 -23.643 396 HD11 LEU 52 1HD1 LEU 52 -20.630 8.795 -23.044 397 HD12 LEU 52 2HD1 LEU 52 -20.029 7.307 -22.313 398 HD13 LEU 52 3HD1 LEU 52 -21.128 7.231 -23.690 399 HD21 LEU 52 1HD2 LEU 52 -19.388 5.673 -24.103 400 HD22 LEU 52 2HD2 LEU 52 -17.761 6.187 -24.552 401 HD23 LEU 52 3HD2 LEU 52 -19.077 6.302 -25.722 402 H GLU 53 H GLU 53 -19.089 11.436 -26.762 403 HA GLU 53 HA GLU 53 -20.348 10.961 -29.201 404 HB2 GLU 53 1HB GLU 53 -19.849 13.191 -27.533 405 HB3 GLU 53 2HB GLU 53 -19.313 13.636 -29.147 406 HG2 GLU 53 1HG GLU 53 -21.411 13.554 -30.023 407 HG3 GLU 53 2HG GLU 53 -21.961 12.330 -28.879 408 H ASP 54 H ASP 54 -17.023 11.869 -28.483 409 HA ASP 54 HA ASP 54 -16.203 12.442 -31.113 410 HB2 ASP 54 1HB ASP 54 -14.987 12.867 -28.861 411 HB3 ASP 54 2HB ASP 54 -14.367 11.231 -29.064 412 H LEU 55 H LEU 55 -16.037 9.439 -29.220 413 HA LEU 55 HA LEU 55 -14.741 7.845 -31.093 414 HB2 LEU 55 1HB LEU 55 -16.801 7.149 -29.012 415 HB3 LEU 55 2HB LEU 55 -15.934 5.941 -29.958 416 HG LEU 55 HG LEU 55 -14.224 7.869 -28.542 417 HD11 LEU 55 1HD1 LEU 55 -15.510 7.764 -26.674 418 HD12 LEU 55 2HD1 LEU 55 -14.611 6.262 -26.463 419 HD13 LEU 55 3HD1 LEU 55 -16.245 6.226 -27.127 420 HD21 LEU 55 1HD2 LEU 55 -12.779 6.234 -28.933 421 HD22 LEU 55 2HD2 LEU 55 -14.066 5.284 -29.675 422 HD23 LEU 55 3HD2 LEU 55 -13.735 5.126 -27.949 423 H GLY 56 H GLY 56 -18.010 8.996 -31.013 424 HA2 GLY 56 1HA GLY 56 -18.953 8.975 -33.372 425 HA3 GLY 56 2HA GLY 56 -18.686 7.240 -33.288 426 H VAL 57 H VAL 57 -19.465 7.476 -30.325 427 HA VAL 57 HA VAL 57 -22.117 6.612 -30.592 428 HB VAL 57 HB VAL 57 -20.891 7.767 -28.087 429 HG11 VAL 57 1HG1 VAL 57 -22.950 5.589 -28.345 430 HG12 VAL 57 2HG1 VAL 57 -22.473 6.474 -26.895 431 HG13 VAL 57 3HG1 VAL 57 -23.373 7.292 -28.173 432 HG21 VAL 57 1HG2 VAL 57 -20.109 5.465 -29.609 433 HG22 VAL 57 2HG2 VAL 57 -19.408 6.111 -28.125 434 HG23 VAL 57 3HG2 VAL 57 -20.743 4.962 -28.041 435 H SER 58 H SER 58 -23.451 8.025 -31.651 436 HA SER 58 HA SER 58 -23.660 10.779 -30.744 437 HB2 SER 58 1HB SER 58 -25.449 10.848 -32.593 438 HB3 SER 58 2HB SER 58 -23.776 10.600 -33.094 439 HG SER 58 HG SER 58 -24.914 9.062 -34.150 440 H ARG 59 H ARG 59 -25.595 7.826 -30.792 441 HA ARG 59 HA ARG 59 -28.002 8.857 -29.841 442 HB2 ARG 59 1HB ARG 59 -26.761 6.230 -30.088 443 HB3 ARG 59 2HB ARG 59 -27.818 6.342 -28.686 444 HG2 ARG 59 1HG ARG 59 -29.091 7.515 -30.974 445 HG3 ARG 59 2HG ARG 59 -28.544 5.879 -31.345 446 HD2 ARG 59 1HD ARG 59 -29.683 5.068 -29.316 447 HD3 ARG 59 2HD ARG 59 -30.268 6.703 -29.011 448 HE ARG 59 HE ARG 59 -31.306 4.819 -30.911 449 HH11 ARG 59 1HH1 ARG 59 -30.977 8.195 -30.129 450 HH12 ARG 59 2HH1 ARG 59 -32.368 8.676 -31.043 451 HH21 ARG 59 1HH2 ARG 59 -33.139 5.440 -32.118 452 HH22 ARG 59 2HH2 ARG 59 -33.598 7.108 -32.173 453 H ILE 60 H ILE 60 -28.952 8.605 -27.683 454 HA ILE 60 HA ILE 60 -27.021 9.392 -25.627 455 HB ILE 60 HB ILE 60 -30.035 9.569 -25.553 456 HG12 ILE 60 1HG1 ILE 60 -29.095 11.006 -27.304 457 HG13 ILE 60 2HG1 ILE 60 -29.714 11.971 -25.968 458 HG21 ILE 60 1HG2 ILE 60 -27.879 10.220 -23.638 459 HG22 ILE 60 2HG2 ILE 60 -29.200 11.379 -23.773 460 HG23 ILE 60 3HG2 ILE 60 -29.539 9.702 -23.347 461 HD11 ILE 60 1HD1 ILE 60 -27.027 11.496 -25.372 462 HD12 ILE 60 2HD1 ILE 60 -27.082 11.891 -27.091 463 HD13 ILE 60 3HD1 ILE 60 -27.765 13.006 -25.908 464 H GLY 61 H GLY 61 -29.779 7.191 -26.086 465 HA2 GLY 61 1HA GLY 61 -29.771 5.941 -23.613 466 HA3 GLY 61 2HA GLY 61 -30.262 5.168 -25.113 467 H HIS 62 H HIS 62 -27.521 5.586 -26.239 468 HA HIS 62 HA HIS 62 -26.377 3.150 -25.157 469 HB2 HIS 62 1HB HIS 62 -25.370 4.872 -27.429 470 HB3 HIS 62 2HB HIS 62 -24.871 3.225 -27.056 471 HD1 HIS 62 HD1 HIS 62 -26.299 4.369 -29.736 472 HD2 HIS 62 HD2 HIS 62 -28.000 2.044 -26.743 473 HE1 HIS 62 HE1 HIS 62 -28.258 3.217 -30.812 474 H GLN 63 H GLN 63 -25.461 6.553 -25.534 475 HA GLN 63 HA GLN 63 -22.875 6.452 -24.557 476 HB2 GLN 63 1HB GLN 63 -24.993 8.545 -24.631 477 HB3 GLN 63 2HB GLN 63 -23.578 8.844 -23.631 478 HG2 GLN 63 1HG GLN 63 -22.228 8.237 -25.734 479 HG3 GLN 63 2HG GLN 63 -23.745 8.491 -26.595 480 HE21 GLN 63 2HE2 GLN 63 -24.348 10.506 -27.083 481 HE22 GLN 63 1HE2 GLN 63 -23.530 11.938 -26.568 482 H GLU 64 H GLU 64 -25.897 6.222 -22.851 483 HA GLU 64 HA GLU 64 -24.619 6.538 -20.255 484 HB2 GLU 64 1HB GLU 64 -27.422 6.375 -21.240 485 HB3 GLU 64 2HB GLU 64 -27.109 5.846 -19.593 486 HG2 GLU 64 1HG GLU 64 -25.777 8.309 -19.950 487 HG3 GLU 64 2HG GLU 64 -27.406 8.488 -20.599 488 H LEU 65 H LEU 65 -25.874 4.032 -22.336 489 HA LEU 65 HA LEU 65 -26.184 1.924 -20.582 490 HB2 LEU 65 1HB LEU 65 -25.747 2.260 -23.426 491 HB3 LEU 65 2HB LEU 65 -24.994 0.786 -22.819 492 HG LEU 65 HG LEU 65 -27.856 1.378 -22.178 493 HD11 LEU 65 1HD1 LEU 65 -27.599 1.660 -24.615 494 HD12 LEU 65 2HD1 LEU 65 -28.571 0.253 -24.187 495 HD13 LEU 65 3HD1 LEU 65 -26.899 0.043 -24.705 496 HD21 LEU 65 1HD2 LEU 65 -27.988 -0.840 -21.655 497 HD22 LEU 65 2HD2 LEU 65 -26.289 -0.551 -21.280 498 HD23 LEU 65 3HD2 LEU 65 -26.739 -1.303 -22.811 499 H ILE 66 H ILE 66 -23.212 2.956 -22.240 500 HA ILE 66 HA ILE 66 -21.542 0.973 -21.134 501 HB ILE 66 HB ILE 66 -20.772 3.730 -22.099 502 HG12 ILE 66 1HG1 ILE 66 -20.647 1.133 -23.631 503 HG13 ILE 66 2HG1 ILE 66 -22.028 2.220 -23.719 504 HG21 ILE 66 1HG2 ILE 66 -18.971 2.859 -20.836 505 HG22 ILE 66 2HG2 ILE 66 -19.163 1.253 -21.537 506 HG23 ILE 66 3HG2 ILE 66 -18.565 2.582 -22.530 507 HD11 ILE 66 1HD1 ILE 66 -20.245 2.383 -25.537 508 HD12 ILE 66 2HD1 ILE 66 -20.798 3.881 -24.788 509 HD13 ILE 66 3HD1 ILE 66 -19.254 3.174 -24.312 510 H LEU 67 H LEU 67 -22.117 4.351 -20.176 511 HA LEU 67 HA LEU 67 -20.366 4.531 -18.051 512 HB2 LEU 67 1HB LEU 67 -23.132 5.717 -18.236 513 HB3 LEU 67 2HB LEU 67 -21.854 6.251 -17.145 514 HG LEU 67 HG LEU 67 -21.560 6.340 -20.138 515 HD11 LEU 67 1HD1 LEU 67 -23.420 7.806 -18.680 516 HD12 LEU 67 2HD1 LEU 67 -22.820 8.161 -20.300 517 HD13 LEU 67 3HD1 LEU 67 -22.051 8.897 -18.894 518 HD21 LEU 67 1HD2 LEU 67 -19.868 8.039 -19.583 519 HD22 LEU 67 2HD2 LEU 67 -19.495 6.465 -18.879 520 HD23 LEU 67 3HD2 LEU 67 -20.160 7.749 -17.868 521 H GLU 68 H GLU 68 -23.755 3.440 -17.972 522 HA GLU 68 HA GLU 68 -23.991 2.924 -15.269 523 HB2 GLU 68 1HB GLU 68 -25.795 2.776 -17.042 524 HB3 GLU 68 2HB GLU 68 -25.176 1.175 -17.424 525 HG2 GLU 68 1HG GLU 68 -25.544 0.626 -14.966 526 HG3 GLU 68 2HG GLU 68 -26.488 2.113 -14.898 527 H ALA 69 H ALA 69 -22.314 1.107 -17.722 528 HA ALA 69 HA ALA 69 -21.965 -1.233 -16.067 529 HB1 ALA 69 1HB ALA 69 -22.119 -1.265 -18.584 530 HB2 ALA 69 2HB ALA 69 -20.491 -0.585 -18.609 531 HB3 ALA 69 3HB ALA 69 -20.774 -2.169 -17.887 532 H VAL 70 H VAL 70 -20.004 1.516 -17.121 533 HA VAL 70 HA VAL 70 -17.534 0.725 -16.117 534 HB VAL 70 HB VAL 70 -18.659 3.527 -16.241 535 HG11 VAL 70 1HG1 VAL 70 -16.729 3.459 -14.794 536 HG12 VAL 70 2HG1 VAL 70 -15.816 2.548 -15.999 537 HG13 VAL 70 3HG1 VAL 70 -16.286 4.218 -16.322 538 HG21 VAL 70 1HG2 VAL 70 -16.817 2.249 -18.236 539 HG22 VAL 70 2HG2 VAL 70 -18.569 2.101 -18.372 540 HG23 VAL 70 3HG2 VAL 70 -17.812 3.694 -18.416 541 H ASP 71 H ASP 71 -20.298 2.140 -14.483 542 HA ASP 71 HA ASP 71 -19.155 2.943 -12.094 543 HB2 ASP 71 1HB ASP 71 -21.654 2.976 -13.002 544 HB3 ASP 71 2HB ASP 71 -21.785 1.541 -11.988 545 H LEU 72 H LEU 72 -20.377 -0.274 -12.978 546 HA LEU 72 HA LEU 72 -19.878 -1.533 -10.527 547 HB2 LEU 72 1HB LEU 72 -20.220 -2.453 -13.337 548 HB3 LEU 72 2HB LEU 72 -19.619 -3.601 -12.142 549 HG LEU 72 HG LEU 72 -22.076 -3.715 -12.555 550 HD11 LEU 72 1HD1 LEU 72 -22.666 -3.971 -10.248 551 HD12 LEU 72 2HD1 LEU 72 -21.348 -2.914 -9.744 552 HD13 LEU 72 3HD1 LEU 72 -20.992 -4.487 -10.457 553 HD21 LEU 72 1HD2 LEU 72 -22.135 -1.064 -11.121 554 HD22 LEU 72 2HD2 LEU 72 -23.519 -1.996 -11.694 555 HD23 LEU 72 3HD2 LEU 72 -22.401 -1.273 -12.852 556 H LEU 73 H LEU 73 -17.788 -0.855 -13.258 557 HA LEU 73 HA LEU 73 -15.642 -2.536 -12.511 558 HB2 LEU 73 1HB LEU 73 -16.132 -0.402 -14.441 559 HB3 LEU 73 2HB LEU 73 -14.472 -0.445 -13.851 560 HG LEU 73 HG LEU 73 -15.905 -2.781 -15.113 561 HD11 LEU 73 1HD1 LEU 73 -14.366 -2.323 -17.027 562 HD12 LEU 73 2HD1 LEU 73 -13.973 -0.781 -16.269 563 HD13 LEU 73 3HD1 LEU 73 -15.625 -1.110 -16.791 564 HD21 LEU 73 1HD2 LEU 73 -13.078 -2.950 -15.232 565 HD22 LEU 73 2HD2 LEU 73 -14.207 -4.002 -14.376 566 HD23 LEU 73 3HD2 LEU 73 -13.529 -2.589 -13.565 567 H CYS 74 H CYS 74 -16.461 0.805 -11.734 568 HA CYS 74 HA CYS 74 -14.019 1.280 -10.297 569 HB2 CYS 74 1HB CYS 74 -15.689 2.969 -11.465 570 HB3 CYS 74 2HB CYS 74 -16.454 2.960 -9.881 571 HG CYS 74 HG CYS 74 -14.217 4.952 -10.753 572 H ALA 75 H ALA 75 -17.312 0.349 -9.495 573 HA ALA 75 HA ALA 75 -17.017 0.627 -6.673 574 HB1 ALA 75 1HB ALA 75 -19.156 0.393 -8.251 575 HB2 ALA 75 2HB ALA 75 -19.003 -1.290 -7.743 576 HB3 ALA 75 3HB ALA 75 -19.186 -0.017 -6.536 577 H LEU 76 H LEU 76 -16.741 -2.090 -8.928 578 HA LEU 76 HA LEU 76 -16.447 -4.158 -7.091 579 HB2 LEU 76 1HB LEU 76 -15.539 -3.711 -9.893 580 HB3 LEU 76 2HB LEU 76 -14.916 -5.104 -9.011 581 HG LEU 76 HG LEU 76 -17.864 -4.598 -9.308 582 HD11 LEU 76 1HD1 LEU 76 -17.680 -6.355 -11.145 583 HD12 LEU 76 2HD1 LEU 76 -15.968 -5.939 -11.210 584 HD13 LEU 76 3HD1 LEU 76 -17.187 -4.710 -11.548 585 HD21 LEU 76 1HD2 LEU 76 -17.787 -7.153 -9.082 586 HD22 LEU 76 2HD2 LEU 76 -17.486 -6.184 -7.639 587 HD23 LEU 76 3HD2 LEU 76 -16.136 -6.915 -8.508 588 H ASN 77 H ASN 77 -14.179 -1.724 -8.136 589 HA ASN 77 HA ASN 77 -12.008 -3.035 -6.666 590 HB2 ASN 77 1HB ASN 77 -12.126 -1.402 -9.021 591 HB3 ASN 77 2HB ASN 77 -11.115 -0.605 -7.820 592 HD21 ASN 77 2HD2 ASN 77 -11.343 -3.095 -10.111 593 HD22 ASN 77 1HD2 ASN 77 -9.801 -3.821 -9.828 594 H SER 78 H SER 78 -12.116 -2.590 -4.552 595 HA SER 78 HA SER 78 -12.136 -1.432 -2.594 596 HB2 SER 78 1HB SER 78 -11.426 0.994 -4.255 597 HB3 SER 78 2HB SER 78 -11.088 0.730 -2.544 598 HG SER 78 HG SER 78 -9.264 -0.040 -3.239 599 H GLY 79 H GLY 79 -13.004 0.868 -1.666 600 HA2 GLY 79 1HA GLY 79 -14.845 2.186 -1.258 601 HA3 GLY 79 2HA GLY 79 -15.307 1.944 -2.936 602 HA PRO 80 HA PRO 80 -18.310 -0.236 -0.071 603 HB2 PRO 80 1HB PRO 80 -20.529 1.062 -0.946 604 HB3 PRO 80 2HB PRO 80 -19.522 1.665 0.376 605 HG2 PRO 80 1HG PRO 80 -19.553 2.480 -2.505 606 HG3 PRO 80 2HG PRO 80 -19.451 3.496 -1.055 607 HD2 PRO 80 1HD PRO 80 -17.282 2.864 -2.547 608 HD3 PRO 80 2HD PRO 80 -17.194 3.112 -0.791 609 H SER 81 H SER 81 -20.575 -1.133 -0.921 610 HA SER 81 HA SER 81 -19.985 -2.408 -3.503 611 HB2 SER 81 1HB SER 81 -22.087 -3.425 -1.625 612 HB3 SER 81 2HB SER 81 -21.081 -4.318 -2.766 613 HG SER 81 HG SER 81 -19.384 -4.190 -1.378 614 H SER 82 H SER 82 -22.000 -3.077 -4.746 615 HA SER 82 HA SER 82 -23.795 -2.456 -5.997 616 HB2 SER 82 1HB SER 82 -25.721 -2.001 -4.838 617 HB3 SER 82 2HB SER 82 -24.712 -2.518 -3.487 618 HG SER 82 HG SER 82 -24.842 -0.580 -2.704 619 H GLY 83 H GLY 83 -25.304 -0.229 -6.262 620 HA2 GLY 83 1HA GLY 83 -25.275 2.068 -6.716 621 HA3 GLY 83 2HA GLY 83 -23.577 2.113 -6.264 Start of MODEL 13 1 H1 GLY 1 H GLY 1 -12.375 10.021 -5.629 2 HA2 GLY 1 1HA GLY 1 -11.981 8.328 -4.048 3 HA3 GLY 1 2HA GLY 1 -12.490 7.134 -5.232 4 H SER 2 H SER 2 -10.977 6.034 -6.330 5 HA SER 2 HA SER 2 -8.932 5.242 -6.934 6 HB2 SER 2 1HB SER 2 -8.515 8.213 -7.075 7 HB3 SER 2 2HB SER 2 -7.170 7.112 -7.373 8 HG SER 2 HG SER 2 -8.394 7.738 -9.273 9 H SER 3 H SER 3 -9.550 5.341 -4.153 10 HA SER 3 HA SER 3 -6.821 5.369 -3.078 11 HB2 SER 3 1HB SER 3 -8.699 7.316 -2.425 12 HB3 SER 3 2HB SER 3 -8.779 6.179 -1.079 13 HG SER 3 HG SER 3 -6.745 7.882 -1.845 14 H GLY 4 H GLY 4 -6.596 3.195 -2.908 15 HA2 GLY 4 1HA GLY 4 -7.063 1.622 -0.923 16 HA3 GLY 4 2HA GLY 4 -8.715 1.694 -1.518 17 H SER 5 H SER 5 -8.671 1.361 -4.098 18 HA SER 5 HA SER 5 -6.917 -0.910 -4.712 19 HB2 SER 5 1HB SER 5 -9.050 -1.837 -3.893 20 HB3 SER 5 2HB SER 5 -9.920 -0.909 -5.115 21 HG SER 5 HG SER 5 -9.613 -2.937 -5.943 22 H SER 6 H SER 6 -5.815 -0.282 -6.442 23 HA SER 6 HA SER 6 -7.184 1.313 -8.499 24 HB2 SER 6 1HB SER 6 -4.259 1.010 -7.806 25 HB3 SER 6 2HB SER 6 -4.816 1.806 -9.278 26 HG SER 6 HG SER 6 -5.640 2.558 -6.671 27 H GLY 7 H GLY 7 -6.641 0.864 -10.758 28 HA2 GLY 7 1HA GLY 7 -5.292 -1.291 -11.777 29 HA3 GLY 7 2HA GLY 7 -6.855 -1.943 -11.310 30 H VAL 8 H VAL 8 -8.691 -0.233 -12.023 31 HA VAL 8 HA VAL 8 -8.836 -0.436 -14.820 32 HB VAL 8 HB VAL 8 -10.441 1.438 -13.078 33 HG11 VAL 8 1HG1 VAL 8 -12.146 1.205 -14.809 34 HG12 VAL 8 2HG1 VAL 8 -10.647 1.849 -15.481 35 HG13 VAL 8 3HG1 VAL 8 -11.073 0.156 -15.735 36 HG21 VAL 8 1HG2 VAL 8 -10.909 -1.468 -13.737 37 HG22 VAL 8 2HG2 VAL 8 -10.556 -0.790 -12.148 38 HG23 VAL 8 3HG2 VAL 8 -12.080 -0.410 -12.950 39 H SER 9 H SER 9 -7.521 2.009 -12.755 40 HA SER 9 HA SER 9 -7.591 4.149 -14.640 41 HB2 SER 9 1HB SER 9 -5.839 5.146 -13.068 42 HB3 SER 9 2HB SER 9 -7.410 4.777 -12.359 43 HG SER 9 HG SER 9 -5.813 3.988 -11.008 44 H LYS 10 H LYS 10 -5.463 1.479 -14.050 45 HA LYS 10 HA LYS 10 -3.488 2.589 -15.924 46 HB2 LYS 10 1HB LYS 10 -3.145 0.184 -14.132 47 HB3 LYS 10 2HB LYS 10 -1.892 1.049 -15.013 48 HG2 LYS 10 1HG LYS 10 -3.192 2.925 -13.349 49 HG3 LYS 10 2HG LYS 10 -2.855 1.492 -12.374 50 HD2 LYS 10 1HD LYS 10 -0.880 2.627 -12.126 51 HD3 LYS 10 2HD LYS 10 -0.503 1.659 -13.553 52 HE2 LYS 10 1HE LYS 10 -0.319 3.468 -14.854 53 HE3 LYS 10 2HE LYS 10 -1.793 4.185 -14.206 54 HZ1 LYS 10 1HZ LYS 10 -0.633 5.479 -12.836 55 HZ2 LYS 10 2HZ LYS 10 0.725 5.086 -13.764 56 HZ3 LYS 10 3HZ LYS 10 0.392 4.226 -12.347 57 H TRP 11 H TRP 11 -6.117 1.281 -16.548 58 HA TRP 11 HA TRP 11 -5.523 -1.273 -17.682 59 HB2 TRP 11 1HB TRP 11 -7.852 0.515 -17.506 60 HB3 TRP 11 2HB TRP 11 -7.785 -0.444 -18.982 61 HD1 TRP 11 HD1 TRP 11 -6.457 -1.932 -15.732 62 HE1 TRP 11 HE1 TRP 11 -8.006 -3.856 -15.007 63 HE3 TRP 11 HE3 TRP 11 -10.221 -1.269 -19.128 64 HZ2 TRP 11 HZ2 TRP 11 -10.493 -4.948 -15.774 65 HZ3 TRP 11 HZ3 TRP 11 -12.149 -2.796 -19.065 66 HH2 TRP 11 HH2 TRP 11 -12.280 -4.597 -17.422 67 H SER 12 H SER 12 -4.663 -1.745 -19.600 68 HA SER 12 HA SER 12 -3.493 0.186 -21.245 69 HB2 SER 12 1HB SER 12 -4.161 -2.327 -22.609 70 HB3 SER 12 2HB SER 12 -2.588 -1.588 -22.313 71 HG SER 12 HG SER 12 -2.506 -3.308 -21.031 72 HA PRO 13 HA PRO 13 -6.607 1.584 -23.998 73 HB2 PRO 13 1HB PRO 13 -5.293 1.683 -26.372 74 HB3 PRO 13 2HB PRO 13 -4.985 2.822 -25.056 75 HG2 PRO 13 1HG PRO 13 -3.448 0.376 -25.844 76 HG3 PRO 13 2HG PRO 13 -2.842 1.973 -25.368 77 HD2 PRO 13 1HD PRO 13 -2.899 -0.130 -23.664 78 HD3 PRO 13 2HD PRO 13 -3.114 1.546 -23.120 79 H SER 14 H SER 14 -5.034 -1.436 -24.661 80 HA SER 14 HA SER 14 -7.007 -2.173 -26.683 81 HB2 SER 14 1HB SER 14 -4.687 -3.801 -25.620 82 HB3 SER 14 2HB SER 14 -5.647 -4.144 -27.059 83 HG SER 14 HG SER 14 -4.541 -2.708 -28.141 84 H GLN 15 H GLN 15 -6.251 -2.695 -23.345 85 HA GLN 15 HA GLN 15 -7.690 -5.092 -22.940 86 HB2 GLN 15 1HB GLN 15 -6.741 -2.887 -21.144 87 HB3 GLN 15 2HB GLN 15 -7.801 -4.140 -20.512 88 HG2 GLN 15 1HG GLN 15 -5.481 -5.108 -22.030 89 HG3 GLN 15 2HG GLN 15 -5.109 -4.278 -20.520 90 HE21 GLN 15 2HE2 GLN 15 -4.925 -7.132 -21.371 91 HE22 GLN 15 1HE2 GLN 15 -5.782 -8.012 -20.157 92 H VAL 16 H VAL 16 -8.602 -1.681 -22.598 93 HA VAL 16 HA VAL 16 -11.138 -1.954 -21.548 94 HB VAL 16 HB VAL 16 -10.251 0.050 -23.628 95 HG11 VAL 16 1HG1 VAL 16 -12.627 0.083 -23.529 96 HG12 VAL 16 2HG1 VAL 16 -12.618 0.004 -21.767 97 HG13 VAL 16 3HG1 VAL 16 -12.052 1.459 -22.588 98 HG21 VAL 16 1HG2 VAL 16 -10.234 0.197 -20.615 99 HG22 VAL 16 2HG2 VAL 16 -8.818 0.058 -21.657 100 HG23 VAL 16 3HG2 VAL 16 -9.812 1.514 -21.710 101 H VAL 17 H VAL 17 -10.030 -2.552 -24.805 102 HA VAL 17 HA VAL 17 -12.525 -2.571 -26.113 103 HB VAL 17 HB VAL 17 -10.122 -4.247 -26.838 104 HG11 VAL 17 1HG1 VAL 17 -12.090 -3.031 -28.739 105 HG12 VAL 17 2HG1 VAL 17 -11.010 -4.405 -28.979 106 HG13 VAL 17 3HG1 VAL 17 -12.432 -4.570 -27.949 107 HG21 VAL 17 1HG2 VAL 17 -9.339 -2.008 -26.582 108 HG22 VAL 17 2HG2 VAL 17 -9.526 -2.308 -28.310 109 HG23 VAL 17 3HG2 VAL 17 -10.734 -1.360 -27.444 110 H ASP 18 H ASP 18 -10.697 -5.112 -24.467 111 HA ASP 18 HA ASP 18 -12.391 -7.257 -25.153 112 HB2 ASP 18 1HB ASP 18 -10.053 -7.408 -24.186 113 HB3 ASP 18 2HB ASP 18 -10.765 -7.041 -22.617 114 H TRP 19 H TRP 19 -12.618 -4.764 -22.749 115 HA TRP 19 HA TRP 19 -14.509 -6.043 -21.058 116 HB2 TRP 19 1HB TRP 19 -13.232 -4.192 -20.198 117 HB3 TRP 19 2HB TRP 19 -13.827 -3.128 -21.469 118 HD1 TRP 19 HD1 TRP 19 -15.435 -5.238 -18.619 119 HE1 TRP 19 HE1 TRP 19 -17.332 -3.838 -17.585 120 HE3 TRP 19 HE3 TRP 19 -15.117 -1.103 -21.609 121 HZ2 TRP 19 HZ2 TRP 19 -18.534 -1.316 -17.984 122 HZ3 TRP 19 HZ3 TRP 19 -16.677 0.759 -21.217 123 HH2 TRP 19 HH2 TRP 19 -18.350 0.653 -19.442 124 H MET 20 H MET 20 -14.806 -3.783 -23.773 125 HA MET 20 HA MET 20 -17.597 -3.454 -23.640 126 HB2 MET 20 1HB MET 20 -15.819 -3.302 -26.080 127 HB3 MET 20 2HB MET 20 -17.431 -2.616 -25.928 128 HG2 MET 20 1HG MET 20 -15.514 -1.754 -23.880 129 HG3 MET 20 2HG MET 20 -15.135 -1.253 -25.526 130 HE1 MET 20 1HE MET 20 -16.512 0.371 -26.948 131 HE2 MET 20 2HE MET 20 -17.859 -0.767 -26.940 132 HE3 MET 20 3HE MET 20 -18.137 0.931 -26.550 133 H LYS 21 H LYS 21 -15.636 -6.044 -24.783 134 HA LYS 21 HA LYS 21 -17.468 -7.218 -26.597 135 HB2 LYS 21 1HB LYS 21 -15.223 -8.450 -24.991 136 HB3 LYS 21 2HB LYS 21 -16.095 -9.275 -26.276 137 HG2 LYS 21 1HG LYS 21 -15.364 -7.269 -27.735 138 HG3 LYS 21 2HG LYS 21 -14.172 -6.996 -26.461 139 HD2 LYS 21 1HD LYS 21 -12.975 -8.842 -27.001 140 HD3 LYS 21 2HD LYS 21 -14.408 -9.767 -27.459 141 HE2 LYS 21 1HE LYS 21 -14.440 -7.986 -29.433 142 HE3 LYS 21 2HE LYS 21 -12.713 -7.946 -29.079 143 HZ1 LYS 21 1HZ LYS 21 -14.082 -9.820 -30.592 144 HZ2 LYS 21 2HZ LYS 21 -13.615 -10.620 -29.177 145 HZ3 LYS 21 3HZ LYS 21 -12.452 -9.856 -30.140 146 H GLY 22 H GLY 22 -17.523 -6.913 -23.234 147 HA2 GLY 22 1HA GLY 22 -19.413 -9.174 -23.006 148 HA3 GLY 22 2HA GLY 22 -18.406 -8.606 -21.682 149 H LEU 23 H LEU 23 -19.840 -6.253 -23.758 150 HA LEU 23 HA LEU 23 -21.750 -5.583 -21.618 151 HB2 LEU 23 1HB LEU 23 -20.598 -3.716 -23.680 152 HB3 LEU 23 2HB LEU 23 -21.576 -3.285 -22.279 153 HG LEU 23 HG LEU 23 -18.744 -4.323 -22.252 154 HD11 LEU 23 1HD1 LEU 23 -19.954 -1.639 -21.614 155 HD12 LEU 23 2HD1 LEU 23 -18.825 -2.024 -22.913 156 HD13 LEU 23 3HD1 LEU 23 -18.294 -2.099 -21.233 157 HD21 LEU 23 1HD2 LEU 23 -19.907 -5.225 -20.353 158 HD22 LEU 23 2HD2 LEU 23 -20.616 -3.653 -19.986 159 HD23 LEU 23 3HD2 LEU 23 -18.878 -3.899 -19.810 160 H ASP 24 H ASP 24 -23.352 -3.799 -22.889 161 HA ASP 24 HA ASP 24 -25.253 -5.350 -24.151 162 HB2 ASP 24 1HB ASP 24 -25.115 -2.743 -23.325 163 HB3 ASP 24 2HB ASP 24 -25.199 -2.559 -25.074 164 H ASP 25 H ASP 25 -25.927 -5.580 -26.315 165 HA ASP 25 HA ASP 25 -23.822 -5.967 -28.171 166 HB2 ASP 25 1HB ASP 25 -26.093 -7.183 -28.019 167 HB3 ASP 25 2HB ASP 25 -26.730 -5.819 -28.932 168 H CYS 26 H CYS 26 -25.947 -3.317 -27.499 169 HA CYS 26 HA CYS 26 -25.680 -1.979 -29.995 170 HB2 CYS 26 1HB CYS 26 -26.827 -1.390 -27.348 171 HB3 CYS 26 2HB CYS 26 -26.234 0.020 -28.217 172 HG CYS 26 HG CYS 26 -29.071 -0.465 -28.523 173 H LEU 27 H LEU 27 -23.682 -2.260 -27.203 174 HA LEU 27 HA LEU 27 -22.060 0.049 -27.956 175 HB2 LEU 27 1HB LEU 27 -21.460 -1.812 -25.689 176 HB3 LEU 27 2HB LEU 27 -21.025 -0.115 -25.873 177 HG LEU 27 HG LEU 27 -23.817 -1.136 -25.358 178 HD11 LEU 27 1HD1 LEU 27 -21.584 -0.622 -23.581 179 HD12 LEU 27 2HD1 LEU 27 -23.137 -1.389 -23.254 180 HD13 LEU 27 3HD1 LEU 27 -22.992 0.367 -23.193 181 HD21 LEU 27 1HD2 LEU 27 -24.129 0.900 -26.392 182 HD22 LEU 27 2HD2 LEU 27 -22.623 1.571 -25.766 183 HD23 LEU 27 3HD2 LEU 27 -24.014 1.377 -24.698 184 H GLN 28 H GLN 28 -22.258 -2.552 -29.482 185 HA GLN 28 HA GLN 28 -19.551 -3.599 -29.250 186 HB2 GLN 28 1HB GLN 28 -21.856 -4.411 -31.028 187 HB3 GLN 28 2HB GLN 28 -20.295 -5.220 -30.979 188 HG2 GLN 28 1HG GLN 28 -22.161 -4.956 -28.633 189 HG3 GLN 28 2HG GLN 28 -22.049 -6.370 -29.680 190 HE21 GLN 28 2HE2 GLN 28 -21.330 -5.540 -26.754 191 HE22 GLN 28 1HE2 GLN 28 -19.796 -6.300 -26.522 192 H GLN 29 H GLN 29 -21.603 -2.001 -31.667 193 HA GLN 29 HA GLN 29 -19.773 -1.900 -33.759 194 HB2 GLN 29 1HB GLN 29 -21.132 -0.177 -34.705 195 HB3 GLN 29 2HB GLN 29 -22.206 -1.291 -33.869 196 HG2 GLN 29 1HG GLN 29 -22.268 0.257 -31.952 197 HG3 GLN 29 2HG GLN 29 -21.270 1.386 -32.865 198 HE21 GLN 29 2HE2 GLN 29 -24.044 1.547 -31.790 199 HE22 GLN 29 1HE2 GLN 29 -25.019 2.004 -33.142 200 H TYR 30 H TYR 30 -19.921 -0.068 -30.825 201 HA TYR 30 HA TYR 30 -18.234 2.073 -31.708 202 HB2 TYR 30 1HB TYR 30 -18.896 1.198 -28.889 203 HB3 TYR 30 2HB TYR 30 -18.191 2.740 -29.359 204 HD1 TYR 30 HD2 TYR 30 -19.847 3.433 -31.708 205 HD2 TYR 30 HD1 TYR 30 -20.956 1.767 -27.953 206 HE1 TYR 30 HE2 TYR 30 -22.099 4.391 -31.954 207 HE2 TYR 30 HE1 TYR 30 -23.211 2.720 -28.190 208 HH TYR 30 HH TYR 30 -24.349 4.040 -31.129 209 H ILE 31 H ILE 31 -17.747 -1.092 -30.395 210 HA ILE 31 HA ILE 31 -15.255 -0.912 -29.226 211 HB ILE 31 HB ILE 31 -16.242 -3.173 -30.970 212 HG12 ILE 31 1HG1 ILE 31 -16.515 -2.726 -27.989 213 HG13 ILE 31 2HG1 ILE 31 -17.817 -2.606 -29.168 214 HG21 ILE 31 1HG2 ILE 31 -13.861 -3.328 -30.554 215 HG22 ILE 31 2HG2 ILE 31 -14.124 -3.103 -28.826 216 HG23 ILE 31 3HG2 ILE 31 -14.715 -4.559 -29.625 217 HD11 ILE 31 1HD1 ILE 31 -16.411 -5.025 -28.143 218 HD12 ILE 31 2HD1 ILE 31 -18.139 -4.703 -28.288 219 HD13 ILE 31 3HD1 ILE 31 -17.184 -5.056 -29.728 220 H LYS 32 H LYS 32 -16.027 -1.362 -32.663 221 HA LYS 32 HA LYS 32 -13.430 -1.627 -33.635 222 HB2 LYS 32 1HB LYS 32 -15.838 -0.366 -34.959 223 HB3 LYS 32 2HB LYS 32 -14.361 -0.826 -35.796 224 HG2 LYS 32 1HG LYS 32 -14.781 -3.177 -34.957 225 HG3 LYS 32 2HG LYS 32 -16.386 -2.614 -34.485 226 HD2 LYS 32 1HD LYS 32 -16.987 -2.147 -36.718 227 HD3 LYS 32 2HD LYS 32 -15.316 -2.264 -37.275 228 HE2 LYS 32 1HE LYS 32 -15.295 -4.621 -36.967 229 HE3 LYS 32 2HE LYS 32 -16.827 -4.586 -36.095 230 HZ1 LYS 32 1HZ LYS 32 -16.747 -3.586 -38.852 231 HZ2 LYS 32 2HZ LYS 32 -18.018 -4.319 -38.011 232 HZ3 LYS 32 3HZ LYS 32 -16.739 -5.259 -38.597 233 H ASN 33 H ASN 33 -15.162 1.186 -32.561 234 HA ASN 33 HA ASN 33 -13.275 3.043 -33.735 235 HB2 ASN 33 1HB ASN 33 -15.686 3.372 -31.954 236 HB3 ASN 33 2HB ASN 33 -14.628 4.723 -32.353 237 HD21 ASN 33 2HD2 ASN 33 -17.319 4.675 -33.003 238 HD22 ASN 33 1HD2 ASN 33 -17.480 4.605 -34.722 239 H PHE 34 H PHE 34 -13.798 1.425 -30.708 240 HA PHE 34 HA PHE 34 -12.129 3.144 -29.142 241 HB2 PHE 34 1HB PHE 34 -13.523 0.546 -28.724 242 HB3 PHE 34 2HB PHE 34 -12.178 0.929 -27.655 243 HD1 PHE 34 HD2 PHE 34 -15.002 2.882 -29.125 244 HD2 PHE 34 HD1 PHE 34 -12.887 1.704 -25.624 245 HE1 PHE 34 HE2 PHE 34 -16.494 4.280 -27.758 246 HE2 PHE 34 HE1 PHE 34 -14.378 3.099 -24.251 247 HZ PHE 34 HZ PHE 34 -16.183 4.390 -25.317 248 H GLU 35 H GLU 35 -11.623 0.390 -31.186 249 HA GLU 35 HA GLU 35 -9.093 -0.390 -30.150 250 HB2 GLU 35 1HB GLU 35 -10.876 -1.303 -32.145 251 HB3 GLU 35 2HB GLU 35 -9.339 -1.006 -32.944 252 HG2 GLU 35 1HG GLU 35 -9.679 -2.692 -30.476 253 HG3 GLU 35 2HG GLU 35 -9.613 -3.321 -32.121 254 H ARG 36 H ARG 36 -10.093 1.688 -32.842 255 HA ARG 36 HA ARG 36 -7.391 2.304 -33.596 256 HB2 ARG 36 1HB ARG 36 -9.742 2.406 -34.925 257 HB3 ARG 36 2HB ARG 36 -9.581 4.095 -34.462 258 HG2 ARG 36 1HG ARG 36 -7.428 4.224 -35.563 259 HG3 ARG 36 2HG ARG 36 -7.511 2.508 -35.966 260 HD2 ARG 36 1HD ARG 36 -8.873 2.867 -37.711 261 HD3 ARG 36 2HD ARG 36 -9.849 4.037 -36.824 262 HE ARG 36 HE ARG 36 -7.538 5.372 -37.348 263 HH11 ARG 36 1HH1 ARG 36 -9.857 3.657 -39.297 264 HH12 ARG 36 2HH1 ARG 36 -9.597 4.639 -40.702 265 HH21 ARG 36 1HH2 ARG 36 -7.187 6.670 -39.190 266 HH22 ARG 36 2HH2 ARG 36 -8.077 6.352 -40.639 267 H GLU 37 H GLU 37 -9.755 3.621 -31.434 268 HA GLU 37 HA GLU 37 -8.447 6.185 -31.188 269 HB2 GLU 37 1HB GLU 37 -10.778 4.878 -29.809 270 HB3 GLU 37 2HB GLU 37 -10.096 6.385 -29.212 271 HG2 GLU 37 1HG GLU 37 -10.700 6.350 -32.083 272 HG3 GLU 37 2HG GLU 37 -12.098 6.211 -31.018 273 H LYS 38 H LYS 38 -8.210 3.078 -29.748 274 HA LYS 38 HA LYS 38 -6.929 2.224 -28.075 275 HB2 LYS 38 1HB LYS 38 -5.372 4.796 -28.395 276 HB3 LYS 38 2HB LYS 38 -4.800 3.331 -27.608 277 HG2 LYS 38 1HG LYS 38 -5.717 3.105 -30.417 278 HG3 LYS 38 2HG LYS 38 -4.186 3.931 -30.114 279 HD2 LYS 38 1HD LYS 38 -3.620 1.875 -28.663 280 HD3 LYS 38 2HD LYS 38 -4.950 1.092 -29.520 281 HE2 LYS 38 1HE LYS 38 -3.377 0.547 -31.023 282 HE3 LYS 38 2HE LYS 38 -3.565 2.210 -31.576 283 HZ1 LYS 38 1HZ LYS 38 -1.796 2.519 -29.605 284 HZ2 LYS 38 2HZ LYS 38 -1.364 2.279 -31.222 285 HZ3 LYS 38 3HZ LYS 38 -1.369 0.974 -30.147 286 H ILE 39 H ILE 39 -9.248 3.561 -27.269 287 HA ILE 39 HA ILE 39 -8.977 5.472 -25.277 288 HB ILE 39 HB ILE 39 -10.975 3.207 -25.348 289 HG12 ILE 39 1HG1 ILE 39 -11.011 4.500 -27.416 290 HG13 ILE 39 2HG1 ILE 39 -12.447 4.850 -26.461 291 HG21 ILE 39 1HG2 ILE 39 -10.580 5.468 -23.547 292 HG22 ILE 39 2HG2 ILE 39 -12.208 5.377 -24.217 293 HG23 ILE 39 3HG2 ILE 39 -11.539 4.003 -23.336 294 HD11 ILE 39 1HD1 ILE 39 -11.492 6.855 -27.481 295 HD12 ILE 39 2HD1 ILE 39 -11.472 6.937 -25.719 296 HD13 ILE 39 3HD1 ILE 39 -9.988 6.578 -26.602 297 H SER 40 H SER 40 -7.615 5.369 -23.615 298 HA SER 40 HA SER 40 -6.934 2.846 -22.376 299 HB2 SER 40 1HB SER 40 -5.641 4.557 -20.821 300 HB3 SER 40 2HB SER 40 -5.051 4.178 -22.439 301 HG SER 40 HG SER 40 -5.209 6.238 -22.783 302 H GLY 41 H GLY 41 -7.101 2.476 -20.068 303 HA2 GLY 41 1HA GLY 41 -9.673 2.781 -19.063 304 HA3 GLY 41 2HA GLY 41 -8.264 2.381 -18.092 305 H ASP 42 H ASP 42 -6.780 4.709 -18.353 306 HA ASP 42 HA ASP 42 -7.776 6.311 -16.337 307 HB2 ASP 42 1HB ASP 42 -5.411 6.218 -17.434 308 HB3 ASP 42 2HB ASP 42 -6.038 7.487 -18.483 309 H GLN 43 H GLN 43 -8.421 6.421 -19.760 310 HA GLN 43 HA GLN 43 -9.804 8.974 -19.547 311 HB2 GLN 43 1HB GLN 43 -9.104 7.157 -21.836 312 HB3 GLN 43 2HB GLN 43 -10.269 8.459 -22.039 313 HG2 GLN 43 1HG GLN 43 -8.380 9.931 -21.017 314 HG3 GLN 43 2HG GLN 43 -7.338 8.602 -21.522 315 HE21 GLN 43 2HE2 GLN 43 -10.118 10.331 -22.901 316 HE22 GLN 43 1HE2 GLN 43 -9.385 10.635 -24.435 317 H LEU 44 H LEU 44 -10.487 5.579 -19.643 318 HA LEU 44 HA LEU 44 -13.238 5.807 -20.375 319 HB2 LEU 44 1HB LEU 44 -12.009 3.750 -20.745 320 HB3 LEU 44 2HB LEU 44 -11.723 3.585 -19.014 321 HG LEU 44 HG LEU 44 -14.308 3.489 -18.843 322 HD11 LEU 44 1HD1 LEU 44 -15.489 2.742 -20.745 323 HD12 LEU 44 2HD1 LEU 44 -14.008 2.534 -21.678 324 HD13 LEU 44 3HD1 LEU 44 -14.569 4.154 -21.266 325 HD21 LEU 44 1HD2 LEU 44 -12.803 1.192 -20.090 326 HD22 LEU 44 2HD2 LEU 44 -14.256 1.090 -19.096 327 HD23 LEU 44 3HD2 LEU 44 -12.737 1.635 -18.384 328 H LEU 45 H LEU 45 -11.543 5.301 -17.291 329 HA LEU 45 HA LEU 45 -13.712 5.088 -15.600 330 HB2 LEU 45 1HB LEU 45 -10.976 6.253 -15.224 331 HB3 LEU 45 2HB LEU 45 -12.149 6.242 -13.908 332 HG LEU 45 HG LEU 45 -11.099 3.795 -15.329 333 HD11 LEU 45 1HD1 LEU 45 -9.388 4.917 -13.976 334 HD12 LEU 45 2HD1 LEU 45 -9.862 3.364 -13.289 335 HD13 LEU 45 3HD1 LEU 45 -10.467 4.862 -12.581 336 HD21 LEU 45 1HD2 LEU 45 -12.149 2.724 -13.235 337 HD22 LEU 45 2HD2 LEU 45 -13.213 3.209 -14.555 338 HD23 LEU 45 3HD2 LEU 45 -13.074 4.220 -13.116 339 H ARG 46 H ARG 46 -12.259 7.978 -16.983 340 HA ARG 46 HA ARG 46 -14.320 9.613 -15.667 341 HB2 ARG 46 1HB ARG 46 -12.900 11.525 -16.037 342 HB3 ARG 46 2HB ARG 46 -11.950 10.258 -15.274 343 HG2 ARG 46 1HG ARG 46 -10.849 9.736 -17.309 344 HG3 ARG 46 2HG ARG 46 -11.959 10.746 -18.239 345 HD2 ARG 46 1HD ARG 46 -10.685 12.536 -17.907 346 HD3 ARG 46 2HD ARG 46 -10.738 12.298 -16.161 347 HE ARG 46 HE ARG 46 -8.897 10.497 -16.937 348 HH11 ARG 46 1HH1 ARG 46 -9.305 13.886 -17.617 349 HH12 ARG 46 2HH1 ARG 46 -7.608 14.188 -17.793 350 HH21 ARG 46 1HH2 ARG 46 -6.661 10.882 -17.166 351 HH22 ARG 46 2HH2 ARG 46 -6.105 12.478 -17.538 352 H ILE 47 H ILE 47 -14.673 7.928 -18.073 353 HA ILE 47 HA ILE 47 -14.727 9.491 -20.409 354 HB ILE 47 HB ILE 47 -14.935 7.008 -20.358 355 HG12 ILE 47 1HG1 ILE 47 -17.358 7.673 -21.834 356 HG13 ILE 47 2HG1 ILE 47 -16.071 8.842 -22.111 357 HG21 ILE 47 1HG2 ILE 47 -17.060 5.971 -19.892 358 HG22 ILE 47 2HG2 ILE 47 -16.551 6.909 -18.490 359 HG23 ILE 47 3HG2 ILE 47 -17.794 7.541 -19.568 360 HD11 ILE 47 1HD1 ILE 47 -16.315 6.714 -23.610 361 HD12 ILE 47 2HD1 ILE 47 -14.723 7.315 -23.143 362 HD13 ILE 47 3HD1 ILE 47 -15.434 5.945 -22.290 363 H THR 48 H THR 48 -16.177 10.888 -21.243 364 HA THR 48 HA THR 48 -18.709 11.292 -19.800 365 HB THR 48 HB THR 48 -17.124 13.047 -19.104 366 HG1 THR 48 HG1 THR 48 -18.766 14.384 -19.118 367 HG21 THR 48 1HG2 THR 48 -15.730 14.023 -20.542 368 HG22 THR 48 2HG2 THR 48 -17.086 14.601 -21.511 369 HG23 THR 48 3HG2 THR 48 -16.389 13.012 -21.828 370 H HIS 49 H HIS 49 -20.256 12.665 -21.103 371 HA HIS 49 HA HIS 49 -20.866 11.464 -23.512 372 HB2 HIS 49 1HB HIS 49 -21.622 14.173 -22.422 373 HB3 HIS 49 2HB HIS 49 -22.284 13.541 -23.926 374 HD1 HIS 49 HD1 HIS 49 -23.288 13.910 -20.629 375 HD2 HIS 49 HD2 HIS 49 -23.299 10.664 -23.223 376 HE1 HIS 49 HE1 HIS 49 -25.001 12.318 -19.707 377 H GLN 50 H GLN 50 -18.784 14.200 -22.872 378 HA GLN 50 HA GLN 50 -18.574 15.169 -25.512 379 HB2 GLN 50 1HB GLN 50 -17.561 15.883 -23.018 380 HB3 GLN 50 2HB GLN 50 -16.134 15.486 -23.967 381 HG2 GLN 50 1HG GLN 50 -16.297 17.659 -24.536 382 HG3 GLN 50 2HG GLN 50 -17.399 17.008 -25.749 383 HE21 GLN 50 2HE2 GLN 50 -17.057 19.470 -23.738 384 HE22 GLN 50 1HE2 GLN 50 -18.704 19.797 -23.330 385 H GLU 51 H GLU 51 -16.787 12.707 -23.727 386 HA GLU 51 HA GLU 51 -14.854 12.277 -25.791 387 HB2 GLU 51 1HB GLU 51 -15.625 10.622 -23.384 388 HB3 GLU 51 2HB GLU 51 -14.291 10.230 -24.460 389 HG2 GLU 51 1HG GLU 51 -14.245 12.961 -23.401 390 HG3 GLU 51 2HG GLU 51 -14.076 11.692 -22.190 391 H LEU 52 H LEU 52 -17.754 10.542 -24.700 392 HA LEU 52 HA LEU 52 -17.629 8.397 -26.473 393 HB2 LEU 52 1HB LEU 52 -19.831 9.770 -25.007 394 HB3 LEU 52 2HB LEU 52 -20.241 8.569 -26.230 395 HG LEU 52 HG LEU 52 -18.465 8.022 -23.855 396 HD11 LEU 52 1HD1 LEU 52 -20.771 8.614 -23.184 397 HD12 LEU 52 2HD1 LEU 52 -20.354 6.938 -22.831 398 HD13 LEU 52 3HD1 LEU 52 -21.374 7.319 -24.218 399 HD21 LEU 52 1HD2 LEU 52 -19.370 6.484 -26.197 400 HD22 LEU 52 2HD2 LEU 52 -19.484 5.651 -24.647 401 HD23 LEU 52 3HD2 LEU 52 -17.933 6.290 -25.193 402 H GLU 53 H GLU 53 -18.795 11.673 -26.930 403 HA GLU 53 HA GLU 53 -20.135 11.259 -29.380 404 HB2 GLU 53 1HB GLU 53 -19.927 13.351 -27.683 405 HB3 GLU 53 2HB GLU 53 -18.820 13.874 -28.945 406 HG2 GLU 53 1HG GLU 53 -20.881 13.138 -30.472 407 HG3 GLU 53 2HG GLU 53 -21.755 13.562 -29.001 408 H ASP 54 H ASP 54 -16.791 12.013 -28.578 409 HA ASP 54 HA ASP 54 -15.911 12.554 -31.208 410 HB2 ASP 54 1HB ASP 54 -14.777 12.811 -28.776 411 HB3 ASP 54 2HB ASP 54 -13.990 11.329 -29.312 412 H LEU 55 H LEU 55 -16.262 9.592 -29.361 413 HA LEU 55 HA LEU 55 -14.822 7.930 -31.168 414 HB2 LEU 55 1HB LEU 55 -16.852 7.334 -29.029 415 HB3 LEU 55 2HB LEU 55 -16.052 6.079 -29.973 416 HG LEU 55 HG LEU 55 -14.269 7.995 -28.608 417 HD11 LEU 55 1HD1 LEU 55 -15.575 7.860 -26.735 418 HD12 LEU 55 2HD1 LEU 55 -14.576 6.422 -26.527 419 HD13 LEU 55 3HD1 LEU 55 -16.216 6.272 -27.159 420 HD21 LEU 55 1HD2 LEU 55 -12.869 6.372 -29.177 421 HD22 LEU 55 2HD2 LEU 55 -14.206 5.354 -29.713 422 HD23 LEU 55 3HD2 LEU 55 -13.682 5.308 -28.029 423 H GLY 56 H GLY 56 -18.105 9.082 -30.995 424 HA2 GLY 56 1HA GLY 56 -19.103 9.075 -33.336 425 HA3 GLY 56 2HA GLY 56 -18.824 7.341 -33.266 426 H VAL 57 H VAL 57 -19.529 7.561 -30.283 427 HA VAL 57 HA VAL 57 -22.203 6.715 -30.510 428 HB VAL 57 HB VAL 57 -20.877 7.745 -28.002 429 HG11 VAL 57 1HG1 VAL 57 -22.399 6.134 -26.900 430 HG12 VAL 57 2HG1 VAL 57 -23.255 7.419 -27.754 431 HG13 VAL 57 3HG1 VAL 57 -23.143 5.809 -28.465 432 HG21 VAL 57 1HG2 VAL 57 -20.185 5.496 -29.640 433 HG22 VAL 57 2HG2 VAL 57 -19.428 6.066 -28.153 434 HG23 VAL 57 3HG2 VAL 57 -20.781 4.938 -28.077 435 H SER 58 H SER 58 -23.484 8.235 -31.522 436 HA SER 58 HA SER 58 -23.664 10.916 -30.399 437 HB2 SER 58 1HB SER 58 -25.374 11.187 -32.301 438 HB3 SER 58 2HB SER 58 -23.688 10.947 -32.759 439 HG SER 58 HG SER 58 -25.845 9.414 -33.305 440 H ARG 59 H ARG 59 -25.530 7.956 -30.626 441 HA ARG 59 HA ARG 59 -28.028 8.865 -29.820 442 HB2 ARG 59 1HB ARG 59 -26.661 6.319 -30.005 443 HB3 ARG 59 2HB ARG 59 -27.708 6.370 -28.593 444 HG2 ARG 59 1HG ARG 59 -29.095 5.529 -30.236 445 HG3 ARG 59 2HG ARG 59 -29.495 7.248 -30.232 446 HD2 ARG 59 1HD ARG 59 -28.806 7.503 -32.337 447 HD3 ARG 59 2HD ARG 59 -27.292 6.658 -32.016 448 HE ARG 59 HE ARG 59 -29.432 4.817 -32.203 449 HH11 ARG 59 1HH1 ARG 59 -27.408 6.874 -34.149 450 HH12 ARG 59 2HH1 ARG 59 -27.548 5.889 -35.568 451 HH21 ARG 59 1HH2 ARG 59 -29.624 3.512 -34.064 452 HH22 ARG 59 2HH2 ARG 59 -28.809 3.978 -35.518 453 H ILE 60 H ILE 60 -29.044 8.243 -27.639 454 HA ILE 60 HA ILE 60 -27.302 9.292 -25.511 455 HB ILE 60 HB ILE 60 -30.318 9.321 -25.676 456 HG12 ILE 60 1HG1 ILE 60 -29.288 10.879 -27.254 457 HG13 ILE 60 2HG1 ILE 60 -30.049 11.758 -25.932 458 HG21 ILE 60 1HG2 ILE 60 -28.539 9.596 -23.456 459 HG22 ILE 60 2HG2 ILE 60 -29.354 11.131 -23.746 460 HG23 ILE 60 3HG2 ILE 60 -30.301 9.667 -23.484 461 HD11 ILE 60 1HD1 ILE 60 -27.109 11.197 -26.237 462 HD12 ILE 60 2HD1 ILE 60 -27.918 12.743 -26.492 463 HD13 ILE 60 3HD1 ILE 60 -27.855 12.036 -24.878 464 H GLY 61 H GLY 61 -29.864 6.910 -26.148 465 HA2 GLY 61 1HA GLY 61 -29.859 5.672 -23.636 466 HA3 GLY 61 2HA GLY 61 -30.353 4.908 -25.139 467 H HIS 62 H HIS 62 -27.670 5.342 -26.332 468 HA HIS 62 HA HIS 62 -26.481 2.904 -25.371 469 HB2 HIS 62 1HB HIS 62 -25.457 4.850 -27.449 470 HB3 HIS 62 2HB HIS 62 -24.874 3.209 -27.185 471 HD1 HIS 62 HD1 HIS 62 -26.135 4.309 -29.879 472 HD2 HIS 62 HD2 HIS 62 -28.082 2.006 -27.022 473 HE1 HIS 62 HE1 HIS 62 -28.024 3.182 -31.098 474 H GLN 63 H GLN 63 -25.672 6.344 -25.314 475 HA GLN 63 HA GLN 63 -23.098 6.194 -24.283 476 HB2 GLN 63 1HB GLN 63 -25.259 8.263 -23.898 477 HB3 GLN 63 2HB GLN 63 -23.621 8.471 -23.293 478 HG2 GLN 63 1HG GLN 63 -22.736 8.359 -25.534 479 HG3 GLN 63 2HG GLN 63 -24.342 8.028 -26.180 480 HE21 GLN 63 2HE2 GLN 63 -22.306 10.264 -26.483 481 HE22 GLN 63 1HE2 GLN 63 -23.236 11.702 -26.260 482 H GLU 64 H GLU 64 -26.195 6.327 -22.549 483 HA GLU 64 HA GLU 64 -25.042 6.248 -19.958 484 HB2 GLU 64 1HB GLU 64 -27.760 6.029 -21.107 485 HB3 GLU 64 2HB GLU 64 -27.527 5.275 -19.536 486 HG2 GLU 64 1HG GLU 64 -26.489 8.021 -19.857 487 HG3 GLU 64 2HG GLU 64 -28.241 7.824 -19.843 488 H LEU 65 H LEU 65 -26.152 3.786 -22.205 489 HA LEU 65 HA LEU 65 -26.254 1.571 -20.550 490 HB2 LEU 65 1HB LEU 65 -25.851 2.057 -23.416 491 HB3 LEU 65 2HB LEU 65 -25.208 0.522 -22.834 492 HG LEU 65 HG LEU 65 -28.059 1.389 -22.392 493 HD11 LEU 65 1HD1 LEU 65 -27.358 -0.652 -24.426 494 HD12 LEU 65 2HD1 LEU 65 -27.138 1.045 -24.853 495 HD13 LEU 65 3HD1 LEU 65 -28.726 0.459 -24.357 496 HD21 LEU 65 1HD2 LEU 65 -26.652 -1.271 -22.194 497 HD22 LEU 65 2HD2 LEU 65 -28.390 -1.026 -22.022 498 HD23 LEU 65 3HD2 LEU 65 -27.278 -0.307 -20.856 499 H ILE 66 H ILE 66 -23.460 3.101 -22.064 500 HA ILE 66 HA ILE 66 -21.604 1.095 -21.212 501 HB ILE 66 HB ILE 66 -21.056 3.922 -22.122 502 HG12 ILE 66 1HG1 ILE 66 -20.892 1.380 -23.745 503 HG13 ILE 66 2HG1 ILE 66 -22.310 2.423 -23.738 504 HG21 ILE 66 1HG2 ILE 66 -18.977 3.469 -21.455 505 HG22 ILE 66 2HG2 ILE 66 -19.351 1.767 -21.187 506 HG23 ILE 66 3HG2 ILE 66 -18.906 2.329 -22.798 507 HD11 ILE 66 1HD1 ILE 66 -19.641 3.583 -24.375 508 HD12 ILE 66 2HD1 ILE 66 -20.515 2.660 -25.598 509 HD13 ILE 66 3HD1 ILE 66 -21.247 4.099 -24.889 510 H LEU 67 H LEU 67 -22.283 4.429 -20.157 511 HA LEU 67 HA LEU 67 -20.462 4.586 -18.076 512 HB2 LEU 67 1HB LEU 67 -23.224 5.788 -18.207 513 HB3 LEU 67 2HB LEU 67 -21.937 6.295 -17.115 514 HG LEU 67 HG LEU 67 -21.646 6.433 -20.105 515 HD11 LEU 67 1HD1 LEU 67 -23.640 7.743 -19.016 516 HD12 LEU 67 2HD1 LEU 67 -22.593 8.515 -20.206 517 HD13 LEU 67 3HD1 LEU 67 -22.356 8.830 -18.487 518 HD21 LEU 67 1HD2 LEU 67 -19.783 7.728 -19.704 519 HD22 LEU 67 2HD2 LEU 67 -19.704 6.574 -18.372 520 HD23 LEU 67 3HD2 LEU 67 -20.326 8.202 -18.094 521 H GLU 68 H GLU 68 -23.826 3.441 -17.984 522 HA GLU 68 HA GLU 68 -24.067 2.928 -15.283 523 HB2 GLU 68 1HB GLU 68 -25.943 2.734 -16.823 524 HB3 GLU 68 2HB GLU 68 -25.196 1.342 -17.595 525 HG2 GLU 68 1HG GLU 68 -25.660 1.158 -14.684 526 HG3 GLU 68 2HG GLU 68 -27.083 1.138 -15.724 527 H ALA 69 H ALA 69 -22.326 1.141 -17.717 528 HA ALA 69 HA ALA 69 -21.912 -1.172 -16.040 529 HB1 ALA 69 1HB ALA 69 -20.447 -0.502 -18.582 530 HB2 ALA 69 2HB ALA 69 -20.687 -2.088 -17.848 531 HB3 ALA 69 3HB ALA 69 -22.054 -1.229 -18.558 532 H VAL 70 H VAL 70 -20.073 1.665 -17.051 533 HA VAL 70 HA VAL 70 -17.569 0.938 -16.039 534 HB VAL 70 HB VAL 70 -18.769 3.706 -16.226 535 HG11 VAL 70 1HG1 VAL 70 -16.141 4.098 -16.550 536 HG12 VAL 70 2HG1 VAL 70 -16.938 4.177 -14.977 537 HG13 VAL 70 3HG1 VAL 70 -16.091 2.708 -15.465 538 HG21 VAL 70 1HG2 VAL 70 -18.812 2.853 -18.397 539 HG22 VAL 70 2HG2 VAL 70 -17.280 3.725 -18.325 540 HG23 VAL 70 3HG2 VAL 70 -17.302 1.968 -18.181 541 H ASP 71 H ASP 71 -20.421 2.165 -14.448 542 HA ASP 71 HA ASP 71 -19.312 3.085 -12.059 543 HB2 ASP 71 1HB ASP 71 -21.756 3.193 -12.920 544 HB3 ASP 71 2HB ASP 71 -21.940 1.627 -12.137 545 H LEU 72 H LEU 72 -20.412 -0.172 -12.947 546 HA LEU 72 HA LEU 72 -19.947 -1.402 -10.475 547 HB2 LEU 72 1HB LEU 72 -20.170 -2.346 -13.289 548 HB3 LEU 72 2HB LEU 72 -19.568 -3.467 -12.070 549 HG LEU 72 HG LEU 72 -22.006 -3.666 -12.558 550 HD11 LEU 72 1HD1 LEU 72 -21.054 -4.462 -10.457 551 HD12 LEU 72 2HD1 LEU 72 -22.681 -3.826 -10.221 552 HD13 LEU 72 3HD1 LEU 72 -21.282 -2.865 -9.743 553 HD21 LEU 72 1HD2 LEU 72 -22.518 -1.322 -12.919 554 HD22 LEU 72 2HD2 LEU 72 -22.110 -0.953 -11.243 555 HD23 LEU 72 3HD2 LEU 72 -23.506 -1.968 -11.609 556 H LEU 73 H LEU 73 -17.812 -0.806 -13.215 557 HA LEU 73 HA LEU 73 -15.640 -2.373 -12.469 558 HB2 LEU 73 1HB LEU 73 -16.107 -0.071 -14.208 559 HB3 LEU 73 2HB LEU 73 -14.466 -0.157 -13.572 560 HG LEU 73 HG LEU 73 -15.836 -2.366 -15.104 561 HD11 LEU 73 1HD1 LEU 73 -13.669 -0.511 -16.065 562 HD12 LEU 73 2HD1 LEU 73 -15.380 -0.285 -16.423 563 HD13 LEU 73 3HD1 LEU 73 -14.544 -1.728 -16.995 564 HD21 LEU 73 1HD2 LEU 73 -13.259 -2.937 -15.301 565 HD22 LEU 73 2HD2 LEU 73 -14.233 -3.492 -13.939 566 HD23 LEU 73 3HD2 LEU 73 -13.201 -2.072 -13.765 567 H CYS 74 H CYS 74 -16.679 0.763 -11.305 568 HA CYS 74 HA CYS 74 -14.266 1.144 -9.741 569 HB2 CYS 74 1HB CYS 74 -15.866 2.938 -10.894 570 HB3 CYS 74 2HB CYS 74 -16.675 2.849 -9.334 571 HG CYS 74 HG CYS 74 -14.678 5.009 -9.767 572 H ALA 75 H ALA 75 -17.593 0.152 -9.276 573 HA ALA 75 HA ALA 75 -17.712 0.320 -6.476 574 HB1 ALA 75 1HB ALA 75 -19.429 -1.634 -6.859 575 HB2 ALA 75 2HB ALA 75 -19.785 0.008 -7.396 576 HB3 ALA 75 3HB ALA 75 -19.214 -1.194 -8.553 577 H LEU 76 H LEU 76 -16.932 -2.460 -8.567 578 HA LEU 76 HA LEU 76 -16.459 -4.348 -6.602 579 HB2 LEU 76 1HB LEU 76 -15.742 -3.981 -9.406 580 HB3 LEU 76 2HB LEU 76 -14.565 -4.936 -8.507 581 HG LEU 76 HG LEU 76 -17.470 -5.633 -8.365 582 HD11 LEU 76 1HD1 LEU 76 -17.295 -7.026 -10.305 583 HD12 LEU 76 2HD1 LEU 76 -15.604 -6.582 -10.531 584 HD13 LEU 76 3HD1 LEU 76 -16.870 -5.376 -10.764 585 HD21 LEU 76 1HD2 LEU 76 -14.864 -7.105 -8.068 586 HD22 LEU 76 2HD2 LEU 76 -16.420 -7.926 -8.190 587 HD23 LEU 76 3HD2 LEU 76 -16.106 -6.826 -6.847 588 H ASN 77 H ASN 77 -14.481 -1.674 -7.625 589 HA ASN 77 HA ASN 77 -12.158 -2.630 -6.162 590 HB2 ASN 77 1HB ASN 77 -12.723 -0.391 -8.041 591 HB3 ASN 77 2HB ASN 77 -11.420 -0.162 -6.878 592 HD21 ASN 77 2HD2 ASN 77 -12.624 -2.362 -9.358 593 HD22 ASN 77 1HD2 ASN 77 -11.073 -2.942 -9.849 594 H SER 78 H SER 78 -13.029 -2.662 -4.044 595 HA SER 78 HA SER 78 -12.789 -0.131 -2.681 596 HB2 SER 78 1HB SER 78 -15.037 -0.493 -1.506 597 HB3 SER 78 2HB SER 78 -15.095 0.109 -3.163 598 HG SER 78 HG SER 78 -16.047 -1.669 -3.765 599 H GLY 79 H GLY 79 -12.270 -0.352 -0.523 600 HA2 GLY 79 1HA GLY 79 -12.679 -2.640 1.046 601 HA3 GLY 79 2HA GLY 79 -11.102 -2.781 0.284 602 HA PRO 80 HA PRO 80 -11.003 -0.155 4.239 603 HB2 PRO 80 1HB PRO 80 -9.706 -1.932 5.829 604 HB3 PRO 80 2HB PRO 80 -11.468 -1.851 5.717 605 HG2 PRO 80 1HG PRO 80 -9.569 -3.728 4.364 606 HG3 PRO 80 2HG PRO 80 -11.128 -4.076 5.136 607 HD2 PRO 80 1HD PRO 80 -10.851 -3.841 2.452 608 HD3 PRO 80 2HD PRO 80 -12.335 -3.368 3.304 609 H SER 81 H SER 81 -9.271 1.120 4.615 610 HA SER 81 HA SER 81 -6.755 0.387 3.294 611 HB2 SER 81 1HB SER 81 -6.962 3.121 4.323 612 HB3 SER 81 2HB SER 81 -6.530 2.554 2.710 613 HG SER 81 HG SER 81 -8.826 3.611 3.516 614 H SER 82 H SER 82 -7.512 -0.694 5.873 615 HA SER 82 HA SER 82 -5.149 0.135 7.362 616 HB2 SER 82 1HB SER 82 -6.544 1.493 8.594 617 HB3 SER 82 2HB SER 82 -7.960 0.484 8.303 618 HG SER 82 HG SER 82 -7.575 -0.323 10.194 619 H GLY 83 H GLY 83 -8.047 -1.933 7.661 620 HA2 GLY 83 1HA GLY 83 -7.899 -4.327 7.464 621 HA3 GLY 83 2HA GLY 83 -6.244 -4.230 8.045 Start of MODEL 14 1 H1 GLY 1 H GLY 1 6.660 5.830 -0.993 2 HA2 GLY 1 1HA GLY 1 5.306 7.715 -1.553 3 HA3 GLY 1 2HA GLY 1 5.573 7.361 -3.253 4 H SER 2 H SER 2 3.554 7.105 -4.018 5 HA SER 2 HA SER 2 1.789 5.212 -2.615 6 HB2 SER 2 1HB SER 2 0.949 7.260 -4.673 7 HB3 SER 2 2HB SER 2 -0.089 6.339 -3.585 8 HG SER 2 HG SER 2 1.151 8.685 -3.158 9 H SER 3 H SER 3 1.276 3.351 -3.570 10 HA SER 3 HA SER 3 2.482 2.631 -6.056 11 HB2 SER 3 1HB SER 3 2.295 0.908 -4.419 12 HB3 SER 3 2HB SER 3 0.569 1.200 -4.208 13 HG SER 3 HG SER 3 0.883 -0.612 -5.510 14 H GLY 4 H GLY 4 -0.916 2.926 -5.008 15 HA2 GLY 4 1HA GLY 4 -2.550 4.042 -6.366 16 HA3 GLY 4 2HA GLY 4 -1.609 3.609 -7.786 17 H SER 5 H SER 5 -3.594 2.240 -5.189 18 HA SER 5 HA SER 5 -3.976 -0.230 -6.647 19 HB2 SER 5 1HB SER 5 -5.481 0.627 -4.177 20 HB3 SER 5 2HB SER 5 -5.149 -1.011 -4.740 21 HG SER 5 HG SER 5 -3.726 0.418 -3.056 22 H SER 6 H SER 6 -5.250 -0.156 -8.384 23 HA SER 6 HA SER 6 -8.016 0.550 -8.095 24 HB2 SER 6 1HB SER 6 -7.017 2.039 -10.388 25 HB3 SER 6 2HB SER 6 -8.081 2.568 -9.085 26 HG SER 6 HG SER 6 -5.246 2.489 -9.078 27 H GLY 7 H GLY 7 -5.446 0.027 -10.510 28 HA2 GLY 7 1HA GLY 7 -5.276 -1.754 -12.011 29 HA3 GLY 7 2HA GLY 7 -6.881 -2.283 -11.528 30 H VAL 8 H VAL 8 -8.672 -0.694 -12.207 31 HA VAL 8 HA VAL 8 -8.803 -0.614 -14.982 32 HB VAL 8 HB VAL 8 -10.354 1.183 -13.116 33 HG11 VAL 8 1HG1 VAL 8 -10.571 1.750 -15.478 34 HG12 VAL 8 2HG1 VAL 8 -11.014 0.083 -15.847 35 HG13 VAL 8 3HG1 VAL 8 -12.076 1.079 -14.851 36 HG21 VAL 8 1HG2 VAL 8 -11.020 -0.749 -12.180 37 HG22 VAL 8 2HG2 VAL 8 -12.001 -0.914 -13.636 38 HG23 VAL 8 3HG2 VAL 8 -10.437 -1.723 -13.530 39 H SER 9 H SER 9 -7.422 1.643 -12.753 40 HA SER 9 HA SER 9 -7.437 3.914 -14.477 41 HB2 SER 9 1HB SER 9 -5.778 4.840 -12.860 42 HB3 SER 9 2HB SER 9 -7.237 4.229 -12.081 43 HG SER 9 HG SER 9 -4.893 3.605 -11.371 44 H LYS 10 H LYS 10 -5.337 1.177 -14.043 45 HA LYS 10 HA LYS 10 -3.373 2.354 -15.887 46 HB2 LYS 10 1HB LYS 10 -3.027 -0.149 -14.238 47 HB3 LYS 10 2HB LYS 10 -1.779 0.777 -15.062 48 HG2 LYS 10 1HG LYS 10 -3.066 2.546 -13.288 49 HG3 LYS 10 2HG LYS 10 -2.762 1.051 -12.400 50 HD2 LYS 10 1HD LYS 10 -0.396 1.152 -13.242 51 HD3 LYS 10 2HD LYS 10 -0.760 2.764 -13.865 52 HE2 LYS 10 1HE LYS 10 0.335 2.836 -11.663 53 HE3 LYS 10 2HE LYS 10 -1.280 3.542 -11.631 54 HZ1 LYS 10 1HZ LYS 10 -1.058 0.709 -10.973 55 HZ2 LYS 10 2HZ LYS 10 -2.075 1.894 -10.324 56 HZ3 LYS 10 3HZ LYS 10 -0.459 1.806 -9.832 57 H TRP 11 H TRP 11 -6.023 1.105 -16.546 58 HA TRP 11 HA TRP 11 -5.464 -1.396 -17.812 59 HB2 TRP 11 1HB TRP 11 -7.778 0.400 -17.520 60 HB3 TRP 11 2HB TRP 11 -7.737 -0.496 -19.036 61 HD1 TRP 11 HD1 TRP 11 -6.370 -2.138 -15.881 62 HE1 TRP 11 HE1 TRP 11 -7.925 -4.077 -15.212 63 HE3 TRP 11 HE3 TRP 11 -10.191 -1.285 -19.169 64 HZ2 TRP 11 HZ2 TRP 11 -10.439 -5.108 -15.977 65 HZ3 TRP 11 HZ3 TRP 11 -12.134 -2.794 -19.136 66 HH2 TRP 11 HH2 TRP 11 -12.253 -4.666 -17.573 67 H SER 12 H SER 12 -4.569 -1.756 -19.731 68 HA SER 12 HA SER 12 -3.461 0.269 -21.306 69 HB2 SER 12 1HB SER 12 -3.742 -2.643 -21.466 70 HB3 SER 12 2HB SER 12 -3.697 -1.859 -23.045 71 HG SER 12 HG SER 12 -1.772 -0.752 -22.226 72 HA PRO 13 HA PRO 13 -6.625 1.671 -24.001 73 HB2 PRO 13 1HB PRO 13 -5.323 1.895 -26.372 74 HB3 PRO 13 2HB PRO 13 -5.045 2.994 -25.016 75 HG2 PRO 13 1HG PRO 13 -3.437 0.627 -25.896 76 HG3 PRO 13 2HG PRO 13 -2.879 2.224 -25.364 77 HD2 PRO 13 1HD PRO 13 -2.866 0.059 -23.737 78 HD3 PRO 13 2HD PRO 13 -3.130 1.707 -23.132 79 H SER 14 H SER 14 -4.977 -1.283 -24.753 80 HA SER 14 HA SER 14 -6.917 -2.004 -26.813 81 HB2 SER 14 1HB SER 14 -4.201 -2.676 -26.312 82 HB3 SER 14 2HB SER 14 -5.144 -4.161 -26.187 83 HG SER 14 HG SER 14 -4.578 -2.613 -28.385 84 H GLN 15 H GLN 15 -6.173 -2.609 -23.486 85 HA GLN 15 HA GLN 15 -7.578 -5.047 -23.178 86 HB2 GLN 15 1HB GLN 15 -6.575 -2.929 -21.323 87 HB3 GLN 15 2HB GLN 15 -7.702 -4.131 -20.708 88 HG2 GLN 15 1HG GLN 15 -5.490 -5.267 -22.235 89 HG3 GLN 15 2HG GLN 15 -4.989 -4.390 -20.790 90 HE21 GLN 15 2HE2 GLN 15 -7.840 -6.373 -21.494 91 HE22 GLN 15 1HE2 GLN 15 -7.599 -7.489 -20.198 92 H VAL 16 H VAL 16 -8.518 -1.658 -22.746 93 HA VAL 16 HA VAL 16 -11.037 -1.970 -21.666 94 HB VAL 16 HB VAL 16 -10.194 0.071 -23.729 95 HG11 VAL 16 1HG1 VAL 16 -12.421 0.472 -23.715 96 HG12 VAL 16 2HG1 VAL 16 -12.662 -0.305 -22.149 97 HG13 VAL 16 3HG1 VAL 16 -12.023 1.337 -22.231 98 HG21 VAL 16 1HG2 VAL 16 -8.788 -0.051 -21.671 99 HG22 VAL 16 2HG2 VAL 16 -9.617 1.491 -21.889 100 HG23 VAL 16 3HG2 VAL 16 -10.230 0.316 -20.725 101 H VAL 17 H VAL 17 -9.983 -2.437 -24.975 102 HA VAL 17 HA VAL 17 -12.507 -2.499 -26.217 103 HB VAL 17 HB VAL 17 -10.076 -4.081 -27.057 104 HG11 VAL 17 1HG1 VAL 17 -12.102 -2.852 -28.882 105 HG12 VAL 17 2HG1 VAL 17 -11.017 -4.214 -29.168 106 HG13 VAL 17 3HG1 VAL 17 -12.421 -4.409 -28.118 107 HG21 VAL 17 1HG2 VAL 17 -10.779 -1.191 -27.531 108 HG22 VAL 17 2HG2 VAL 17 -9.336 -1.838 -26.751 109 HG23 VAL 17 3HG2 VAL 17 -9.583 -2.072 -28.481 110 H ASP 18 H ASP 18 -10.583 -5.015 -24.654 111 HA ASP 18 HA ASP 18 -12.186 -7.209 -25.386 112 HB2 ASP 18 1HB ASP 18 -9.873 -7.348 -24.433 113 HB3 ASP 18 2HB ASP 18 -10.547 -6.925 -22.862 114 H TRP 19 H TRP 19 -12.520 -4.785 -22.917 115 HA TRP 19 HA TRP 19 -14.396 -6.174 -21.295 116 HB2 TRP 19 1HB TRP 19 -13.168 -4.320 -20.360 117 HB3 TRP 19 2HB TRP 19 -13.795 -3.226 -21.590 118 HD1 TRP 19 HD1 TRP 19 -15.430 -5.551 -18.926 119 HE1 TRP 19 HE1 TRP 19 -17.337 -4.235 -17.806 120 HE3 TRP 19 HE3 TRP 19 -15.023 -1.166 -21.522 121 HZ2 TRP 19 HZ2 TRP 19 -18.514 -1.676 -17.998 122 HZ3 TRP 19 HZ3 TRP 19 -16.579 0.666 -20.994 123 HH2 TRP 19 HH2 TRP 19 -18.287 0.414 -19.268 124 H MET 20 H MET 20 -14.711 -3.840 -23.942 125 HA MET 20 HA MET 20 -17.504 -3.556 -23.834 126 HB2 MET 20 1HB MET 20 -15.835 -3.389 -26.341 127 HB3 MET 20 2HB MET 20 -17.347 -2.559 -25.998 128 HG2 MET 20 1HG MET 20 -16.175 -1.314 -24.191 129 HG3 MET 20 2HG MET 20 -14.670 -2.056 -24.728 130 HE1 MET 20 1HE MET 20 -17.761 -0.209 -25.745 131 HE2 MET 20 2HE MET 20 -17.239 1.016 -26.901 132 HE3 MET 20 3HE MET 20 -17.516 -0.642 -27.437 133 H LYS 21 H LYS 21 -15.499 -6.097 -25.017 134 HA LYS 21 HA LYS 21 -17.303 -7.264 -26.860 135 HB2 LYS 21 1HB LYS 21 -15.045 -8.484 -25.264 136 HB3 LYS 21 2HB LYS 21 -15.906 -9.313 -26.554 137 HG2 LYS 21 1HG LYS 21 -15.196 -7.442 -28.080 138 HG3 LYS 21 2HG LYS 21 -14.145 -6.888 -26.775 139 HD2 LYS 21 1HD LYS 21 -12.989 -9.036 -26.779 140 HD3 LYS 21 2HD LYS 21 -14.059 -9.620 -28.055 141 HE2 LYS 21 1HE LYS 21 -13.090 -8.283 -29.662 142 HE3 LYS 21 2HE LYS 21 -12.511 -7.106 -28.484 143 HZ1 LYS 21 1HZ LYS 21 -10.556 -8.114 -28.810 144 HZ2 LYS 21 2HZ LYS 21 -11.249 -9.516 -29.454 145 HZ3 LYS 21 3HZ LYS 21 -11.156 -9.312 -27.777 146 H GLY 22 H GLY 22 -17.378 -7.026 -23.490 147 HA2 GLY 22 1HA GLY 22 -19.259 -9.300 -23.324 148 HA3 GLY 22 2HA GLY 22 -18.247 -8.777 -21.986 149 H LEU 23 H LEU 23 -19.794 -6.448 -24.054 150 HA LEU 23 HA LEU 23 -21.656 -5.810 -21.861 151 HB2 LEU 23 1HB LEU 23 -20.532 -3.880 -23.880 152 HB3 LEU 23 2HB LEU 23 -21.497 -3.496 -22.456 153 HG LEU 23 HG LEU 23 -18.654 -4.502 -22.501 154 HD11 LEU 23 1HD1 LEU 23 -19.014 -2.116 -23.078 155 HD12 LEU 23 2HD1 LEU 23 -18.093 -2.354 -21.593 156 HD13 LEU 23 3HD1 LEU 23 -19.793 -1.894 -21.511 157 HD21 LEU 23 1HD2 LEU 23 -19.178 -3.733 -19.937 158 HD22 LEU 23 2HD2 LEU 23 -19.169 -5.400 -20.514 159 HD23 LEU 23 3HD2 LEU 23 -20.691 -4.514 -20.399 160 H ASP 24 H ASP 24 -23.272 -4.001 -23.082 161 HA ASP 24 HA ASP 24 -25.172 -5.530 -24.373 162 HB2 ASP 24 1HB ASP 24 -24.946 -2.871 -23.562 163 HB3 ASP 24 2HB ASP 24 -25.246 -2.776 -25.295 164 H ASP 25 H ASP 25 -25.820 -5.779 -26.524 165 HA ASP 25 HA ASP 25 -23.735 -6.096 -28.400 166 HB2 ASP 25 1HB ASP 25 -26.387 -6.927 -28.178 167 HB3 ASP 25 2HB ASP 25 -26.366 -5.917 -29.622 168 H CYS 26 H CYS 26 -26.060 -3.536 -27.829 169 HA CYS 26 HA CYS 26 -25.694 -2.130 -30.245 170 HB2 CYS 26 1HB CYS 26 -26.765 -0.267 -29.136 171 HB3 CYS 26 2HB CYS 26 -27.577 -1.754 -28.661 172 HG CYS 26 HG CYS 26 -26.588 0.547 -26.717 173 H LEU 27 H LEU 27 -23.748 -2.428 -27.424 174 HA LEU 27 HA LEU 27 -22.165 -0.065 -28.086 175 HB2 LEU 27 1HB LEU 27 -21.609 -1.986 -25.850 176 HB3 LEU 27 2HB LEU 27 -21.131 -0.295 -25.992 177 HG LEU 27 HG LEU 27 -23.951 -1.272 -25.541 178 HD11 LEU 27 1HD1 LEU 27 -23.047 0.246 -23.373 179 HD12 LEU 27 2HD1 LEU 27 -21.754 -0.899 -23.729 180 HD13 LEU 27 3HD1 LEU 27 -23.387 -1.484 -23.408 181 HD21 LEU 27 1HD2 LEU 27 -24.100 0.791 -26.645 182 HD22 LEU 27 2HD2 LEU 27 -22.716 1.456 -25.777 183 HD23 LEU 27 3HD2 LEU 27 -24.242 1.187 -24.932 184 H GLN 28 H GLN 28 -22.278 -2.629 -29.682 185 HA GLN 28 HA GLN 28 -19.544 -3.607 -29.432 186 HB2 GLN 28 1HB GLN 28 -21.811 -4.462 -31.239 187 HB3 GLN 28 2HB GLN 28 -20.225 -5.221 -31.197 188 HG2 GLN 28 1HG GLN 28 -22.090 -5.052 -28.843 189 HG3 GLN 28 2HG GLN 28 -21.964 -6.439 -29.924 190 HE21 GLN 28 2HE2 GLN 28 -21.179 -5.558 -26.990 191 HE22 GLN 28 1HE2 GLN 28 -19.652 -6.340 -26.787 192 H GLN 29 H GLN 29 -21.621 -2.026 -31.836 193 HA GLN 29 HA GLN 29 -19.789 -1.842 -33.918 194 HB2 GLN 29 1HB GLN 29 -21.147 0.029 -34.740 195 HB3 GLN 29 2HB GLN 29 -22.153 -1.305 -34.193 196 HG2 GLN 29 1HG GLN 29 -22.168 0.052 -31.946 197 HG3 GLN 29 2HG GLN 29 -21.778 1.398 -33.016 198 HE21 GLN 29 2HE2 GLN 29 -24.199 -0.734 -31.896 199 HE22 GLN 29 1HE2 GLN 29 -25.508 -0.110 -32.836 200 H TYR 30 H TYR 30 -19.979 -0.073 -30.949 201 HA TYR 30 HA TYR 30 -18.333 2.119 -31.787 202 HB2 TYR 30 1HB TYR 30 -18.972 1.185 -28.982 203 HB3 TYR 30 2HB TYR 30 -18.323 2.756 -29.436 204 HD1 TYR 30 HD2 TYR 30 -20.013 3.409 -31.777 205 HD2 TYR 30 HD1 TYR 30 -21.045 1.680 -28.030 206 HE1 TYR 30 HE2 TYR 30 -22.298 4.290 -32.007 207 HE2 TYR 30 HE1 TYR 30 -23.333 2.555 -28.249 208 HH TYR 30 HH TYR 30 -24.271 4.573 -31.011 209 H ILE 31 H ILE 31 -17.788 -1.062 -30.540 210 HA ILE 31 HA ILE 31 -15.309 -0.859 -29.349 211 HB ILE 31 HB ILE 31 -16.241 -3.096 -31.153 212 HG12 ILE 31 1HG1 ILE 31 -16.518 -2.747 -28.160 213 HG13 ILE 31 2HG1 ILE 31 -17.824 -2.591 -29.329 214 HG21 ILE 31 1HG2 ILE 31 -14.696 -4.479 -29.795 215 HG22 ILE 31 2HG2 ILE 31 -13.875 -3.254 -30.760 216 HG23 ILE 31 3HG2 ILE 31 -14.105 -3.004 -29.030 217 HD11 ILE 31 1HD1 ILE 31 -18.009 -4.730 -28.337 218 HD12 ILE 31 2HD1 ILE 31 -17.396 -4.972 -29.973 219 HD13 ILE 31 3HD1 ILE 31 -16.298 -5.071 -28.597 220 H LYS 32 H LYS 32 -16.048 -1.234 -32.801 221 HA LYS 32 HA LYS 32 -13.447 -1.431 -33.768 222 HB2 LYS 32 1HB LYS 32 -15.832 -0.116 -35.083 223 HB3 LYS 32 2HB LYS 32 -14.362 -0.615 -35.909 224 HG2 LYS 32 1HG LYS 32 -16.343 -2.414 -34.529 225 HG3 LYS 32 2HG LYS 32 -16.106 -2.238 -36.269 226 HD2 LYS 32 1HD LYS 32 -13.732 -3.002 -35.911 227 HD3 LYS 32 2HD LYS 32 -14.190 -3.398 -34.253 228 HE2 LYS 32 1HE LYS 32 -14.288 -5.354 -35.736 229 HE3 LYS 32 2HE LYS 32 -15.865 -4.954 -35.058 230 HZ1 LYS 32 1HZ LYS 32 -15.017 -4.018 -37.734 231 HZ2 LYS 32 2HZ LYS 32 -16.580 -4.063 -37.090 232 HZ3 LYS 32 3HZ LYS 32 -15.794 -5.503 -37.505 233 H ASN 33 H ASN 33 -15.217 1.331 -32.620 234 HA ASN 33 HA ASN 33 -13.377 3.257 -33.736 235 HB2 ASN 33 1HB ASN 33 -15.626 3.565 -31.734 236 HB3 ASN 33 2HB ASN 33 -14.701 4.901 -32.414 237 HD21 ASN 33 2HD2 ASN 33 -17.411 4.824 -32.671 238 HD22 ASN 33 1HD2 ASN 33 -17.837 4.533 -34.320 239 H PHE 34 H PHE 34 -13.918 1.654 -30.662 240 HA PHE 34 HA PHE 34 -12.111 3.278 -29.168 241 HB2 PHE 34 1HB PHE 34 -13.537 0.691 -28.687 242 HB3 PHE 34 2HB PHE 34 -12.227 1.162 -27.610 243 HD1 PHE 34 HD2 PHE 34 -15.102 2.914 -29.227 244 HD2 PHE 34 HD1 PHE 34 -12.962 2.070 -25.647 245 HE1 PHE 34 HE2 PHE 34 -16.659 4.340 -27.964 246 HE2 PHE 34 HE1 PHE 34 -14.516 3.493 -24.378 247 HZ PHE 34 HZ PHE 34 -16.367 4.632 -25.536 248 H GLU 35 H GLU 35 -11.827 0.346 -31.056 249 HA GLU 35 HA GLU 35 -9.293 -0.477 -30.121 250 HB2 GLU 35 1HB GLU 35 -11.182 -1.401 -31.978 251 HB3 GLU 35 2HB GLU 35 -9.711 -1.136 -32.904 252 HG2 GLU 35 1HG GLU 35 -9.968 -2.834 -30.432 253 HG3 GLU 35 2HG GLU 35 -9.835 -3.417 -32.091 254 H ARG 36 H ARG 36 -10.305 1.906 -32.449 255 HA ARG 36 HA ARG 36 -7.585 2.266 -33.440 256 HB2 ARG 36 1HB ARG 36 -9.749 2.343 -34.870 257 HB3 ARG 36 2HB ARG 36 -9.939 3.963 -34.212 258 HG2 ARG 36 1HG ARG 36 -8.294 4.814 -35.482 259 HG3 ARG 36 2HG ARG 36 -7.288 3.372 -35.331 260 HD2 ARG 36 1HD ARG 36 -9.785 3.167 -36.926 261 HD3 ARG 36 2HD ARG 36 -8.436 4.064 -37.622 262 HE ARG 36 HE ARG 36 -8.617 1.222 -37.247 263 HH11 ARG 36 1HH1 ARG 36 -6.457 3.930 -37.589 264 HH12 ARG 36 2HH1 ARG 36 -5.138 2.971 -38.173 265 HH21 ARG 36 1HH2 ARG 36 -6.888 -0.052 -38.016 266 HH22 ARG 36 2HH2 ARG 36 -5.384 0.707 -38.417 267 H GLU 37 H GLU 37 -9.979 3.866 -31.436 268 HA GLU 37 HA GLU 37 -8.547 6.325 -31.194 269 HB2 GLU 37 1HB GLU 37 -10.979 5.126 -30.029 270 HB3 GLU 37 2HB GLU 37 -10.150 6.287 -29.001 271 HG2 GLU 37 1HG GLU 37 -10.324 7.352 -31.637 272 HG3 GLU 37 2HG GLU 37 -11.917 6.787 -31.136 273 H LYS 38 H LYS 38 -8.318 3.242 -29.701 274 HA LYS 38 HA LYS 38 -6.956 2.392 -28.090 275 HB2 LYS 38 1HB LYS 38 -5.411 4.977 -28.291 276 HB3 LYS 38 2HB LYS 38 -4.816 3.415 -27.745 277 HG2 LYS 38 1HG LYS 38 -5.813 3.012 -30.339 278 HG3 LYS 38 2HG LYS 38 -4.878 4.509 -30.386 279 HD2 LYS 38 1HD LYS 38 -3.160 3.053 -28.996 280 HD3 LYS 38 2HD LYS 38 -3.996 1.726 -29.806 281 HE2 LYS 38 1HE LYS 38 -3.114 2.234 -31.813 282 HE3 LYS 38 2HE LYS 38 -3.263 3.971 -31.551 283 HZ1 LYS 38 1HZ LYS 38 -1.065 2.165 -30.813 284 HZ2 LYS 38 2HZ LYS 38 -1.324 3.565 -29.900 285 HZ3 LYS 38 3HZ LYS 38 -1.002 3.684 -31.556 286 H ILE 39 H ILE 39 -9.270 3.638 -27.198 287 HA ILE 39 HA ILE 39 -8.950 5.546 -25.185 288 HB ILE 39 HB ILE 39 -10.986 3.318 -25.307 289 HG12 ILE 39 1HG1 ILE 39 -10.980 4.738 -27.317 290 HG13 ILE 39 2HG1 ILE 39 -12.440 4.981 -26.364 291 HG21 ILE 39 1HG2 ILE 39 -10.614 5.634 -23.506 292 HG22 ILE 39 2HG2 ILE 39 -12.258 5.296 -24.044 293 HG23 ILE 39 3HG2 ILE 39 -11.337 4.057 -23.193 294 HD11 ILE 39 1HD1 ILE 39 -11.359 7.006 -25.385 295 HD12 ILE 39 2HD1 ILE 39 -10.053 6.794 -26.551 296 HD13 ILE 39 3HD1 ILE 39 -11.695 7.104 -27.113 297 H SER 40 H SER 40 -7.596 5.391 -23.524 298 HA SER 40 HA SER 40 -6.900 2.835 -22.373 299 HB2 SER 40 1HB SER 40 -5.798 4.766 -20.729 300 HB3 SER 40 2HB SER 40 -5.002 4.022 -22.116 301 HG SER 40 HG SER 40 -6.542 6.408 -22.147 302 H GLY 41 H GLY 41 -6.966 2.500 -20.000 303 HA2 GLY 41 1HA GLY 41 -9.579 2.659 -19.016 304 HA3 GLY 41 2HA GLY 41 -8.158 2.285 -18.052 305 H ASP 42 H ASP 42 -6.752 4.668 -18.267 306 HA ASP 42 HA ASP 42 -7.799 6.193 -16.217 307 HB2 ASP 42 1HB ASP 42 -5.453 6.315 -16.941 308 HB3 ASP 42 2HB ASP 42 -5.950 7.120 -18.426 309 H GLN 43 H GLN 43 -8.453 6.350 -19.636 310 HA GLN 43 HA GLN 43 -9.890 8.864 -19.398 311 HB2 GLN 43 1HB GLN 43 -9.343 7.023 -21.724 312 HB3 GLN 43 2HB GLN 43 -10.364 8.449 -21.854 313 HG2 GLN 43 1HG GLN 43 -8.463 9.841 -21.141 314 HG3 GLN 43 2HG GLN 43 -7.450 8.399 -21.105 315 HE21 GLN 43 2HE2 GLN 43 -9.857 9.680 -23.378 316 HE22 GLN 43 1HE2 GLN 43 -8.832 9.611 -24.767 317 H LEU 44 H LEU 44 -10.534 5.444 -19.591 318 HA LEU 44 HA LEU 44 -13.298 5.636 -20.218 319 HB2 LEU 44 1HB LEU 44 -12.192 3.582 -20.646 320 HB3 LEU 44 2HB LEU 44 -11.620 3.467 -18.983 321 HG LEU 44 HG LEU 44 -13.871 3.004 -18.210 322 HD11 LEU 44 1HD1 LEU 44 -14.562 3.851 -20.941 323 HD12 LEU 44 2HD1 LEU 44 -15.478 3.986 -19.440 324 HD13 LEU 44 3HD1 LEU 44 -15.454 2.460 -20.324 325 HD21 LEU 44 1HD2 LEU 44 -12.325 1.334 -19.889 326 HD22 LEU 44 2HD2 LEU 44 -14.022 1.042 -20.268 327 HD23 LEU 44 3HD2 LEU 44 -13.445 0.865 -18.610 328 H LEU 45 H LEU 45 -11.567 5.082 -17.156 329 HA LEU 45 HA LEU 45 -13.725 4.897 -15.448 330 HB2 LEU 45 1HB LEU 45 -10.942 5.936 -15.106 331 HB3 LEU 45 2HB LEU 45 -12.094 6.041 -13.776 332 HG LEU 45 HG LEU 45 -11.706 3.390 -15.062 333 HD11 LEU 45 1HD1 LEU 45 -9.638 4.840 -13.465 334 HD12 LEU 45 2HD1 LEU 45 -9.443 3.820 -14.890 335 HD13 LEU 45 3HD1 LEU 45 -9.805 3.090 -13.326 336 HD21 LEU 45 1HD2 LEU 45 -12.417 4.495 -12.382 337 HD22 LEU 45 2HD2 LEU 45 -11.766 2.860 -12.507 338 HD23 LEU 45 3HD2 LEU 45 -13.251 3.286 -13.358 339 H ARG 46 H ARG 46 -12.108 7.807 -16.649 340 HA ARG 46 HA ARG 46 -14.192 9.445 -15.379 341 HB2 ARG 46 1HB ARG 46 -12.696 11.335 -15.656 342 HB3 ARG 46 2HB ARG 46 -11.853 10.026 -14.837 343 HG2 ARG 46 1HG ARG 46 -10.236 10.214 -16.335 344 HG3 ARG 46 2HG ARG 46 -11.367 9.640 -17.563 345 HD2 ARG 46 1HD ARG 46 -10.873 11.617 -18.535 346 HD3 ARG 46 2HD ARG 46 -12.107 12.218 -17.428 347 HE ARG 46 HE ARG 46 -9.790 12.383 -16.003 348 HH11 ARG 46 1HH1 ARG 46 -10.855 13.579 -19.095 349 HH12 ARG 46 2HH1 ARG 46 -9.851 14.990 -19.041 350 HH21 ARG 46 1HH2 ARG 46 -8.463 14.236 -15.921 351 HH22 ARG 46 2HH2 ARG 46 -8.490 15.362 -17.236 352 H ILE 47 H ILE 47 -14.463 7.866 -17.879 353 HA ILE 47 HA ILE 47 -14.367 9.486 -20.156 354 HB ILE 47 HB ILE 47 -14.738 7.025 -20.180 355 HG12 ILE 47 1HG1 ILE 47 -17.039 7.728 -21.746 356 HG13 ILE 47 2HG1 ILE 47 -15.841 9.012 -21.869 357 HG21 ILE 47 1HG2 ILE 47 -17.647 7.308 -19.887 358 HG22 ILE 47 2HG2 ILE 47 -16.570 6.019 -19.352 359 HG23 ILE 47 3HG2 ILE 47 -16.720 7.494 -18.398 360 HD11 ILE 47 1HD1 ILE 47 -14.184 7.456 -22.641 361 HD12 ILE 47 2HD1 ILE 47 -15.287 6.103 -22.388 362 HD13 ILE 47 3HD1 ILE 47 -15.636 7.305 -23.630 363 H THR 48 H THR 48 -15.682 11.003 -21.002 364 HA THR 48 HA THR 48 -18.150 11.641 -19.520 365 HB THR 48 HB THR 48 -16.468 13.363 -19.119 366 HG1 THR 48 HG1 THR 48 -17.733 15.138 -19.904 367 HG21 THR 48 1HG2 THR 48 -15.418 14.611 -20.826 368 HG22 THR 48 2HG2 THR 48 -16.489 13.962 -22.068 369 HG23 THR 48 3HG2 THR 48 -15.271 12.926 -21.325 370 H HIS 49 H HIS 49 -19.764 12.859 -20.823 371 HA HIS 49 HA HIS 49 -20.564 11.465 -23.068 372 HB2 HIS 49 1HB HIS 49 -21.307 14.037 -21.816 373 HB3 HIS 49 2HB HIS 49 -21.753 13.863 -23.511 374 HD1 HIS 49 HD1 HIS 49 -22.695 12.801 -20.115 375 HD2 HIS 49 HD2 HIS 49 -23.568 11.693 -24.023 376 HE1 HIS 49 HE1 HIS 49 -24.753 11.364 -19.963 377 H GLN 50 H GLN 50 -18.478 14.277 -22.833 378 HA GLN 50 HA GLN 50 -18.447 15.007 -25.543 379 HB2 GLN 50 1HB GLN 50 -17.284 15.956 -23.238 380 HB3 GLN 50 2HB GLN 50 -15.898 15.362 -24.142 381 HG2 GLN 50 1HG GLN 50 -17.164 16.719 -26.082 382 HG3 GLN 50 2HG GLN 50 -17.671 17.650 -24.674 383 HE21 GLN 50 2HE2 GLN 50 -14.895 16.470 -26.464 384 HE22 GLN 50 1HE2 GLN 50 -13.786 17.672 -25.905 385 H GLU 51 H GLU 51 -16.590 12.624 -23.734 386 HA GLU 51 HA GLU 51 -14.745 12.029 -25.808 387 HB2 GLU 51 1HB GLU 51 -15.600 10.602 -23.304 388 HB3 GLU 51 2HB GLU 51 -14.496 9.845 -24.444 389 HG2 GLU 51 1HG GLU 51 -13.649 12.526 -23.834 390 HG3 GLU 51 2HG GLU 51 -13.855 11.577 -22.362 391 H LEU 52 H LEU 52 -17.638 10.302 -24.645 392 HA LEU 52 HA LEU 52 -17.651 8.238 -26.490 393 HB2 LEU 52 1HB LEU 52 -19.786 9.640 -24.948 394 HB3 LEU 52 2HB LEU 52 -20.241 8.451 -26.166 395 HG LEU 52 HG LEU 52 -18.297 7.731 -24.006 396 HD11 LEU 52 1HD1 LEU 52 -19.949 8.408 -22.578 397 HD12 LEU 52 2HD1 LEU 52 -20.493 6.767 -22.927 398 HD13 LEU 52 3HD1 LEU 52 -21.234 8.137 -23.755 399 HD21 LEU 52 1HD2 LEU 52 -19.751 6.395 -26.131 400 HD22 LEU 52 2HD2 LEU 52 -20.005 5.629 -24.562 401 HD23 LEU 52 3HD2 LEU 52 -18.368 5.843 -25.185 402 H GLU 53 H GLU 53 -19.052 11.481 -26.768 403 HA GLU 53 HA GLU 53 -20.348 11.161 -29.216 404 HB2 GLU 53 1HB GLU 53 -19.803 13.280 -27.446 405 HB3 GLU 53 2HB GLU 53 -19.187 13.790 -29.011 406 HG2 GLU 53 1HG GLU 53 -21.274 13.712 -30.007 407 HG3 GLU 53 2HG GLU 53 -21.932 12.637 -28.774 408 H ASP 54 H ASP 54 -17.012 12.120 -28.510 409 HA ASP 54 HA ASP 54 -16.213 12.675 -31.137 410 HB2 ASP 54 1HB ASP 54 -15.008 12.949 -28.771 411 HB3 ASP 54 2HB ASP 54 -14.247 11.441 -29.272 412 H LEU 55 H LEU 55 -16.252 9.654 -29.308 413 HA LEU 55 HA LEU 55 -14.880 8.072 -31.188 414 HB2 LEU 55 1HB LEU 55 -16.910 7.378 -29.078 415 HB3 LEU 55 2HB LEU 55 -16.082 6.166 -30.053 416 HG LEU 55 HG LEU 55 -14.303 8.049 -28.670 417 HD11 LEU 55 1HD1 LEU 55 -14.662 6.512 -26.563 418 HD12 LEU 55 2HD1 LEU 55 -16.304 6.415 -27.198 419 HD13 LEU 55 3HD1 LEU 55 -15.606 7.984 -26.796 420 HD21 LEU 55 1HD2 LEU 55 -14.420 5.217 -29.474 421 HD22 LEU 55 2HD2 LEU 55 -13.531 5.558 -27.989 422 HD23 LEU 55 3HD2 LEU 55 -13.069 6.352 -29.495 423 H GLY 56 H GLY 56 -18.179 9.171 -31.011 424 HA2 GLY 56 1HA GLY 56 -19.154 9.200 -33.366 425 HA3 GLY 56 2HA GLY 56 -18.863 7.468 -33.321 426 H VAL 57 H VAL 57 -19.595 7.635 -30.341 427 HA VAL 57 HA VAL 57 -22.245 6.748 -30.587 428 HB VAL 57 HB VAL 57 -20.982 7.839 -28.072 429 HG11 VAL 57 1HG1 VAL 57 -22.982 5.613 -28.296 430 HG12 VAL 57 2HG1 VAL 57 -22.554 6.581 -26.883 431 HG13 VAL 57 3HG1 VAL 57 -23.484 7.301 -28.198 432 HG21 VAL 57 1HG2 VAL 57 -20.421 5.403 -29.623 433 HG22 VAL 57 2HG2 VAL 57 -19.416 6.264 -28.457 434 HG23 VAL 57 3HG2 VAL 57 -20.668 5.157 -27.894 435 H SER 58 H SER 58 -23.592 8.193 -31.595 436 HA SER 58 HA SER 58 -23.825 10.903 -30.556 437 HB2 SER 58 1HB SER 58 -25.495 11.157 -32.432 438 HB3 SER 58 2HB SER 58 -23.861 10.738 -32.949 439 HG SER 58 HG SER 58 -25.322 9.425 -34.024 440 H ARG 59 H ARG 59 -25.586 7.881 -30.601 441 HA ARG 59 HA ARG 59 -28.095 8.786 -29.762 442 HB2 ARG 59 1HB ARG 59 -26.701 6.241 -29.948 443 HB3 ARG 59 2HB ARG 59 -27.763 6.304 -28.548 444 HG2 ARG 59 1HG ARG 59 -29.093 5.423 -30.242 445 HG3 ARG 59 2HG ARG 59 -29.558 7.124 -30.171 446 HD2 ARG 59 1HD ARG 59 -27.901 7.536 -32.023 447 HD3 ARG 59 2HD ARG 59 -27.750 5.785 -32.172 448 HE ARG 59 HE ARG 59 -29.798 5.724 -33.203 449 HH11 ARG 59 1HH1 ARG 59 -29.344 8.837 -31.710 450 HH12 ARG 59 2HH1 ARG 59 -30.747 9.539 -32.445 451 HH21 ARG 59 1HH2 ARG 59 -31.648 6.638 -34.176 452 HH22 ARG 59 2HH2 ARG 59 -32.057 8.287 -33.847 453 H ILE 60 H ILE 60 -29.044 8.192 -27.555 454 HA ILE 60 HA ILE 60 -27.228 9.221 -25.480 455 HB ILE 60 HB ILE 60 -30.248 9.283 -25.520 456 HG12 ILE 60 1HG1 ILE 60 -29.304 10.780 -27.206 457 HG13 ILE 60 2HG1 ILE 60 -29.977 11.711 -25.872 458 HG21 ILE 60 1HG2 ILE 60 -29.014 11.134 -23.714 459 HG22 ILE 60 2HG2 ILE 60 -30.171 9.847 -23.376 460 HG23 ILE 60 3HG2 ILE 60 -28.442 9.499 -23.381 461 HD11 ILE 60 1HD1 ILE 60 -27.323 11.716 -26.933 462 HD12 ILE 60 2HD1 ILE 60 -28.049 12.778 -25.727 463 HD13 ILE 60 3HD1 ILE 60 -27.288 11.268 -25.228 464 H GLY 61 H GLY 61 -29.875 6.904 -26.012 465 HA2 GLY 61 1HA GLY 61 -29.805 5.665 -23.507 466 HA3 GLY 61 2HA GLY 61 -30.366 4.909 -24.991 467 H HIS 62 H HIS 62 -27.594 5.445 -26.142 468 HA HIS 62 HA HIS 62 -26.446 2.942 -25.211 469 HB2 HIS 62 1HB HIS 62 -25.475 4.767 -27.417 470 HB3 HIS 62 2HB HIS 62 -24.975 3.103 -27.130 471 HD1 HIS 62 HD1 HIS 62 -26.336 4.230 -29.780 472 HD2 HIS 62 HD2 HIS 62 -28.210 2.063 -26.771 473 HE1 HIS 62 HE1 HIS 62 -28.344 3.172 -30.863 474 H GLN 63 H GLN 63 -25.721 6.378 -25.212 475 HA GLN 63 HA GLN 63 -23.052 6.228 -24.343 476 HB2 GLN 63 1HB GLN 63 -25.157 8.365 -24.051 477 HB3 GLN 63 2HB GLN 63 -23.511 8.577 -23.469 478 HG2 GLN 63 1HG GLN 63 -22.637 8.339 -25.692 479 HG3 GLN 63 2HG GLN 63 -24.236 7.943 -26.319 480 HE21 GLN 63 2HE2 GLN 63 -22.199 10.187 -26.725 481 HE22 GLN 63 1HE2 GLN 63 -23.156 11.622 -26.630 482 H GLU 64 H GLU 64 -26.103 6.162 -22.604 483 HA GLU 64 HA GLU 64 -24.836 6.318 -20.015 484 HB2 GLU 64 1HB GLU 64 -27.627 6.114 -21.027 485 HB3 GLU 64 2HB GLU 64 -27.315 5.546 -19.394 486 HG2 GLU 64 1HG GLU 64 -26.114 8.136 -19.919 487 HG3 GLU 64 2HG GLU 64 -27.863 8.134 -20.145 488 H LEU 65 H LEU 65 -25.981 3.839 -22.182 489 HA LEU 65 HA LEU 65 -26.197 1.688 -20.419 490 HB2 LEU 65 1HB LEU 65 -25.781 2.029 -23.320 491 HB3 LEU 65 2HB LEU 65 -25.303 0.470 -22.651 492 HG LEU 65 HG LEU 65 -28.045 1.624 -22.211 493 HD11 LEU 65 1HD1 LEU 65 -27.069 1.048 -24.701 494 HD12 LEU 65 2HD1 LEU 65 -28.768 1.002 -24.230 495 HD13 LEU 65 3HD1 LEU 65 -27.809 -0.479 -24.220 496 HD21 LEU 65 1HD2 LEU 65 -27.677 -0.119 -20.712 497 HD22 LEU 65 2HD2 LEU 65 -26.746 -1.058 -21.879 498 HD23 LEU 65 3HD2 LEU 65 -28.495 -0.905 -22.063 499 H ILE 66 H ILE 66 -23.385 2.861 -22.241 500 HA ILE 66 HA ILE 66 -21.596 0.869 -21.328 501 HB ILE 66 HB ILE 66 -20.977 3.655 -22.318 502 HG12 ILE 66 1HG1 ILE 66 -20.867 1.062 -23.859 503 HG13 ILE 66 2HG1 ILE 66 -22.283 2.108 -23.856 504 HG21 ILE 66 1HG2 ILE 66 -19.298 1.660 -21.187 505 HG22 ILE 66 2HG2 ILE 66 -18.922 1.797 -22.903 506 HG23 ILE 66 3HG2 ILE 66 -18.849 3.223 -21.869 507 HD11 ILE 66 1HD1 ILE 66 -20.339 2.240 -25.689 508 HD12 ILE 66 2HD1 ILE 66 -21.325 3.623 -25.213 509 HD13 ILE 66 3HD1 ILE 66 -19.722 3.402 -24.514 510 H LEU 67 H LEU 67 -22.327 4.142 -20.186 511 HA LEU 67 HA LEU 67 -20.358 4.254 -18.178 512 HB2 LEU 67 1HB LEU 67 -23.041 5.624 -18.265 513 HB3 LEU 67 2HB LEU 67 -21.686 6.073 -17.232 514 HG LEU 67 HG LEU 67 -21.421 6.106 -20.219 515 HD11 LEU 67 1HD1 LEU 67 -21.980 8.682 -18.980 516 HD12 LEU 67 2HD1 LEU 67 -23.351 7.574 -18.937 517 HD13 LEU 67 3HD1 LEU 67 -22.597 7.984 -20.477 518 HD21 LEU 67 1HD2 LEU 67 -19.804 7.940 -19.591 519 HD22 LEU 67 2HD2 LEU 67 -19.356 6.311 -19.084 520 HD23 LEU 67 3HD2 LEU 67 -20.029 7.446 -17.913 521 H GLU 68 H GLU 68 -23.746 3.213 -18.102 522 HA GLU 68 HA GLU 68 -24.065 2.798 -15.392 523 HB2 GLU 68 1HB GLU 68 -25.843 2.566 -17.128 524 HB3 GLU 68 2HB GLU 68 -25.146 1.016 -17.580 525 HG2 GLU 68 1HG GLU 68 -25.552 0.963 -14.789 526 HG3 GLU 68 2HG GLU 68 -27.019 1.609 -15.522 527 H ALA 69 H ALA 69 -22.285 0.906 -17.714 528 HA ALA 69 HA ALA 69 -21.959 -1.364 -15.967 529 HB1 ALA 69 1HB ALA 69 -20.306 -0.816 -18.410 530 HB2 ALA 69 2HB ALA 69 -20.758 -2.368 -17.703 531 HB3 ALA 69 3HB ALA 69 -21.971 -1.387 -18.527 532 H VAL 70 H VAL 70 -20.091 1.469 -16.896 533 HA VAL 70 HA VAL 70 -17.621 0.736 -15.792 534 HB VAL 70 HB VAL 70 -18.805 3.504 -16.049 535 HG11 VAL 70 1HG1 VAL 70 -17.022 4.078 -14.815 536 HG12 VAL 70 2HG1 VAL 70 -16.229 2.521 -15.060 537 HG13 VAL 70 3HG1 VAL 70 -16.105 3.778 -16.291 538 HG21 VAL 70 1HG2 VAL 70 -17.852 3.637 -18.180 539 HG22 VAL 70 2HG2 VAL 70 -16.832 2.223 -17.913 540 HG23 VAL 70 3HG2 VAL 70 -18.571 2.028 -18.133 541 H ASP 71 H ASP 71 -20.481 2.184 -14.346 542 HA ASP 71 HA ASP 71 -19.474 3.043 -11.920 543 HB2 ASP 71 1HB ASP 71 -21.874 3.198 -12.874 544 HB3 ASP 71 2HB ASP 71 -22.125 1.635 -12.102 545 H LEU 72 H LEU 72 -20.225 -0.211 -12.986 546 HA LEU 72 HA LEU 72 -19.982 -1.417 -10.408 547 HB2 LEU 72 1HB LEU 72 -20.080 -2.443 -13.218 548 HB3 LEU 72 2HB LEU 72 -19.680 -3.525 -11.885 549 HG LEU 72 HG LEU 72 -22.165 -1.912 -11.658 550 HD11 LEU 72 1HD1 LEU 72 -23.033 -2.652 -13.562 551 HD12 LEU 72 2HD1 LEU 72 -22.950 -4.281 -12.892 552 HD13 LEU 72 3HD1 LEU 72 -21.626 -3.666 -13.882 553 HD21 LEU 72 1HD2 LEU 72 -21.587 -4.797 -11.012 554 HD22 LEU 72 2HD2 LEU 72 -22.938 -3.814 -10.448 555 HD23 LEU 72 3HD2 LEU 72 -21.301 -3.465 -9.892 556 H LEU 73 H LEU 73 -17.782 -0.661 -13.012 557 HA LEU 73 HA LEU 73 -15.635 -2.309 -12.161 558 HB2 LEU 73 1HB LEU 73 -16.060 -0.160 -14.114 559 HB3 LEU 73 2HB LEU 73 -14.418 -0.266 -13.483 560 HG LEU 73 HG LEU 73 -15.882 -2.571 -14.762 561 HD11 LEU 73 1HD1 LEU 73 -14.823 -2.109 -16.788 562 HD12 LEU 73 2HD1 LEU 73 -13.707 -0.960 -16.051 563 HD13 LEU 73 3HD1 LEU 73 -15.408 -0.536 -16.244 564 HD21 LEU 73 1HD2 LEU 73 -12.967 -2.528 -14.747 565 HD22 LEU 73 2HD2 LEU 73 -14.085 -3.820 -14.311 566 HD23 LEU 73 3HD2 LEU 73 -13.675 -2.573 -13.132 567 H CYS 74 H CYS 74 -16.574 1.018 -11.470 568 HA CYS 74 HA CYS 74 -14.217 1.500 -9.865 569 HB2 CYS 74 1HB CYS 74 -15.430 3.257 -11.257 570 HB3 CYS 74 2HB CYS 74 -16.681 3.233 -10.021 571 HG CYS 74 HG CYS 74 -15.559 5.008 -8.561 572 H ALA 75 H ALA 75 -17.671 0.951 -9.338 573 HA ALA 75 HA ALA 75 -17.767 1.373 -6.586 574 HB1 ALA 75 1HB ALA 75 -19.774 -0.029 -6.602 575 HB2 ALA 75 2HB ALA 75 -19.766 1.112 -7.948 576 HB3 ALA 75 3HB ALA 75 -19.370 -0.584 -8.227 577 H LEU 76 H LEU 76 -17.228 -1.675 -8.353 578 HA LEU 76 HA LEU 76 -16.948 -3.374 -6.187 579 HB2 LEU 76 1HB LEU 76 -15.795 -3.368 -8.945 580 HB3 LEU 76 2HB LEU 76 -15.309 -4.605 -7.788 581 HG LEU 76 HG LEU 76 -18.156 -4.101 -8.647 582 HD11 LEU 76 1HD1 LEU 76 -17.448 -6.551 -9.621 583 HD12 LEU 76 2HD1 LEU 76 -15.985 -5.606 -9.897 584 HD13 LEU 76 3HD1 LEU 76 -17.524 -5.062 -10.564 585 HD21 LEU 76 1HD2 LEU 76 -16.815 -6.110 -6.875 586 HD22 LEU 76 2HD2 LEU 76 -18.326 -6.494 -7.700 587 HD23 LEU 76 3HD2 LEU 76 -18.257 -5.141 -6.570 588 H ASN 77 H ASN 77 -14.486 -1.379 -7.776 589 HA ASN 77 HA ASN 77 -12.366 -2.265 -6.075 590 HB2 ASN 77 1HB ASN 77 -12.690 -0.403 -8.314 591 HB3 ASN 77 2HB ASN 77 -11.530 0.149 -7.109 592 HD21 ASN 77 2HD2 ASN 77 -12.143 -2.000 -9.673 593 HD22 ASN 77 1HD2 ASN 77 -10.629 -2.832 -9.648 594 H SER 78 H SER 78 -11.397 -1.207 -4.355 595 HA SER 78 HA SER 78 -11.383 -0.047 -2.395 596 HB2 SER 78 1HB SER 78 -12.520 2.131 -4.164 597 HB3 SER 78 2HB SER 78 -11.805 2.378 -2.571 598 HG SER 78 HG SER 78 -10.510 1.397 -4.898 599 H GLY 79 H GLY 79 -13.436 -1.734 -2.378 600 HA2 GLY 79 1HA GLY 79 -15.102 -1.333 -0.450 601 HA3 GLY 79 2HA GLY 79 -15.812 -0.190 -1.580 602 HA PRO 80 HA PRO 80 -16.460 -4.632 -3.423 603 HB2 PRO 80 1HB PRO 80 -16.062 -6.689 -1.695 604 HB3 PRO 80 2HB PRO 80 -14.787 -6.053 -2.742 605 HG2 PRO 80 1HG PRO 80 -15.314 -5.498 0.152 606 HG3 PRO 80 2HG PRO 80 -13.770 -5.801 -0.666 607 HD2 PRO 80 1HD PRO 80 -14.609 -3.311 -0.013 608 HD3 PRO 80 2HD PRO 80 -13.616 -3.639 -1.448 609 H SER 81 H SER 81 -17.204 -3.874 -0.085 610 HA SER 81 HA SER 81 -19.784 -5.246 -0.289 611 HB2 SER 81 1HB SER 81 -19.022 -5.822 1.788 612 HB3 SER 81 2HB SER 81 -18.052 -4.359 1.955 613 HG SER 81 HG SER 81 -20.017 -4.578 3.316 614 H SER 82 H SER 82 -21.527 -4.145 -0.858 615 HA SER 82 HA SER 82 -21.515 -1.219 -0.537 616 HB2 SER 82 1HB SER 82 -21.723 -2.212 -2.869 617 HB3 SER 82 2HB SER 82 -23.309 -2.807 -2.378 618 HG SER 82 HG SER 82 -22.490 -0.088 -2.317 619 H GLY 83 H GLY 83 -22.245 -1.254 1.625 620 HA2 GLY 83 1HA GLY 83 -25.000 -2.251 1.989 621 HA3 GLY 83 2HA GLY 83 -23.830 -2.059 3.286 Start of MODEL 15 1 H1 GLY 1 H GLY 1 1.875 -0.411 -2.838 2 HA2 GLY 1 1HA GLY 1 0.426 -0.423 -0.957 3 HA3 GLY 1 2HA GLY 1 1.433 0.806 -0.207 4 H SER 2 H SER 2 1.060 2.960 -0.628 5 HA SER 2 HA SER 2 -1.541 3.748 -1.216 6 HB2 SER 2 1HB SER 2 1.065 5.262 -1.179 7 HB3 SER 2 2HB SER 2 -0.466 6.062 -1.535 8 HG SER 2 HG SER 2 -0.277 6.244 0.620 9 H SER 3 H SER 3 1.209 3.282 -3.315 10 HA SER 3 HA SER 3 0.069 4.618 -5.577 11 HB2 SER 3 1HB SER 3 1.993 2.796 -6.506 12 HB3 SER 3 2HB SER 3 2.227 4.513 -6.177 13 HG SER 3 HG SER 3 3.118 4.050 -4.276 14 H GLY 4 H GLY 4 -0.732 3.664 -7.492 15 HA2 GLY 4 1HA GLY 4 -2.124 2.235 -8.631 16 HA3 GLY 4 2HA GLY 4 -1.076 0.966 -8.013 17 H SER 5 H SER 5 -3.996 2.824 -7.409 18 HA SER 5 HA SER 5 -5.015 0.582 -5.823 19 HB2 SER 5 1HB SER 5 -5.304 3.475 -4.980 20 HB3 SER 5 2HB SER 5 -5.936 2.066 -4.128 21 HG SER 5 HG SER 5 -3.835 1.420 -3.697 22 H SER 6 H SER 6 -5.826 0.534 -8.222 23 HA SER 6 HA SER 6 -8.596 1.169 -8.147 24 HB2 SER 6 1HB SER 6 -8.298 2.556 -10.403 25 HB3 SER 6 2HB SER 6 -8.273 3.341 -8.825 26 HG SER 6 HG SER 6 -6.313 3.930 -9.244 27 H GLY 7 H GLY 7 -5.859 0.513 -10.322 28 HA2 GLY 7 1HA GLY 7 -5.533 -1.316 -11.710 29 HA3 GLY 7 2HA GLY 7 -7.091 -1.945 -11.193 30 H VAL 8 H VAL 8 -8.984 -0.454 -11.995 31 HA VAL 8 HA VAL 8 -9.085 -0.686 -14.784 32 HB VAL 8 HB VAL 8 -10.818 1.096 -13.067 33 HG11 VAL 8 1HG1 VAL 8 -11.270 -0.161 -15.771 34 HG12 VAL 8 2HG1 VAL 8 -12.498 0.695 -14.836 35 HG13 VAL 8 3HG1 VAL 8 -11.076 1.557 -15.423 36 HG21 VAL 8 1HG2 VAL 8 -11.379 -0.820 -12.046 37 HG22 VAL 8 2HG2 VAL 8 -12.261 -1.176 -13.532 38 HG23 VAL 8 3HG2 VAL 8 -10.635 -1.817 -13.297 39 H SER 9 H SER 9 -7.941 1.866 -12.749 40 HA SER 9 HA SER 9 -8.127 3.968 -14.670 41 HB2 SER 9 1HB SER 9 -6.937 5.298 -13.109 42 HB3 SER 9 2HB SER 9 -7.919 4.208 -12.130 43 HG SER 9 HG SER 9 -5.828 4.229 -11.323 44 H LYS 10 H LYS 10 -5.835 1.454 -14.001 45 HA LYS 10 HA LYS 10 -3.905 2.657 -15.864 46 HB2 LYS 10 1HB LYS 10 -3.477 0.295 -14.030 47 HB3 LYS 10 2HB LYS 10 -2.249 1.174 -14.932 48 HG2 LYS 10 1HG LYS 10 -3.677 3.008 -13.279 49 HG3 LYS 10 2HG LYS 10 -3.149 1.635 -12.305 50 HD2 LYS 10 1HD LYS 10 -0.861 1.934 -13.160 51 HD3 LYS 10 2HD LYS 10 -1.403 3.335 -14.087 52 HE2 LYS 10 1HE LYS 10 -2.077 3.395 -11.227 53 HE3 LYS 10 2HE LYS 10 -0.352 3.448 -11.585 54 HZ1 LYS 10 1HZ LYS 10 -2.456 5.365 -12.351 55 HZ2 LYS 10 2HZ LYS 10 -1.024 5.269 -13.245 56 HZ3 LYS 10 3HZ LYS 10 -0.969 5.661 -11.600 57 H TRP 11 H TRP 11 -6.448 1.205 -16.524 58 HA TRP 11 HA TRP 11 -5.710 -1.320 -17.632 59 HB2 TRP 11 1HB TRP 11 -8.120 0.367 -17.536 60 HB3 TRP 11 2HB TRP 11 -7.972 -0.611 -18.993 61 HD1 TRP 11 HD1 TRP 11 -6.654 -2.001 -15.700 62 HE1 TRP 11 HE1 TRP 11 -8.138 -3.976 -14.977 63 HE3 TRP 11 HE3 TRP 11 -10.380 -1.528 -19.168 64 HZ2 TRP 11 HZ2 TRP 11 -10.567 -5.174 -15.773 65 HZ3 TRP 11 HZ3 TRP 11 -12.247 -3.129 -19.119 66 HH2 TRP 11 HH2 TRP 11 -12.337 -4.914 -17.456 67 H SER 12 H SER 12 -4.846 -1.789 -19.555 68 HA SER 12 HA SER 12 -3.674 0.166 -21.172 69 HB2 SER 12 1HB SER 12 -3.948 -2.733 -21.199 70 HB3 SER 12 2HB SER 12 -3.971 -2.053 -22.826 71 HG SER 12 HG SER 12 -1.878 -2.446 -21.265 72 HA PRO 13 HA PRO 13 -6.764 1.534 -23.969 73 HB2 PRO 13 1HB PRO 13 -5.415 1.661 -26.321 74 HB3 PRO 13 2HB PRO 13 -5.142 2.798 -24.995 75 HG2 PRO 13 1HG PRO 13 -3.561 0.377 -25.770 76 HG3 PRO 13 2HG PRO 13 -2.984 1.980 -25.278 77 HD2 PRO 13 1HD PRO 13 -3.038 -0.131 -23.583 78 HD3 PRO 13 2HD PRO 13 -3.285 1.539 -23.036 79 H SER 14 H SER 14 -5.130 -1.457 -24.633 80 HA SER 14 HA SER 14 -7.071 -2.214 -26.679 81 HB2 SER 14 1HB SER 14 -4.374 -3.065 -25.937 82 HB3 SER 14 2HB SER 14 -5.461 -4.421 -26.238 83 HG SER 14 HG SER 14 -4.231 -3.267 -28.069 84 H GLN 15 H GLN 15 -6.336 -2.748 -23.339 85 HA GLN 15 HA GLN 15 -7.725 -5.175 -22.960 86 HB2 GLN 15 1HB GLN 15 -6.924 -2.940 -21.116 87 HB3 GLN 15 2HB GLN 15 -7.872 -4.301 -20.535 88 HG2 GLN 15 1HG GLN 15 -5.252 -4.651 -21.956 89 HG3 GLN 15 2HG GLN 15 -5.369 -4.429 -20.211 90 HE21 GLN 15 2HE2 GLN 15 -4.199 -6.649 -20.901 91 HE22 GLN 15 1HE2 GLN 15 -5.231 -8.024 -20.735 92 H VAL 16 H VAL 16 -8.727 -1.791 -22.554 93 HA VAL 16 HA VAL 16 -11.282 -2.167 -21.580 94 HB VAL 16 HB VAL 16 -10.388 -0.058 -23.550 95 HG11 VAL 16 1HG1 VAL 16 -12.897 -0.479 -22.026 96 HG12 VAL 16 2HG1 VAL 16 -12.284 1.171 -22.153 97 HG13 VAL 16 3HG1 VAL 16 -12.643 0.247 -23.612 98 HG21 VAL 16 1HG2 VAL 16 -9.341 0.985 -21.880 99 HG22 VAL 16 2HG2 VAL 16 -10.695 0.741 -20.777 100 HG23 VAL 16 3HG2 VAL 16 -9.482 -0.523 -20.976 101 H VAL 17 H VAL 17 -10.076 -2.597 -24.830 102 HA VAL 17 HA VAL 17 -12.521 -2.611 -26.216 103 HB VAL 17 HB VAL 17 -10.081 -4.248 -26.910 104 HG11 VAL 17 1HG1 VAL 17 -10.894 -4.351 -29.080 105 HG12 VAL 17 2HG1 VAL 17 -12.356 -4.541 -28.110 106 HG13 VAL 17 3HG1 VAL 17 -11.980 -2.982 -28.846 107 HG21 VAL 17 1HG2 VAL 17 -9.351 -1.994 -26.537 108 HG22 VAL 17 2HG2 VAL 17 -9.418 -2.274 -28.277 109 HG23 VAL 17 3HG2 VAL 17 -10.695 -1.352 -27.482 110 H ASP 18 H ASP 18 -10.771 -5.153 -24.508 111 HA ASP 18 HA ASP 18 -12.451 -7.287 -25.339 112 HB2 ASP 18 1HB ASP 18 -10.088 -7.417 -24.334 113 HB3 ASP 18 2HB ASP 18 -10.880 -7.247 -22.770 114 H TRP 19 H TRP 19 -12.688 -4.865 -22.879 115 HA TRP 19 HA TRP 19 -14.556 -6.198 -21.203 116 HB2 TRP 19 1HB TRP 19 -13.288 -4.351 -20.314 117 HB3 TRP 19 2HB TRP 19 -13.908 -3.267 -21.557 118 HD1 TRP 19 HD1 TRP 19 -15.484 -5.470 -18.759 119 HE1 TRP 19 HE1 TRP 19 -17.379 -4.112 -17.670 120 HE3 TRP 19 HE3 TRP 19 -15.195 -1.238 -21.613 121 HZ2 TRP 19 HZ2 TRP 19 -18.593 -1.582 -17.980 122 HZ3 TRP 19 HZ3 TRP 19 -16.760 0.604 -21.153 123 HH2 TRP 19 HH2 TRP 19 -18.423 0.433 -19.373 124 H MET 20 H MET 20 -14.891 -3.871 -23.858 125 HA MET 20 HA MET 20 -17.685 -3.584 -23.705 126 HB2 MET 20 1HB MET 20 -15.913 -3.335 -26.142 127 HB3 MET 20 2HB MET 20 -17.538 -2.684 -25.974 128 HG2 MET 20 1HG MET 20 -15.565 -1.858 -23.940 129 HG3 MET 20 2HG MET 20 -15.329 -1.244 -25.575 130 HE1 MET 20 1HE MET 20 -18.868 -0.181 -26.380 131 HE2 MET 20 2HE MET 20 -17.594 1.035 -26.477 132 HE3 MET 20 3HE MET 20 -17.261 -0.631 -26.952 133 H LYS 21 H LYS 21 -15.695 -6.114 -24.927 134 HA LYS 21 HA LYS 21 -17.501 -7.262 -26.777 135 HB2 LYS 21 1HB LYS 21 -15.270 -8.523 -25.173 136 HB3 LYS 21 2HB LYS 21 -16.119 -9.315 -26.494 137 HG2 LYS 21 1HG LYS 21 -15.365 -7.128 -27.789 138 HG3 LYS 21 2HG LYS 21 -14.100 -7.148 -26.558 139 HD2 LYS 21 1HD LYS 21 -13.400 -9.337 -27.216 140 HD3 LYS 21 2HD LYS 21 -14.792 -9.520 -28.285 141 HE2 LYS 21 1HE LYS 21 -13.955 -7.749 -29.717 142 HE3 LYS 21 2HE LYS 21 -12.602 -7.472 -28.622 143 HZ1 LYS 21 1HZ LYS 21 -12.589 -10.173 -29.285 144 HZ2 LYS 21 2HZ LYS 21 -11.470 -8.990 -29.741 145 HZ3 LYS 21 3HZ LYS 21 -12.800 -9.322 -30.732 146 H GLY 22 H GLY 22 -17.579 -7.052 -23.401 147 HA2 GLY 22 1HA GLY 22 -19.474 -9.316 -23.255 148 HA3 GLY 22 2HA GLY 22 -18.472 -8.794 -21.909 149 H LEU 23 H LEU 23 -19.917 -6.393 -23.933 150 HA LEU 23 HA LEU 23 -21.834 -5.786 -21.779 151 HB2 LEU 23 1HB LEU 23 -20.658 -3.844 -23.756 152 HB3 LEU 23 2HB LEU 23 -21.645 -3.466 -22.347 153 HG LEU 23 HG LEU 23 -18.815 -4.509 -22.341 154 HD11 LEU 23 1HD1 LEU 23 -18.210 -2.378 -21.480 155 HD12 LEU 23 2HD1 LEU 23 -19.898 -1.890 -21.327 156 HD13 LEU 23 3HD1 LEU 23 -19.182 -2.101 -22.925 157 HD21 LEU 23 1HD2 LEU 23 -19.593 -5.472 -20.423 158 HD22 LEU 23 2HD2 LEU 23 -20.869 -4.274 -20.205 159 HD23 LEU 23 3HD2 LEU 23 -19.199 -3.866 -19.809 160 H ASP 24 H ASP 24 -23.415 -3.948 -23.001 161 HA ASP 24 HA ASP 24 -25.308 -5.444 -24.340 162 HB2 ASP 24 1HB ASP 24 -25.133 -2.844 -23.443 163 HB3 ASP 24 2HB ASP 24 -25.271 -2.641 -25.187 164 H ASP 25 H ASP 25 -25.934 -5.642 -26.508 165 HA ASP 25 HA ASP 25 -23.822 -5.963 -28.355 166 HB2 ASP 25 1HB ASP 25 -26.653 -6.513 -28.251 167 HB3 ASP 25 2HB ASP 25 -26.220 -5.837 -29.818 168 H CYS 26 H CYS 26 -25.912 -3.307 -27.610 169 HA CYS 26 HA CYS 26 -25.602 -1.884 -30.053 170 HB2 CYS 26 1HB CYS 26 -26.720 -1.337 -27.371 171 HB3 CYS 26 2HB CYS 26 -26.160 0.072 -28.263 172 HG CYS 26 HG CYS 26 -28.025 0.118 -30.103 173 H LEU 27 H LEU 27 -23.628 -2.306 -27.264 174 HA LEU 27 HA LEU 27 -21.966 0.007 -27.913 175 HB2 LEU 27 1HB LEU 27 -21.389 -1.950 -25.724 176 HB3 LEU 27 2HB LEU 27 -20.960 -0.244 -25.830 177 HG LEU 27 HG LEU 27 -23.778 -1.241 -25.437 178 HD11 LEU 27 1HD1 LEU 27 -21.785 -1.537 -23.607 179 HD12 LEU 27 2HD1 LEU 27 -23.494 -1.341 -23.218 180 HD13 LEU 27 3HD1 LEU 27 -22.418 0.056 -23.192 181 HD21 LEU 27 1HD2 LEU 27 -22.474 1.409 -25.654 182 HD22 LEU 27 2HD2 LEU 27 -23.749 1.234 -24.448 183 HD23 LEU 27 3HD2 LEU 27 -24.087 0.892 -26.145 184 H GLN 28 H GLN 28 -22.196 -2.527 -29.545 185 HA GLN 28 HA GLN 28 -19.497 -3.610 -29.347 186 HB2 GLN 28 1HB GLN 28 -21.803 -4.353 -31.154 187 HB3 GLN 28 2HB GLN 28 -20.254 -5.184 -31.103 188 HG2 GLN 28 1HG GLN 28 -22.155 -4.947 -28.782 189 HG3 GLN 28 2HG GLN 28 -22.030 -6.343 -29.851 190 HE21 GLN 28 2HE2 GLN 28 -21.406 -5.655 -26.899 191 HE22 GLN 28 1HE2 GLN 28 -19.864 -6.393 -26.650 192 H GLN 29 H GLN 29 -21.554 -1.976 -31.741 193 HA GLN 29 HA GLN 29 -19.714 -1.808 -33.816 194 HB2 GLN 29 1HB GLN 29 -21.059 0.014 -34.682 195 HB3 GLN 29 2HB GLN 29 -22.108 -1.234 -34.022 196 HG2 GLN 29 1HG GLN 29 -22.137 0.178 -31.892 197 HG3 GLN 29 2HG GLN 29 -21.468 1.465 -32.893 198 HE21 GLN 29 2HE2 GLN 29 -24.126 0.956 -31.508 199 HE22 GLN 29 1HE2 GLN 29 -25.299 1.295 -32.730 200 H TYR 30 H TYR 30 -19.890 -0.042 -30.843 201 HA TYR 30 HA TYR 30 -18.213 2.130 -31.673 202 HB2 TYR 30 1HB TYR 30 -18.908 1.191 -28.882 203 HB3 TYR 30 2HB TYR 30 -18.183 2.739 -29.302 204 HD1 TYR 30 HD2 TYR 30 -19.800 3.500 -31.661 205 HD2 TYR 30 HD1 TYR 30 -20.975 1.761 -27.960 206 HE1 TYR 30 HE2 TYR 30 -22.039 4.484 -31.916 207 HE2 TYR 30 HE1 TYR 30 -23.218 2.739 -28.206 208 HH TYR 30 HH TYR 30 -24.524 3.703 -30.850 209 H ILE 31 H ILE 31 -17.714 -1.058 -30.418 210 HA ILE 31 HA ILE 31 -15.233 -0.885 -29.226 211 HB ILE 31 HB ILE 31 -16.193 -3.115 -31.022 212 HG12 ILE 31 1HG1 ILE 31 -16.484 -2.736 -28.034 213 HG13 ILE 31 2HG1 ILE 31 -17.781 -2.593 -29.215 214 HG21 ILE 31 1HG2 ILE 31 -14.076 -3.062 -28.876 215 HG22 ILE 31 2HG2 ILE 31 -14.669 -4.517 -29.676 216 HG23 ILE 31 3HG2 ILE 31 -13.820 -3.282 -30.607 217 HD11 ILE 31 1HD1 ILE 31 -16.246 -5.078 -28.502 218 HD12 ILE 31 2HD1 ILE 31 -17.935 -4.721 -28.143 219 HD13 ILE 31 3HD1 ILE 31 -17.422 -4.970 -29.811 220 H LYS 32 H LYS 32 -15.974 -1.268 -32.677 221 HA LYS 32 HA LYS 32 -13.380 -1.509 -33.645 222 HB2 LYS 32 1HB LYS 32 -15.772 -0.183 -34.934 223 HB3 LYS 32 2HB LYS 32 -14.294 -0.619 -35.782 224 HG2 LYS 32 1HG LYS 32 -16.019 -2.610 -34.332 225 HG3 LYS 32 2HG LYS 32 -16.199 -2.221 -36.044 226 HD2 LYS 32 1HD LYS 32 -14.402 -3.433 -36.623 227 HD3 LYS 32 2HD LYS 32 -13.451 -2.839 -35.260 228 HE2 LYS 32 1HE LYS 32 -13.754 -5.220 -35.043 229 HE3 LYS 32 2HE LYS 32 -14.669 -4.399 -33.779 230 HZ1 LYS 32 1HZ LYS 32 -16.467 -5.455 -34.477 231 HZ2 LYS 32 2HZ LYS 32 -15.605 -6.183 -35.738 232 HZ3 LYS 32 3HZ LYS 32 -16.352 -4.684 -35.979 233 H ASN 33 H ASN 33 -15.089 1.285 -32.487 234 HA ASN 33 HA ASN 33 -13.159 3.152 -33.579 235 HB2 ASN 33 1HB ASN 33 -15.614 3.458 -31.858 236 HB3 ASN 33 2HB ASN 33 -14.526 4.807 -32.169 237 HD21 ASN 33 2HD2 ASN 33 -17.362 4.152 -32.951 238 HD22 ASN 33 1HD2 ASN 33 -17.402 4.411 -34.659 239 H PHE 34 H PHE 34 -13.814 1.504 -30.582 240 HA PHE 34 HA PHE 34 -12.149 3.144 -28.943 241 HB2 PHE 34 1HB PHE 34 -13.573 0.546 -28.628 242 HB3 PHE 34 2HB PHE 34 -12.260 0.901 -27.510 243 HD1 PHE 34 HD2 PHE 34 -15.047 2.875 -29.020 244 HD2 PHE 34 HD1 PHE 34 -13.010 1.655 -25.488 245 HE1 PHE 34 HE2 PHE 34 -16.576 4.250 -27.668 246 HE2 PHE 34 HE1 PHE 34 -14.536 3.027 -24.130 247 HZ PHE 34 HZ PHE 34 -16.321 4.327 -25.220 248 H GLU 35 H GLU 35 -11.621 0.437 -31.044 249 HA GLU 35 HA GLU 35 -9.122 -0.388 -29.964 250 HB2 GLU 35 1HB GLU 35 -10.865 -1.222 -32.047 251 HB3 GLU 35 2HB GLU 35 -9.276 -0.975 -32.756 252 HG2 GLU 35 1HG GLU 35 -9.820 -2.673 -30.333 253 HG3 GLU 35 2HG GLU 35 -9.672 -3.285 -31.979 254 H ARG 36 H ARG 36 -10.050 1.751 -32.632 255 HA ARG 36 HA ARG 36 -7.344 2.340 -33.365 256 HB2 ARG 36 1HB ARG 36 -9.409 2.465 -34.867 257 HB3 ARG 36 2HB ARG 36 -9.767 3.989 -34.065 258 HG2 ARG 36 1HG ARG 36 -7.400 4.686 -34.753 259 HG3 ARG 36 2HG ARG 36 -7.465 3.306 -35.852 260 HD2 ARG 36 1HD ARG 36 -8.461 4.667 -37.307 261 HD3 ARG 36 2HD ARG 36 -9.878 4.591 -36.260 262 HE ARG 36 HE ARG 36 -8.362 6.571 -35.175 263 HH11 ARG 36 1HH1 ARG 36 -9.639 5.945 -38.352 264 HH12 ARG 36 2HH1 ARG 36 -9.786 7.621 -38.766 265 HH21 ARG 36 1HH2 ARG 36 -8.551 8.781 -35.708 266 HH22 ARG 36 2HH2 ARG 36 -9.166 9.233 -37.261 267 H GLU 37 H GLU 37 -9.870 4.011 -31.525 268 HA GLU 37 HA GLU 37 -8.399 6.380 -31.063 269 HB2 GLU 37 1HB GLU 37 -10.823 5.120 -29.855 270 HB3 GLU 37 2HB GLU 37 -10.057 6.454 -29.005 271 HG2 GLU 37 1HG GLU 37 -10.491 6.940 -31.856 272 HG3 GLU 37 2HG GLU 37 -11.967 6.705 -30.922 273 H LYS 38 H LYS 38 -8.250 3.243 -29.678 274 HA LYS 38 HA LYS 38 -6.985 2.324 -28.026 275 HB2 LYS 38 1HB LYS 38 -5.378 4.873 -28.274 276 HB3 LYS 38 2HB LYS 38 -4.837 3.377 -27.525 277 HG2 LYS 38 1HG LYS 38 -5.752 2.965 -30.244 278 HG3 LYS 38 2HG LYS 38 -4.441 4.144 -30.146 279 HD2 LYS 38 1HD LYS 38 -2.972 2.602 -29.181 280 HD3 LYS 38 2HD LYS 38 -4.279 1.515 -28.708 281 HE2 LYS 38 1HE LYS 38 -4.151 0.419 -30.640 282 HE3 LYS 38 2HE LYS 38 -4.270 1.918 -31.560 283 HZ1 LYS 38 1HZ LYS 38 -2.141 1.732 -32.073 284 HZ2 LYS 38 2HZ LYS 38 -2.029 0.289 -31.199 285 HZ3 LYS 38 3HZ LYS 38 -1.708 1.765 -30.438 286 H ILE 39 H ILE 39 -9.274 3.559 -27.144 287 HA ILE 39 HA ILE 39 -9.000 5.463 -25.128 288 HB ILE 39 HB ILE 39 -10.995 3.196 -25.235 289 HG12 ILE 39 1HG1 ILE 39 -10.999 4.564 -27.280 290 HG13 ILE 39 2HG1 ILE 39 -12.469 4.810 -26.343 291 HG21 ILE 39 1HG2 ILE 39 -12.387 4.949 -23.969 292 HG22 ILE 39 2HG2 ILE 39 -11.150 4.062 -23.079 293 HG23 ILE 39 3HG2 ILE 39 -10.838 5.713 -23.616 294 HD11 ILE 39 1HD1 ILE 39 -11.650 6.913 -25.525 295 HD12 ILE 39 2HD1 ILE 39 -10.092 6.651 -26.310 296 HD13 ILE 39 3HD1 ILE 39 -11.542 6.887 -27.285 297 H SER 40 H SER 40 -7.640 5.330 -23.467 298 HA SER 40 HA SER 40 -6.954 2.778 -22.286 299 HB2 SER 40 1HB SER 40 -5.861 4.856 -20.730 300 HB3 SER 40 2HB SER 40 -5.032 3.876 -21.939 301 HG SER 40 HG SER 40 -4.790 5.790 -22.827 302 H GLY 41 H GLY 41 -7.055 2.425 -19.947 303 HA2 GLY 41 1HA GLY 41 -9.622 2.658 -18.919 304 HA3 GLY 41 2HA GLY 41 -8.192 2.320 -17.956 305 H ASP 42 H ASP 42 -6.793 4.696 -18.263 306 HA ASP 42 HA ASP 42 -7.821 6.288 -16.256 307 HB2 ASP 42 1HB ASP 42 -6.088 7.785 -16.699 308 HB3 ASP 42 2HB ASP 42 -5.468 6.272 -17.355 309 H GLN 43 H GLN 43 -8.398 6.436 -19.714 310 HA GLN 43 HA GLN 43 -9.864 8.920 -19.539 311 HB2 GLN 43 1HB GLN 43 -9.198 7.004 -21.746 312 HB3 GLN 43 2HB GLN 43 -10.447 8.219 -21.985 313 HG2 GLN 43 1HG GLN 43 -8.714 9.925 -21.261 314 HG3 GLN 43 2HG GLN 43 -7.527 8.635 -21.444 315 HE21 GLN 43 2HE2 GLN 43 -7.457 7.569 -23.567 316 HE22 GLN 43 1HE2 GLN 43 -7.744 8.528 -24.975 317 H LEU 44 H LEU 44 -10.558 5.493 -19.651 318 HA LEU 44 HA LEU 44 -13.325 5.693 -20.211 319 HB2 LEU 44 1HB LEU 44 -12.202 3.613 -20.548 320 HB3 LEU 44 2HB LEU 44 -11.685 3.558 -18.864 321 HG LEU 44 HG LEU 44 -14.176 3.404 -18.293 322 HD11 LEU 44 1HD1 LEU 44 -14.541 2.262 -21.012 323 HD12 LEU 44 2HD1 LEU 44 -14.661 4.011 -20.815 324 HD13 LEU 44 3HD1 LEU 44 -15.728 2.945 -19.899 325 HD21 LEU 44 1HD2 LEU 44 -14.173 0.922 -18.997 326 HD22 LEU 44 2HD2 LEU 44 -12.919 1.491 -17.895 327 HD23 LEU 44 3HD2 LEU 44 -12.551 1.256 -19.604 328 H LEU 45 H LEU 45 -11.562 5.252 -17.149 329 HA LEU 45 HA LEU 45 -13.741 5.214 -15.431 330 HB2 LEU 45 1HB LEU 45 -10.984 5.214 -15.180 331 HB3 LEU 45 2HB LEU 45 -11.484 6.676 -14.334 332 HG LEU 45 HG LEU 45 -13.044 5.245 -12.982 333 HD11 LEU 45 1HD1 LEU 45 -11.442 2.868 -13.747 334 HD12 LEU 45 2HD1 LEU 45 -12.751 3.363 -14.820 335 HD13 LEU 45 3HD1 LEU 45 -13.093 2.976 -13.134 336 HD21 LEU 45 1HD2 LEU 45 -11.191 5.841 -11.775 337 HD22 LEU 45 2HD2 LEU 45 -10.072 5.072 -12.901 338 HD23 LEU 45 3HD2 LEU 45 -11.014 4.086 -11.782 339 H ARG 46 H ARG 46 -12.255 7.877 -17.091 340 HA ARG 46 HA ARG 46 -14.075 9.732 -15.701 341 HB2 ARG 46 1HB ARG 46 -12.511 11.500 -16.050 342 HB3 ARG 46 2HB ARG 46 -11.614 10.145 -15.380 343 HG2 ARG 46 1HG ARG 46 -10.996 9.559 -17.768 344 HG3 ARG 46 2HG ARG 46 -11.629 11.147 -18.207 345 HD2 ARG 46 1HD ARG 46 -9.742 11.097 -15.944 346 HD3 ARG 46 2HD ARG 46 -9.061 10.678 -17.516 347 HE ARG 46 HE ARG 46 -10.519 12.968 -17.937 348 HH11 ARG 46 1HH1 ARG 46 -7.856 12.024 -15.902 349 HH12 ARG 46 2HH1 ARG 46 -7.152 13.607 -15.868 350 HH21 ARG 46 1HH2 ARG 46 -9.601 15.056 -17.900 351 HH22 ARG 46 2HH2 ARG 46 -8.145 15.330 -17.004 352 H ILE 47 H ILE 47 -14.571 8.027 -18.074 353 HA ILE 47 HA ILE 47 -14.545 9.613 -20.417 354 HB ILE 47 HB ILE 47 -14.771 7.146 -20.435 355 HG12 ILE 47 1HG1 ILE 47 -17.178 7.621 -21.883 356 HG13 ILE 47 2HG1 ILE 47 -16.170 9.057 -22.029 357 HG21 ILE 47 1HG2 ILE 47 -16.543 6.008 -19.590 358 HG22 ILE 47 2HG2 ILE 47 -16.601 7.406 -18.517 359 HG23 ILE 47 3HG2 ILE 47 -17.679 7.319 -19.909 360 HD11 ILE 47 1HD1 ILE 47 -15.193 7.980 -23.710 361 HD12 ILE 47 2HD1 ILE 47 -14.388 7.025 -22.465 362 HD13 ILE 47 3HD1 ILE 47 -15.864 6.424 -23.220 363 H THR 48 H THR 48 -15.946 11.077 -21.200 364 HA THR 48 HA THR 48 -18.440 11.535 -19.696 365 HB THR 48 HB THR 48 -16.796 13.311 -19.223 366 HG1 THR 48 HG1 THR 48 -18.232 14.992 -19.641 367 HG21 THR 48 1HG2 THR 48 -15.705 14.531 -20.810 368 HG22 THR 48 2HG2 THR 48 -17.018 14.386 -21.979 369 HG23 THR 48 3HG2 THR 48 -15.910 13.038 -21.726 370 H HIS 49 H HIS 49 -20.070 12.804 -20.981 371 HA HIS 49 HA HIS 49 -20.801 11.458 -23.285 372 HB2 HIS 49 1HB HIS 49 -21.583 14.107 -22.121 373 HB3 HIS 49 2HB HIS 49 -22.195 13.637 -23.705 374 HD1 HIS 49 HD1 HIS 49 -23.287 13.653 -20.406 375 HD2 HIS 49 HD2 HIS 49 -23.264 10.728 -23.356 376 HE1 HIS 49 HE1 HIS 49 -25.042 11.989 -19.716 377 H GLN 50 H GLN 50 -18.784 14.298 -22.908 378 HA GLN 50 HA GLN 50 -18.750 15.150 -25.584 379 HB2 GLN 50 1HB GLN 50 -17.677 16.076 -23.256 380 HB3 GLN 50 2HB GLN 50 -16.240 15.483 -24.079 381 HG2 GLN 50 1HG GLN 50 -16.229 17.561 -24.932 382 HG3 GLN 50 2HG GLN 50 -17.354 16.849 -26.088 383 HE21 GLN 50 2HE2 GLN 50 -16.866 19.511 -24.394 384 HE22 GLN 50 1HE2 GLN 50 -18.490 20.003 -24.069 385 H GLU 51 H GLU 51 -16.646 12.904 -23.820 386 HA GLU 51 HA GLU 51 -14.904 12.387 -25.995 387 HB2 GLU 51 1HB GLU 51 -15.476 11.030 -23.385 388 HB3 GLU 51 2HB GLU 51 -14.470 10.227 -24.583 389 HG2 GLU 51 1HG GLU 51 -13.869 13.028 -23.735 390 HG3 GLU 51 2HG GLU 51 -13.360 11.660 -22.747 391 H LEU 52 H LEU 52 -17.695 10.614 -24.691 392 HA LEU 52 HA LEU 52 -17.664 8.416 -26.363 393 HB2 LEU 52 1HB LEU 52 -19.883 9.928 -25.041 394 HB3 LEU 52 2HB LEU 52 -20.235 8.556 -26.090 395 HG LEU 52 HG LEU 52 -18.317 8.214 -23.827 396 HD11 LEU 52 1HD1 LEU 52 -19.859 8.241 -22.198 397 HD12 LEU 52 2HD1 LEU 52 -21.120 7.578 -23.236 398 HD13 LEU 52 3HD1 LEU 52 -20.743 9.299 -23.297 399 HD21 LEU 52 1HD2 LEU 52 -18.898 5.961 -23.981 400 HD22 LEU 52 2HD2 LEU 52 -18.853 6.498 -25.661 401 HD23 LEU 52 3HD2 LEU 52 -20.401 6.308 -24.836 402 H GLU 53 H GLU 53 -19.161 11.585 -26.925 403 HA GLU 53 HA GLU 53 -20.407 11.070 -29.345 404 HB2 GLU 53 1HB GLU 53 -19.953 13.307 -27.773 405 HB3 GLU 53 2HB GLU 53 -19.140 13.695 -29.283 406 HG2 GLU 53 1HG GLU 53 -21.173 13.328 -30.523 407 HG3 GLU 53 2HG GLU 53 -22.004 12.802 -29.060 408 H ASP 54 H ASP 54 -17.064 12.089 -28.741 409 HA ASP 54 HA ASP 54 -16.265 12.352 -31.412 410 HB2 ASP 54 1HB ASP 54 -15.058 12.901 -29.106 411 HB3 ASP 54 2HB ASP 54 -14.311 11.333 -29.404 412 H LEU 55 H LEU 55 -16.200 9.554 -29.241 413 HA LEU 55 HA LEU 55 -14.864 7.781 -30.950 414 HB2 LEU 55 1HB LEU 55 -16.821 7.380 -28.711 415 HB3 LEU 55 2HB LEU 55 -16.151 6.017 -29.605 416 HG LEU 55 HG LEU 55 -14.255 7.971 -28.407 417 HD11 LEU 55 1HD1 LEU 55 -14.431 6.274 -26.367 418 HD12 LEU 55 2HD1 LEU 55 -16.116 6.241 -26.885 419 HD13 LEU 55 3HD1 LEU 55 -15.361 7.771 -26.436 420 HD21 LEU 55 1HD2 LEU 55 -12.849 6.393 -29.077 421 HD22 LEU 55 2HD2 LEU 55 -14.192 5.370 -29.587 422 HD23 LEU 55 3HD2 LEU 55 -13.590 5.274 -27.932 423 H GLY 56 H GLY 56 -18.167 8.874 -30.882 424 HA2 GLY 56 1HA GLY 56 -19.162 8.640 -33.212 425 HA3 GLY 56 2HA GLY 56 -18.846 6.925 -32.992 426 H VAL 57 H VAL 57 -19.561 7.385 -30.039 427 HA VAL 57 HA VAL 57 -22.214 6.463 -30.191 428 HB VAL 57 HB VAL 57 -20.923 7.745 -27.783 429 HG11 VAL 57 1HG1 VAL 57 -22.492 6.617 -26.483 430 HG12 VAL 57 2HG1 VAL 57 -23.436 7.179 -27.865 431 HG13 VAL 57 3HG1 VAL 57 -22.906 5.498 -27.781 432 HG21 VAL 57 1HG2 VAL 57 -20.289 5.377 -27.203 433 HG22 VAL 57 2HG2 VAL 57 -20.677 4.947 -28.868 434 HG23 VAL 57 3HG2 VAL 57 -19.384 6.099 -28.533 435 H SER 58 H SER 58 -23.534 7.850 -31.330 436 HA SER 58 HA SER 58 -23.770 10.623 -30.478 437 HB2 SER 58 1HB SER 58 -25.568 10.591 -32.360 438 HB3 SER 58 2HB SER 58 -23.866 10.479 -32.809 439 HG SER 58 HG SER 58 -25.305 8.915 -33.826 440 H ARG 59 H ARG 59 -25.770 7.700 -30.644 441 HA ARG 59 HA ARG 59 -28.173 8.704 -29.729 442 HB2 ARG 59 1HB ARG 59 -26.963 6.120 -30.025 443 HB3 ARG 59 2HB ARG 59 -27.831 6.180 -28.496 444 HG2 ARG 59 1HG ARG 59 -29.519 5.493 -29.842 445 HG3 ARG 59 2HG ARG 59 -29.712 7.237 -30.031 446 HD2 ARG 59 1HD ARG 59 -28.590 7.226 -32.118 447 HD3 ARG 59 2HD ARG 59 -28.020 5.574 -31.880 448 HE ARG 59 HE ARG 59 -30.046 4.797 -32.624 449 HH11 ARG 59 1HH1 ARG 59 -30.289 8.204 -31.946 450 HH12 ARG 59 2HH1 ARG 59 -31.862 8.365 -32.655 451 HH21 ARG 59 1HH2 ARG 59 -32.117 4.998 -33.560 452 HH22 ARG 59 2HH2 ARG 59 -32.901 6.541 -33.571 453 H ILE 60 H ILE 60 -29.167 8.244 -27.538 454 HA ILE 60 HA ILE 60 -27.350 9.272 -25.480 455 HB ILE 60 HB ILE 60 -30.368 9.168 -25.498 456 HG12 ILE 60 1HG1 ILE 60 -29.505 10.749 -27.142 457 HG13 ILE 60 2HG1 ILE 60 -30.210 11.618 -25.784 458 HG21 ILE 60 1HG2 ILE 60 -30.136 9.379 -23.286 459 HG22 ILE 60 2HG2 ILE 60 -28.415 9.736 -23.412 460 HG23 ILE 60 3HG2 ILE 60 -29.600 11.024 -23.628 461 HD11 ILE 60 1HD1 ILE 60 -28.332 12.782 -25.687 462 HD12 ILE 60 2HD1 ILE 60 -27.530 11.317 -25.119 463 HD13 ILE 60 3HD1 ILE 60 -27.536 11.710 -26.838 464 H GLY 61 H GLY 61 -29.934 6.847 -25.873 465 HA2 GLY 61 1HA GLY 61 -29.724 5.619 -23.390 466 HA3 GLY 61 2HA GLY 61 -30.255 4.813 -24.859 467 H HIS 62 H HIS 62 -27.599 5.406 -26.127 468 HA HIS 62 HA HIS 62 -26.297 2.994 -25.250 469 HB2 HIS 62 1HB HIS 62 -25.431 5.031 -27.313 470 HB3 HIS 62 2HB HIS 62 -24.718 3.438 -27.079 471 HD1 HIS 62 HD1 HIS 62 -26.012 4.344 -29.769 472 HD2 HIS 62 HD2 HIS 62 -27.922 2.108 -26.833 473 HE1 HIS 62 HE1 HIS 62 -27.860 3.116 -30.954 474 H GLN 63 H GLN 63 -25.484 6.452 -25.288 475 HA GLN 63 HA GLN 63 -22.936 6.346 -24.236 476 HB2 GLN 63 1HB GLN 63 -25.102 8.401 -23.784 477 HB3 GLN 63 2HB GLN 63 -23.424 8.627 -23.311 478 HG2 GLN 63 1HG GLN 63 -22.691 8.599 -25.563 479 HG3 GLN 63 2HG GLN 63 -24.264 8.047 -26.135 480 HE21 GLN 63 2HE2 GLN 63 -22.853 10.331 -27.057 481 HE22 GLN 63 1HE2 GLN 63 -23.815 11.720 -26.696 482 H GLU 64 H GLU 64 -26.032 6.318 -22.520 483 HA GLU 64 HA GLU 64 -24.823 6.286 -19.922 484 HB2 GLU 64 1HB GLU 64 -27.577 6.119 -21.014 485 HB3 GLU 64 2HB GLU 64 -27.314 5.414 -19.425 486 HG2 GLU 64 1HG GLU 64 -26.170 8.088 -19.782 487 HG3 GLU 64 2HG GLU 64 -27.928 8.011 -19.888 488 H LEU 65 H LEU 65 -25.936 3.884 -22.206 489 HA LEU 65 HA LEU 65 -26.154 1.650 -20.584 490 HB2 LEU 65 1HB LEU 65 -25.826 2.197 -23.401 491 HB3 LEU 65 2HB LEU 65 -24.956 0.738 -22.932 492 HG LEU 65 HG LEU 65 -27.890 1.219 -22.420 493 HD11 LEU 65 1HD1 LEU 65 -26.917 0.915 -24.869 494 HD12 LEU 65 2HD1 LEU 65 -28.424 0.156 -24.356 495 HD13 LEU 65 3HD1 LEU 65 -26.930 -0.781 -24.387 496 HD21 LEU 65 1HD2 LEU 65 -27.899 -1.215 -21.986 497 HD22 LEU 65 2HD2 LEU 65 -26.918 -0.313 -20.830 498 HD23 LEU 65 3HD2 LEU 65 -26.141 -1.220 -22.128 499 H ILE 66 H ILE 66 -23.263 2.963 -22.172 500 HA ILE 66 HA ILE 66 -21.503 0.955 -21.209 501 HB ILE 66 HB ILE 66 -20.793 3.757 -22.079 502 HG12 ILE 66 1HG1 ILE 66 -20.903 1.237 -23.748 503 HG13 ILE 66 2HG1 ILE 66 -22.142 2.487 -23.759 504 HG21 ILE 66 1HG2 ILE 66 -19.236 1.626 -21.048 505 HG22 ILE 66 2HG2 ILE 66 -18.840 1.809 -22.756 506 HG23 ILE 66 3HG2 ILE 66 -18.691 3.185 -21.664 507 HD11 ILE 66 1HD1 ILE 66 -19.379 2.545 -24.856 508 HD12 ILE 66 2HD1 ILE 66 -20.898 3.065 -25.587 509 HD13 ILE 66 3HD1 ILE 66 -20.136 4.051 -24.340 510 H LEU 67 H LEU 67 -22.034 4.332 -20.199 511 HA LEU 67 HA LEU 67 -20.266 4.439 -18.083 512 HB2 LEU 67 1HB LEU 67 -22.998 5.708 -18.212 513 HB3 LEU 67 2HB LEU 67 -21.671 6.206 -17.163 514 HG LEU 67 HG LEU 67 -21.389 6.258 -20.150 515 HD11 LEU 67 1HD1 LEU 67 -23.324 7.707 -18.782 516 HD12 LEU 67 2HD1 LEU 67 -22.688 8.044 -20.391 517 HD13 LEU 67 3HD1 LEU 67 -21.980 8.832 -18.981 518 HD21 LEU 67 1HD2 LEU 67 -19.345 6.489 -18.923 519 HD22 LEU 67 2HD2 LEU 67 -20.061 7.701 -17.861 520 HD23 LEU 67 3HD2 LEU 67 -19.786 8.071 -19.564 521 H GLU 68 H GLU 68 -23.665 3.392 -18.028 522 HA GLU 68 HA GLU 68 -23.923 2.882 -15.320 523 HB2 GLU 68 1HB GLU 68 -25.825 2.795 -16.821 524 HB3 GLU 68 2HB GLU 68 -25.144 1.407 -17.657 525 HG2 GLU 68 1HG GLU 68 -25.338 0.104 -15.566 526 HG3 GLU 68 2HG GLU 68 -26.129 1.489 -14.816 527 H ALA 69 H ALA 69 -22.238 1.073 -17.763 528 HA ALA 69 HA ALA 69 -21.948 -1.292 -16.125 529 HB1 ALA 69 1HB ALA 69 -22.106 -1.410 -18.595 530 HB2 ALA 69 2HB ALA 69 -20.543 -0.600 -18.701 531 HB3 ALA 69 3HB ALA 69 -20.662 -2.190 -17.949 532 H VAL 70 H VAL 70 -20.031 1.518 -17.019 533 HA VAL 70 HA VAL 70 -17.559 0.622 -15.987 534 HB VAL 70 HB VAL 70 -18.564 3.453 -16.309 535 HG11 VAL 70 1HG1 VAL 70 -16.728 3.933 -15.109 536 HG12 VAL 70 2HG1 VAL 70 -16.032 2.329 -15.344 537 HG13 VAL 70 3HG1 VAL 70 -15.863 3.557 -16.599 538 HG21 VAL 70 1HG2 VAL 70 -18.589 2.201 -18.402 539 HG22 VAL 70 2HG2 VAL 70 -17.320 3.426 -18.418 540 HG23 VAL 70 3HG2 VAL 70 -16.907 1.732 -18.152 541 H ASP 71 H ASP 71 -20.266 2.362 -14.549 542 HA ASP 71 HA ASP 71 -19.149 3.181 -12.159 543 HB2 ASP 71 1HB ASP 71 -21.559 3.484 -13.123 544 HB3 ASP 71 2HB ASP 71 -21.916 2.025 -12.203 545 H LEU 72 H LEU 72 -20.082 -0.019 -13.175 546 HA LEU 72 HA LEU 72 -19.982 -1.183 -10.557 547 HB2 LEU 72 1HB LEU 72 -19.943 -2.426 -13.302 548 HB3 LEU 72 2HB LEU 72 -20.049 -3.335 -11.796 549 HG LEU 72 HG LEU 72 -22.106 -1.434 -12.914 550 HD11 LEU 72 1HD1 LEU 72 -23.395 -3.736 -12.566 551 HD12 LEU 72 2HD1 LEU 72 -21.776 -4.375 -12.846 552 HD13 LEU 72 3HD1 LEU 72 -22.538 -3.344 -14.057 553 HD21 LEU 72 1HD2 LEU 72 -22.056 -2.937 -10.300 554 HD22 LEU 72 2HD2 LEU 72 -23.472 -2.127 -10.971 555 HD23 LEU 72 3HD2 LEU 72 -22.050 -1.187 -10.517 556 H LEU 73 H LEU 73 -17.742 -0.754 -13.221 557 HA LEU 73 HA LEU 73 -15.736 -2.529 -12.371 558 HB2 LEU 73 1HB LEU 73 -15.893 -0.199 -14.189 559 HB3 LEU 73 2HB LEU 73 -14.289 -0.665 -13.628 560 HG LEU 73 HG LEU 73 -16.200 -2.515 -15.050 561 HD11 LEU 73 1HD1 LEU 73 -13.730 -1.309 -16.240 562 HD12 LEU 73 2HD1 LEU 73 -15.293 -0.502 -16.358 563 HD13 LEU 73 3HD1 LEU 73 -15.077 -2.111 -17.048 564 HD21 LEU 73 1HD2 LEU 73 -13.579 -2.823 -13.762 565 HD22 LEU 73 2HD2 LEU 73 -13.698 -3.508 -15.384 566 HD23 LEU 73 3HD2 LEU 73 -14.818 -4.025 -14.122 567 H CYS 74 H CYS 74 -16.179 0.944 -11.761 568 HA CYS 74 HA CYS 74 -13.865 1.186 -10.122 569 HB2 CYS 74 1HB CYS 74 -15.118 3.048 -11.364 570 HB3 CYS 74 2HB CYS 74 -16.259 3.014 -10.024 571 HG CYS 74 HG CYS 74 -14.732 5.136 -9.386 572 H ALA 75 H ALA 75 -17.306 0.710 -9.462 573 HA ALA 75 HA ALA 75 -17.180 0.944 -6.662 574 HB1 ALA 75 1HB ALA 75 -19.257 0.972 -8.062 575 HB2 ALA 75 2HB ALA 75 -19.111 -0.780 -8.200 576 HB3 ALA 75 3HB ALA 75 -19.349 -0.037 -6.619 577 H LEU 76 H LEU 76 -16.486 -1.712 -8.828 578 HA LEU 76 HA LEU 76 -16.459 -3.749 -6.836 579 HB2 LEU 76 1HB LEU 76 -15.806 -3.506 -9.683 580 HB3 LEU 76 2HB LEU 76 -14.830 -4.688 -8.813 581 HG LEU 76 HG LEU 76 -17.773 -4.822 -8.458 582 HD11 LEU 76 1HD1 LEU 76 -18.290 -5.162 -10.584 583 HD12 LEU 76 2HD1 LEU 76 -17.053 -6.412 -10.711 584 HD13 LEU 76 3HD1 LEU 76 -16.642 -4.730 -11.041 585 HD21 LEU 76 1HD2 LEU 76 -15.907 -6.312 -7.437 586 HD22 LEU 76 2HD2 LEU 76 -15.895 -7.078 -9.026 587 HD23 LEU 76 3HD2 LEU 76 -17.374 -7.064 -8.065 588 H ASN 77 H ASN 77 -14.175 -1.389 -7.936 589 HA ASN 77 HA ASN 77 -12.030 -2.684 -6.401 590 HB2 ASN 77 1HB ASN 77 -12.091 -1.152 -8.863 591 HB3 ASN 77 2HB ASN 77 -10.955 -0.459 -7.709 592 HD21 ASN 77 2HD2 ASN 77 -11.463 -2.838 -10.020 593 HD22 ASN 77 1HD2 ASN 77 -10.045 -3.781 -9.731 594 H SER 78 H SER 78 -12.385 -2.067 -4.321 595 HA SER 78 HA SER 78 -11.838 0.695 -3.670 596 HB2 SER 78 1HB SER 78 -14.099 1.133 -3.700 597 HB3 SER 78 2HB SER 78 -14.535 -0.531 -3.313 598 HG SER 78 HG SER 78 -13.776 1.560 -1.609 599 H GLY 79 H GLY 79 -13.404 -1.974 -1.903 600 HA2 GLY 79 1HA GLY 79 -11.168 -2.984 -0.605 601 HA3 GLY 79 2HA GLY 79 -11.744 -1.645 0.377 602 HA PRO 80 HA PRO 80 -14.748 -4.186 2.296 603 HB2 PRO 80 1HB PRO 80 -16.933 -2.581 2.438 604 HB3 PRO 80 2HB PRO 80 -15.490 -2.330 3.428 605 HG2 PRO 80 1HG PRO 80 -16.315 -0.956 0.900 606 HG3 PRO 80 2HG PRO 80 -15.627 -0.259 2.378 607 HD2 PRO 80 1HD PRO 80 -14.142 -0.738 0.165 608 HD3 PRO 80 2HD PRO 80 -13.475 -0.853 1.806 609 H SER 81 H SER 81 -17.038 -5.042 2.111 610 HA SER 81 HA SER 81 -17.426 -6.067 -0.516 611 HB2 SER 81 1HB SER 81 -18.476 -6.567 2.146 612 HB3 SER 81 2HB SER 81 -19.750 -6.625 0.928 613 HG SER 81 HG SER 81 -18.706 -8.654 1.222 614 H SER 82 H SER 82 -19.158 -3.715 1.485 615 HA SER 82 HA SER 82 -20.785 -2.195 1.006 616 HB2 SER 82 1HB SER 82 -19.131 -2.274 -1.492 617 HB3 SER 82 2HB SER 82 -20.604 -1.305 -1.462 618 HG SER 82 HG SER 82 -19.064 0.052 -0.743 619 H GLY 83 H GLY 83 -21.410 -5.027 0.646 620 HA2 GLY 83 1HA GLY 83 -23.887 -4.670 -0.817 621 HA3 GLY 83 2HA GLY 83 -22.784 -5.844 -1.519 Start of MODEL 16 1 H1 GLY 1 H GLY 1 -3.106 3.701 3.181 2 HA2 GLY 1 1HA GLY 1 -3.498 2.551 1.026 3 HA3 GLY 1 2HA GLY 1 -3.030 4.056 0.247 4 H SER 2 H SER 2 -1.888 1.282 2.059 5 HA SER 2 HA SER 2 0.852 1.996 2.094 6 HB2 SER 2 1HB SER 2 1.233 -0.416 2.592 7 HB3 SER 2 2HB SER 2 -0.001 0.311 3.622 8 HG SER 2 HG SER 2 -1.371 -1.074 2.860 9 H SER 3 H SER 3 -0.831 -0.443 0.104 10 HA SER 3 HA SER 3 0.889 0.264 -2.151 11 HB2 SER 3 1HB SER 3 0.990 -2.378 -2.493 12 HB3 SER 3 2HB SER 3 2.197 -1.521 -1.535 13 HG SER 3 HG SER 3 1.415 -3.300 -0.386 14 H GLY 4 H GLY 4 -0.121 0.158 -4.086 15 HA2 GLY 4 1HA GLY 4 -1.698 -0.612 -5.656 16 HA3 GLY 4 2HA GLY 4 -2.578 -1.397 -4.353 17 H SER 5 H SER 5 -3.724 0.209 -6.410 18 HA SER 5 HA SER 5 -5.117 2.128 -4.733 19 HB2 SER 5 1HB SER 5 -3.364 2.890 -7.026 20 HB3 SER 5 2HB SER 5 -4.869 3.780 -6.797 21 HG SER 5 HG SER 5 -4.170 4.487 -4.854 22 H SER 6 H SER 6 -4.827 1.505 -8.232 23 HA SER 6 HA SER 6 -7.426 0.263 -8.327 24 HB2 SER 6 1HB SER 6 -7.288 2.603 -10.138 25 HB3 SER 6 2HB SER 6 -8.669 1.919 -9.281 26 HG SER 6 HG SER 6 -7.071 3.984 -8.582 27 H GLY 7 H GLY 7 -7.622 -1.069 -10.053 28 HA2 GLY 7 1HA GLY 7 -5.289 -1.337 -11.769 29 HA3 GLY 7 2HA GLY 7 -6.636 -2.460 -11.654 30 H VAL 8 H VAL 8 -8.743 -0.645 -12.116 31 HA VAL 8 HA VAL 8 -8.871 -0.664 -14.910 32 HB VAL 8 HB VAL 8 -10.473 1.120 -13.074 33 HG11 VAL 8 1HG1 VAL 8 -10.797 1.757 -15.343 34 HG12 VAL 8 2HG1 VAL 8 -10.945 0.076 -15.859 35 HG13 VAL 8 3HG1 VAL 8 -12.205 0.809 -14.865 36 HG21 VAL 8 1HG2 VAL 8 -11.400 -0.699 -12.204 37 HG22 VAL 8 2HG2 VAL 8 -11.918 -1.197 -13.815 38 HG23 VAL 8 3HG2 VAL 8 -10.356 -1.725 -13.189 39 H SER 9 H SER 9 -7.553 1.662 -12.715 40 HA SER 9 HA SER 9 -7.612 3.904 -14.474 41 HB2 SER 9 1HB SER 9 -6.056 4.935 -12.870 42 HB3 SER 9 2HB SER 9 -7.414 4.176 -12.039 43 HG SER 9 HG SER 9 -5.898 2.291 -11.896 44 H LYS 10 H LYS 10 -5.474 1.207 -14.022 45 HA LYS 10 HA LYS 10 -3.526 2.402 -15.873 46 HB2 LYS 10 1HB LYS 10 -3.153 -0.054 -14.156 47 HB3 LYS 10 2HB LYS 10 -1.913 0.825 -15.042 48 HG2 LYS 10 1HG LYS 10 -2.967 2.767 -13.427 49 HG3 LYS 10 2HG LYS 10 -3.051 1.329 -12.407 50 HD2 LYS 10 1HD LYS 10 -0.636 0.908 -13.009 51 HD3 LYS 10 2HD LYS 10 -0.622 2.517 -13.736 52 HE2 LYS 10 1HE LYS 10 -0.221 3.398 -11.738 53 HE3 LYS 10 2HE LYS 10 -1.762 2.765 -11.160 54 HZ1 LYS 10 1HZ LYS 10 -0.771 1.021 -10.143 55 HZ2 LYS 10 2HZ LYS 10 0.534 2.094 -10.070 56 HZ3 LYS 10 3HZ LYS 10 0.484 0.905 -11.273 57 H TRP 11 H TRP 11 -6.152 1.094 -16.515 58 HA TRP 11 HA TRP 11 -5.560 -1.416 -17.739 59 HB2 TRP 11 1HB TRP 11 -7.888 0.367 -17.501 60 HB3 TRP 11 2HB TRP 11 -7.826 -0.549 -19.004 61 HD1 TRP 11 HD1 TRP 11 -6.484 -2.134 -15.807 62 HE1 TRP 11 HE1 TRP 11 -8.032 -4.076 -15.130 63 HE3 TRP 11 HE3 TRP 11 -10.267 -1.364 -19.159 64 HZ2 TRP 11 HZ2 TRP 11 -10.525 -5.141 -15.914 65 HZ3 TRP 11 HZ3 TRP 11 -12.197 -2.890 -19.130 66 HH2 TRP 11 HH2 TRP 11 -12.321 -4.739 -17.540 67 H SER 12 H SER 12 -4.654 -1.808 -19.648 68 HA SER 12 HA SER 12 -3.519 0.179 -21.243 69 HB2 SER 12 1HB SER 12 -3.658 -2.683 -21.243 70 HB3 SER 12 2HB SER 12 -3.956 -2.099 -22.880 71 HG SER 12 HG SER 12 -1.646 -2.147 -21.460 72 HA PRO 13 HA PRO 13 -6.648 1.608 -23.965 73 HB2 PRO 13 1HB PRO 13 -5.331 1.790 -26.332 74 HB3 PRO 13 2HB PRO 13 -5.042 2.896 -24.984 75 HG2 PRO 13 1HG PRO 13 -3.469 0.496 -25.835 76 HG3 PRO 13 2HG PRO 13 -2.887 2.088 -25.315 77 HD2 PRO 13 1HD PRO 13 -2.917 -0.062 -23.669 78 HD3 PRO 13 2HD PRO 13 -3.157 1.595 -23.080 79 H SER 14 H SER 14 -5.029 -1.370 -24.708 80 HA SER 14 HA SER 14 -6.989 -2.080 -26.752 81 HB2 SER 14 1HB SER 14 -4.470 -3.423 -25.766 82 HB3 SER 14 2HB SER 14 -5.578 -4.194 -26.901 83 HG SER 14 HG SER 14 -5.273 -2.155 -28.159 84 H GLN 15 H GLN 15 -6.227 -2.684 -23.430 85 HA GLN 15 HA GLN 15 -7.625 -5.113 -23.090 86 HB2 GLN 15 1HB GLN 15 -6.702 -2.943 -21.245 87 HB3 GLN 15 2HB GLN 15 -7.771 -4.200 -20.639 88 HG2 GLN 15 1HG GLN 15 -5.628 -5.386 -22.120 89 HG3 GLN 15 2HG GLN 15 -4.982 -4.283 -20.905 90 HE21 GLN 15 2HE2 GLN 15 -6.057 -4.518 -18.709 91 HE22 GLN 15 1HE2 GLN 15 -6.310 -6.133 -18.152 92 H VAL 16 H VAL 16 -8.602 -1.730 -22.650 93 HA VAL 16 HA VAL 16 -11.139 -2.084 -21.627 94 HB VAL 16 HB VAL 16 -10.275 0.004 -23.633 95 HG11 VAL 16 1HG1 VAL 16 -12.695 -0.248 -21.879 96 HG12 VAL 16 2HG1 VAL 16 -12.114 1.325 -22.429 97 HG13 VAL 16 3HG1 VAL 16 -12.609 0.105 -23.604 98 HG21 VAL 16 1HG2 VAL 16 -10.386 0.215 -20.630 99 HG22 VAL 16 2HG2 VAL 16 -8.917 -0.165 -21.530 100 HG23 VAL 16 3HG2 VAL 16 -9.722 1.386 -21.769 101 H VAL 17 H VAL 17 -10.015 -2.483 -24.920 102 HA VAL 17 HA VAL 17 -12.498 -2.528 -26.230 103 HB VAL 17 HB VAL 17 -10.056 -4.124 -27.007 104 HG11 VAL 17 1HG1 VAL 17 -11.838 -2.879 -29.008 105 HG12 VAL 17 2HG1 VAL 17 -11.001 -4.432 -29.040 106 HG13 VAL 17 3HG1 VAL 17 -12.493 -4.252 -28.117 107 HG21 VAL 17 1HG2 VAL 17 -9.055 -2.102 -27.005 108 HG22 VAL 17 2HG2 VAL 17 -9.919 -1.901 -28.529 109 HG23 VAL 17 3HG2 VAL 17 -10.584 -1.225 -27.042 110 H ASP 18 H ASP 18 -10.679 -5.043 -24.564 111 HA ASP 18 HA ASP 18 -12.307 -7.216 -25.374 112 HB2 ASP 18 1HB ASP 18 -9.962 -7.318 -24.372 113 HB3 ASP 18 2HB ASP 18 -10.732 -7.083 -22.805 114 H TRP 19 H TRP 19 -12.580 -4.819 -22.872 115 HA TRP 19 HA TRP 19 -14.460 -6.181 -21.242 116 HB2 TRP 19 1HB TRP 19 -13.234 -4.339 -20.306 117 HB3 TRP 19 2HB TRP 19 -13.818 -3.245 -21.558 118 HD1 TRP 19 HD1 TRP 19 -15.459 -5.454 -18.803 119 HE1 TRP 19 HE1 TRP 19 -17.385 -4.102 -17.761 120 HE3 TRP 19 HE3 TRP 19 -15.118 -1.225 -21.655 121 HZ2 TRP 19 HZ2 TRP 19 -18.600 -1.577 -18.104 122 HZ3 TRP 19 HZ3 TRP 19 -16.700 0.612 -21.235 123 HH2 TRP 19 HH2 TRP 19 -18.405 0.437 -19.496 124 H MET 20 H MET 20 -14.791 -3.837 -23.882 125 HA MET 20 HA MET 20 -17.583 -3.556 -23.756 126 HB2 MET 20 1HB MET 20 -15.800 -3.333 -26.187 127 HB3 MET 20 2HB MET 20 -17.423 -2.674 -26.030 128 HG2 MET 20 1HG MET 20 -15.494 -1.831 -23.974 129 HG3 MET 20 2HG MET 20 -15.175 -1.265 -25.612 130 HE1 MET 20 1HE MET 20 -18.507 -0.260 -26.708 131 HE2 MET 20 2HE MET 20 -17.466 1.156 -26.563 132 HE3 MET 20 3HE MET 20 -16.787 -0.390 -27.077 133 H LYS 21 H LYS 21 -15.587 -6.095 -24.959 134 HA LYS 21 HA LYS 21 -17.408 -7.255 -26.791 135 HB2 LYS 21 1HB LYS 21 -15.166 -8.531 -25.214 136 HB3 LYS 21 2HB LYS 21 -16.002 -9.280 -26.567 137 HG2 LYS 21 1HG LYS 21 -15.246 -7.099 -27.821 138 HG3 LYS 21 2HG LYS 21 -14.022 -7.063 -26.550 139 HD2 LYS 21 1HD LYS 21 -13.053 -9.044 -27.249 140 HD3 LYS 21 2HD LYS 21 -14.520 -9.594 -28.063 141 HE2 LYS 21 1HE LYS 21 -14.196 -7.879 -29.783 142 HE3 LYS 21 2HE LYS 21 -12.727 -7.342 -28.970 143 HZ1 LYS 21 1HZ LYS 21 -13.048 -10.136 -29.875 144 HZ2 LYS 21 2HZ LYS 21 -11.622 -9.300 -29.517 145 HZ3 LYS 21 3HZ LYS 21 -12.487 -8.934 -30.924 146 H GLY 22 H GLY 22 -17.454 -7.026 -23.422 147 HA2 GLY 22 1HA GLY 22 -19.311 -9.318 -23.238 148 HA3 GLY 22 2HA GLY 22 -18.306 -8.767 -21.906 149 H LEU 23 H LEU 23 -19.777 -6.383 -23.917 150 HA LEU 23 HA LEU 23 -21.686 -5.788 -21.755 151 HB2 LEU 23 1HB LEU 23 -20.570 -3.861 -23.782 152 HB3 LEU 23 2HB LEU 23 -21.548 -3.474 -22.368 153 HG LEU 23 HG LEU 23 -18.701 -4.472 -22.376 154 HD11 LEU 23 1HD1 LEU 23 -19.414 -1.997 -22.920 155 HD12 LEU 23 2HD1 LEU 23 -18.038 -2.345 -21.875 156 HD13 LEU 23 3HD1 LEU 23 -19.592 -1.905 -21.168 157 HD21 LEU 23 1HD2 LEU 23 -20.754 -4.345 -20.262 158 HD22 LEU 23 2HD2 LEU 23 -19.166 -3.704 -19.839 159 HD23 LEU 23 3HD2 LEU 23 -19.324 -5.369 -20.401 160 H ASP 24 H ASP 24 -23.321 -4.001 -22.975 161 HA ASP 24 HA ASP 24 -25.207 -5.550 -24.263 162 HB2 ASP 24 1HB ASP 24 -25.131 -2.983 -23.357 163 HB3 ASP 24 2HB ASP 24 -25.170 -2.722 -25.099 164 H ASP 25 H ASP 25 -25.864 -5.790 -26.416 165 HA ASP 25 HA ASP 25 -23.774 -6.085 -28.295 166 HB2 ASP 25 1HB ASP 25 -26.620 -6.656 -28.159 167 HB3 ASP 25 2HB ASP 25 -26.149 -6.080 -29.755 168 H CYS 26 H CYS 26 -25.933 -3.480 -27.556 169 HA CYS 26 HA CYS 26 -25.701 -2.086 -30.023 170 HB2 CYS 26 1HB CYS 26 -26.821 -1.556 -27.347 171 HB3 CYS 26 2HB CYS 26 -26.276 -0.127 -28.218 172 HG CYS 26 HG CYS 26 -29.143 -0.917 -28.416 173 H LEU 27 H LEU 27 -23.670 -2.412 -27.265 174 HA LEU 27 HA LEU 27 -22.090 -0.058 -27.966 175 HB2 LEU 27 1HB LEU 27 -21.459 -1.987 -25.761 176 HB3 LEU 27 2HB LEU 27 -21.009 -0.289 -25.904 177 HG LEU 27 HG LEU 27 -23.812 -1.284 -25.400 178 HD11 LEU 27 1HD1 LEU 27 -22.823 0.153 -23.202 179 HD12 LEU 27 2HD1 LEU 27 -21.580 -1.024 -23.625 180 HD13 LEU 27 3HD1 LEU 27 -23.223 -1.563 -23.282 181 HD21 LEU 27 1HD2 LEU 27 -23.964 1.197 -24.637 182 HD22 LEU 27 2HD2 LEU 27 -24.073 0.804 -26.353 183 HD23 LEU 27 3HD2 LEU 27 -22.560 1.416 -25.682 184 H GLN 28 H GLN 28 -22.271 -2.614 -29.569 185 HA GLN 28 HA GLN 28 -19.551 -3.636 -29.401 186 HB2 GLN 28 1HB GLN 28 -21.848 -4.403 -31.211 187 HB3 GLN 28 2HB GLN 28 -20.286 -5.210 -31.165 188 HG2 GLN 28 1HG GLN 28 -22.175 -5.012 -28.832 189 HG3 GLN 28 2HG GLN 28 -22.058 -6.395 -29.919 190 HE21 GLN 28 2HE2 GLN 28 -21.202 -5.372 -26.986 191 HE22 GLN 28 1HE2 GLN 28 -19.734 -6.253 -26.755 192 H GLN 29 H GLN 29 -21.641 -2.020 -31.779 193 HA GLN 29 HA GLN 29 -19.805 -1.804 -33.854 194 HB2 GLN 29 1HB GLN 29 -21.170 0.102 -34.636 195 HB3 GLN 29 2HB GLN 29 -22.150 -1.283 -34.172 196 HG2 GLN 29 1HG GLN 29 -22.260 -0.037 -31.869 197 HG3 GLN 29 2HG GLN 29 -21.871 1.369 -32.858 198 HE21 GLN 29 2HE2 GLN 29 -24.324 -0.482 -31.635 199 HE22 GLN 29 1HE2 GLN 29 -25.600 0.013 -32.690 200 H TYR 30 H TYR 30 -20.012 -0.066 -30.869 201 HA TYR 30 HA TYR 30 -18.379 2.145 -31.686 202 HB2 TYR 30 1HB TYR 30 -19.051 1.182 -28.898 203 HB3 TYR 30 2HB TYR 30 -18.370 2.750 -29.317 204 HD1 TYR 30 HD2 TYR 30 -20.014 3.466 -31.673 205 HD2 TYR 30 HD1 TYR 30 -21.130 1.695 -27.968 206 HE1 TYR 30 HE2 TYR 30 -22.281 4.387 -31.922 207 HE2 TYR 30 HE1 TYR 30 -23.400 2.610 -28.208 208 HH TYR 30 HH TYR 30 -24.206 4.897 -30.698 209 H ILE 31 H ILE 31 -17.819 -1.041 -30.464 210 HA ILE 31 HA ILE 31 -15.349 -0.833 -29.255 211 HB ILE 31 HB ILE 31 -16.261 -3.057 -31.086 212 HG12 ILE 31 1HG1 ILE 31 -16.546 -2.733 -28.090 213 HG13 ILE 31 2HG1 ILE 31 -17.851 -2.592 -29.263 214 HG21 ILE 31 1HG2 ILE 31 -14.293 -4.006 -30.703 215 HG22 ILE 31 2HG2 ILE 31 -13.799 -2.627 -29.723 216 HG23 ILE 31 3HG2 ILE 31 -14.631 -3.988 -28.973 217 HD11 ILE 31 1HD1 ILE 31 -17.333 -4.974 -29.921 218 HD12 ILE 31 2HD1 ILE 31 -16.313 -5.045 -28.484 219 HD13 ILE 31 3HD1 ILE 31 -18.041 -4.733 -28.324 220 H LYS 32 H LYS 32 -16.052 -1.220 -32.717 221 HA LYS 32 HA LYS 32 -13.461 -1.390 -33.681 222 HB2 LYS 32 1HB LYS 32 -14.326 -0.790 -35.807 223 HB3 LYS 32 2HB LYS 32 -15.617 -1.652 -34.981 224 HG2 LYS 32 1HG LYS 32 -16.332 0.780 -34.272 225 HG3 LYS 32 2HG LYS 32 -15.417 1.219 -35.716 226 HD2 LYS 32 1HD LYS 32 -17.340 -1.023 -35.963 227 HD3 LYS 32 2HD LYS 32 -18.014 0.599 -35.784 228 HE2 LYS 32 1HE LYS 32 -17.692 -0.091 -38.146 229 HE3 LYS 32 2HE LYS 32 -16.810 1.373 -37.711 230 HZ1 LYS 32 1HZ LYS 32 -15.669 -0.569 -39.028 231 HZ2 LYS 32 2HZ LYS 32 -15.422 -1.193 -37.475 232 HZ3 LYS 32 3HZ LYS 32 -14.810 0.331 -37.881 233 H ASN 33 H ASN 33 -15.231 1.385 -32.533 234 HA ASN 33 HA ASN 33 -13.315 3.288 -33.564 235 HB2 ASN 33 1HB ASN 33 -15.628 3.649 -31.644 236 HB3 ASN 33 2HB ASN 33 -14.672 4.956 -32.337 237 HD21 ASN 33 2HD2 ASN 33 -17.540 4.306 -32.542 238 HD22 ASN 33 1HD2 ASN 33 -17.869 4.208 -34.236 239 H PHE 34 H PHE 34 -13.896 1.540 -30.615 240 HA PHE 34 HA PHE 34 -12.232 3.171 -28.956 241 HB2 PHE 34 1HB PHE 34 -13.639 0.559 -28.671 242 HB3 PHE 34 2HB PHE 34 -12.318 0.906 -27.560 243 HD1 PHE 34 HD2 PHE 34 -15.197 2.800 -29.003 244 HD2 PHE 34 HD1 PHE 34 -12.993 1.707 -25.530 245 HE1 PHE 34 HE2 PHE 34 -16.724 4.141 -27.616 246 HE2 PHE 34 HE1 PHE 34 -14.517 3.046 -24.137 247 HZ PHE 34 HZ PHE 34 -16.384 4.266 -25.180 248 H GLU 35 H GLU 35 -11.723 0.495 -31.104 249 HA GLU 35 HA GLU 35 -9.219 -0.359 -30.076 250 HB2 GLU 35 1HB GLU 35 -10.972 -1.128 -32.163 251 HB3 GLU 35 2HB GLU 35 -9.404 -0.825 -32.898 252 HG2 GLU 35 1HG GLU 35 -9.966 -2.695 -30.608 253 HG3 GLU 35 2HG GLU 35 -9.623 -3.151 -32.276 254 H ARG 36 H ARG 36 -10.145 1.883 -32.660 255 HA ARG 36 HA ARG 36 -7.409 2.512 -33.301 256 HB2 ARG 36 1HB ARG 36 -9.577 2.600 -34.805 257 HB3 ARG 36 2HB ARG 36 -9.695 4.232 -34.161 258 HG2 ARG 36 1HG ARG 36 -7.512 4.777 -35.042 259 HG3 ARG 36 2HG ARG 36 -7.299 3.118 -35.605 260 HD2 ARG 36 1HD ARG 36 -8.209 3.742 -37.535 261 HD3 ARG 36 2HD ARG 36 -9.736 3.943 -36.678 262 HE ARG 36 HE ARG 36 -8.336 6.280 -36.278 263 HH11 ARG 36 1HH1 ARG 36 -9.546 4.488 -39.007 264 HH12 ARG 36 2HH1 ARG 36 -9.780 5.894 -39.992 265 HH21 ARG 36 1HH2 ARG 36 -8.640 8.139 -37.565 266 HH22 ARG 36 2HH2 ARG 36 -9.264 7.970 -39.171 267 H GLU 37 H GLU 37 -9.998 3.927 -31.398 268 HA GLU 37 HA GLU 37 -8.746 6.439 -30.963 269 HB2 GLU 37 1HB GLU 37 -10.996 4.954 -29.648 270 HB3 GLU 37 2HB GLU 37 -10.366 6.425 -28.920 271 HG2 GLU 37 1HG GLU 37 -10.966 6.642 -31.778 272 HG3 GLU 37 2HG GLU 37 -12.363 6.326 -30.751 273 H LYS 38 H LYS 38 -8.301 3.310 -29.623 274 HA LYS 38 HA LYS 38 -6.939 2.485 -28.000 275 HB2 LYS 38 1HB LYS 38 -5.555 5.157 -28.300 276 HB3 LYS 38 2HB LYS 38 -4.880 3.737 -27.511 277 HG2 LYS 38 1HG LYS 38 -5.741 3.701 -30.384 278 HG3 LYS 38 2HG LYS 38 -4.128 4.220 -29.888 279 HD2 LYS 38 1HD LYS 38 -4.106 1.961 -28.586 280 HD3 LYS 38 2HD LYS 38 -5.391 1.515 -29.711 281 HE2 LYS 38 1HE LYS 38 -3.954 1.251 -31.399 282 HE3 LYS 38 2HE LYS 38 -3.132 2.769 -31.041 283 HZ1 LYS 38 1HZ LYS 38 -2.635 0.122 -29.798 284 HZ2 LYS 38 2HZ LYS 38 -1.969 1.565 -29.218 285 HZ3 LYS 38 3HZ LYS 38 -1.577 1.016 -30.769 286 H ILE 39 H ILE 39 -9.325 3.705 -27.136 287 HA ILE 39 HA ILE 39 -9.105 5.542 -25.069 288 HB ILE 39 HB ILE 39 -11.030 3.221 -25.247 289 HG12 ILE 39 1HG1 ILE 39 -11.134 4.632 -27.230 290 HG13 ILE 39 2HG1 ILE 39 -12.564 4.894 -26.237 291 HG21 ILE 39 1HG2 ILE 39 -10.618 5.181 -23.213 292 HG22 ILE 39 2HG2 ILE 39 -12.182 5.459 -23.977 293 HG23 ILE 39 3HG2 ILE 39 -11.811 3.883 -23.279 294 HD11 ILE 39 1HD1 ILE 39 -10.154 6.685 -26.418 295 HD12 ILE 39 2HD1 ILE 39 -11.757 6.992 -27.088 296 HD13 ILE 39 3HD1 ILE 39 -11.527 6.937 -25.340 297 H SER 40 H SER 40 -7.736 5.416 -23.415 298 HA SER 40 HA SER 40 -6.972 2.864 -22.285 299 HB2 SER 40 1HB SER 40 -5.211 4.473 -22.502 300 HB3 SER 40 2HB SER 40 -6.155 5.709 -21.671 301 HG SER 40 HG SER 40 -4.548 4.674 -20.343 302 H GLY 41 H GLY 41 -7.042 2.483 -19.940 303 HA2 GLY 41 1HA GLY 41 -9.620 2.597 -18.910 304 HA3 GLY 41 2HA GLY 41 -8.176 2.298 -17.953 305 H ASP 42 H ASP 42 -6.851 4.690 -18.139 306 HA ASP 42 HA ASP 42 -7.990 6.223 -16.146 307 HB2 ASP 42 1HB ASP 42 -5.614 6.347 -16.869 308 HB3 ASP 42 2HB ASP 42 -6.126 7.227 -18.307 309 H GLN 43 H GLN 43 -8.536 6.326 -19.587 310 HA GLN 43 HA GLN 43 -10.035 8.810 -19.421 311 HB2 GLN 43 1HB GLN 43 -9.021 7.073 -21.604 312 HB3 GLN 43 2HB GLN 43 -10.480 7.996 -21.938 313 HG2 GLN 43 1HG GLN 43 -9.080 9.987 -20.990 314 HG3 GLN 43 2HG GLN 43 -7.714 8.951 -21.397 315 HE21 GLN 43 2HE2 GLN 43 -7.046 8.857 -23.446 316 HE22 GLN 43 1HE2 GLN 43 -7.840 9.608 -24.784 317 H LEU 44 H LEU 44 -10.596 5.369 -19.676 318 HA LEU 44 HA LEU 44 -13.345 5.509 -20.367 319 HB2 LEU 44 1HB LEU 44 -12.188 3.482 -20.782 320 HB3 LEU 44 2HB LEU 44 -11.653 3.366 -19.107 321 HG LEU 44 HG LEU 44 -14.013 2.965 -18.439 322 HD11 LEU 44 1HD1 LEU 44 -14.557 2.612 -21.375 323 HD12 LEU 44 2HD1 LEU 44 -14.964 4.081 -20.489 324 HD13 LEU 44 3HD1 LEU 44 -15.704 2.545 -20.037 325 HD21 LEU 44 1HD2 LEU 44 -12.171 1.215 -19.459 326 HD22 LEU 44 2HD2 LEU 44 -13.613 0.840 -20.402 327 HD23 LEU 44 3HD2 LEU 44 -13.666 0.764 -18.641 328 H LEU 45 H LEU 45 -11.605 5.404 -17.306 329 HA LEU 45 HA LEU 45 -13.855 5.032 -15.638 330 HB2 LEU 45 1HB LEU 45 -11.122 6.184 -15.158 331 HB3 LEU 45 2HB LEU 45 -12.327 6.054 -13.879 332 HG LEU 45 HG LEU 45 -11.451 3.646 -15.441 333 HD11 LEU 45 1HD1 LEU 45 -10.159 4.714 -12.936 334 HD12 LEU 45 2HD1 LEU 45 -9.435 4.720 -14.543 335 HD13 LEU 45 3HD1 LEU 45 -9.787 3.189 -13.741 336 HD21 LEU 45 1HD2 LEU 45 -13.278 4.179 -13.311 337 HD22 LEU 45 2HD2 LEU 45 -11.989 3.129 -12.721 338 HD23 LEU 45 3HD2 LEU 45 -12.939 2.654 -14.130 339 H ARG 46 H ARG 46 -12.201 7.928 -16.819 340 HA ARG 46 HA ARG 46 -14.284 9.589 -15.583 341 HB2 ARG 46 1HB ARG 46 -12.763 11.484 -16.025 342 HB3 ARG 46 2HB ARG 46 -12.016 10.248 -15.022 343 HG2 ARG 46 1HG ARG 46 -10.332 10.083 -16.442 344 HG3 ARG 46 2HG ARG 46 -11.444 9.667 -17.747 345 HD2 ARG 46 1HD ARG 46 -10.054 11.652 -18.246 346 HD3 ARG 46 2HD ARG 46 -11.784 11.991 -18.267 347 HE ARG 46 HE ARG 46 -10.717 12.541 -15.710 348 HH11 ARG 46 1HH1 ARG 46 -10.775 13.776 -18.965 349 HH12 ARG 46 2HH1 ARG 46 -10.538 15.423 -18.483 350 HH21 ARG 46 1HH2 ARG 46 -10.405 14.706 -15.063 351 HH22 ARG 46 2HH2 ARG 46 -10.327 15.951 -16.263 352 H ILE 47 H ILE 47 -14.655 7.977 -18.014 353 HA ILE 47 HA ILE 47 -14.579 9.616 -20.314 354 HB ILE 47 HB ILE 47 -14.779 7.169 -20.439 355 HG12 ILE 47 1HG1 ILE 47 -17.229 7.662 -21.830 356 HG13 ILE 47 2HG1 ILE 47 -16.213 9.093 -21.963 357 HG21 ILE 47 1HG2 ILE 47 -16.456 5.964 -19.541 358 HG22 ILE 47 2HG2 ILE 47 -16.651 7.378 -18.508 359 HG23 ILE 47 3HG2 ILE 47 -17.676 7.176 -19.928 360 HD11 ILE 47 1HD1 ILE 47 -15.951 7.425 -23.799 361 HD12 ILE 47 2HD1 ILE 47 -14.457 7.846 -22.961 362 HD13 ILE 47 3HD1 ILE 47 -15.264 6.317 -22.611 363 H THR 48 H THR 48 -15.916 11.147 -21.047 364 HA THR 48 HA THR 48 -18.431 11.595 -19.575 365 HB THR 48 HB THR 48 -16.790 13.396 -19.216 366 HG1 THR 48 HG1 THR 48 -18.499 14.629 -19.176 367 HG21 THR 48 1HG2 THR 48 -15.713 14.524 -20.873 368 HG22 THR 48 2HG2 THR 48 -17.055 14.360 -22.006 369 HG23 THR 48 3HG2 THR 48 -15.960 13.005 -21.732 370 H HIS 49 H HIS 49 -20.095 12.804 -20.874 371 HA HIS 49 HA HIS 49 -20.897 11.358 -23.085 372 HB2 HIS 49 1HB HIS 49 -21.655 13.967 -21.901 373 HB3 HIS 49 2HB HIS 49 -22.156 13.692 -23.567 374 HD1 HIS 49 HD1 HIS 49 -22.550 12.191 -20.119 375 HD2 HIS 49 HD2 HIS 49 -24.339 12.064 -23.867 376 HE1 HIS 49 HE1 HIS 49 -24.669 10.873 -19.809 377 H GLN 50 H GLN 50 -18.898 14.246 -22.934 378 HA GLN 50 HA GLN 50 -18.897 14.873 -25.674 379 HB2 GLN 50 1HB GLN 50 -17.706 15.891 -23.356 380 HB3 GLN 50 2HB GLN 50 -16.361 15.459 -24.403 381 HG2 GLN 50 1HG GLN 50 -17.644 16.746 -26.223 382 HG3 GLN 50 2HG GLN 50 -18.558 17.430 -24.880 383 HE21 GLN 50 2HE2 GLN 50 -16.169 18.114 -26.892 384 HE22 GLN 50 1HE2 GLN 50 -15.170 19.110 -25.896 385 H GLU 51 H GLU 51 -16.704 12.861 -23.737 386 HA GLU 51 HA GLU 51 -14.905 12.219 -25.789 387 HB2 GLU 51 1HB GLU 51 -15.687 10.757 -23.270 388 HB3 GLU 51 2HB GLU 51 -14.428 10.174 -24.350 389 HG2 GLU 51 1HG GLU 51 -14.295 12.965 -23.317 390 HG3 GLU 51 2HG GLU 51 -13.824 11.623 -22.275 391 H LEU 52 H LEU 52 -17.797 10.505 -24.640 392 HA LEU 52 HA LEU 52 -17.668 8.275 -26.277 393 HB2 LEU 52 1HB LEU 52 -19.910 9.787 -25.019 394 HB3 LEU 52 2HB LEU 52 -20.277 8.489 -26.153 395 HG LEU 52 HG LEU 52 -18.495 8.005 -23.792 396 HD11 LEU 52 1HD1 LEU 52 -21.266 7.204 -23.430 397 HD12 LEU 52 2HD1 LEU 52 -21.059 8.954 -23.494 398 HD13 LEU 52 3HD1 LEU 52 -20.160 8.003 -22.312 399 HD21 LEU 52 1HD2 LEU 52 -18.394 6.090 -24.977 400 HD22 LEU 52 2HD2 LEU 52 -19.897 6.417 -25.840 401 HD23 LEU 52 3HD2 LEU 52 -19.944 5.769 -24.200 402 H GLU 53 H GLU 53 -19.169 11.425 -26.941 403 HA GLU 53 HA GLU 53 -20.232 10.846 -29.449 404 HB2 GLU 53 1HB GLU 53 -20.371 12.990 -27.917 405 HB3 GLU 53 2HB GLU 53 -19.043 13.538 -28.930 406 HG2 GLU 53 1HG GLU 53 -20.548 12.965 -30.909 407 HG3 GLU 53 2HG GLU 53 -21.854 12.880 -29.728 408 H ASP 54 H ASP 54 -16.984 11.870 -28.532 409 HA ASP 54 HA ASP 54 -15.955 12.367 -31.081 410 HB2 ASP 54 1HB ASP 54 -14.960 12.477 -28.536 411 HB3 ASP 54 2HB ASP 54 -14.080 11.102 -29.199 412 H LEU 55 H LEU 55 -16.178 9.358 -29.237 413 HA LEU 55 HA LEU 55 -14.727 7.756 -31.056 414 HB2 LEU 55 1HB LEU 55 -16.844 7.028 -29.039 415 HB3 LEU 55 2HB LEU 55 -15.863 5.857 -29.917 416 HG LEU 55 HG LEU 55 -14.328 7.881 -28.441 417 HD11 LEU 55 1HD1 LEU 55 -15.595 7.764 -26.592 418 HD12 LEU 55 2HD1 LEU 55 -14.830 6.189 -26.388 419 HD13 LEU 55 3HD1 LEU 55 -16.427 6.304 -27.126 420 HD21 LEU 55 1HD2 LEU 55 -12.792 6.294 -28.648 421 HD22 LEU 55 2HD2 LEU 55 -13.967 5.319 -29.531 422 HD23 LEU 55 3HD2 LEU 55 -13.807 5.139 -27.783 423 H GLY 56 H GLY 56 -18.008 8.892 -30.996 424 HA2 GLY 56 1HA GLY 56 -18.925 8.872 -33.370 425 HA3 GLY 56 2HA GLY 56 -18.657 7.138 -33.279 426 H VAL 57 H VAL 57 -19.463 7.380 -30.324 427 HA VAL 57 HA VAL 57 -22.100 6.494 -30.596 428 HB VAL 57 HB VAL 57 -20.917 7.727 -28.108 429 HG11 VAL 57 1HG1 VAL 57 -22.458 6.254 -26.933 430 HG12 VAL 57 2HG1 VAL 57 -23.333 7.317 -28.037 431 HG13 VAL 57 3HG1 VAL 57 -23.055 5.630 -28.470 432 HG21 VAL 57 1HG2 VAL 57 -20.751 4.922 -27.997 433 HG22 VAL 57 2HG2 VAL 57 -20.088 5.400 -29.561 434 HG23 VAL 57 3HG2 VAL 57 -19.424 6.081 -28.076 435 H SER 58 H SER 58 -23.473 7.838 -31.675 436 HA SER 58 HA SER 58 -23.857 10.546 -30.591 437 HB2 SER 58 1HB SER 58 -25.212 10.772 -32.821 438 HB3 SER 58 2HB SER 58 -23.450 10.834 -32.863 439 HG SER 58 HG SER 58 -25.109 8.610 -33.457 440 H ARG 59 H ARG 59 -24.943 8.882 -28.920 441 HA ARG 59 HA ARG 59 -27.805 9.202 -29.358 442 HB2 ARG 59 1HB ARG 59 -26.469 6.666 -29.546 443 HB3 ARG 59 2HB ARG 59 -27.533 6.663 -28.146 444 HG2 ARG 59 1HG ARG 59 -28.512 7.595 -30.816 445 HG3 ARG 59 2HG ARG 59 -28.460 5.878 -30.409 446 HD2 ARG 59 1HD ARG 59 -30.539 6.284 -29.630 447 HD3 ARG 59 2HD ARG 59 -29.661 6.840 -28.205 448 HE ARG 59 HE ARG 59 -30.389 8.956 -28.647 449 HH11 ARG 59 1HH1 ARG 59 -30.681 7.047 -31.544 450 HH12 ARG 59 2HH1 ARG 59 -31.494 8.289 -32.437 451 HH21 ARG 59 1HH2 ARG 59 -31.458 10.600 -29.812 452 HH22 ARG 59 2HH2 ARG 59 -31.935 10.310 -31.451 453 H ILE 60 H ILE 60 -29.000 8.451 -27.273 454 HA ILE 60 HA ILE 60 -27.500 9.555 -24.998 455 HB ILE 60 HB ILE 60 -30.491 9.332 -25.351 456 HG12 ILE 60 1HG1 ILE 60 -29.480 10.960 -26.894 457 HG13 ILE 60 2HG1 ILE 60 -30.445 11.762 -25.659 458 HG21 ILE 60 1HG2 ILE 60 -28.750 10.385 -23.156 459 HG22 ILE 60 2HG2 ILE 60 -30.375 11.023 -23.403 460 HG23 ILE 60 3HG2 ILE 60 -30.144 9.310 -23.055 461 HD11 ILE 60 1HD1 ILE 60 -27.447 11.514 -25.672 462 HD12 ILE 60 2HD1 ILE 60 -28.378 12.957 -26.074 463 HD13 ILE 60 3HD1 ILE 60 -28.412 12.315 -24.432 464 H GLY 61 H GLY 61 -29.777 6.977 -25.884 465 HA2 GLY 61 1HA GLY 61 -29.661 5.694 -23.334 466 HA3 GLY 61 2HA GLY 61 -30.329 5.014 -24.811 467 H HIS 62 H HIS 62 -27.613 5.666 -26.091 468 HA HIS 62 HA HIS 62 -26.427 3.095 -25.448 469 HB2 HIS 62 1HB HIS 62 -25.698 5.161 -27.535 470 HB3 HIS 62 2HB HIS 62 -24.930 3.585 -27.369 471 HD1 HIS 62 HD1 HIS 62 -26.529 4.569 -29.912 472 HD2 HIS 62 HD2 HIS 62 -27.988 2.076 -26.926 473 HE1 HIS 62 HE1 HIS 62 -28.408 3.277 -30.973 474 H GLN 63 H GLN 63 -25.546 6.522 -25.337 475 HA GLN 63 HA GLN 63 -22.901 6.194 -24.461 476 HB2 GLN 63 1HB GLN 63 -24.887 8.437 -24.220 477 HB3 GLN 63 2HB GLN 63 -23.293 8.556 -23.486 478 HG2 GLN 63 1HG GLN 63 -22.368 8.011 -25.792 479 HG3 GLN 63 2HG GLN 63 -23.995 8.332 -26.391 480 HE21 GLN 63 2HE2 GLN 63 -24.040 10.251 -27.303 481 HE22 GLN 63 1HE2 GLN 63 -23.318 11.692 -26.682 482 H GLU 64 H GLU 64 -25.949 6.340 -22.708 483 HA GLU 64 HA GLU 64 -24.707 6.391 -20.120 484 HB2 GLU 64 1HB GLU 64 -27.559 5.831 -20.951 485 HB3 GLU 64 2HB GLU 64 -27.020 5.997 -19.286 486 HG2 GLU 64 1HG GLU 64 -26.332 8.295 -19.732 487 HG3 GLU 64 2HG GLU 64 -26.865 8.130 -21.404 488 H LEU 65 H LEU 65 -25.771 3.952 -22.348 489 HA LEU 65 HA LEU 65 -26.095 1.779 -20.624 490 HB2 LEU 65 1HB LEU 65 -25.642 2.189 -23.484 491 HB3 LEU 65 2HB LEU 65 -25.028 0.652 -22.878 492 HG LEU 65 HG LEU 65 -27.874 1.607 -22.574 493 HD11 LEU 65 1HD1 LEU 65 -28.426 0.620 -24.510 494 HD12 LEU 65 2HD1 LEU 65 -27.287 -0.705 -24.279 495 HD13 LEU 65 3HD1 LEU 65 -26.723 0.842 -24.910 496 HD21 LEU 65 1HD2 LEU 65 -27.707 -1.162 -22.332 497 HD22 LEU 65 2HD2 LEU 65 -27.994 0.003 -21.039 498 HD23 LEU 65 3HD2 LEU 65 -26.352 -0.541 -21.389 499 H ILE 66 H ILE 66 -23.189 2.960 -22.286 500 HA ILE 66 HA ILE 66 -21.471 0.940 -21.268 501 HB ILE 66 HB ILE 66 -20.715 3.689 -22.265 502 HG12 ILE 66 1HG1 ILE 66 -20.825 1.095 -23.813 503 HG13 ILE 66 2HG1 ILE 66 -22.088 2.320 -23.864 504 HG21 ILE 66 1HG2 ILE 66 -19.181 1.585 -21.135 505 HG22 ILE 66 2HG2 ILE 66 -18.781 1.699 -22.848 506 HG23 ILE 66 3HG2 ILE 66 -18.621 3.115 -21.809 507 HD11 ILE 66 1HD1 ILE 66 -20.881 3.698 -25.176 508 HD12 ILE 66 2HD1 ILE 66 -19.345 3.234 -24.444 509 HD13 ILE 66 3HD1 ILE 66 -20.105 2.184 -25.639 510 H LEU 67 H LEU 67 -22.187 4.261 -20.260 511 HA LEU 67 HA LEU 67 -20.300 4.461 -18.205 512 HB2 LEU 67 1HB LEU 67 -23.032 5.725 -18.373 513 HB3 LEU 67 2HB LEU 67 -21.727 6.236 -17.303 514 HG LEU 67 HG LEU 67 -21.356 6.244 -20.277 515 HD11 LEU 67 1HD1 LEU 67 -22.079 8.813 -19.123 516 HD12 LEU 67 2HD1 LEU 67 -23.399 7.645 -19.080 517 HD13 LEU 67 3HD1 LEU 67 -22.625 8.044 -20.613 518 HD21 LEU 67 1HD2 LEU 67 -19.435 6.527 -18.707 519 HD22 LEU 67 2HD2 LEU 67 -20.206 7.998 -18.113 520 HD23 LEU 67 3HD2 LEU 67 -19.692 7.889 -19.797 521 H GLU 68 H GLU 68 -23.691 3.399 -18.101 522 HA GLU 68 HA GLU 68 -23.917 2.954 -15.373 523 HB2 GLU 68 1HB GLU 68 -25.768 2.839 -17.062 524 HB3 GLU 68 2HB GLU 68 -25.171 1.254 -17.532 525 HG2 GLU 68 1HG GLU 68 -26.651 0.502 -16.040 526 HG3 GLU 68 2HG GLU 68 -25.418 0.931 -14.857 527 H ALA 69 H ALA 69 -22.250 1.113 -17.794 528 HA ALA 69 HA ALA 69 -21.968 -1.241 -16.140 529 HB1 ALA 69 1HB ALA 69 -22.062 -1.133 -18.719 530 HB2 ALA 69 2HB ALA 69 -20.352 -0.714 -18.604 531 HB3 ALA 69 3HB ALA 69 -20.929 -2.248 -17.954 532 H VAL 70 H VAL 70 -20.197 1.671 -16.799 533 HA VAL 70 HA VAL 70 -17.667 0.753 -15.841 534 HB VAL 70 HB VAL 70 -18.703 3.575 -16.143 535 HG11 VAL 70 1HG1 VAL 70 -16.892 4.011 -14.868 536 HG12 VAL 70 2HG1 VAL 70 -16.132 2.459 -15.225 537 HG13 VAL 70 3HG1 VAL 70 -16.031 3.780 -16.389 538 HG21 VAL 70 1HG2 VAL 70 -17.523 1.618 -18.018 539 HG22 VAL 70 2HG2 VAL 70 -18.664 2.929 -18.316 540 HG23 VAL 70 3HG2 VAL 70 -16.945 3.280 -18.141 541 H ASP 71 H ASP 71 -20.440 2.370 -14.407 542 HA ASP 71 HA ASP 71 -19.359 3.207 -11.997 543 HB2 ASP 71 1HB ASP 71 -21.877 3.152 -13.097 544 HB3 ASP 71 2HB ASP 71 -22.037 2.038 -11.742 545 H LEU 72 H LEU 72 -20.153 0.002 -13.080 546 HA LEU 72 HA LEU 72 -20.021 -1.177 -10.451 547 HB2 LEU 72 1HB LEU 72 -20.483 -2.131 -13.217 548 HB3 LEU 72 2HB LEU 72 -19.829 -3.296 -12.068 549 HG LEU 72 HG LEU 72 -22.352 -1.740 -11.548 550 HD11 LEU 72 1HD1 LEU 72 -23.065 -4.349 -12.134 551 HD12 LEU 72 2HD1 LEU 72 -21.903 -3.928 -13.391 552 HD13 LEU 72 3HD1 LEU 72 -23.337 -2.930 -13.147 553 HD21 LEU 72 1HD2 LEU 72 -20.815 -3.150 -9.832 554 HD22 LEU 72 2HD2 LEU 72 -21.887 -4.420 -10.423 555 HD23 LEU 72 3HD2 LEU 72 -22.563 -2.972 -9.675 556 H LEU 73 H LEU 73 -17.853 -0.576 -13.106 557 HA LEU 73 HA LEU 73 -15.821 -2.410 -12.386 558 HB2 LEU 73 1HB LEU 73 -16.114 -0.128 -14.211 559 HB3 LEU 73 2HB LEU 73 -14.472 -0.410 -13.637 560 HG LEU 73 HG LEU 73 -16.177 -2.481 -15.018 561 HD11 LEU 73 1HD1 LEU 73 -15.758 -0.860 -16.660 562 HD12 LEU 73 2HD1 LEU 73 -14.500 -2.073 -16.889 563 HD13 LEU 73 3HD1 LEU 73 -14.124 -0.558 -16.069 564 HD21 LEU 73 1HD2 LEU 73 -13.729 -2.611 -13.538 565 HD22 LEU 73 2HD2 LEU 73 -13.425 -3.015 -15.228 566 HD23 LEU 73 3HD2 LEU 73 -14.636 -3.911 -14.310 567 H CYS 74 H CYS 74 -16.338 1.017 -11.635 568 HA CYS 74 HA CYS 74 -13.957 1.204 -10.041 569 HB2 CYS 74 1HB CYS 74 -15.203 3.092 -11.319 570 HB3 CYS 74 2HB CYS 74 -16.243 3.149 -9.902 571 HG CYS 74 HG CYS 74 -14.449 4.106 -8.171 572 H ALA 75 H ALA 75 -17.401 0.773 -9.432 573 HA ALA 75 HA ALA 75 -17.360 1.092 -6.644 574 HB1 ALA 75 1HB ALA 75 -19.456 -0.315 -6.717 575 HB2 ALA 75 2HB ALA 75 -19.459 1.128 -7.732 576 HB3 ALA 75 3HB ALA 75 -19.194 -0.458 -8.456 577 H LEU 76 H LEU 76 -16.445 -1.573 -8.687 578 HA LEU 76 HA LEU 76 -16.471 -3.565 -6.638 579 HB2 LEU 76 1HB LEU 76 -15.527 -3.379 -9.444 580 HB3 LEU 76 2HB LEU 76 -14.821 -4.635 -8.430 581 HG LEU 76 HG LEU 76 -17.786 -4.320 -8.866 582 HD11 LEU 76 1HD1 LEU 76 -17.654 -6.079 -10.491 583 HD12 LEU 76 2HD1 LEU 76 -15.914 -6.232 -10.250 584 HD13 LEU 76 3HD1 LEU 76 -16.576 -4.773 -10.985 585 HD21 LEU 76 1HD2 LEU 76 -16.353 -6.809 -8.035 586 HD22 LEU 76 2HD2 LEU 76 -18.033 -6.340 -7.770 587 HD23 LEU 76 3HD2 LEU 76 -16.745 -5.570 -6.842 588 H ASN 77 H ASN 77 -14.058 -1.382 -7.976 589 HA ASN 77 HA ASN 77 -12.020 -2.479 -6.185 590 HB2 ASN 77 1HB ASN 77 -11.979 -0.837 -8.664 591 HB3 ASN 77 2HB ASN 77 -10.686 -0.562 -7.501 592 HD21 ASN 77 2HD2 ASN 77 -11.737 -2.430 -10.060 593 HD22 ASN 77 1HD2 ASN 77 -10.589 -3.716 -9.936 594 H SER 78 H SER 78 -13.316 -1.599 -4.351 595 HA SER 78 HA SER 78 -12.295 1.034 -3.649 596 HB2 SER 78 1HB SER 78 -15.180 0.394 -4.040 597 HB3 SER 78 2HB SER 78 -14.748 1.430 -2.680 598 HG SER 78 HG SER 78 -13.768 1.930 -5.279 599 H GLY 79 H GLY 79 -12.899 1.545 -1.292 600 HA2 GLY 79 1HA GLY 79 -12.730 0.964 0.922 601 HA3 GLY 79 2HA GLY 79 -13.662 -0.466 0.504 602 HA PRO 80 HA PRO 80 -8.979 -1.623 -0.002 603 HB2 PRO 80 1HB PRO 80 -7.205 0.125 1.080 604 HB3 PRO 80 2HB PRO 80 -7.740 0.217 -0.602 605 HG2 PRO 80 1HG PRO 80 -8.675 1.784 1.771 606 HG3 PRO 80 2HG PRO 80 -8.325 2.346 0.126 607 HD2 PRO 80 1HD PRO 80 -10.845 1.885 1.003 608 HD3 PRO 80 2HD PRO 80 -10.360 1.632 -0.686 609 H SER 81 H SER 81 -9.847 -3.062 1.601 610 HA SER 81 HA SER 81 -9.974 -2.633 4.331 611 HB2 SER 81 1HB SER 81 -10.571 -4.728 2.771 612 HB3 SER 81 2HB SER 81 -9.042 -5.311 3.428 613 HG SER 81 HG SER 81 -11.389 -4.577 4.826 614 H SER 82 H SER 82 -8.578 -3.135 6.064 615 HA SER 82 HA SER 82 -5.793 -3.719 5.512 616 HB2 SER 82 1HB SER 82 -6.357 -1.116 5.411 617 HB3 SER 82 2HB SER 82 -6.222 -1.272 7.163 618 HG SER 82 HG SER 82 -4.272 -1.571 5.185 619 H GLY 83 H GLY 83 -4.529 -3.595 7.702 620 HA2 GLY 83 1HA GLY 83 -5.933 -3.903 10.133 621 HA3 GLY 83 2HA GLY 83 -5.640 -5.487 9.431 Start of MODEL 17 1 H1 GLY 1 H GLY 1 -9.677 13.671 -8.695 2 HA2 GLY 1 1HA GLY 1 -11.527 12.397 -8.218 3 HA3 GLY 1 2HA GLY 1 -10.737 11.085 -9.079 4 H SER 2 H SER 2 -8.441 10.898 -7.395 5 HA SER 2 HA SER 2 -9.113 10.597 -4.676 6 HB2 SER 2 1HB SER 2 -10.538 8.774 -5.728 7 HB3 SER 2 2HB SER 2 -9.031 7.964 -6.156 8 HG SER 2 HG SER 2 -9.707 8.736 -3.513 9 H SER 3 H SER 3 -7.469 9.049 -3.569 10 HA SER 3 HA SER 3 -4.898 9.176 -4.997 11 HB2 SER 3 1HB SER 3 -3.792 9.870 -2.923 12 HB3 SER 3 2HB SER 3 -5.039 11.033 -3.376 13 HG SER 3 HG SER 3 -5.031 10.403 -1.118 14 H GLY 4 H GLY 4 -6.796 6.969 -4.556 15 HA2 GLY 4 1HA GLY 4 -5.244 5.244 -2.745 16 HA3 GLY 4 2HA GLY 4 -6.886 4.933 -3.290 17 H SER 5 H SER 5 -6.215 2.810 -3.887 18 HA SER 5 HA SER 5 -4.457 2.685 -6.240 19 HB2 SER 5 1HB SER 5 -5.218 0.665 -4.145 20 HB3 SER 5 2HB SER 5 -4.566 0.150 -5.700 21 HG SER 5 HG SER 5 -2.708 1.350 -5.271 22 H SER 6 H SER 6 -5.096 1.574 -8.100 23 HA SER 6 HA SER 6 -7.655 0.338 -8.349 24 HB2 SER 6 1HB SER 6 -8.599 1.988 -9.968 25 HB3 SER 6 2HB SER 6 -8.463 2.623 -8.328 26 HG SER 6 HG SER 6 -7.491 4.194 -9.369 27 H GLY 7 H GLY 7 -7.719 -0.972 -10.103 28 HA2 GLY 7 1HA GLY 7 -5.307 -1.112 -11.719 29 HA3 GLY 7 2HA GLY 7 -6.611 -2.290 -11.684 30 H VAL 8 H VAL 8 -8.769 -0.559 -12.212 31 HA VAL 8 HA VAL 8 -8.820 -0.552 -14.991 32 HB VAL 8 HB VAL 8 -10.459 1.244 -13.199 33 HG11 VAL 8 1HG1 VAL 8 -10.619 1.818 -15.555 34 HG12 VAL 8 2HG1 VAL 8 -10.990 0.140 -15.956 35 HG13 VAL 8 3HG1 VAL 8 -12.124 1.090 -14.995 36 HG21 VAL 8 1HG2 VAL 8 -11.947 -1.010 -13.932 37 HG22 VAL 8 2HG2 VAL 8 -10.381 -1.624 -13.402 38 HG23 VAL 8 3HG2 VAL 8 -11.337 -0.604 -12.327 39 H SER 9 H SER 9 -7.545 1.786 -12.783 40 HA SER 9 HA SER 9 -7.560 4.019 -14.550 41 HB2 SER 9 1HB SER 9 -5.935 4.997 -12.925 42 HB3 SER 9 2HB SER 9 -7.400 4.382 -12.159 43 HG SER 9 HG SER 9 -5.506 3.734 -11.046 44 H LYS 10 H LYS 10 -5.458 1.302 -14.081 45 HA LYS 10 HA LYS 10 -3.480 2.483 -15.912 46 HB2 LYS 10 1HB LYS 10 -3.148 0.073 -14.118 47 HB3 LYS 10 2HB LYS 10 -1.890 0.864 -15.059 48 HG2 LYS 10 1HG LYS 10 -2.921 2.901 -13.505 49 HG3 LYS 10 2HG LYS 10 -2.922 1.502 -12.429 50 HD2 LYS 10 1HD LYS 10 -0.643 1.301 -12.464 51 HD3 LYS 10 2HD LYS 10 -0.498 1.999 -14.079 52 HE2 LYS 10 1HE LYS 10 0.352 3.703 -12.800 53 HE3 LYS 10 2HE LYS 10 -1.346 4.169 -12.876 54 HZ1 LYS 10 1HZ LYS 10 -1.506 3.999 -10.687 55 HZ2 LYS 10 2HZ LYS 10 0.164 3.745 -10.607 56 HZ3 LYS 10 3HZ LYS 10 -0.889 2.423 -10.691 57 H TRP 11 H TRP 11 -6.099 1.167 -16.563 58 HA TRP 11 HA TRP 11 -5.497 -1.359 -17.749 59 HB2 TRP 11 1HB TRP 11 -7.824 0.430 -17.558 60 HB3 TRP 11 2HB TRP 11 -7.747 -0.500 -19.052 61 HD1 TRP 11 HD1 TRP 11 -6.450 -2.053 -15.819 62 HE1 TRP 11 HE1 TRP 11 -8.007 -3.988 -15.146 63 HE3 TRP 11 HE3 TRP 11 -10.180 -1.320 -19.237 64 HZ2 TRP 11 HZ2 TRP 11 -10.489 -5.063 -15.957 65 HZ3 TRP 11 HZ3 TRP 11 -12.111 -2.846 -19.222 66 HH2 TRP 11 HH2 TRP 11 -12.259 -4.678 -17.615 67 H SER 12 H SER 12 -4.690 -1.816 -19.700 68 HA SER 12 HA SER 12 -3.495 0.163 -21.295 69 HB2 SER 12 1HB SER 12 -4.048 -2.275 -22.773 70 HB3 SER 12 2HB SER 12 -2.500 -1.605 -22.259 71 HG SER 12 HG SER 12 -2.690 -2.654 -20.326 72 HA PRO 13 HA PRO 13 -6.609 1.537 -24.061 73 HB2 PRO 13 1HB PRO 13 -5.277 1.683 -26.422 74 HB3 PRO 13 2HB PRO 13 -5.000 2.813 -25.092 75 HG2 PRO 13 1HG PRO 13 -3.415 0.402 -25.891 76 HG3 PRO 13 2HG PRO 13 -2.840 2.005 -25.394 77 HD2 PRO 13 1HD PRO 13 -2.875 -0.117 -23.712 78 HD3 PRO 13 2HD PRO 13 -3.124 1.550 -23.152 79 H SER 14 H SER 14 -5.000 -1.460 -24.708 80 HA SER 14 HA SER 14 -6.919 -2.207 -26.777 81 HB2 SER 14 1HB SER 14 -4.238 -2.825 -26.374 82 HB3 SER 14 2HB SER 14 -5.085 -4.307 -25.931 83 HG SER 14 HG SER 14 -4.561 -4.147 -28.191 84 H GLN 15 H GLN 15 -6.236 -2.733 -23.424 85 HA GLN 15 HA GLN 15 -7.670 -5.139 -23.057 86 HB2 GLN 15 1HB GLN 15 -6.763 -2.935 -21.241 87 HB3 GLN 15 2HB GLN 15 -7.850 -4.174 -20.630 88 HG2 GLN 15 1HG GLN 15 -5.349 -4.968 -22.046 89 HG3 GLN 15 2HG GLN 15 -5.282 -4.440 -20.366 90 HE21 GLN 15 2HE2 GLN 15 -6.374 -6.887 -22.565 91 HE22 GLN 15 1HE2 GLN 15 -6.789 -8.067 -21.372 92 H VAL 16 H VAL 16 -8.613 -1.734 -22.713 93 HA VAL 16 HA VAL 16 -11.174 -2.035 -21.734 94 HB VAL 16 HB VAL 16 -10.244 -0.004 -23.769 95 HG11 VAL 16 1HG1 VAL 16 -12.819 -0.488 -22.598 96 HG12 VAL 16 2HG1 VAL 16 -12.202 1.084 -22.084 97 HG13 VAL 16 3HG1 VAL 16 -12.346 0.711 -23.802 98 HG21 VAL 16 1HG2 VAL 16 -8.878 -0.031 -21.739 99 HG22 VAL 16 2HG2 VAL 16 -9.842 1.441 -21.845 100 HG23 VAL 16 3HG2 VAL 16 -10.332 0.143 -20.757 101 H VAL 17 H VAL 17 -9.989 -2.520 -24.995 102 HA VAL 17 HA VAL 17 -12.445 -2.566 -26.355 103 HB VAL 17 HB VAL 17 -9.999 -4.201 -27.034 104 HG11 VAL 17 1HG1 VAL 17 -12.039 -3.045 -28.914 105 HG12 VAL 17 2HG1 VAL 17 -10.818 -4.276 -29.241 106 HG13 VAL 17 3HG1 VAL 17 -12.203 -4.655 -28.215 107 HG21 VAL 17 1HG2 VAL 17 -9.357 -2.272 -28.448 108 HG22 VAL 17 2HG2 VAL 17 -10.668 -1.341 -27.723 109 HG23 VAL 17 3HG2 VAL 17 -9.329 -1.905 -26.723 110 H ASP 18 H ASP 18 -10.709 -5.054 -24.570 111 HA ASP 18 HA ASP 18 -12.379 -7.215 -25.366 112 HB2 ASP 18 1HB ASP 18 -10.048 -7.418 -24.419 113 HB3 ASP 18 2HB ASP 18 -10.730 -7.036 -22.841 114 H TRP 19 H TRP 19 -12.614 -4.742 -22.953 115 HA TRP 19 HA TRP 19 -14.487 -6.037 -21.255 116 HB2 TRP 19 1HB TRP 19 -13.217 -4.173 -20.404 117 HB3 TRP 19 2HB TRP 19 -13.838 -3.114 -21.668 118 HD1 TRP 19 HD1 TRP 19 -15.406 -5.258 -18.820 119 HE1 TRP 19 HE1 TRP 19 -17.304 -3.880 -17.760 120 HE3 TRP 19 HE3 TRP 19 -15.133 -1.092 -21.772 121 HZ2 TRP 19 HZ2 TRP 19 -18.524 -1.361 -18.126 122 HZ3 TRP 19 HZ3 TRP 19 -16.702 0.756 -21.351 123 HH2 TRP 19 HH2 TRP 19 -18.362 0.622 -19.566 124 H MET 20 H MET 20 -14.815 -3.766 -23.959 125 HA MET 20 HA MET 20 -17.610 -3.473 -23.816 126 HB2 MET 20 1HB MET 20 -15.837 -3.275 -26.257 127 HB3 MET 20 2HB MET 20 -17.459 -2.615 -26.099 128 HG2 MET 20 1HG MET 20 -15.535 -1.746 -24.054 129 HG3 MET 20 2HG MET 20 -15.200 -1.209 -25.698 130 HE1 MET 20 1HE MET 20 -18.695 0.108 -26.674 131 HE2 MET 20 2HE MET 20 -17.177 0.982 -26.883 132 HE3 MET 20 3HE MET 20 -17.242 -0.756 -27.176 133 H LYS 21 H LYS 21 -15.619 -6.028 -24.985 134 HA LYS 21 HA LYS 21 -17.433 -7.209 -26.809 135 HB2 LYS 21 1HB LYS 21 -15.180 -8.429 -25.204 136 HB3 LYS 21 2HB LYS 21 -16.041 -9.255 -26.497 137 HG2 LYS 21 1HG LYS 21 -15.314 -7.085 -27.844 138 HG3 LYS 21 2HG LYS 21 -14.028 -7.088 -26.634 139 HD2 LYS 21 1HD LYS 21 -13.617 -9.497 -27.234 140 HD3 LYS 21 2HD LYS 21 -14.730 -9.275 -28.585 141 HE2 LYS 21 1HE LYS 21 -13.299 -7.851 -29.701 142 HE3 LYS 21 2HE LYS 21 -12.458 -7.373 -28.227 143 HZ1 LYS 21 1HZ LYS 21 -12.245 -10.028 -29.541 144 HZ2 LYS 21 2HZ LYS 21 -11.417 -9.543 -28.148 145 HZ3 LYS 21 3HZ LYS 21 -11.089 -8.796 -29.630 146 H GLY 22 H GLY 22 -17.496 -6.935 -23.441 147 HA2 GLY 22 1HA GLY 22 -19.368 -9.213 -23.238 148 HA3 GLY 22 2HA GLY 22 -18.369 -8.647 -21.907 149 H LEU 23 H LEU 23 -19.826 -6.295 -23.971 150 HA LEU 23 HA LEU 23 -21.750 -5.664 -21.832 151 HB2 LEU 23 1HB LEU 23 -20.604 -3.757 -23.860 152 HB3 LEU 23 2HB LEU 23 -21.587 -3.356 -22.454 153 HG LEU 23 HG LEU 23 -18.747 -4.373 -22.440 154 HD11 LEU 23 1HD1 LEU 23 -19.904 -1.724 -21.584 155 HD12 LEU 23 2HD1 LEU 23 -19.028 -2.014 -23.087 156 HD13 LEU 23 3HD1 LEU 23 -18.206 -2.197 -21.538 157 HD21 LEU 23 1HD2 LEU 23 -20.779 -4.056 -20.283 158 HD22 LEU 23 2HD2 LEU 23 -19.089 -3.697 -19.928 159 HD23 LEU 23 3HD2 LEU 23 -19.549 -5.301 -20.501 160 H ASP 24 H ASP 24 -23.353 -3.871 -23.093 161 HA ASP 24 HA ASP 24 -25.237 -5.418 -24.387 162 HB2 ASP 24 1HB ASP 24 -25.043 -2.765 -23.590 163 HB3 ASP 24 2HB ASP 24 -25.277 -2.663 -25.333 164 H ASP 25 H ASP 25 -25.880 -5.656 -26.552 165 HA ASP 25 HA ASP 25 -23.767 -6.010 -28.397 166 HB2 ASP 25 1HB ASP 25 -26.641 -6.496 -28.313 167 HB3 ASP 25 2HB ASP 25 -26.092 -5.999 -29.910 168 H CYS 26 H CYS 26 -25.994 -3.399 -27.792 169 HA CYS 26 HA CYS 26 -25.651 -2.027 -30.246 170 HB2 CYS 26 1HB CYS 26 -26.723 -0.164 -29.172 171 HB3 CYS 26 2HB CYS 26 -27.515 -1.634 -28.619 172 HG CYS 26 HG CYS 26 -27.482 -0.588 -26.243 173 H LEU 27 H LEU 27 -23.701 -2.328 -27.427 174 HA LEU 27 HA LEU 27 -22.088 0.008 -28.114 175 HB2 LEU 27 1HB LEU 27 -21.533 -1.895 -25.866 176 HB3 LEU 27 2HB LEU 27 -21.066 -0.202 -26.020 177 HG LEU 27 HG LEU 27 -23.889 -1.172 -25.579 178 HD11 LEU 27 1HD1 LEU 27 -21.703 -0.879 -23.748 179 HD12 LEU 27 2HD1 LEU 27 -23.352 -1.424 -23.444 180 HD13 LEU 27 3HD1 LEU 27 -22.965 0.295 -23.378 181 HD21 LEU 27 1HD2 LEU 27 -23.904 0.935 -26.689 182 HD22 LEU 27 2HD2 LEU 27 -22.633 1.566 -25.641 183 HD23 LEU 27 3HD2 LEU 27 -24.237 1.238 -24.984 184 H GLN 28 H GLN 28 -22.238 -2.569 -29.687 185 HA GLN 28 HA GLN 28 -19.517 -3.580 -29.434 186 HB2 GLN 28 1HB GLN 28 -21.791 -4.422 -31.239 187 HB3 GLN 28 2HB GLN 28 -20.219 -5.209 -31.170 188 HG2 GLN 28 1HG GLN 28 -22.118 -4.975 -28.848 189 HG3 GLN 28 2HG GLN 28 -21.977 -6.384 -29.897 190 HE21 GLN 28 2HE2 GLN 28 -21.326 -5.606 -26.960 191 HE22 GLN 28 1HE2 GLN 28 -19.777 -6.330 -26.713 192 H GLN 29 H GLN 29 -21.582 -2.011 -31.859 193 HA GLN 29 HA GLN 29 -19.746 -1.865 -33.941 194 HB2 GLN 29 1HB GLN 29 -21.096 -0.035 -34.814 195 HB3 GLN 29 2HB GLN 29 -22.130 -1.308 -34.178 196 HG2 GLN 29 1HG GLN 29 -21.826 0.328 -32.010 197 HG3 GLN 29 2HG GLN 29 -21.849 1.473 -33.351 198 HE21 GLN 29 2HE2 GLN 29 -23.592 -1.291 -32.004 199 HE22 GLN 29 1HE2 GLN 29 -25.161 -0.773 -32.508 200 H TYR 30 H TYR 30 -19.925 -0.057 -30.993 201 HA TYR 30 HA TYR 30 -18.261 2.110 -31.857 202 HB2 TYR 30 1HB TYR 30 -18.913 1.215 -29.042 203 HB3 TYR 30 2HB TYR 30 -18.245 2.774 -29.512 204 HD1 TYR 30 HD2 TYR 30 -19.922 3.420 -31.865 205 HD2 TYR 30 HD1 TYR 30 -20.982 1.745 -28.100 206 HE1 TYR 30 HE2 TYR 30 -22.196 4.324 -32.110 207 HE2 TYR 30 HE1 TYR 30 -23.259 2.644 -28.335 208 HH TYR 30 HH TYR 30 -24.094 4.993 -30.504 209 H ILE 31 H ILE 31 -17.743 -1.058 -30.565 210 HA ILE 31 HA ILE 31 -15.261 -0.859 -29.378 211 HB ILE 31 HB ILE 31 -16.213 -3.114 -31.148 212 HG12 ILE 31 1HG1 ILE 31 -16.491 -2.714 -28.161 213 HG13 ILE 31 2HG1 ILE 31 -17.794 -2.571 -29.336 214 HG21 ILE 31 1HG2 ILE 31 -14.081 -3.013 -29.019 215 HG22 ILE 31 2HG2 ILE 31 -14.680 -4.490 -29.773 216 HG23 ILE 31 3HG2 ILE 31 -13.844 -3.280 -30.746 217 HD11 ILE 31 1HD1 ILE 31 -17.305 -4.981 -29.946 218 HD12 ILE 31 2HD1 ILE 31 -16.316 -5.034 -28.486 219 HD13 ILE 31 3HD1 ILE 31 -18.041 -4.687 -28.370 220 H LYS 32 H LYS 32 -16.005 -1.281 -32.824 221 HA LYS 32 HA LYS 32 -13.419 -1.529 -33.802 222 HB2 LYS 32 1HB LYS 32 -15.760 -0.137 -35.118 223 HB3 LYS 32 2HB LYS 32 -14.317 -0.715 -35.941 224 HG2 LYS 32 1HG LYS 32 -16.094 -2.560 -34.382 225 HG3 LYS 32 2HG LYS 32 -16.409 -2.158 -36.072 226 HD2 LYS 32 1HD LYS 32 -14.514 -3.243 -36.820 227 HD3 LYS 32 2HD LYS 32 -13.689 -3.096 -35.267 228 HE2 LYS 32 1HE LYS 32 -15.777 -4.630 -34.544 229 HE3 LYS 32 2HE LYS 32 -15.600 -5.134 -36.224 230 HZ1 LYS 32 1HZ LYS 32 -14.191 -6.569 -35.161 231 HZ2 LYS 32 2HZ LYS 32 -13.726 -5.446 -33.986 232 HZ3 LYS 32 3HZ LYS 32 -13.110 -5.329 -35.557 233 H ASN 33 H ASN 33 -15.105 1.278 -32.640 234 HA ASN 33 HA ASN 33 -13.154 3.125 -33.737 235 HB2 ASN 33 1HB ASN 33 -15.645 3.447 -32.078 236 HB3 ASN 33 2HB ASN 33 -14.531 4.789 -32.321 237 HD21 ASN 33 2HD2 ASN 33 -17.256 4.622 -33.165 238 HD22 ASN 33 1HD2 ASN 33 -17.264 4.747 -34.888 239 H PHE 34 H PHE 34 -13.828 1.472 -30.756 240 HA PHE 34 HA PHE 34 -12.176 3.122 -29.103 241 HB2 PHE 34 1HB PHE 34 -13.633 0.544 -28.781 242 HB3 PHE 34 2HB PHE 34 -12.328 0.893 -27.652 243 HD1 PHE 34 HD2 PHE 34 -15.137 2.811 -29.198 244 HD2 PHE 34 HD1 PHE 34 -13.031 1.749 -25.655 245 HE1 PHE 34 HE2 PHE 34 -16.664 4.214 -27.874 246 HE2 PHE 34 HE1 PHE 34 -14.555 3.150 -24.325 247 HZ PHE 34 HZ PHE 34 -16.373 4.386 -25.435 248 H GLU 35 H GLU 35 -11.654 0.405 -31.186 249 HA GLU 35 HA GLU 35 -9.170 -0.433 -30.068 250 HB2 GLU 35 1HB GLU 35 -10.905 -1.265 -32.180 251 HB3 GLU 35 2HB GLU 35 -9.280 -1.098 -32.830 252 HG2 GLU 35 1HG GLU 35 -9.949 -2.685 -30.365 253 HG3 GLU 35 2HG GLU 35 -9.835 -3.370 -31.986 254 H ARG 36 H ARG 36 -10.075 1.675 -32.767 255 HA ARG 36 HA ARG 36 -7.351 2.231 -33.484 256 HB2 ARG 36 1HB ARG 36 -9.452 2.310 -34.991 257 HB3 ARG 36 2HB ARG 36 -9.712 3.904 -34.295 258 HG2 ARG 36 1HG ARG 36 -7.069 3.979 -35.057 259 HG3 ARG 36 2HG ARG 36 -7.839 3.042 -36.339 260 HD2 ARG 36 1HD ARG 36 -9.603 4.896 -36.377 261 HD3 ARG 36 2HD ARG 36 -8.453 5.837 -35.428 262 HE ARG 36 HE ARG 36 -8.333 5.307 -38.224 263 HH11 ARG 36 1HH1 ARG 36 -6.374 5.816 -35.391 264 HH12 ARG 36 2HH1 ARG 36 -5.014 6.417 -36.280 265 HH21 ARG 36 1HH2 ARG 36 -6.548 6.097 -39.405 266 HH22 ARG 36 2HH2 ARG 36 -5.114 6.578 -38.563 267 H GLU 37 H GLU 37 -9.803 3.722 -31.480 268 HA GLU 37 HA GLU 37 -8.405 6.201 -31.150 269 HB2 GLU 37 1HB GLU 37 -10.809 4.932 -29.899 270 HB3 GLU 37 2HB GLU 37 -10.070 6.325 -29.122 271 HG2 GLU 37 1HG GLU 37 -10.398 6.837 -31.919 272 HG3 GLU 37 2HG GLU 37 -11.925 6.304 -31.220 273 H LYS 38 H LYS 38 -8.232 3.087 -29.718 274 HA LYS 38 HA LYS 38 -6.971 2.205 -28.043 275 HB2 LYS 38 1HB LYS 38 -5.396 4.757 -28.434 276 HB3 LYS 38 2HB LYS 38 -4.847 3.370 -27.502 277 HG2 LYS 38 1HG LYS 38 -5.656 2.570 -30.148 278 HG3 LYS 38 2HG LYS 38 -4.443 3.851 -30.213 279 HD2 LYS 38 1HD LYS 38 -3.236 2.389 -28.409 280 HD3 LYS 38 2HD LYS 38 -4.245 1.099 -29.066 281 HE2 LYS 38 1HE LYS 38 -3.063 0.984 -30.973 282 HE3 LYS 38 2HE LYS 38 -2.906 2.736 -31.094 283 HZ1 LYS 38 1HZ LYS 38 -0.893 1.061 -30.505 284 HZ2 LYS 38 2HZ LYS 38 -1.375 1.542 -28.957 285 HZ3 LYS 38 3HZ LYS 38 -0.918 2.703 -30.099 286 H ILE 39 H ILE 39 -9.274 3.474 -27.206 287 HA ILE 39 HA ILE 39 -9.036 5.409 -25.230 288 HB ILE 39 HB ILE 39 -10.978 3.096 -25.293 289 HG12 ILE 39 1HG1 ILE 39 -11.075 4.410 -27.342 290 HG13 ILE 39 2HG1 ILE 39 -12.502 4.728 -26.361 291 HG21 ILE 39 1HG2 ILE 39 -10.678 5.436 -23.528 292 HG22 ILE 39 2HG2 ILE 39 -12.312 5.106 -24.100 293 HG23 ILE 39 3HG2 ILE 39 -11.420 3.866 -23.219 294 HD11 ILE 39 1HD1 ILE 39 -11.320 6.782 -25.519 295 HD12 ILE 39 2HD1 ILE 39 -10.112 6.494 -26.773 296 HD13 ILE 39 3HD1 ILE 39 -11.790 6.801 -27.219 297 H SER 40 H SER 40 -7.654 5.348 -23.582 298 HA SER 40 HA SER 40 -6.884 2.857 -22.341 299 HB2 SER 40 1HB SER 40 -5.710 4.687 -20.770 300 HB3 SER 40 2HB SER 40 -5.041 4.213 -22.331 301 HG SER 40 HG SER 40 -5.179 6.487 -22.109 302 H GLY 41 H GLY 41 -7.043 2.463 -20.040 303 HA2 GLY 41 1HA GLY 41 -9.615 2.643 -19.028 304 HA3 GLY 41 2HA GLY 41 -8.187 2.331 -18.054 305 H ASP 42 H ASP 42 -6.839 4.742 -18.339 306 HA ASP 42 HA ASP 42 -7.919 6.297 -16.331 307 HB2 ASP 42 1HB ASP 42 -5.569 6.421 -17.146 308 HB3 ASP 42 2HB ASP 42 -6.141 7.289 -18.568 309 H GLN 43 H GLN 43 -8.583 6.345 -19.752 310 HA GLN 43 HA GLN 43 -10.106 8.817 -19.560 311 HB2 GLN 43 1HB GLN 43 -9.452 6.976 -21.858 312 HB3 GLN 43 2HB GLN 43 -10.540 8.349 -22.019 313 HG2 GLN 43 1HG GLN 43 -8.712 9.837 -21.289 314 HG3 GLN 43 2HG GLN 43 -7.633 8.444 -21.249 315 HE21 GLN 43 2HE2 GLN 43 -9.788 10.252 -23.388 316 HE22 GLN 43 1HE2 GLN 43 -8.875 9.981 -24.829 317 H LEU 44 H LEU 44 -10.610 5.388 -19.603 318 HA LEU 44 HA LEU 44 -13.371 5.446 -20.310 319 HB2 LEU 44 1HB LEU 44 -11.993 3.453 -20.601 320 HB3 LEU 44 2HB LEU 44 -11.768 3.346 -18.856 321 HG LEU 44 HG LEU 44 -14.322 3.091 -18.743 322 HD11 LEU 44 1HD1 LEU 44 -13.807 2.772 -21.674 323 HD12 LEU 44 2HD1 LEU 44 -15.090 3.662 -20.855 324 HD13 LEU 44 3HD1 LEU 44 -15.123 1.900 -20.887 325 HD21 LEU 44 1HD2 LEU 44 -12.389 1.043 -19.766 326 HD22 LEU 44 2HD2 LEU 44 -14.077 0.628 -19.468 327 HD23 LEU 44 3HD2 LEU 44 -13.069 1.225 -18.149 328 H LEU 45 H LEU 45 -11.606 5.322 -17.244 329 HA LEU 45 HA LEU 45 -13.853 5.056 -15.566 330 HB2 LEU 45 1HB LEU 45 -11.070 6.087 -15.144 331 HB3 LEU 45 2HB LEU 45 -12.264 6.122 -13.849 332 HG LEU 45 HG LEU 45 -11.784 3.527 -15.214 333 HD11 LEU 45 1HD1 LEU 45 -9.824 4.888 -13.390 334 HD12 LEU 45 2HD1 LEU 45 -9.528 4.131 -14.955 335 HD13 LEU 45 3HD1 LEU 45 -9.908 3.133 -13.552 336 HD21 LEU 45 1HD2 LEU 45 -11.798 3.178 -12.492 337 HD22 LEU 45 2HD2 LEU 45 -13.197 3.031 -13.556 338 HD23 LEU 45 3HD2 LEU 45 -12.885 4.550 -12.715 339 H ARG 46 H ARG 46 -12.250 7.856 -16.960 340 HA ARG 46 HA ARG 46 -14.220 9.608 -15.655 341 HB2 ARG 46 1HB ARG 46 -12.707 11.441 -16.058 342 HB3 ARG 46 2HB ARG 46 -11.819 10.136 -15.283 343 HG2 ARG 46 1HG ARG 46 -10.330 10.216 -16.913 344 HG3 ARG 46 2HG ARG 46 -11.583 9.737 -18.059 345 HD2 ARG 46 1HD ARG 46 -11.096 11.709 -19.030 346 HD3 ARG 46 2HD ARG 46 -12.150 12.362 -17.777 347 HE ARG 46 HE ARG 46 -9.396 12.154 -16.980 348 HH11 ARG 46 1HH1 ARG 46 -11.775 14.134 -18.575 349 HH12 ARG 46 2HH1 ARG 46 -10.923 15.615 -18.291 350 HH21 ARG 46 1HH2 ARG 46 -8.265 14.098 -16.599 351 HH22 ARG 46 2HH2 ARG 46 -8.926 15.594 -17.167 352 H ILE 47 H ILE 47 -14.692 7.919 -18.029 353 HA ILE 47 HA ILE 47 -14.695 9.508 -20.369 354 HB ILE 47 HB ILE 47 -14.887 7.048 -20.413 355 HG12 ILE 47 1HG1 ILE 47 -17.351 7.513 -21.787 356 HG13 ILE 47 2HG1 ILE 47 -16.332 8.936 -21.971 357 HG21 ILE 47 1HG2 ILE 47 -17.779 7.288 -19.698 358 HG22 ILE 47 2HG2 ILE 47 -16.732 5.870 -19.668 359 HG23 ILE 47 3HG2 ILE 47 -16.563 7.117 -18.432 360 HD11 ILE 47 1HD1 ILE 47 -14.578 7.631 -22.929 361 HD12 ILE 47 2HD1 ILE 47 -15.437 6.132 -22.577 362 HD13 ILE 47 3HD1 ILE 47 -16.080 7.256 -23.774 363 H THR 48 H THR 48 -16.092 10.984 -21.119 364 HA THR 48 HA THR 48 -18.618 11.374 -19.650 365 HB THR 48 HB THR 48 -16.957 13.138 -19.090 366 HG1 THR 48 HG1 THR 48 -18.425 14.850 -19.488 367 HG21 THR 48 1HG2 THR 48 -15.823 14.324 -20.628 368 HG22 THR 48 2HG2 THR 48 -17.234 14.494 -21.673 369 HG23 THR 48 3HG2 THR 48 -16.263 13.023 -21.734 370 H HIS 49 H HIS 49 -20.190 12.755 -20.942 371 HA HIS 49 HA HIS 49 -20.897 11.476 -23.292 372 HB2 HIS 49 1HB HIS 49 -21.634 14.132 -22.109 373 HB3 HIS 49 2HB HIS 49 -22.232 13.683 -23.703 374 HD1 HIS 49 HD1 HIS 49 -23.304 13.654 -20.369 375 HD2 HIS 49 HD2 HIS 49 -23.446 10.856 -23.437 376 HE1 HIS 49 HE1 HIS 49 -25.125 12.044 -19.726 377 H GLN 50 H GLN 50 -18.830 14.266 -22.806 378 HA GLN 50 HA GLN 50 -18.695 15.104 -25.500 379 HB2 GLN 50 1HB GLN 50 -17.691 16.003 -23.072 380 HB3 GLN 50 2HB GLN 50 -16.253 15.576 -23.988 381 HG2 GLN 50 1HG GLN 50 -16.889 17.931 -24.254 382 HG3 GLN 50 2HG GLN 50 -16.897 17.046 -25.779 383 HE21 GLN 50 2HE2 GLN 50 -18.233 18.815 -26.522 384 HE22 GLN 50 1HE2 GLN 50 -19.931 18.787 -26.206 385 H GLU 51 H GLU 51 -16.874 12.751 -23.627 386 HA GLU 51 HA GLU 51 -14.882 12.296 -25.618 387 HB2 GLU 51 1HB GLU 51 -15.747 10.620 -23.257 388 HB3 GLU 51 2HB GLU 51 -14.345 10.276 -24.259 389 HG2 GLU 51 1HG GLU 51 -14.443 12.994 -23.159 390 HG3 GLU 51 2HG GLU 51 -14.285 11.705 -21.967 391 H LEU 52 H LEU 52 -17.718 10.419 -24.558 392 HA LEU 52 HA LEU 52 -17.537 8.332 -26.366 393 HB2 LEU 52 1HB LEU 52 -19.898 9.665 -25.078 394 HB3 LEU 52 2HB LEU 52 -20.087 8.277 -26.147 395 HG LEU 52 HG LEU 52 -18.334 8.167 -23.710 396 HD11 LEU 52 1HD1 LEU 52 -20.827 6.862 -23.281 397 HD12 LEU 52 2HD1 LEU 52 -21.133 8.545 -23.709 398 HD13 LEU 52 3HD1 LEU 52 -20.080 8.159 -22.348 399 HD21 LEU 52 1HD2 LEU 52 -19.646 6.148 -25.510 400 HD22 LEU 52 2HD2 LEU 52 -18.994 5.729 -23.926 401 HD23 LEU 52 3HD2 LEU 52 -17.928 6.368 -25.177 402 H GLU 53 H GLU 53 -19.006 11.521 -26.779 403 HA GLU 53 HA GLU 53 -20.221 11.117 -29.256 404 HB2 GLU 53 1HB GLU 53 -20.133 13.191 -27.575 405 HB3 GLU 53 2HB GLU 53 -18.929 13.745 -28.730 406 HG2 GLU 53 1HG GLU 53 -21.053 12.868 -30.293 407 HG3 GLU 53 2HG GLU 53 -21.802 13.711 -28.938 408 H ASP 54 H ASP 54 -16.897 11.979 -28.450 409 HA ASP 54 HA ASP 54 -16.019 12.523 -31.072 410 HB2 ASP 54 1HB ASP 54 -14.831 13.074 -28.887 411 HB3 ASP 54 2HB ASP 54 -14.296 11.395 -28.867 412 H LEU 55 H LEU 55 -16.331 9.548 -29.242 413 HA LEU 55 HA LEU 55 -14.855 7.921 -31.057 414 HB2 LEU 55 1HB LEU 55 -16.829 7.318 -28.875 415 HB3 LEU 55 2HB LEU 55 -16.110 6.050 -29.865 416 HG LEU 55 HG LEU 55 -14.218 7.903 -28.556 417 HD11 LEU 55 1HD1 LEU 55 -16.162 6.237 -27.055 418 HD12 LEU 55 2HD1 LEU 55 -15.396 7.762 -26.613 419 HD13 LEU 55 3HD1 LEU 55 -14.487 6.255 -26.504 420 HD21 LEU 55 1HD2 LEU 55 -14.371 5.109 -29.471 421 HD22 LEU 55 2HD2 LEU 55 -13.421 5.383 -28.010 422 HD23 LEU 55 3HD2 LEU 55 -13.021 6.244 -29.497 423 H GLY 56 H GLY 56 -18.143 9.040 -30.894 424 HA2 GLY 56 1HA GLY 56 -19.137 9.000 -33.237 425 HA3 GLY 56 2HA GLY 56 -18.853 7.269 -33.145 426 H VAL 57 H VAL 57 -19.562 7.529 -30.164 427 HA VAL 57 HA VAL 57 -22.231 6.665 -30.381 428 HB VAL 57 HB VAL 57 -20.919 7.749 -27.887 429 HG11 VAL 57 1HG1 VAL 57 -23.437 7.241 -28.000 430 HG12 VAL 57 2HG1 VAL 57 -22.947 5.547 -28.054 431 HG13 VAL 57 3HG1 VAL 57 -22.506 6.550 -26.672 432 HG21 VAL 57 1HG2 VAL 57 -19.376 6.159 -28.520 433 HG22 VAL 57 2HG2 VAL 57 -20.496 5.190 -27.561 434 HG23 VAL 57 3HG2 VAL 57 -20.582 5.152 -29.322 435 H SER 58 H SER 58 -23.524 8.155 -31.417 436 HA SER 58 HA SER 58 -23.723 10.856 -30.342 437 HB2 SER 58 1HB SER 58 -25.364 11.153 -32.252 438 HB3 SER 58 2HB SER 58 -23.712 10.762 -32.729 439 HG SER 58 HG SER 58 -24.976 9.404 -33.888 440 H ARG 59 H ARG 59 -25.551 7.874 -30.501 441 HA ARG 59 HA ARG 59 -28.063 8.787 -29.721 442 HB2 ARG 59 1HB ARG 59 -26.695 6.246 -29.898 443 HB3 ARG 59 2HB ARG 59 -27.720 6.302 -28.470 444 HG2 ARG 59 1HG ARG 59 -29.293 5.587 -29.902 445 HG3 ARG 59 2HG ARG 59 -29.416 7.301 -30.303 446 HD2 ARG 59 1HD ARG 59 -28.407 7.041 -32.320 447 HD3 ARG 59 2HD ARG 59 -27.365 5.737 -31.750 448 HE ARG 59 HE ARG 59 -30.117 4.968 -31.913 449 HH11 ARG 59 1HH1 ARG 59 -27.179 5.377 -33.735 450 HH12 ARG 59 2HH1 ARG 59 -27.619 4.225 -34.952 451 HH21 ARG 59 1HH2 ARG 59 -30.708 3.449 -33.509 452 HH22 ARG 59 2HH2 ARG 59 -29.627 3.129 -34.822 453 H ILE 60 H ILE 60 -29.074 8.167 -27.531 454 HA ILE 60 HA ILE 60 -27.337 9.248 -25.415 455 HB ILE 60 HB ILE 60 -30.355 9.245 -25.544 456 HG12 ILE 60 1HG1 ILE 60 -29.346 10.757 -27.200 457 HG13 ILE 60 2HG1 ILE 60 -30.146 11.660 -25.917 458 HG21 ILE 60 1HG2 ILE 60 -29.516 9.153 -23.263 459 HG22 ILE 60 2HG2 ILE 60 -28.466 10.533 -23.579 460 HG23 ILE 60 3HG2 ILE 60 -30.218 10.734 -23.603 461 HD11 ILE 60 1HD1 ILE 60 -27.978 12.615 -26.600 462 HD12 ILE 60 2HD1 ILE 60 -28.035 12.167 -24.895 463 HD13 ILE 60 3HD1 ILE 60 -27.187 11.139 -26.049 464 H GLY 61 H GLY 61 -29.699 6.733 -26.169 465 HA2 GLY 61 1HA GLY 61 -29.749 5.547 -23.595 466 HA3 GLY 61 2HA GLY 61 -30.240 4.775 -25.096 467 H HIS 62 H HIS 62 -27.436 5.434 -26.140 468 HA HIS 62 HA HIS 62 -26.233 2.966 -25.169 469 HB2 HIS 62 1HB HIS 62 -25.238 4.789 -27.364 470 HB3 HIS 62 2HB HIS 62 -24.756 3.122 -27.064 471 HD1 HIS 62 HD1 HIS 62 -26.114 4.357 -29.717 472 HD2 HIS 62 HD2 HIS 62 -27.932 2.001 -26.818 473 HE1 HIS 62 HE1 HIS 62 -28.082 3.285 -30.859 474 H GLN 63 H GLN 63 -25.618 6.427 -25.222 475 HA GLN 63 HA GLN 63 -22.971 6.392 -24.294 476 HB2 GLN 63 1HB GLN 63 -25.169 8.440 -24.078 477 HB3 GLN 63 2HB GLN 63 -23.558 8.728 -23.434 478 HG2 GLN 63 1HG GLN 63 -22.597 8.462 -25.641 479 HG3 GLN 63 2HG GLN 63 -24.185 8.087 -26.307 480 HE21 GLN 63 2HE2 GLN 63 -22.099 10.328 -26.596 481 HE22 GLN 63 1HE2 GLN 63 -23.053 11.766 -26.525 482 H GLU 64 H GLU 64 -26.040 6.166 -22.616 483 HA GLU 64 HA GLU 64 -24.803 6.382 -20.005 484 HB2 GLU 64 1HB GLU 64 -27.596 6.097 -21.023 485 HB3 GLU 64 2HB GLU 64 -27.256 5.637 -19.360 486 HG2 GLU 64 1HG GLU 64 -26.193 8.249 -20.177 487 HG3 GLU 64 2HG GLU 64 -27.950 8.121 -20.149 488 H LEU 65 H LEU 65 -26.089 3.885 -22.113 489 HA LEU 65 HA LEU 65 -26.262 1.742 -20.384 490 HB2 LEU 65 1HB LEU 65 -25.827 2.095 -23.269 491 HB3 LEU 65 2HB LEU 65 -25.278 0.551 -22.618 492 HG LEU 65 HG LEU 65 -28.058 1.530 -22.077 493 HD11 LEU 65 1HD1 LEU 65 -27.022 1.047 -24.657 494 HD12 LEU 65 2HD1 LEU 65 -28.702 1.290 -24.182 495 HD13 LEU 65 3HD1 LEU 65 -28.026 -0.338 -24.229 496 HD21 LEU 65 1HD2 LEU 65 -27.016 -1.268 -22.437 497 HD22 LEU 65 2HD2 LEU 65 -28.533 -0.752 -21.700 498 HD23 LEU 65 3HD2 LEU 65 -27.002 -0.436 -20.882 499 H ILE 66 H ILE 66 -23.405 2.928 -22.123 500 HA ILE 66 HA ILE 66 -21.635 0.933 -21.186 501 HB ILE 66 HB ILE 66 -20.999 3.736 -22.114 502 HG12 ILE 66 1HG1 ILE 66 -20.876 1.153 -23.677 503 HG13 ILE 66 2HG1 ILE 66 -22.250 2.251 -23.728 504 HG21 ILE 66 1HG2 ILE 66 -19.111 2.931 -20.944 505 HG22 ILE 66 2HG2 ILE 66 -19.270 1.322 -21.646 506 HG23 ILE 66 3HG2 ILE 66 -18.767 2.677 -22.655 507 HD11 ILE 66 1HD1 ILE 66 -20.981 2.774 -25.613 508 HD12 ILE 66 2HD1 ILE 66 -20.579 4.032 -24.444 509 HD13 ILE 66 3HD1 ILE 66 -19.461 2.697 -24.722 510 H LEU 67 H LEU 67 -22.293 4.241 -20.067 511 HA LEU 67 HA LEU 67 -20.421 4.345 -18.006 512 HB2 LEU 67 1HB LEU 67 -23.151 5.620 -18.110 513 HB3 LEU 67 2HB LEU 67 -21.842 6.085 -17.026 514 HG LEU 67 HG LEU 67 -21.548 6.230 -20.013 515 HD11 LEU 67 1HD1 LEU 67 -22.666 8.165 -20.171 516 HD12 LEU 67 2HD1 LEU 67 -22.122 8.727 -18.591 517 HD13 LEU 67 3HD1 LEU 67 -23.488 7.618 -18.710 518 HD21 LEU 67 1HD2 LEU 67 -20.140 7.467 -17.658 519 HD22 LEU 67 2HD2 LEU 67 -19.918 8.023 -19.317 520 HD23 LEU 67 3HD2 LEU 67 -19.476 6.374 -18.873 521 H GLU 68 H GLU 68 -23.797 3.244 -17.941 522 HA GLU 68 HA GLU 68 -24.075 2.732 -15.244 523 HB2 GLU 68 1HB GLU 68 -25.907 2.552 -16.880 524 HB3 GLU 68 2HB GLU 68 -25.179 1.090 -17.530 525 HG2 GLU 68 1HG GLU 68 -26.460 -0.034 -16.116 526 HG3 GLU 68 2HG GLU 68 -25.406 0.557 -14.832 527 H ALA 69 H ALA 69 -22.316 0.935 -17.656 528 HA ALA 69 HA ALA 69 -21.944 -1.389 -15.988 529 HB1 ALA 69 1HB ALA 69 -22.022 -1.385 -18.525 530 HB2 ALA 69 2HB ALA 69 -20.386 -0.725 -18.471 531 HB3 ALA 69 3HB ALA 69 -20.721 -2.311 -17.776 532 H VAL 70 H VAL 70 -20.052 1.434 -16.951 533 HA VAL 70 HA VAL 70 -17.594 0.666 -15.839 534 HB VAL 70 HB VAL 70 -18.713 3.454 -16.162 535 HG11 VAL 70 1HG1 VAL 70 -15.942 3.508 -16.422 536 HG12 VAL 70 2HG1 VAL 70 -16.893 4.121 -15.068 537 HG13 VAL 70 3HG1 VAL 70 -16.245 2.481 -15.021 538 HG21 VAL 70 1HG2 VAL 70 -17.562 3.512 -18.270 539 HG22 VAL 70 2HG2 VAL 70 -16.877 1.911 -17.990 540 HG23 VAL 70 3HG2 VAL 70 -18.612 2.095 -18.242 541 H ASP 71 H ASP 71 -20.419 2.208 -14.423 542 HA ASP 71 HA ASP 71 -19.387 3.108 -12.021 543 HB2 ASP 71 1HB ASP 71 -21.881 2.974 -13.105 544 HB3 ASP 71 2HB ASP 71 -22.014 1.781 -11.816 545 H LEU 72 H LEU 72 -20.161 -0.155 -13.021 546 HA LEU 72 HA LEU 72 -19.936 -1.298 -10.404 547 HB2 LEU 72 1HB LEU 72 -20.175 -2.357 -13.182 548 HB3 LEU 72 2HB LEU 72 -19.662 -3.441 -11.890 549 HG LEU 72 HG LEU 72 -22.213 -1.855 -11.740 550 HD11 LEU 72 1HD1 LEU 72 -22.158 -3.303 -13.776 551 HD12 LEU 72 2HD1 LEU 72 -23.412 -3.721 -12.610 552 HD13 LEU 72 3HD1 LEU 72 -21.943 -4.692 -12.711 553 HD21 LEU 72 1HD2 LEU 72 -20.814 -3.410 -9.897 554 HD22 LEU 72 2HD2 LEU 72 -22.140 -4.433 -10.450 555 HD23 LEU 72 3HD2 LEU 72 -22.478 -2.842 -9.767 556 H LEU 73 H LEU 73 -17.767 -0.719 -13.091 557 HA LEU 73 HA LEU 73 -15.652 -2.391 -12.288 558 HB2 LEU 73 1HB LEU 73 -16.035 -0.155 -14.150 559 HB3 LEU 73 2HB LEU 73 -14.391 -0.328 -13.540 560 HG LEU 73 HG LEU 73 -15.952 -2.488 -14.956 561 HD11 LEU 73 1HD1 LEU 73 -15.481 -0.833 -16.567 562 HD12 LEU 73 2HD1 LEU 73 -14.224 -2.056 -16.752 563 HD13 LEU 73 3HD1 LEU 73 -13.867 -0.546 -15.914 564 HD21 LEU 73 1HD2 LEU 73 -14.327 -3.907 -14.414 565 HD22 LEU 73 2HD2 LEU 73 -13.784 -2.707 -13.240 566 HD23 LEU 73 3HD2 LEU 73 -13.072 -2.748 -14.853 567 H CYS 74 H CYS 74 -16.509 0.915 -11.429 568 HA CYS 74 HA CYS 74 -14.125 1.218 -9.795 569 HB2 CYS 74 1HB CYS 74 -15.850 2.994 -11.133 570 HB3 CYS 74 2HB CYS 74 -16.078 3.307 -9.416 571 HG CYS 74 HG CYS 74 -14.222 5.140 -10.394 572 H ALA 75 H ALA 75 -17.588 0.745 -9.408 573 HA ALA 75 HA ALA 75 -17.818 1.214 -6.668 574 HB1 ALA 75 1HB ALA 75 -19.345 -0.594 -8.521 575 HB2 ALA 75 2HB ALA 75 -19.773 -0.393 -6.821 576 HB3 ALA 75 3HB ALA 75 -19.809 0.994 -7.909 577 H LEU 76 H LEU 76 -16.564 -1.537 -8.411 578 HA LEU 76 HA LEU 76 -16.490 -3.220 -6.053 579 HB2 LEU 76 1HB LEU 76 -15.737 -3.547 -8.923 580 HB3 LEU 76 2HB LEU 76 -15.099 -4.670 -7.723 581 HG LEU 76 HG LEU 76 -18.049 -4.182 -8.005 582 HD11 LEU 76 1HD1 LEU 76 -16.560 -6.392 -9.392 583 HD12 LEU 76 2HD1 LEU 76 -16.972 -4.876 -10.193 584 HD13 LEU 76 3HD1 LEU 76 -18.250 -5.923 -9.574 585 HD21 LEU 76 1HD2 LEU 76 -16.437 -5.682 -6.251 586 HD22 LEU 76 2HD2 LEU 76 -17.247 -6.838 -7.309 587 HD23 LEU 76 3HD2 LEU 76 -18.196 -5.679 -6.376 588 H ASN 77 H ASN 77 -14.332 -1.188 -7.905 589 HA ASN 77 HA ASN 77 -12.046 -2.037 -6.285 590 HB2 ASN 77 1HB ASN 77 -12.297 -0.418 -8.813 591 HB3 ASN 77 2HB ASN 77 -10.799 -0.458 -7.887 592 HD21 ASN 77 2HD2 ASN 77 -12.721 -2.018 -10.188 593 HD22 ASN 77 1HD2 ASN 77 -11.782 -3.458 -10.355 594 H SER 78 H SER 78 -13.261 -0.976 -4.440 595 HA SER 78 HA SER 78 -12.224 1.733 -4.125 596 HB2 SER 78 1HB SER 78 -14.212 2.790 -3.891 597 HB3 SER 78 2HB SER 78 -14.856 1.424 -4.801 598 HG SER 78 HG SER 78 -15.622 0.544 -2.976 599 H GLY 79 H GLY 79 -11.569 2.199 -2.075 600 HA2 GLY 79 1HA GLY 79 -11.597 1.948 0.291 601 HA3 GLY 79 2HA GLY 79 -12.334 0.366 0.086 602 HA PRO 80 HA PRO 80 -7.734 -0.032 0.938 603 HB2 PRO 80 1HB PRO 80 -7.984 -1.513 3.199 604 HB3 PRO 80 2HB PRO 80 -7.948 0.254 3.207 605 HG2 PRO 80 1HG PRO 80 -10.299 -1.592 3.351 606 HG3 PRO 80 2HG PRO 80 -9.979 -0.114 4.277 607 HD2 PRO 80 1HD PRO 80 -11.648 -0.166 2.146 608 HD3 PRO 80 2HD PRO 80 -10.677 1.260 2.563 609 H SER 81 H SER 81 -10.422 -2.317 1.204 610 HA SER 81 HA SER 81 -10.696 -4.452 0.470 611 HB2 SER 81 1HB SER 81 -9.762 -3.333 -1.649 612 HB3 SER 81 2HB SER 81 -8.233 -4.106 -1.233 613 HG SER 81 HG SER 81 -10.703 -5.459 -1.593 614 H SER 82 H SER 82 -9.990 -4.928 2.724 615 HA SER 82 HA SER 82 -8.162 -7.078 2.748 616 HB2 SER 82 1HB SER 82 -6.826 -4.694 2.872 617 HB3 SER 82 2HB SER 82 -7.052 -5.060 4.582 618 HG SER 82 HG SER 82 -6.259 -7.275 3.813 619 H GLY 83 H GLY 83 -8.129 -8.194 4.753 620 HA2 GLY 83 1HA GLY 83 -9.114 -7.347 7.186 621 HA3 GLY 83 2HA GLY 83 -10.523 -7.869 6.274 Start of MODEL 18 1 H1 GLY 1 H GLY 1 -4.655 8.646 5.865 2 HA2 GLY 1 1HA GLY 1 -4.682 8.327 3.502 3 HA3 GLY 1 2HA GLY 1 -4.935 6.723 4.175 4 H SER 2 H SER 2 -5.802 7.077 1.688 5 HA SER 2 HA SER 2 -8.546 6.471 1.835 6 HB2 SER 2 1HB SER 2 -8.400 9.083 2.119 7 HB3 SER 2 2HB SER 2 -8.169 9.058 0.371 8 HG SER 2 HG SER 2 -10.313 9.125 0.545 9 H SER 3 H SER 3 -6.431 5.179 0.712 10 HA SER 3 HA SER 3 -6.889 5.502 -2.182 11 HB2 SER 3 1HB SER 3 -4.465 5.627 -0.835 12 HB3 SER 3 2HB SER 3 -4.498 3.985 -1.480 13 HG SER 3 HG SER 3 -3.671 5.830 -2.850 14 H GLY 4 H GLY 4 -6.518 3.418 -3.419 15 HA2 GLY 4 1HA GLY 4 -7.362 1.067 -1.860 16 HA3 GLY 4 2HA GLY 4 -8.280 1.546 -3.280 17 H SER 5 H SER 5 -7.810 0.449 -5.052 18 HA SER 5 HA SER 5 -5.148 -0.786 -5.270 19 HB2 SER 5 1HB SER 5 -6.625 -2.566 -5.391 20 HB3 SER 5 2HB SER 5 -7.873 -1.613 -6.193 21 HG SER 5 HG SER 5 -6.386 -3.263 -7.388 22 H SER 6 H SER 6 -7.648 0.882 -7.158 23 HA SER 6 HA SER 6 -7.535 2.199 -9.009 24 HB2 SER 6 1HB SER 6 -4.565 2.372 -8.461 25 HB3 SER 6 2HB SER 6 -5.547 3.510 -9.383 26 HG SER 6 HG SER 6 -4.988 3.830 -6.959 27 H GLY 7 H GLY 7 -7.818 -0.263 -9.744 28 HA2 GLY 7 1HA GLY 7 -5.630 -1.106 -11.480 29 HA3 GLY 7 2HA GLY 7 -7.098 -2.011 -11.141 30 H VAL 8 H VAL 8 -9.104 -0.388 -11.838 31 HA VAL 8 HA VAL 8 -9.187 -0.575 -14.628 32 HB VAL 8 HB VAL 8 -10.899 1.245 -12.933 33 HG11 VAL 8 1HG1 VAL 8 -12.565 0.910 -14.679 34 HG12 VAL 8 2HG1 VAL 8 -11.083 1.592 -15.352 35 HG13 VAL 8 3HG1 VAL 8 -11.445 -0.122 -15.567 36 HG21 VAL 8 1HG2 VAL 8 -10.979 -0.921 -11.929 37 HG22 VAL 8 2HG2 VAL 8 -12.465 -0.705 -12.855 38 HG23 VAL 8 3HG2 VAL 8 -11.161 -1.703 -13.499 39 H SER 9 H SER 9 -8.014 1.932 -12.551 40 HA SER 9 HA SER 9 -8.142 4.059 -14.449 41 HB2 SER 9 1HB SER 9 -6.055 4.294 -12.406 42 HB3 SER 9 2HB SER 9 -7.435 5.342 -12.733 43 HG SER 9 HG SER 9 -7.141 3.532 -10.794 44 H LYS 10 H LYS 10 -5.908 1.492 -13.796 45 HA LYS 10 HA LYS 10 -3.940 2.680 -15.627 46 HB2 LYS 10 1HB LYS 10 -3.555 0.289 -13.824 47 HB3 LYS 10 2HB LYS 10 -2.311 1.183 -14.688 48 HG2 LYS 10 1HG LYS 10 -3.613 3.080 -13.110 49 HG3 LYS 10 2HG LYS 10 -3.433 1.655 -12.084 50 HD2 LYS 10 1HD LYS 10 -0.987 1.748 -13.226 51 HD3 LYS 10 2HD LYS 10 -1.389 3.466 -13.195 52 HE2 LYS 10 1HE LYS 10 -2.117 2.860 -10.717 53 HE3 LYS 10 2HE LYS 10 -0.939 1.569 -10.952 54 HZ1 LYS 10 1HZ LYS 10 -0.361 4.444 -11.408 55 HZ2 LYS 10 2HZ LYS 10 0.749 3.169 -11.419 56 HZ3 LYS 10 3HZ LYS 10 -0.002 3.623 -9.973 57 H TRP 11 H TRP 11 -6.501 1.275 -16.319 58 HA TRP 11 HA TRP 11 -5.790 -1.253 -17.442 59 HB2 TRP 11 1HB TRP 11 -8.180 0.460 -17.335 60 HB3 TRP 11 2HB TRP 11 -8.038 -0.496 -18.808 61 HD1 TRP 11 HD1 TRP 11 -6.758 -1.944 -15.521 62 HE1 TRP 11 HE1 TRP 11 -8.265 -3.916 -14.840 63 HE3 TRP 11 HE3 TRP 11 -10.443 -1.396 -19.022 64 HZ2 TRP 11 HZ2 TRP 11 -10.694 -5.085 -15.677 65 HZ3 TRP 11 HZ3 TRP 11 -12.323 -2.983 -19.013 66 HH2 TRP 11 HH2 TRP 11 -12.444 -4.789 -17.375 67 H SER 12 H SER 12 -4.918 -1.713 -19.364 68 HA SER 12 HA SER 12 -3.732 0.254 -20.962 69 HB2 SER 12 1HB SER 12 -2.774 -1.494 -22.031 70 HB3 SER 12 2HB SER 12 -3.533 -2.472 -20.775 71 HG SER 12 HG SER 12 -4.041 -3.264 -22.843 72 HA PRO 13 HA PRO 13 -6.806 1.607 -23.783 73 HB2 PRO 13 1HB PRO 13 -5.439 1.745 -26.124 74 HB3 PRO 13 2HB PRO 13 -5.185 2.882 -24.795 75 HG2 PRO 13 1HG PRO 13 -3.581 0.472 -25.558 76 HG3 PRO 13 2HG PRO 13 -3.019 2.078 -25.060 77 HD2 PRO 13 1HD PRO 13 -3.075 -0.036 -23.368 78 HD3 PRO 13 2HD PRO 13 -3.336 1.632 -22.821 79 H SER 14 H SER 14 -5.161 -1.379 -24.419 80 HA SER 14 HA SER 14 -7.067 -2.144 -26.495 81 HB2 SER 14 1HB SER 14 -4.399 -3.053 -25.645 82 HB3 SER 14 2HB SER 14 -5.502 -4.353 -26.095 83 HG SER 14 HG SER 14 -5.882 -3.115 -28.062 84 H GLN 15 H GLN 15 -6.388 -2.668 -23.140 85 HA GLN 15 HA GLN 15 -7.792 -5.092 -22.783 86 HB2 GLN 15 1HB GLN 15 -6.959 -2.873 -20.941 87 HB3 GLN 15 2HB GLN 15 -7.974 -4.184 -20.356 88 HG2 GLN 15 1HG GLN 15 -5.637 -5.103 -21.834 89 HG3 GLN 15 2HG GLN 15 -5.239 -4.165 -20.395 90 HE21 GLN 15 2HE2 GLN 15 -5.577 -5.026 -18.408 91 HE22 GLN 15 1HE2 GLN 15 -6.133 -6.639 -18.139 92 H VAL 16 H VAL 16 -8.775 -1.700 -22.421 93 HA VAL 16 HA VAL 16 -11.335 -2.037 -21.453 94 HB VAL 16 HB VAL 16 -10.430 0.020 -23.473 95 HG11 VAL 16 1HG1 VAL 16 -12.702 0.288 -23.521 96 HG12 VAL 16 2HG1 VAL 16 -12.920 -0.314 -21.877 97 HG13 VAL 16 3HG1 VAL 16 -12.300 1.315 -22.146 98 HG21 VAL 16 1HG2 VAL 16 -10.524 0.171 -20.461 99 HG22 VAL 16 2HG2 VAL 16 -9.062 -0.037 -21.425 100 HG23 VAL 16 3HG2 VAL 16 -10.002 1.449 -21.559 101 H VAL 17 H VAL 17 -10.130 -2.508 -24.704 102 HA VAL 17 HA VAL 17 -12.578 -2.559 -26.080 103 HB VAL 17 HB VAL 17 -10.084 -4.134 -26.732 104 HG11 VAL 17 1HG1 VAL 17 -11.638 -3.171 -28.967 105 HG12 VAL 17 2HG1 VAL 17 -11.096 -4.809 -28.595 106 HG13 VAL 17 3HG1 VAL 17 -12.605 -4.202 -27.912 107 HG21 VAL 17 1HG2 VAL 17 -9.589 -1.762 -26.461 108 HG22 VAL 17 2HG2 VAL 17 -9.480 -2.236 -28.157 109 HG23 VAL 17 3HG2 VAL 17 -10.892 -1.352 -27.577 110 H ASP 18 H ASP 18 -10.796 -5.076 -24.363 111 HA ASP 18 HA ASP 18 -12.447 -7.236 -25.158 112 HB2 ASP 18 1HB ASP 18 -10.097 -7.306 -24.104 113 HB3 ASP 18 2HB ASP 18 -10.929 -7.136 -22.560 114 H TRP 19 H TRP 19 -12.732 -4.791 -22.715 115 HA TRP 19 HA TRP 19 -14.632 -6.120 -21.071 116 HB2 TRP 19 1HB TRP 19 -13.378 -4.273 -20.163 117 HB3 TRP 19 2HB TRP 19 -13.974 -3.190 -21.417 118 HD1 TRP 19 HD1 TRP 19 -15.560 -5.360 -18.603 119 HE1 TRP 19 HE1 TRP 19 -17.491 -4.009 -17.567 120 HE3 TRP 19 HE3 TRP 19 -15.317 -1.198 -21.561 121 HZ2 TRP 19 HZ2 TRP 19 -18.745 -1.510 -17.953 122 HZ3 TRP 19 HZ3 TRP 19 -16.919 0.627 -21.163 123 HH2 TRP 19 HH2 TRP 19 -18.597 0.472 -19.396 124 H MET 20 H MET 20 -14.912 -3.810 -23.746 125 HA MET 20 HA MET 20 -17.704 -3.498 -23.645 126 HB2 MET 20 1HB MET 20 -15.892 -3.308 -26.059 127 HB3 MET 20 2HB MET 20 -17.513 -2.638 -25.927 128 HG2 MET 20 1HG MET 20 -15.562 -1.798 -23.877 129 HG3 MET 20 2HG MET 20 -15.296 -1.213 -25.518 130 HE1 MET 20 1HE MET 20 -17.593 1.091 -26.468 131 HE2 MET 20 2HE MET 20 -17.146 -0.549 -26.937 132 HE3 MET 20 3HE MET 20 -18.794 -0.199 -26.412 133 H LYS 21 H LYS 21 -15.720 -6.066 -24.802 134 HA LYS 21 HA LYS 21 -17.525 -7.225 -26.650 135 HB2 LYS 21 1HB LYS 21 -15.297 -8.468 -25.029 136 HB3 LYS 21 2HB LYS 21 -16.152 -9.283 -26.331 137 HG2 LYS 21 1HG LYS 21 -15.408 -7.223 -27.740 138 HG3 LYS 21 2HG LYS 21 -14.204 -7.029 -26.464 139 HD2 LYS 21 1HD LYS 21 -13.539 -9.410 -26.840 140 HD3 LYS 21 2HD LYS 21 -14.624 -9.436 -28.232 141 HE2 LYS 21 1HE LYS 21 -13.146 -8.367 -29.517 142 HE3 LYS 21 2HE LYS 21 -12.842 -7.148 -28.280 143 HZ1 LYS 21 1HZ LYS 21 -10.926 -8.663 -29.000 144 HZ2 LYS 21 2HZ LYS 21 -11.674 -9.848 -28.053 145 HZ3 LYS 21 3HZ LYS 21 -11.154 -8.403 -27.343 146 H GLY 22 H GLY 22 -17.620 -6.964 -23.282 147 HA2 GLY 22 1HA GLY 22 -19.512 -9.228 -23.107 148 HA3 GLY 22 2HA GLY 22 -18.521 -8.677 -21.764 149 H LEU 23 H LEU 23 -19.934 -6.299 -23.827 150 HA LEU 23 HA LEU 23 -21.874 -5.663 -21.705 151 HB2 LEU 23 1HB LEU 23 -20.694 -3.758 -23.716 152 HB3 LEU 23 2HB LEU 23 -21.688 -3.354 -22.318 153 HG LEU 23 HG LEU 23 -18.856 -4.393 -22.279 154 HD11 LEU 23 1HD1 LEU 23 -18.163 -2.280 -21.931 155 HD12 LEU 23 2HD1 LEU 23 -19.601 -1.844 -21.008 156 HD13 LEU 23 3HD1 LEU 23 -19.659 -1.869 -22.770 157 HD21 LEU 23 1HD2 LEU 23 -19.263 -3.681 -19.762 158 HD22 LEU 23 2HD2 LEU 23 -19.624 -5.309 -20.339 159 HD23 LEU 23 3HD2 LEU 23 -20.922 -4.127 -20.162 160 H ASP 24 H ASP 24 -23.452 -3.853 -22.973 161 HA ASP 24 HA ASP 24 -25.336 -5.380 -24.289 162 HB2 ASP 24 1HB ASP 24 -25.161 -2.755 -23.454 163 HB3 ASP 24 2HB ASP 24 -25.308 -2.600 -25.202 164 H ASP 25 H ASP 25 -25.941 -5.647 -26.449 165 HA ASP 25 HA ASP 25 -23.822 -5.996 -28.280 166 HB2 ASP 25 1HB ASP 25 -26.638 -6.578 -28.167 167 HB3 ASP 25 2HB ASP 25 -26.233 -5.902 -29.742 168 H CYS 26 H CYS 26 -26.074 -3.386 -27.722 169 HA CYS 26 HA CYS 26 -25.681 -2.011 -30.162 170 HB2 CYS 26 1HB CYS 26 -26.754 -0.137 -29.094 171 HB3 CYS 26 2HB CYS 26 -27.571 -1.607 -28.579 172 HG CYS 26 HG CYS 26 -27.555 -0.743 -26.152 173 H LEU 27 H LEU 27 -23.770 -2.320 -27.319 174 HA LEU 27 HA LEU 27 -22.145 0.016 -27.977 175 HB2 LEU 27 1HB LEU 27 -21.655 -1.903 -25.723 176 HB3 LEU 27 2HB LEU 27 -21.128 -0.228 -25.872 177 HG LEU 27 HG LEU 27 -23.976 -1.127 -25.437 178 HD11 LEU 27 1HD1 LEU 27 -23.443 -1.306 -23.293 179 HD12 LEU 27 2HD1 LEU 27 -23.042 0.411 -23.290 180 HD13 LEU 27 3HD1 LEU 27 -21.788 -0.786 -23.614 181 HD21 LEU 27 1HD2 LEU 27 -24.237 1.337 -24.884 182 HD22 LEU 27 2HD2 LEU 27 -24.048 0.924 -26.588 183 HD23 LEU 27 3HD2 LEU 27 -22.681 1.574 -25.682 184 H GLN 28 H GLN 28 -22.279 -2.555 -29.560 185 HA GLN 28 HA GLN 28 -19.562 -3.571 -29.276 186 HB2 GLN 28 1HB GLN 28 -21.811 -4.404 -31.115 187 HB3 GLN 28 2HB GLN 28 -20.243 -5.194 -31.023 188 HG2 GLN 28 1HG GLN 28 -22.173 -4.959 -28.727 189 HG3 GLN 28 2HG GLN 28 -22.029 -6.365 -29.781 190 HE21 GLN 28 2HE2 GLN 28 -21.404 -5.594 -26.832 191 HE22 GLN 28 1HE2 GLN 28 -19.865 -6.332 -26.569 192 H GLN 29 H GLN 29 -21.592 -1.979 -31.713 193 HA GLN 29 HA GLN 29 -19.737 -1.833 -33.777 194 HB2 GLN 29 1HB GLN 29 -21.052 0.092 -34.595 195 HB3 GLN 29 2HB GLN 29 -22.067 -1.262 -34.118 196 HG2 GLN 29 1HG GLN 29 -22.135 0.038 -31.829 197 HG3 GLN 29 2HG GLN 29 -21.753 1.411 -32.867 198 HE21 GLN 29 2HE2 GLN 29 -24.211 -0.058 -31.415 199 HE22 GLN 29 1HE2 GLN 29 -25.493 0.279 -32.523 200 H TYR 30 H TYR 30 -19.932 -0.038 -30.821 201 HA TYR 30 HA TYR 30 -18.244 2.121 -31.655 202 HB2 TYR 30 1HB TYR 30 -18.923 1.213 -28.851 203 HB3 TYR 30 2HB TYR 30 -18.245 2.772 -29.308 204 HD1 TYR 30 HD2 TYR 30 -19.903 3.438 -31.668 205 HD2 TYR 30 HD1 TYR 30 -20.997 1.743 -27.922 206 HE1 TYR 30 HE2 TYR 30 -22.172 4.353 -31.923 207 HE2 TYR 30 HE1 TYR 30 -23.269 2.652 -28.167 208 HH TYR 30 HH TYR 30 -24.718 3.375 -30.509 209 H ILE 31 H ILE 31 -17.759 -1.059 -30.379 210 HA ILE 31 HA ILE 31 -15.285 -0.883 -29.171 211 HB ILE 31 HB ILE 31 -16.239 -3.123 -30.959 212 HG12 ILE 31 1HG1 ILE 31 -16.539 -2.736 -27.973 213 HG13 ILE 31 2HG1 ILE 31 -17.831 -2.577 -29.157 214 HG21 ILE 31 1HG2 ILE 31 -13.876 -3.310 -30.540 215 HG22 ILE 31 2HG2 ILE 31 -14.123 -3.044 -28.815 216 HG23 ILE 31 3HG2 ILE 31 -14.727 -4.516 -29.575 217 HD11 ILE 31 1HD1 ILE 31 -18.130 -4.695 -28.251 218 HD12 ILE 31 2HD1 ILE 31 -17.298 -4.999 -29.776 219 HD13 ILE 31 3HD1 ILE 31 -16.402 -5.046 -28.258 220 H LYS 32 H LYS 32 -15.992 -1.334 -32.625 221 HA LYS 32 HA LYS 32 -13.379 -1.549 -33.554 222 HB2 LYS 32 1HB LYS 32 -15.790 -0.325 -34.906 223 HB3 LYS 32 2HB LYS 32 -14.288 -0.734 -35.725 224 HG2 LYS 32 1HG LYS 32 -15.706 -2.849 -34.183 225 HG3 LYS 32 2HG LYS 32 -16.333 -2.366 -35.761 226 HD2 LYS 32 1HD LYS 32 -13.720 -2.640 -36.355 227 HD3 LYS 32 2HD LYS 32 -13.866 -3.830 -35.060 228 HE2 LYS 32 1HE LYS 32 -16.043 -4.474 -36.458 229 HE3 LYS 32 2HE LYS 32 -15.076 -3.796 -37.767 230 HZ1 LYS 32 1HZ LYS 32 -14.661 -6.227 -36.216 231 HZ2 LYS 32 2HZ LYS 32 -13.273 -5.357 -36.638 232 HZ3 LYS 32 3HZ LYS 32 -14.323 -5.910 -37.844 233 H ASN 33 H ASN 33 -15.147 1.225 -32.461 234 HA ASN 33 HA ASN 33 -13.264 3.114 -33.600 235 HB2 ASN 33 1HB ASN 33 -15.621 3.516 -31.745 236 HB3 ASN 33 2HB ASN 33 -14.655 4.816 -32.437 237 HD21 ASN 33 2HD2 ASN 33 -17.468 4.365 -32.749 238 HD22 ASN 33 1HD2 ASN 33 -17.758 4.137 -34.437 239 H PHE 34 H PHE 34 -13.847 1.481 -30.590 240 HA PHE 34 HA PHE 34 -12.204 3.213 -28.999 241 HB2 PHE 34 1HB PHE 34 -13.665 0.655 -28.577 242 HB3 PHE 34 2HB PHE 34 -12.332 1.015 -27.485 243 HD1 PHE 34 HD2 PHE 34 -15.134 2.950 -29.021 244 HD2 PHE 34 HD1 PHE 34 -13.000 1.905 -25.490 245 HE1 PHE 34 HE2 PHE 34 -16.617 4.401 -27.699 246 HE2 PHE 34 HE1 PHE 34 -14.480 3.355 -24.162 247 HZ PHE 34 HZ PHE 34 -16.290 4.606 -25.267 248 H GLU 35 H GLU 35 -11.703 0.405 -30.974 249 HA GLU 35 HA GLU 35 -9.232 -0.432 -29.870 250 HB2 GLU 35 1HB GLU 35 -10.958 -1.306 -31.902 251 HB3 GLU 35 2HB GLU 35 -9.428 -0.975 -32.701 252 HG2 GLU 35 1HG GLU 35 -9.759 -2.736 -30.283 253 HG3 GLU 35 2HG GLU 35 -9.653 -3.308 -31.947 254 H ARG 36 H ARG 36 -10.068 1.733 -32.545 255 HA ARG 36 HA ARG 36 -7.327 2.269 -33.210 256 HB2 ARG 36 1HB ARG 36 -9.416 2.407 -34.739 257 HB3 ARG 36 2HB ARG 36 -9.645 3.997 -34.024 258 HG2 ARG 36 1HG ARG 36 -7.322 4.566 -34.758 259 HG3 ARG 36 2HG ARG 36 -7.300 3.038 -35.641 260 HD2 ARG 36 1HD ARG 36 -9.484 3.879 -36.715 261 HD3 ARG 36 2HD ARG 36 -9.000 5.462 -36.108 262 HE ARG 36 HE ARG 36 -6.932 4.154 -37.598 263 HH11 ARG 36 1HH1 ARG 36 -9.801 6.111 -37.838 264 HH12 ARG 36 2HH1 ARG 36 -9.363 6.798 -39.367 265 HH21 ARG 36 1HH2 ARG 36 -6.344 5.050 -39.611 266 HH22 ARG 36 2HH2 ARG 36 -7.396 6.193 -40.375 267 H GLU 37 H GLU 37 -9.873 3.913 -31.396 268 HA GLU 37 HA GLU 37 -8.431 6.312 -30.947 269 HB2 GLU 37 1HB GLU 37 -10.895 5.059 -29.862 270 HB3 GLU 37 2HB GLU 37 -10.131 6.296 -28.874 271 HG2 GLU 37 1HG GLU 37 -10.450 7.004 -31.701 272 HG3 GLU 37 2HG GLU 37 -11.956 6.775 -30.813 273 H LYS 38 H LYS 38 -8.281 3.184 -29.541 274 HA LYS 38 HA LYS 38 -7.045 2.284 -27.858 275 HB2 LYS 38 1HB LYS 38 -5.412 4.819 -28.049 276 HB3 LYS 38 2HB LYS 38 -4.889 3.273 -27.394 277 HG2 LYS 38 1HG LYS 38 -5.819 2.939 -30.088 278 HG3 LYS 38 2HG LYS 38 -4.597 4.210 -30.011 279 HD2 LYS 38 1HD LYS 38 -2.999 2.749 -29.065 280 HD3 LYS 38 2HD LYS 38 -4.219 1.526 -28.704 281 HE2 LYS 38 1HE LYS 38 -4.388 0.860 -30.921 282 HE3 LYS 38 2HE LYS 38 -3.721 2.374 -31.530 283 HZ1 LYS 38 1HZ LYS 38 -2.149 0.542 -31.733 284 HZ2 LYS 38 2HZ LYS 38 -2.192 0.294 -30.061 285 HZ3 LYS 38 3HZ LYS 38 -1.559 1.733 -30.687 286 H ILE 39 H ILE 39 -9.333 3.495 -26.995 287 HA ILE 39 HA ILE 39 -9.064 5.438 -25.002 288 HB ILE 39 HB ILE 39 -11.087 3.197 -25.102 289 HG12 ILE 39 1HG1 ILE 39 -11.091 4.474 -27.179 290 HG13 ILE 39 2HG1 ILE 39 -12.528 4.856 -26.238 291 HG21 ILE 39 1HG2 ILE 39 -11.308 4.095 -22.981 292 HG22 ILE 39 2HG2 ILE 39 -10.884 5.721 -23.514 293 HG23 ILE 39 3HG2 ILE 39 -12.463 5.045 -23.915 294 HD11 ILE 39 1HD1 ILE 39 -10.081 6.536 -26.658 295 HD12 ILE 39 2HD1 ILE 39 -11.753 6.896 -27.091 296 HD13 ILE 39 3HD1 ILE 39 -11.265 6.878 -25.396 297 H SER 40 H SER 40 -7.740 5.305 -23.314 298 HA SER 40 HA SER 40 -7.116 2.747 -22.102 299 HB2 SER 40 1HB SER 40 -5.832 4.527 -20.529 300 HB3 SER 40 2HB SER 40 -5.172 3.936 -22.054 301 HG SER 40 HG SER 40 -5.075 6.065 -22.330 302 H GLY 41 H GLY 41 -7.215 2.463 -19.741 303 HA2 GLY 41 1HA GLY 41 -9.796 2.788 -18.742 304 HA3 GLY 41 2HA GLY 41 -8.386 2.397 -17.769 305 H ASP 42 H ASP 42 -6.897 4.734 -18.136 306 HA ASP 42 HA ASP 42 -7.838 6.372 -16.123 307 HB2 ASP 42 1HB ASP 42 -6.128 7.915 -16.715 308 HB3 ASP 42 2HB ASP 42 -5.505 6.316 -17.116 309 H GLN 43 H GLN 43 -8.423 6.561 -19.587 310 HA GLN 43 HA GLN 43 -9.877 9.053 -19.350 311 HB2 GLN 43 1HB GLN 43 -9.180 7.221 -21.622 312 HB3 GLN 43 2HB GLN 43 -10.403 8.467 -21.832 313 HG2 GLN 43 1HG GLN 43 -8.572 10.049 -20.888 314 HG3 GLN 43 2HG GLN 43 -7.473 8.753 -21.355 315 HE21 GLN 43 2HE2 GLN 43 -10.354 10.257 -22.788 316 HE22 GLN 43 1HE2 GLN 43 -9.637 10.559 -24.331 317 H LEU 44 H LEU 44 -10.562 5.634 -19.588 318 HA LEU 44 HA LEU 44 -13.303 5.820 -20.232 319 HB2 LEU 44 1HB LEU 44 -12.085 3.755 -20.503 320 HB3 LEU 44 2HB LEU 44 -11.760 3.682 -18.773 321 HG LEU 44 HG LEU 44 -14.366 3.600 -18.581 322 HD11 LEU 44 1HD1 LEU 44 -15.544 3.364 -20.444 323 HD12 LEU 44 2HD1 LEU 44 -14.536 2.015 -20.965 324 HD13 LEU 44 3HD1 LEU 44 -14.072 3.668 -21.366 325 HD21 LEU 44 1HD2 LEU 44 -12.537 1.360 -19.391 326 HD22 LEU 44 2HD2 LEU 44 -14.219 1.081 -18.938 327 HD23 LEU 44 3HD2 LEU 44 -13.100 1.796 -17.777 328 H LEU 45 H LEU 45 -11.626 5.495 -17.115 329 HA LEU 45 HA LEU 45 -13.848 5.373 -15.455 330 HB2 LEU 45 1HB LEU 45 -11.072 5.613 -15.153 331 HB3 LEU 45 2HB LEU 45 -11.770 6.960 -14.256 332 HG LEU 45 HG LEU 45 -13.118 5.380 -12.949 333 HD11 LEU 45 1HD1 LEU 45 -11.735 2.962 -13.564 334 HD12 LEU 45 2HD1 LEU 45 -12.464 3.602 -15.036 335 HD13 LEU 45 3HD1 LEU 45 -13.466 3.298 -13.617 336 HD21 LEU 45 1HD2 LEU 45 -11.120 5.964 -11.894 337 HD22 LEU 45 2HD2 LEU 45 -10.139 5.043 -13.033 338 HD23 LEU 45 3HD2 LEU 45 -11.129 4.201 -11.840 339 H ARG 46 H ARG 46 -12.179 8.185 -16.792 340 HA ARG 46 HA ARG 46 -14.245 9.922 -15.627 341 HB2 ARG 46 1HB ARG 46 -12.718 11.771 -15.977 342 HB3 ARG 46 2HB ARG 46 -11.898 10.490 -15.093 343 HG2 ARG 46 1HG ARG 46 -11.077 9.754 -17.446 344 HG3 ARG 46 2HG ARG 46 -11.496 11.406 -17.902 345 HD2 ARG 46 1HD ARG 46 -10.099 11.719 -15.542 346 HD3 ARG 46 2HD ARG 46 -9.245 10.409 -16.355 347 HE ARG 46 HE ARG 46 -9.761 12.593 -18.111 348 HH11 ARG 46 1HH1 ARG 46 -7.655 11.481 -15.572 349 HH12 ARG 46 2HH1 ARG 46 -6.315 12.455 -16.078 350 HH21 ARG 46 1HH2 ARG 46 -8.004 13.880 -18.788 351 HH22 ARG 46 2HH2 ARG 46 -6.514 13.820 -17.907 352 H ILE 47 H ILE 47 -14.690 8.257 -17.958 353 HA ILE 47 HA ILE 47 -14.505 9.784 -20.338 354 HB ILE 47 HB ILE 47 -14.798 7.326 -20.317 355 HG12 ILE 47 1HG1 ILE 47 -17.170 7.956 -21.840 356 HG13 ILE 47 2HG1 ILE 47 -15.957 9.214 -22.048 357 HG21 ILE 47 1HG2 ILE 47 -17.675 7.878 -19.622 358 HG22 ILE 47 2HG2 ILE 47 -16.900 6.309 -19.834 359 HG23 ILE 47 3HG2 ILE 47 -16.472 7.325 -18.458 360 HD11 ILE 47 1HD1 ILE 47 -15.581 7.668 -23.767 361 HD12 ILE 47 2HD1 ILE 47 -14.327 7.348 -22.568 362 HD13 ILE 47 3HD1 ILE 47 -15.735 6.292 -22.675 363 H THR 48 H THR 48 -15.824 11.271 -21.210 364 HA THR 48 HA THR 48 -18.314 11.899 -19.760 365 HB THR 48 HB THR 48 -16.556 13.650 -19.551 366 HG1 THR 48 HG1 THR 48 -18.001 15.369 -20.292 367 HG21 THR 48 1HG2 THR 48 -15.637 14.761 -21.339 368 HG22 THR 48 2HG2 THR 48 -17.009 14.421 -22.394 369 HG23 THR 48 3HG2 THR 48 -15.832 13.156 -22.041 370 H HIS 49 H HIS 49 -19.973 13.008 -21.109 371 HA HIS 49 HA HIS 49 -20.775 11.468 -23.255 372 HB2 HIS 49 1HB HIS 49 -21.560 14.076 -22.126 373 HB3 HIS 49 2HB HIS 49 -21.998 13.837 -23.815 374 HD1 HIS 49 HD1 HIS 49 -22.714 12.560 -20.371 375 HD2 HIS 49 HD2 HIS 49 -24.003 11.947 -24.273 376 HE1 HIS 49 HE1 HIS 49 -24.809 11.181 -20.179 377 H GLN 50 H GLN 50 -18.786 14.367 -23.231 378 HA GLN 50 HA GLN 50 -18.792 14.901 -25.983 379 HB2 GLN 50 1HB GLN 50 -17.610 16.013 -23.738 380 HB3 GLN 50 2HB GLN 50 -16.239 15.455 -24.687 381 HG2 GLN 50 1HG GLN 50 -16.896 16.774 -26.556 382 HG3 GLN 50 2HG GLN 50 -18.434 17.181 -25.797 383 HE21 GLN 50 2HE2 GLN 50 -18.524 18.803 -24.312 384 HE22 GLN 50 1HE2 GLN 50 -17.188 19.832 -23.937 385 H GLU 51 H GLU 51 -16.560 12.952 -24.020 386 HA GLU 51 HA GLU 51 -14.788 12.217 -26.035 387 HB2 GLU 51 1HB GLU 51 -15.667 10.711 -23.569 388 HB3 GLU 51 2HB GLU 51 -14.339 10.198 -24.600 389 HG2 GLU 51 1HG GLU 51 -14.219 12.978 -23.642 390 HG3 GLU 51 2HG GLU 51 -14.039 11.726 -22.415 391 H LEU 52 H LEU 52 -17.680 10.484 -24.888 392 HA LEU 52 HA LEU 52 -17.579 8.305 -26.586 393 HB2 LEU 52 1HB LEU 52 -19.802 9.783 -25.257 394 HB3 LEU 52 2HB LEU 52 -20.189 8.518 -26.422 395 HG LEU 52 HG LEU 52 -18.323 7.885 -24.185 396 HD11 LEU 52 1HD1 LEU 52 -20.802 7.134 -23.243 397 HD12 LEU 52 2HD1 LEU 52 -21.069 8.767 -23.852 398 HD13 LEU 52 3HD1 LEU 52 -19.819 8.470 -22.644 399 HD21 LEU 52 1HD2 LEU 52 -18.641 6.190 -25.832 400 HD22 LEU 52 2HD2 LEU 52 -20.394 6.376 -25.770 401 HD23 LEU 52 3HD2 LEU 52 -19.529 5.701 -24.388 402 H GLU 53 H GLU 53 -19.298 11.381 -27.131 403 HA GLU 53 HA GLU 53 -20.310 10.870 -29.648 404 HB2 GLU 53 1HB GLU 53 -20.409 12.991 -28.022 405 HB3 GLU 53 2HB GLU 53 -19.208 13.588 -29.158 406 HG2 GLU 53 1HG GLU 53 -20.800 13.106 -31.003 407 HG3 GLU 53 2HG GLU 53 -22.007 12.688 -29.788 408 H ASP 54 H ASP 54 -17.074 11.920 -28.734 409 HA ASP 54 HA ASP 54 -16.113 12.497 -31.314 410 HB2 ASP 54 1HB ASP 54 -15.052 13.016 -29.019 411 HB3 ASP 54 2HB ASP 54 -14.384 11.389 -29.114 412 H LEU 55 H LEU 55 -16.281 9.500 -29.474 413 HA LEU 55 HA LEU 55 -14.723 7.951 -31.275 414 HB2 LEU 55 1HB LEU 55 -16.758 7.176 -29.195 415 HB3 LEU 55 2HB LEU 55 -15.798 6.012 -30.106 416 HG LEU 55 HG LEU 55 -14.211 8.055 -28.730 417 HD11 LEU 55 1HD1 LEU 55 -14.635 6.441 -26.606 418 HD12 LEU 55 2HD1 LEU 55 -16.260 6.524 -27.284 419 HD13 LEU 55 3HD1 LEU 55 -15.416 8.005 -26.834 420 HD21 LEU 55 1HD2 LEU 55 -13.893 5.483 -29.776 421 HD22 LEU 55 2HD2 LEU 55 -13.710 5.309 -28.030 422 HD23 LEU 55 3HD2 LEU 55 -12.692 6.446 -28.915 423 H GLY 56 H GLY 56 -18.059 8.917 -31.176 424 HA2 GLY 56 1HA GLY 56 -18.978 8.816 -33.562 425 HA3 GLY 56 2HA GLY 56 -18.665 7.093 -33.412 426 H VAL 57 H VAL 57 -19.456 7.416 -30.461 427 HA VAL 57 HA VAL 57 -22.072 6.455 -30.684 428 HB VAL 57 HB VAL 57 -20.903 7.800 -28.247 429 HG11 VAL 57 1HG1 VAL 57 -22.391 6.287 -27.022 430 HG12 VAL 57 2HG1 VAL 57 -23.292 7.352 -28.103 431 HG13 VAL 57 3HG1 VAL 57 -23.015 5.668 -28.551 432 HG21 VAL 57 1HG2 VAL 57 -20.029 5.447 -29.628 433 HG22 VAL 57 2HG2 VAL 57 -19.368 6.195 -28.174 434 HG23 VAL 57 3HG2 VAL 57 -20.664 5.006 -28.042 435 H SER 58 H SER 58 -23.484 7.730 -31.798 436 HA SER 58 HA SER 58 -23.938 10.456 -30.788 437 HB2 SER 58 1HB SER 58 -25.270 10.623 -33.022 438 HB3 SER 58 2HB SER 58 -23.508 10.675 -33.073 439 HG SER 58 HG SER 58 -24.804 9.152 -34.527 440 H ARG 59 H ARG 59 -24.955 8.507 -29.204 441 HA ARG 59 HA ARG 59 -27.842 8.778 -29.672 442 HB2 ARG 59 1HB ARG 59 -26.281 6.308 -29.390 443 HB3 ARG 59 2HB ARG 59 -27.674 6.398 -28.320 444 HG2 ARG 59 1HG ARG 59 -28.703 5.472 -30.100 445 HG3 ARG 59 2HG ARG 59 -28.845 7.160 -30.594 446 HD2 ARG 59 1HD ARG 59 -26.580 6.795 -31.752 447 HD3 ARG 59 2HD ARG 59 -26.909 5.075 -31.545 448 HE ARG 59 HE ARG 59 -29.152 6.238 -32.723 449 HH11 ARG 59 1HH1 ARG 59 -25.812 5.617 -33.481 450 HH12 ARG 59 2HH1 ARG 59 -26.087 5.492 -35.187 451 HH21 ARG 59 1HH2 ARG 59 -29.528 6.076 -34.967 452 HH22 ARG 59 2HH2 ARG 59 -28.201 5.754 -36.031 453 H ILE 60 H ILE 60 -29.033 8.060 -27.551 454 HA ILE 60 HA ILE 60 -27.654 9.395 -25.316 455 HB ILE 60 HB ILE 60 -30.628 9.130 -25.773 456 HG12 ILE 60 1HG1 ILE 60 -29.636 10.655 -27.391 457 HG13 ILE 60 2HG1 ILE 60 -30.544 11.570 -26.193 458 HG21 ILE 60 1HG2 ILE 60 -30.573 9.374 -23.522 459 HG22 ILE 60 2HG2 ILE 60 -28.976 10.119 -23.530 460 HG23 ILE 60 3HG2 ILE 60 -30.396 11.074 -23.953 461 HD11 ILE 60 1HD1 ILE 60 -27.597 11.385 -26.597 462 HD12 ILE 60 2HD1 ILE 60 -28.621 12.810 -26.417 463 HD13 ILE 60 3HD1 ILE 60 -28.250 11.807 -25.014 464 H GLY 61 H GLY 61 -29.805 6.710 -26.165 465 HA2 GLY 61 1HA GLY 61 -29.845 5.613 -23.522 466 HA3 GLY 61 2HA GLY 61 -30.404 4.820 -24.988 467 H HIS 62 H HIS 62 -27.641 5.421 -26.158 468 HA HIS 62 HA HIS 62 -26.433 2.951 -25.209 469 HB2 HIS 62 1HB HIS 62 -25.538 4.774 -27.451 470 HB3 HIS 62 2HB HIS 62 -24.968 3.137 -27.139 471 HD1 HIS 62 HD1 HIS 62 -26.408 4.174 -29.792 472 HD2 HIS 62 HD2 HIS 62 -28.143 1.957 -26.736 473 HE1 HIS 62 HE1 HIS 62 -28.377 3.012 -30.839 474 H GLN 63 H GLN 63 -25.690 6.399 -25.394 475 HA GLN 63 HA GLN 63 -23.048 6.285 -24.469 476 HB2 GLN 63 1HB GLN 63 -25.163 8.405 -24.484 477 HB3 GLN 63 2HB GLN 63 -23.659 8.686 -23.618 478 HG2 GLN 63 1HG GLN 63 -22.546 7.970 -25.851 479 HG3 GLN 63 2HG GLN 63 -24.122 8.348 -26.545 480 HE21 GLN 63 2HE2 GLN 63 -24.443 10.361 -27.160 481 HE22 GLN 63 1HE2 GLN 63 -23.541 11.739 -26.640 482 H GLU 64 H GLU 64 -26.111 6.238 -22.772 483 HA GLU 64 HA GLU 64 -24.874 6.548 -20.175 484 HB2 GLU 64 1HB GLU 64 -27.712 5.960 -21.022 485 HB3 GLU 64 2HB GLU 64 -27.209 6.105 -19.344 486 HG2 GLU 64 1HG GLU 64 -26.484 8.341 -21.123 487 HG3 GLU 64 2HG GLU 64 -28.199 8.136 -20.773 488 H LEU 65 H LEU 65 -25.918 3.974 -22.260 489 HA LEU 65 HA LEU 65 -26.182 1.903 -20.393 490 HB2 LEU 65 1HB LEU 65 -25.750 2.121 -23.298 491 HB3 LEU 65 2HB LEU 65 -25.237 0.601 -22.567 492 HG LEU 65 HG LEU 65 -27.993 1.656 -22.066 493 HD11 LEU 65 1HD1 LEU 65 -26.998 1.120 -24.636 494 HD12 LEU 65 2HD1 LEU 65 -28.678 1.337 -24.149 495 HD13 LEU 65 3HD1 LEU 65 -27.970 -0.278 -24.178 496 HD21 LEU 65 1HD2 LEU 65 -27.588 -0.179 -20.724 497 HD22 LEU 65 2HD2 LEU 65 -26.577 -0.974 -21.931 498 HD23 LEU 65 3HD2 LEU 65 -28.328 -0.921 -22.142 499 H ILE 66 H ILE 66 -23.348 2.998 -22.233 500 HA ILE 66 HA ILE 66 -21.565 1.059 -21.209 501 HB ILE 66 HB ILE 66 -20.943 3.807 -22.300 502 HG12 ILE 66 1HG1 ILE 66 -20.850 1.137 -23.714 503 HG13 ILE 66 2HG1 ILE 66 -22.214 2.244 -23.817 504 HG21 ILE 66 1HG2 ILE 66 -18.865 1.956 -22.790 505 HG22 ILE 66 2HG2 ILE 66 -18.825 3.403 -21.784 506 HG23 ILE 66 3HG2 ILE 66 -19.272 1.851 -21.077 507 HD11 ILE 66 1HD1 ILE 66 -20.673 2.382 -25.738 508 HD12 ILE 66 2HD1 ILE 66 -20.848 3.909 -24.872 509 HD13 ILE 66 3HD1 ILE 66 -19.403 2.925 -24.641 510 H LEU 67 H LEU 67 -22.311 4.379 -20.218 511 HA LEU 67 HA LEU 67 -20.378 4.618 -18.205 512 HB2 LEU 67 1HB LEU 67 -23.115 5.871 -18.355 513 HB3 LEU 67 2HB LEU 67 -21.807 6.395 -17.296 514 HG LEU 67 HG LEU 67 -21.501 6.394 -20.283 515 HD11 LEU 67 1HD1 LEU 67 -22.702 8.254 -20.556 516 HD12 LEU 67 2HD1 LEU 67 -22.101 8.969 -19.060 517 HD13 LEU 67 3HD1 LEU 67 -23.456 7.842 -19.016 518 HD21 LEU 67 1HD2 LEU 67 -19.977 7.317 -17.950 519 HD22 LEU 67 2HD2 LEU 67 -20.087 8.477 -19.274 520 HD23 LEU 67 3HD2 LEU 67 -19.426 6.867 -19.563 521 H GLU 68 H GLU 68 -23.788 3.618 -17.985 522 HA GLU 68 HA GLU 68 -23.951 3.189 -15.263 523 HB2 GLU 68 1HB GLU 68 -25.870 3.058 -16.806 524 HB3 GLU 68 2HB GLU 68 -25.248 1.541 -17.441 525 HG2 GLU 68 1HG GLU 68 -26.806 0.779 -15.961 526 HG3 GLU 68 2HG GLU 68 -25.366 0.786 -14.945 527 H ALA 69 H ALA 69 -22.399 1.255 -17.709 528 HA ALA 69 HA ALA 69 -22.062 -1.052 -16.015 529 HB1 ALA 69 1HB ALA 69 -20.604 -0.471 -18.582 530 HB2 ALA 69 2HB ALA 69 -20.904 -2.039 -17.832 531 HB3 ALA 69 3HB ALA 69 -22.242 -1.124 -18.528 532 H VAL 70 H VAL 70 -20.200 1.776 -16.907 533 HA VAL 70 HA VAL 70 -17.680 0.909 -15.982 534 HB VAL 70 HB VAL 70 -18.768 3.723 -16.147 535 HG11 VAL 70 1HG1 VAL 70 -16.859 3.719 -14.713 536 HG12 VAL 70 2HG1 VAL 70 -15.959 2.683 -15.822 537 HG13 VAL 70 3HG1 VAL 70 -16.349 4.341 -16.282 538 HG21 VAL 70 1HG2 VAL 70 -17.719 1.832 -18.139 539 HG22 VAL 70 2HG2 VAL 70 -18.788 3.219 -18.343 540 HG23 VAL 70 3HG2 VAL 70 -17.045 3.460 -18.219 541 H ASP 71 H ASP 71 -20.422 2.403 -14.375 542 HA ASP 71 HA ASP 71 -19.247 3.194 -11.989 543 HB2 ASP 71 1HB ASP 71 -21.759 3.277 -12.937 544 HB3 ASP 71 2HB ASP 71 -21.928 1.929 -11.815 545 H LEU 72 H LEU 72 -19.988 0.012 -13.155 546 HA LEU 72 HA LEU 72 -19.764 -1.263 -10.581 547 HB2 LEU 72 1HB LEU 72 -20.051 -2.220 -13.402 548 HB3 LEU 72 2HB LEU 72 -19.623 -3.348 -12.117 549 HG LEU 72 HG LEU 72 -22.097 -1.635 -12.028 550 HD11 LEU 72 1HD1 LEU 72 -22.520 -2.898 -13.924 551 HD12 LEU 72 2HD1 LEU 72 -23.200 -3.890 -12.634 552 HD13 LEU 72 3HD1 LEU 72 -21.625 -4.293 -13.319 553 HD21 LEU 72 1HD2 LEU 72 -22.717 -3.715 -10.558 554 HD22 LEU 72 2HD2 LEU 72 -21.764 -2.391 -9.887 555 HD23 LEU 72 3HD2 LEU 72 -20.966 -3.873 -10.416 556 H LEU 73 H LEU 73 -17.684 -0.642 -13.338 557 HA LEU 73 HA LEU 73 -15.585 -2.369 -12.821 558 HB2 LEU 73 1HB LEU 73 -16.009 0.050 -14.342 559 HB3 LEU 73 2HB LEU 73 -14.386 0.006 -13.656 560 HG LEU 73 HG LEU 73 -14.446 -0.877 -15.939 561 HD11 LEU 73 1HD1 LEU 73 -13.659 -3.321 -15.155 562 HD12 LEU 73 2HD1 LEU 73 -13.615 -2.479 -13.606 563 HD13 LEU 73 3HD1 LEU 73 -12.671 -1.872 -14.967 564 HD21 LEU 73 1HD2 LEU 73 -16.396 -2.839 -14.751 565 HD22 LEU 73 2HD2 LEU 73 -15.538 -3.126 -16.265 566 HD23 LEU 73 3HD2 LEU 73 -16.639 -1.755 -16.122 567 H CYS 74 H CYS 74 -15.929 0.995 -11.686 568 HA CYS 74 HA CYS 74 -13.632 0.979 -10.060 569 HB2 CYS 74 1HB CYS 74 -15.686 2.814 -10.733 570 HB3 CYS 74 2HB CYS 74 -15.616 2.741 -8.976 571 HG CYS 74 HG CYS 74 -13.391 4.033 -8.652 572 H ALA 75 H ALA 75 -16.937 -0.016 -9.483 573 HA ALA 75 HA ALA 75 -16.907 -0.145 -6.689 574 HB1 ALA 75 1HB ALA 75 -18.439 -2.306 -7.815 575 HB2 ALA 75 2HB ALA 75 -18.992 -0.847 -6.991 576 HB3 ALA 75 3HB ALA 75 -18.692 -0.818 -8.729 577 H LEU 76 H LEU 76 -16.060 -2.613 -9.103 578 HA LEU 76 HA LEU 76 -15.535 -4.736 -7.407 579 HB2 LEU 76 1HB LEU 76 -14.301 -3.929 -10.024 580 HB3 LEU 76 2HB LEU 76 -13.857 -5.422 -9.198 581 HG LEU 76 HG LEU 76 -16.700 -4.810 -9.958 582 HD11 LEU 76 1HD1 LEU 76 -14.461 -5.506 -11.690 583 HD12 LEU 76 2HD1 LEU 76 -16.075 -4.924 -12.097 584 HD13 LEU 76 3HD1 LEU 76 -15.807 -6.640 -11.792 585 HD21 LEU 76 1HD2 LEU 76 -15.173 -7.307 -9.249 586 HD22 LEU 76 2HD2 LEU 76 -16.800 -7.318 -9.932 587 HD23 LEU 76 3HD2 LEU 76 -16.506 -6.565 -8.364 588 H ASN 77 H ASN 77 -13.366 -2.123 -8.431 589 HA ASN 77 HA ASN 77 -11.128 -3.111 -6.954 590 HB2 ASN 77 1HB ASN 77 -11.750 -0.602 -8.459 591 HB3 ASN 77 2HB ASN 77 -10.374 -0.615 -7.360 592 HD21 ASN 77 2HD2 ASN 77 -11.815 -2.630 -9.901 593 HD22 ASN 77 1HD2 ASN 77 -10.317 -3.045 -10.656 594 H SER 78 H SER 78 -10.518 -2.712 -4.909 595 HA SER 78 HA SER 78 -10.618 -2.046 -2.736 596 HB2 SER 78 1HB SER 78 -10.235 0.192 -3.973 597 HB3 SER 78 2HB SER 78 -11.939 0.503 -3.643 598 HG SER 78 HG SER 78 -10.892 1.332 -1.920 599 H GLY 79 H GLY 79 -12.074 -3.449 -1.858 600 HA2 GLY 79 1HA GLY 79 -14.760 -2.370 -1.399 601 HA3 GLY 79 2HA GLY 79 -14.629 -3.970 -2.116 602 HA PRO 80 HA PRO 80 -14.662 -4.223 2.577 603 HB2 PRO 80 1HB PRO 80 -16.906 -5.739 2.776 604 HB3 PRO 80 2HB PRO 80 -16.938 -3.971 2.761 605 HG2 PRO 80 1HG PRO 80 -17.464 -5.894 0.528 606 HG3 PRO 80 2HG PRO 80 -18.344 -4.418 0.964 607 HD2 PRO 80 1HD PRO 80 -16.541 -4.496 -1.055 608 HD3 PRO 80 2HD PRO 80 -16.806 -3.045 -0.067 609 H SER 81 H SER 81 -15.112 -6.497 -0.051 610 HA SER 81 HA SER 81 -13.649 -8.515 1.516 611 HB2 SER 81 1HB SER 81 -15.894 -9.330 1.393 612 HB3 SER 81 2HB SER 81 -16.013 -8.928 -0.320 613 HG SER 81 HG SER 81 -15.153 -10.784 -0.768 614 H SER 82 H SER 82 -14.447 -7.267 -1.693 615 HA SER 82 HA SER 82 -12.407 -8.822 -2.998 616 HB2 SER 82 1HB SER 82 -13.140 -6.736 -4.714 617 HB3 SER 82 2HB SER 82 -13.785 -8.378 -4.713 618 HG SER 82 HG SER 82 -15.589 -7.639 -3.937 619 H GLY 83 H GLY 83 -10.975 -7.393 -4.610 620 HA2 GLY 83 1HA GLY 83 -9.791 -5.165 -3.097 621 HA3 GLY 83 2HA GLY 83 -8.767 -6.496 -3.613 Start of MODEL 19 1 H1 GLY 1 H GLY 1 1.531 1.897 1.538 2 HA2 GLY 1 1HA GLY 1 0.191 0.108 2.071 3 HA3 GLY 1 2HA GLY 1 0.100 0.764 3.698 4 H SER 2 H SER 2 -1.712 1.820 4.347 5 HA SER 2 HA SER 2 -4.048 1.524 2.695 6 HB2 SER 2 1HB SER 2 -3.525 2.416 5.507 7 HB3 SER 2 2HB SER 2 -5.079 2.790 4.761 8 HG SER 2 HG SER 2 -5.455 0.617 4.486 9 H SER 3 H SER 3 -3.645 2.920 0.946 10 HA SER 3 HA SER 3 -4.069 5.759 1.588 11 HB2 SER 3 1HB SER 3 -2.619 5.794 -0.780 12 HB3 SER 3 2HB SER 3 -1.998 6.191 0.822 13 HG SER 3 HG SER 3 -1.804 3.769 -0.608 14 H GLY 4 H GLY 4 -4.161 3.292 -0.974 15 HA2 GLY 4 1HA GLY 4 -6.548 3.091 -1.872 16 HA3 GLY 4 2HA GLY 4 -6.358 4.799 -2.238 17 H SER 5 H SER 5 -6.533 2.030 -3.743 18 HA SER 5 HA SER 5 -4.594 2.825 -5.803 19 HB2 SER 5 1HB SER 5 -4.135 0.657 -4.232 20 HB3 SER 5 2HB SER 5 -5.060 -0.082 -5.540 21 HG SER 5 HG SER 5 -2.722 1.504 -5.832 22 H SER 6 H SER 6 -5.070 1.469 -7.882 23 HA SER 6 HA SER 6 -7.763 0.639 -8.318 24 HB2 SER 6 1HB SER 6 -7.811 2.654 -10.177 25 HB3 SER 6 2HB SER 6 -8.643 2.699 -8.623 26 HG SER 6 HG SER 6 -6.955 4.427 -9.378 27 H GLY 7 H GLY 7 -7.840 -0.691 -10.033 28 HA2 GLY 7 1HA GLY 7 -5.413 -0.929 -11.652 29 HA3 GLY 7 2HA GLY 7 -6.691 -2.128 -11.516 30 H VAL 8 H VAL 8 -8.906 -0.502 -12.066 31 HA VAL 8 HA VAL 8 -9.023 -0.611 -14.844 32 HB VAL 8 HB VAL 8 -10.694 1.204 -13.103 33 HG11 VAL 8 1HG1 VAL 8 -10.902 1.577 -15.519 34 HG12 VAL 8 2HG1 VAL 8 -11.299 -0.128 -15.742 35 HG13 VAL 8 3HG1 VAL 8 -12.385 0.919 -14.827 36 HG21 VAL 8 1HG2 VAL 8 -12.270 -0.879 -13.292 37 HG22 VAL 8 2HG2 VAL 8 -10.753 -1.751 -13.517 38 HG23 VAL 8 3HG2 VAL 8 -11.022 -0.815 -12.047 39 H SER 9 H SER 9 -7.795 1.861 -12.758 40 HA SER 9 HA SER 9 -7.936 4.013 -14.624 41 HB2 SER 9 1HB SER 9 -6.511 5.215 -13.063 42 HB3 SER 9 2HB SER 9 -7.751 4.340 -12.164 43 HG SER 9 HG SER 9 -5.404 4.217 -11.482 44 H LYS 10 H LYS 10 -5.705 1.422 -14.040 45 HA LYS 10 HA LYS 10 -3.777 2.609 -15.916 46 HB2 LYS 10 1HB LYS 10 -3.362 0.228 -14.103 47 HB3 LYS 10 2HB LYS 10 -2.133 1.089 -15.021 48 HG2 LYS 10 1HG LYS 10 -3.347 3.034 -13.438 49 HG3 LYS 10 2HG LYS 10 -3.172 1.624 -12.392 50 HD2 LYS 10 1HD LYS 10 -0.898 2.591 -14.095 51 HD3 LYS 10 2HD LYS 10 -1.226 3.305 -12.515 52 HE2 LYS 10 1HE LYS 10 -0.036 1.656 -11.615 53 HE3 LYS 10 2HE LYS 10 -1.320 0.549 -12.100 54 HZ1 LYS 10 1HZ LYS 10 0.530 1.201 -14.211 55 HZ2 LYS 10 2HZ LYS 10 -0.068 -0.304 -13.722 56 HZ3 LYS 10 3HZ LYS 10 1.244 0.389 -12.910 57 H TRP 11 H TRP 11 -6.357 1.207 -16.543 58 HA TRP 11 HA TRP 11 -5.685 -1.324 -17.677 59 HB2 TRP 11 1HB TRP 11 -8.059 0.407 -17.530 60 HB3 TRP 11 2HB TRP 11 -7.952 -0.554 -19.002 61 HD1 TRP 11 HD1 TRP 11 -6.621 -2.003 -15.737 62 HE1 TRP 11 HE1 TRP 11 -8.131 -3.961 -15.021 63 HE3 TRP 11 HE3 TRP 11 -10.368 -1.435 -19.168 64 HZ2 TRP 11 HZ2 TRP 11 -10.585 -5.113 -15.808 65 HZ3 TRP 11 HZ3 TRP 11 -12.261 -3.007 -19.119 66 HH2 TRP 11 HH2 TRP 11 -12.365 -4.808 -17.473 67 H SER 12 H SER 12 -4.766 -1.768 -19.571 68 HA SER 12 HA SER 12 -3.642 0.191 -21.211 69 HB2 SER 12 1HB SER 12 -3.910 -2.725 -21.253 70 HB3 SER 12 2HB SER 12 -3.851 -2.011 -22.864 71 HG SER 12 HG SER 12 -1.841 -2.438 -21.199 72 HA PRO 13 HA PRO 13 -6.762 1.476 -24.013 73 HB2 PRO 13 1HB PRO 13 -5.420 1.608 -26.369 74 HB3 PRO 13 2HB PRO 13 -5.167 2.762 -25.054 75 HG2 PRO 13 1HG PRO 13 -3.541 0.365 -25.810 76 HG3 PRO 13 2HG PRO 13 -2.994 1.983 -25.334 77 HD2 PRO 13 1HD PRO 13 -3.005 -0.115 -23.621 78 HD3 PRO 13 2HD PRO 13 -3.282 1.556 -23.087 79 H SER 14 H SER 14 -5.085 -1.495 -24.637 80 HA SER 14 HA SER 14 -7.001 -2.304 -26.685 81 HB2 SER 14 1HB SER 14 -4.940 -3.062 -27.379 82 HB3 SER 14 2HB SER 14 -4.363 -3.326 -25.734 83 HG SER 14 HG SER 14 -6.114 -4.943 -27.259 84 H GLN 15 H GLN 15 -6.280 -2.787 -23.333 85 HA GLN 15 HA GLN 15 -7.659 -5.224 -22.944 86 HB2 GLN 15 1HB GLN 15 -6.760 -3.004 -21.146 87 HB3 GLN 15 2HB GLN 15 -7.823 -4.255 -20.516 88 HG2 GLN 15 1HG GLN 15 -5.521 -5.280 -21.997 89 HG3 GLN 15 2HG GLN 15 -5.104 -4.364 -20.549 90 HE21 GLN 15 2HE2 GLN 15 -7.862 -6.469 -21.243 91 HE22 GLN 15 1HE2 GLN 15 -7.565 -7.578 -19.953 92 H VAL 16 H VAL 16 -8.655 -1.836 -22.593 93 HA VAL 16 HA VAL 16 -11.196 -2.178 -21.575 94 HB VAL 16 HB VAL 16 -10.345 -0.137 -23.635 95 HG11 VAL 16 1HG1 VAL 16 -12.713 -0.136 -23.543 96 HG12 VAL 16 2HG1 VAL 16 -12.714 -0.270 -21.783 97 HG13 VAL 16 3HG1 VAL 16 -12.174 1.221 -22.554 98 HG21 VAL 16 1HG2 VAL 16 -9.539 -0.522 -20.937 99 HG22 VAL 16 2HG2 VAL 16 -9.101 0.782 -22.041 100 HG23 VAL 16 3HG2 VAL 16 -10.528 0.936 -21.017 101 H VAL 17 H VAL 17 -10.058 -2.621 -24.863 102 HA VAL 17 HA VAL 17 -12.520 -2.713 -26.192 103 HB VAL 17 HB VAL 17 -9.997 -4.246 -26.836 104 HG11 VAL 17 1HG1 VAL 17 -12.584 -4.365 -27.999 105 HG12 VAL 17 2HG1 VAL 17 -11.505 -3.563 -29.142 106 HG13 VAL 17 3HG1 VAL 17 -11.104 -5.166 -28.524 107 HG21 VAL 17 1HG2 VAL 17 -9.437 -2.419 -28.294 108 HG22 VAL 17 2HG2 VAL 17 -10.961 -1.607 -27.935 109 HG23 VAL 17 3HG2 VAL 17 -9.735 -1.778 -26.678 110 H ASP 18 H ASP 18 -10.755 -5.180 -24.406 111 HA ASP 18 HA ASP 18 -12.397 -7.364 -25.171 112 HB2 ASP 18 1HB ASP 18 -10.058 -7.454 -24.144 113 HB3 ASP 18 2HB ASP 18 -10.844 -7.175 -22.593 114 H TRP 19 H TRP 19 -12.642 -4.901 -22.724 115 HA TRP 19 HA TRP 19 -14.571 -6.197 -21.092 116 HB2 TRP 19 1HB TRP 19 -13.293 -4.375 -20.174 117 HB3 TRP 19 2HB TRP 19 -13.858 -3.279 -21.432 118 HD1 TRP 19 HD1 TRP 19 -15.505 -5.417 -18.627 119 HE1 TRP 19 HE1 TRP 19 -17.415 -4.028 -17.603 120 HE3 TRP 19 HE3 TRP 19 -15.162 -1.262 -21.585 121 HZ2 TRP 19 HZ2 TRP 19 -18.617 -1.505 -17.998 122 HZ3 TRP 19 HZ3 TRP 19 -16.730 0.595 -21.197 123 HH2 TRP 19 HH2 TRP 19 -18.421 0.473 -19.441 124 H MET 20 H MET 20 -14.806 -3.892 -23.773 125 HA MET 20 HA MET 20 -17.592 -3.527 -23.674 126 HB2 MET 20 1HB MET 20 -15.776 -3.373 -26.086 127 HB3 MET 20 2HB MET 20 -17.383 -2.672 -25.955 128 HG2 MET 20 1HG MET 20 -15.441 -1.862 -23.893 129 HG3 MET 20 2HG MET 20 -15.120 -1.305 -25.533 130 HE1 MET 20 1HE MET 20 -16.462 0.042 -26.905 131 HE2 MET 20 2HE MET 20 -18.136 -0.500 -26.785 132 HE3 MET 20 3HE MET 20 -17.717 1.167 -26.385 133 H LYS 21 H LYS 21 -15.652 -6.130 -24.826 134 HA LYS 21 HA LYS 21 -17.490 -7.258 -26.667 135 HB2 LYS 21 1HB LYS 21 -15.256 -8.533 -25.077 136 HB3 LYS 21 2HB LYS 21 -16.135 -9.332 -26.374 137 HG2 LYS 21 1HG LYS 21 -15.340 -7.057 -27.613 138 HG3 LYS 21 2HG LYS 21 -14.003 -7.326 -26.494 139 HD2 LYS 21 1HD LYS 21 -13.357 -9.260 -27.516 140 HD3 LYS 21 2HD LYS 21 -14.996 -9.661 -28.034 141 HE2 LYS 21 1HE LYS 21 -14.559 -7.425 -29.480 142 HE3 LYS 21 2HE LYS 21 -12.916 -8.055 -29.372 143 HZ1 LYS 21 1HZ LYS 21 -13.603 -9.185 -31.187 144 HZ2 LYS 21 2HZ LYS 21 -15.238 -9.147 -30.753 145 HZ3 LYS 21 3HZ LYS 21 -14.196 -10.265 -30.027 146 H GLY 22 H GLY 22 -17.558 -6.992 -23.304 147 HA2 GLY 22 1HA GLY 22 -19.455 -9.250 -23.106 148 HA3 GLY 22 2HA GLY 22 -18.457 -8.693 -21.771 149 H LEU 23 H LEU 23 -19.846 -6.301 -23.821 150 HA LEU 23 HA LEU 23 -21.777 -5.650 -21.696 151 HB2 LEU 23 1HB LEU 23 -20.613 -3.773 -23.743 152 HB3 LEU 23 2HB LEU 23 -21.595 -3.348 -22.343 153 HG LEU 23 HG LEU 23 -18.766 -4.395 -22.310 154 HD11 LEU 23 1HD1 LEU 23 -19.573 -1.801 -21.127 155 HD12 LEU 23 2HD1 LEU 23 -19.480 -1.903 -22.885 156 HD13 LEU 23 3HD1 LEU 23 -18.062 -2.276 -21.905 157 HD21 LEU 23 1HD2 LEU 23 -19.202 -3.596 -19.797 158 HD22 LEU 23 2HD2 LEU 23 -19.462 -5.256 -20.334 159 HD23 LEU 23 3HD2 LEU 23 -20.828 -4.147 -20.203 160 H ASP 24 H ASP 24 -23.370 -3.855 -22.964 161 HA ASP 24 HA ASP 24 -25.269 -5.396 -24.243 162 HB2 ASP 24 1HB ASP 24 -25.111 -2.781 -23.414 163 HB3 ASP 24 2HB ASP 24 -25.226 -2.609 -25.163 164 H ASP 25 H ASP 25 -25.962 -5.544 -26.427 165 HA ASP 25 HA ASP 25 -23.841 -5.947 -28.274 166 HB2 ASP 25 1HB ASP 25 -26.311 -6.982 -28.066 167 HB3 ASP 25 2HB ASP 25 -26.627 -5.751 -29.285 168 H CYS 26 H CYS 26 -25.959 -3.296 -27.583 169 HA CYS 26 HA CYS 26 -25.681 -1.935 -30.064 170 HB2 CYS 26 1HB CYS 26 -26.592 -1.125 -27.318 171 HB3 CYS 26 2HB CYS 26 -26.388 0.079 -28.585 172 HG CYS 26 HG CYS 26 -29.121 -0.901 -28.119 173 H LEU 27 H LEU 27 -23.688 -2.256 -27.275 174 HA LEU 27 HA LEU 27 -22.057 0.058 -27.996 175 HB2 LEU 27 1HB LEU 27 -21.441 -1.829 -25.758 176 HB3 LEU 27 2HB LEU 27 -21.041 -0.120 -25.912 177 HG LEU 27 HG LEU 27 -23.825 -1.183 -25.442 178 HD11 LEU 27 1HD1 LEU 27 -22.596 0.318 -23.286 179 HD12 LEU 27 2HD1 LEU 27 -21.735 -1.180 -23.637 180 HD13 LEU 27 3HD1 LEU 27 -23.454 -1.222 -23.248 181 HD21 LEU 27 1HD2 LEU 27 -23.910 0.945 -26.504 182 HD22 LEU 27 2HD2 LEU 27 -22.639 1.586 -25.463 183 HD23 LEU 27 3HD2 LEU 27 -24.224 1.204 -24.788 184 H GLN 28 H GLN 28 -22.263 -2.522 -29.557 185 HA GLN 28 HA GLN 28 -19.565 -3.591 -29.334 186 HB2 GLN 28 1HB GLN 28 -21.862 -4.345 -31.149 187 HB3 GLN 28 2HB GLN 28 -20.311 -5.171 -31.098 188 HG2 GLN 28 1HG GLN 28 -22.193 -4.929 -28.763 189 HG3 GLN 28 2HG GLN 28 -22.097 -6.322 -29.840 190 HE21 GLN 28 2HE2 GLN 28 -21.230 -5.303 -26.914 191 HE22 GLN 28 1HE2 GLN 28 -19.770 -6.196 -26.681 192 H GLN 29 H GLN 29 -21.590 -1.961 -31.757 193 HA GLN 29 HA GLN 29 -19.733 -1.820 -33.819 194 HB2 GLN 29 1HB GLN 29 -21.036 0.131 -34.620 195 HB3 GLN 29 2HB GLN 29 -22.050 -1.236 -34.179 196 HG2 GLN 29 1HG GLN 29 -22.208 -0.019 -31.882 197 HG3 GLN 29 2HG GLN 29 -21.717 1.392 -32.817 198 HE21 GLN 29 2HE2 GLN 29 -24.159 1.227 -31.514 199 HE22 GLN 29 1HE2 GLN 29 -25.421 1.185 -32.693 200 H TYR 30 H TYR 30 -19.917 -0.035 -30.858 201 HA TYR 30 HA TYR 30 -18.217 2.118 -31.688 202 HB2 TYR 30 1HB TYR 30 -18.928 1.204 -28.893 203 HB3 TYR 30 2HB TYR 30 -18.205 2.749 -29.326 204 HD1 TYR 30 HD2 TYR 30 -19.817 3.485 -31.696 205 HD2 TYR 30 HD1 TYR 30 -20.999 1.778 -27.982 206 HE1 TYR 30 HE2 TYR 30 -22.058 4.462 -31.967 207 HE2 TYR 30 HE1 TYR 30 -23.244 2.749 -28.243 208 HH TYR 30 HH TYR 30 -24.020 4.878 -30.958 209 H ILE 31 H ILE 31 -17.753 -1.064 -30.406 210 HA ILE 31 HA ILE 31 -15.278 -0.902 -29.200 211 HB ILE 31 HB ILE 31 -16.245 -3.141 -30.982 212 HG12 ILE 31 1HG1 ILE 31 -16.554 -2.732 -28.000 213 HG13 ILE 31 2HG1 ILE 31 -17.841 -2.587 -29.192 214 HG21 ILE 31 1HG2 ILE 31 -13.879 -3.327 -30.551 215 HG22 ILE 31 2HG2 ILE 31 -14.141 -3.081 -28.825 216 HG23 ILE 31 3HG2 ILE 31 -14.742 -4.542 -29.608 217 HD11 ILE 31 1HD1 ILE 31 -16.378 -5.059 -28.331 218 HD12 ILE 31 2HD1 ILE 31 -18.099 -4.699 -28.200 219 HD13 ILE 31 3HD1 ILE 31 -17.380 -4.999 -29.781 220 H LYS 32 H LYS 32 -15.991 -1.356 -32.652 221 HA LYS 32 HA LYS 32 -13.382 -1.595 -33.585 222 HB2 LYS 32 1HB LYS 32 -15.809 -0.380 -34.913 223 HB3 LYS 32 2HB LYS 32 -14.302 -0.723 -35.752 224 HG2 LYS 32 1HG LYS 32 -15.768 -2.873 -34.270 225 HG3 LYS 32 2HG LYS 32 -16.214 -2.423 -35.918 226 HD2 LYS 32 1HD LYS 32 -13.779 -2.781 -36.526 227 HD3 LYS 32 2HD LYS 32 -13.589 -3.522 -34.935 228 HE2 LYS 32 1HE LYS 32 -14.883 -5.341 -35.480 229 HE3 LYS 32 2HE LYS 32 -15.794 -4.461 -36.706 230 HZ1 LYS 32 1HZ LYS 32 -13.164 -5.748 -36.914 231 HZ2 LYS 32 2HZ LYS 32 -13.494 -4.408 -37.893 232 HZ3 LYS 32 3HZ LYS 32 -14.468 -5.788 -37.991 233 H ASN 33 H ASN 33 -15.119 1.197 -32.489 234 HA ASN 33 HA ASN 33 -13.213 3.064 -33.629 235 HB2 ASN 33 1HB ASN 33 -15.618 3.448 -31.837 236 HB3 ASN 33 2HB ASN 33 -14.594 4.769 -32.391 237 HD21 ASN 33 2HD2 ASN 33 -17.350 4.530 -32.903 238 HD22 ASN 33 1HD2 ASN 33 -17.564 4.360 -34.609 239 H PHE 34 H PHE 34 -13.797 1.415 -30.637 240 HA PHE 34 HA PHE 34 -12.196 3.137 -29.005 241 HB2 PHE 34 1HB PHE 34 -13.586 0.532 -28.660 242 HB3 PHE 34 2HB PHE 34 -12.252 0.879 -27.564 243 HD1 PHE 34 HD2 PHE 34 -15.079 2.845 -29.012 244 HD2 PHE 34 HD1 PHE 34 -12.947 1.648 -25.528 245 HE1 PHE 34 HE2 PHE 34 -16.579 4.217 -27.627 246 HE2 PHE 34 HE1 PHE 34 -14.445 3.018 -24.137 247 HZ PHE 34 HZ PHE 34 -16.263 4.305 -25.186 248 H GLU 35 H GLU 35 -11.595 0.425 -31.075 249 HA GLU 35 HA GLU 35 -9.087 -0.343 -29.981 250 HB2 GLU 35 1HB GLU 35 -10.795 -1.216 -32.073 251 HB3 GLU 35 2HB GLU 35 -9.213 -0.920 -32.781 252 HG2 GLU 35 1HG GLU 35 -9.685 -2.630 -30.352 253 HG3 GLU 35 2HG GLU 35 -9.568 -3.247 -31.999 254 H ARG 36 H ARG 36 -9.983 1.654 -32.786 255 HA ARG 36 HA ARG 36 -7.303 2.339 -33.443 256 HB2 ARG 36 1HB ARG 36 -9.597 2.490 -34.805 257 HB3 ARG 36 2HB ARG 36 -9.534 4.146 -34.218 258 HG2 ARG 36 1HG ARG 36 -7.477 4.553 -35.321 259 HG3 ARG 36 2HG ARG 36 -7.260 2.840 -35.684 260 HD2 ARG 36 1HD ARG 36 -9.695 4.231 -36.691 261 HD3 ARG 36 2HD ARG 36 -8.156 4.517 -37.503 262 HE ARG 36 HE ARG 36 -8.451 1.767 -37.237 263 HH11 ARG 36 1HH1 ARG 36 -10.037 4.408 -38.856 264 HH12 ARG 36 2HH1 ARG 36 -10.608 3.432 -40.169 265 HH21 ARG 36 1HH2 ARG 36 -9.195 0.471 -38.960 266 HH22 ARG 36 2HH2 ARG 36 -10.129 1.193 -40.227 267 H GLU 37 H GLU 37 -9.861 3.942 -31.598 268 HA GLU 37 HA GLU 37 -8.462 6.360 -31.156 269 HB2 GLU 37 1HB GLU 37 -10.753 5.031 -29.720 270 HB3 GLU 37 2HB GLU 37 -10.100 6.580 -29.207 271 HG2 GLU 37 1HG GLU 37 -10.699 6.500 -32.048 272 HG3 GLU 37 2HG GLU 37 -12.109 6.188 -31.037 273 H LYS 38 H LYS 38 -8.207 3.232 -29.764 274 HA LYS 38 HA LYS 38 -6.907 2.356 -28.116 275 HB2 LYS 38 1HB LYS 38 -5.371 4.947 -28.390 276 HB3 LYS 38 2HB LYS 38 -4.784 3.468 -27.640 277 HG2 LYS 38 1HG LYS 38 -5.722 3.216 -30.422 278 HG3 LYS 38 2HG LYS 38 -4.256 4.167 -30.174 279 HD2 LYS 38 1HD LYS 38 -3.423 2.206 -28.771 280 HD3 LYS 38 2HD LYS 38 -4.763 1.289 -29.466 281 HE2 LYS 38 1HE LYS 38 -3.162 0.778 -30.997 282 HE3 LYS 38 2HE LYS 38 -3.754 2.273 -31.719 283 HZ1 LYS 38 1HZ LYS 38 -1.716 2.764 -29.786 284 HZ2 LYS 38 2HZ LYS 38 -1.798 3.245 -31.405 285 HZ3 LYS 38 3HZ LYS 38 -1.170 1.726 -31.006 286 H ILE 39 H ILE 39 -9.230 3.617 -27.257 287 HA ILE 39 HA ILE 39 -8.950 5.502 -25.226 288 HB ILE 39 HB ILE 39 -10.967 3.258 -25.385 289 HG12 ILE 39 1HG1 ILE 39 -10.983 4.659 -27.388 290 HG13 ILE 39 2HG1 ILE 39 -12.424 4.958 -26.422 291 HG21 ILE 39 1HG2 ILE 39 -11.118 4.060 -23.202 292 HG22 ILE 39 2HG2 ILE 39 -10.792 5.722 -23.690 293 HG23 ILE 39 3HG2 ILE 39 -12.347 4.982 -24.068 294 HD11 ILE 39 1HD1 ILE 39 -9.969 6.692 -26.544 295 HD12 ILE 39 2HD1 ILE 39 -11.536 7.029 -27.280 296 HD13 ILE 39 3HD1 ILE 39 -11.378 6.985 -25.524 297 H SER 40 H SER 40 -7.606 5.347 -23.554 298 HA SER 40 HA SER 40 -6.959 2.778 -22.383 299 HB2 SER 40 1HB SER 40 -5.723 4.606 -20.781 300 HB3 SER 40 2HB SER 40 -5.023 3.951 -22.261 301 HG SER 40 HG SER 40 -5.200 5.843 -23.149 302 H GLY 41 H GLY 41 -7.080 2.413 -20.051 303 HA2 GLY 41 1HA GLY 41 -9.642 2.676 -19.027 304 HA3 GLY 41 2HA GLY 41 -8.217 2.330 -18.058 305 H ASP 42 H ASP 42 -6.794 4.681 -18.335 306 HA ASP 42 HA ASP 42 -7.839 6.291 -16.351 307 HB2 ASP 42 1HB ASP 42 -5.514 6.455 -16.916 308 HB3 ASP 42 2HB ASP 42 -5.892 6.960 -18.561 309 H GLN 43 H GLN 43 -8.458 6.341 -19.781 310 HA GLN 43 HA GLN 43 -9.831 8.889 -19.678 311 HB2 GLN 43 1HB GLN 43 -9.169 6.915 -21.823 312 HB3 GLN 43 2HB GLN 43 -10.452 8.084 -22.106 313 HG2 GLN 43 1HG GLN 43 -8.645 9.799 -21.302 314 HG3 GLN 43 2HG GLN 43 -7.529 8.519 -21.773 315 HE21 GLN 43 2HE2 GLN 43 -10.112 10.607 -22.915 316 HE22 GLN 43 1HE2 GLN 43 -9.660 10.569 -24.582 317 H LEU 44 H LEU 44 -10.623 5.473 -19.769 318 HA LEU 44 HA LEU 44 -13.394 5.770 -20.277 319 HB2 LEU 44 1HB LEU 44 -12.251 3.666 -20.643 320 HB3 LEU 44 2HB LEU 44 -11.865 3.550 -18.928 321 HG LEU 44 HG LEU 44 -14.567 3.678 -18.821 322 HD11 LEU 44 1HD1 LEU 44 -15.054 1.809 -20.666 323 HD12 LEU 44 2HD1 LEU 44 -13.821 2.735 -21.521 324 HD13 LEU 44 3HD1 LEU 44 -15.290 3.533 -20.960 325 HD21 LEU 44 1HD2 LEU 44 -12.513 1.695 -18.537 326 HD22 LEU 44 2HD2 LEU 44 -13.980 0.960 -19.185 327 HD23 LEU 44 3HD2 LEU 44 -14.038 1.858 -17.667 328 H LEU 45 H LEU 45 -11.539 5.352 -17.275 329 HA LEU 45 HA LEU 45 -13.657 5.275 -15.480 330 HB2 LEU 45 1HB LEU 45 -10.900 5.322 -15.323 331 HB3 LEU 45 2HB LEU 45 -11.386 6.795 -14.486 332 HG LEU 45 HG LEU 45 -12.860 5.392 -13.035 333 HD11 LEU 45 1HD1 LEU 45 -12.615 3.476 -14.888 334 HD12 LEU 45 2HD1 LEU 45 -13.003 3.144 -13.201 335 HD13 LEU 45 3HD1 LEU 45 -11.345 2.969 -13.775 336 HD21 LEU 45 1HD2 LEU 45 -10.939 5.976 -11.934 337 HD22 LEU 45 2HD2 LEU 45 -9.890 5.184 -13.110 338 HD23 LEU 45 3HD2 LEU 45 -10.781 4.220 -11.931 339 H ARG 46 H ARG 46 -12.266 7.963 -17.192 340 HA ARG 46 HA ARG 46 -14.095 9.784 -15.769 341 HB2 ARG 46 1HB ARG 46 -12.576 11.586 -16.167 342 HB3 ARG 46 2HB ARG 46 -11.646 10.256 -15.490 343 HG2 ARG 46 1HG ARG 46 -10.980 9.650 -17.826 344 HG3 ARG 46 2HG ARG 46 -11.745 11.148 -18.359 345 HD2 ARG 46 1HD ARG 46 -10.220 12.166 -16.446 346 HD3 ARG 46 2HD ARG 46 -9.257 10.729 -16.788 347 HE ARG 46 HE ARG 46 -8.572 11.724 -18.720 348 HH11 ARG 46 1HH1 ARG 46 -11.527 13.243 -17.680 349 HH12 ARG 46 2HH1 ARG 46 -11.497 14.450 -18.922 350 HH21 ARG 46 1HH2 ARG 46 -8.521 13.309 -20.360 351 HH22 ARG 46 2HH2 ARG 46 -9.787 14.486 -20.446 352 H ILE 47 H ILE 47 -14.614 8.064 -18.121 353 HA ILE 47 HA ILE 47 -14.670 9.653 -20.467 354 HB ILE 47 HB ILE 47 -14.825 7.176 -20.477 355 HG12 ILE 47 1HG1 ILE 47 -17.265 7.609 -21.896 356 HG13 ILE 47 2HG1 ILE 47 -16.268 9.049 -22.065 357 HG21 ILE 47 1HG2 ILE 47 -16.731 7.482 -18.570 358 HG22 ILE 47 2HG2 ILE 47 -17.720 7.174 -19.997 359 HG23 ILE 47 3HG2 ILE 47 -16.486 6.011 -19.512 360 HD11 ILE 47 1HD1 ILE 47 -15.070 8.031 -23.613 361 HD12 ILE 47 2HD1 ILE 47 -14.612 6.783 -22.453 362 HD13 ILE 47 3HD1 ILE 47 -16.064 6.586 -23.434 363 H THR 48 H THR 48 -16.139 11.063 -21.230 364 HA THR 48 HA THR 48 -18.602 11.462 -19.659 365 HB THR 48 HB THR 48 -16.990 13.293 -19.270 366 HG1 THR 48 HG1 THR 48 -18.624 14.655 -19.263 367 HG21 THR 48 1HG2 THR 48 -16.016 14.536 -20.916 368 HG22 THR 48 2HG2 THR 48 -17.364 14.316 -22.032 369 HG23 THR 48 3HG2 THR 48 -16.192 13.019 -21.798 370 H HIS 49 H HIS 49 -20.283 12.721 -20.927 371 HA HIS 49 HA HIS 49 -21.076 11.301 -23.169 372 HB2 HIS 49 1HB HIS 49 -21.871 13.897 -21.948 373 HB3 HIS 49 2HB HIS 49 -22.429 13.567 -23.586 374 HD1 HIS 49 HD1 HIS 49 -22.855 12.466 -20.045 375 HD2 HIS 49 HD2 HIS 49 -24.340 11.526 -23.810 376 HE1 HIS 49 HE1 HIS 49 -24.856 10.999 -19.632 377 H GLN 50 H GLN 50 -19.257 14.323 -22.965 378 HA GLN 50 HA GLN 50 -19.249 14.939 -25.706 379 HB2 GLN 50 1HB GLN 50 -18.158 16.031 -23.359 380 HB3 GLN 50 2HB GLN 50 -16.790 15.738 -24.424 381 HG2 GLN 50 1HG GLN 50 -17.281 17.733 -25.281 382 HG3 GLN 50 2HG GLN 50 -18.572 16.884 -26.129 383 HE21 GLN 50 2HE2 GLN 50 -18.809 19.540 -25.669 384 HE22 GLN 50 1HE2 GLN 50 -20.022 19.837 -24.475 385 H GLU 51 H GLU 51 -17.006 13.043 -23.725 386 HA GLU 51 HA GLU 51 -15.083 12.563 -25.712 387 HB2 GLU 51 1HB GLU 51 -15.843 11.218 -23.153 388 HB3 GLU 51 2HB GLU 51 -14.733 10.400 -24.243 389 HG2 GLU 51 1HG GLU 51 -13.920 13.121 -23.921 390 HG3 GLU 51 2HG GLU 51 -14.150 12.377 -22.339 391 H LEU 52 H LEU 52 -17.965 10.728 -24.767 392 HA LEU 52 HA LEU 52 -17.595 8.532 -26.460 393 HB2 LEU 52 1HB LEU 52 -20.042 9.813 -25.287 394 HB3 LEU 52 2HB LEU 52 -20.150 8.394 -26.327 395 HG LEU 52 HG LEU 52 -18.301 8.167 -24.039 396 HD11 LEU 52 1HD1 LEU 52 -20.534 7.493 -22.742 397 HD12 LEU 52 2HD1 LEU 52 -21.168 8.817 -23.719 398 HD13 LEU 52 3HD1 LEU 52 -19.809 9.097 -22.631 399 HD21 LEU 52 1HD2 LEU 52 -20.505 6.289 -24.776 400 HD22 LEU 52 2HD2 LEU 52 -18.911 5.942 -24.105 401 HD23 LEU 52 3HD2 LEU 52 -19.073 6.411 -25.799 402 H GLU 53 H GLU 53 -19.169 11.648 -27.020 403 HA GLU 53 HA GLU 53 -20.292 11.137 -29.514 404 HB2 GLU 53 1HB GLU 53 -20.325 13.260 -27.915 405 HB3 GLU 53 2HB GLU 53 -19.070 13.808 -29.017 406 HG2 GLU 53 1HG GLU 53 -20.876 13.036 -30.813 407 HG3 GLU 53 2HG GLU 53 -21.962 13.412 -29.476 408 H ASP 54 H ASP 54 -16.991 11.848 -28.615 409 HA ASP 54 HA ASP 54 -16.021 12.461 -31.204 410 HB2 ASP 54 1HB ASP 54 -14.893 12.907 -28.948 411 HB3 ASP 54 2HB ASP 54 -14.379 11.223 -29.000 412 H LEU 55 H LEU 55 -16.039 9.454 -29.310 413 HA LEU 55 HA LEU 55 -14.712 7.845 -31.176 414 HB2 LEU 55 1HB LEU 55 -16.784 7.141 -29.106 415 HB3 LEU 55 2HB LEU 55 -15.858 5.951 -30.018 416 HG LEU 55 HG LEU 55 -14.250 7.949 -28.573 417 HD11 LEU 55 1HD1 LEU 55 -16.307 6.353 -27.219 418 HD12 LEU 55 2HD1 LEU 55 -15.445 7.794 -26.681 419 HD13 LEU 55 3HD1 LEU 55 -14.685 6.209 -26.542 420 HD21 LEU 55 1HD2 LEU 55 -13.690 5.212 -27.977 421 HD22 LEU 55 2HD2 LEU 55 -12.728 6.369 -28.897 422 HD23 LEU 55 3HD2 LEU 55 -13.949 5.390 -29.712 423 H GLY 56 H GLY 56 -17.985 8.995 -31.061 424 HA2 GLY 56 1HA GLY 56 -18.942 8.973 -33.420 425 HA3 GLY 56 2HA GLY 56 -18.684 7.238 -33.326 426 H VAL 57 H VAL 57 -19.438 7.495 -30.359 427 HA VAL 57 HA VAL 57 -22.092 6.637 -30.593 428 HB VAL 57 HB VAL 57 -20.849 7.828 -28.114 429 HG11 VAL 57 1HG1 VAL 57 -23.310 7.390 -28.116 430 HG12 VAL 57 2HG1 VAL 57 -22.948 5.682 -28.376 431 HG13 VAL 57 3HG1 VAL 57 -22.407 6.485 -26.901 432 HG21 VAL 57 1HG2 VAL 57 -20.078 5.503 -29.607 433 HG22 VAL 57 2HG2 VAL 57 -19.366 6.171 -28.138 434 HG23 VAL 57 3HG2 VAL 57 -20.702 5.025 -28.028 435 H SER 58 H SER 58 -23.523 7.975 -31.571 436 HA SER 58 HA SER 58 -23.695 10.766 -30.741 437 HB2 SER 58 1HB SER 58 -25.469 10.848 -32.569 438 HB3 SER 58 2HB SER 58 -23.826 10.488 -33.100 439 HG SER 58 HG SER 58 -25.023 8.964 -34.074 440 H ARG 59 H ARG 59 -25.715 7.852 -30.840 441 HA ARG 59 HA ARG 59 -28.068 8.892 -29.815 442 HB2 ARG 59 1HB ARG 59 -26.919 6.283 -30.210 443 HB3 ARG 59 2HB ARG 59 -27.770 6.333 -28.672 444 HG2 ARG 59 1HG ARG 59 -29.332 7.582 -30.743 445 HG3 ARG 59 2HG ARG 59 -28.867 5.942 -31.200 446 HD2 ARG 59 1HD ARG 59 -30.154 4.998 -29.609 447 HD3 ARG 59 2HD ARG 59 -29.795 6.256 -28.428 448 HE ARG 59 HE ARG 59 -31.752 7.261 -29.010 449 HH11 ARG 59 1HH1 ARG 59 -30.737 5.222 -31.644 450 HH12 ARG 59 2HH1 ARG 59 -32.160 5.512 -32.588 451 HH21 ARG 59 1HH2 ARG 59 -33.630 7.649 -30.244 452 HH22 ARG 59 2HH2 ARG 59 -33.805 6.893 -31.791 453 H ILE 60 H ILE 60 -28.989 8.468 -27.613 454 HA ILE 60 HA ILE 60 -27.027 9.288 -25.589 455 HB ILE 60 HB ILE 60 -30.040 9.493 -25.526 456 HG12 ILE 60 1HG1 ILE 60 -29.058 11.014 -27.163 457 HG13 ILE 60 2HG1 ILE 60 -29.643 11.919 -25.771 458 HG21 ILE 60 1HG2 ILE 60 -29.803 9.742 -23.331 459 HG22 ILE 60 2HG2 ILE 60 -28.046 9.694 -23.461 460 HG23 ILE 60 3HG2 ILE 60 -28.902 11.223 -23.654 461 HD11 ILE 60 1HD1 ILE 60 -26.962 11.288 -25.236 462 HD12 ILE 60 2HD1 ILE 60 -27.029 11.846 -26.908 463 HD13 ILE 60 3HD1 ILE 60 -27.656 12.865 -25.612 464 H GLY 61 H GLY 61 -29.761 7.068 -26.074 465 HA2 GLY 61 1HA GLY 61 -29.739 5.792 -23.609 466 HA3 GLY 61 2HA GLY 61 -30.237 5.037 -25.116 467 H HIS 62 H HIS 62 -27.484 5.516 -26.230 468 HA HIS 62 HA HIS 62 -26.334 3.051 -25.222 469 HB2 HIS 62 1HB HIS 62 -25.289 4.851 -27.414 470 HB3 HIS 62 2HB HIS 62 -24.834 3.177 -27.109 471 HD1 HIS 62 HD1 HIS 62 -26.187 4.456 -29.758 472 HD2 HIS 62 HD2 HIS 62 -28.007 2.078 -26.878 473 HE1 HIS 62 HE1 HIS 62 -28.164 3.406 -30.904 474 H GLN 63 H GLN 63 -25.498 6.481 -25.398 475 HA GLN 63 HA GLN 63 -22.896 6.347 -24.413 476 HB2 GLN 63 1HB GLN 63 -25.018 8.463 -24.353 477 HB3 GLN 63 2HB GLN 63 -23.503 8.715 -23.496 478 HG2 GLN 63 1HG GLN 63 -22.330 8.217 -25.669 479 HG3 GLN 63 2HG GLN 63 -23.912 8.301 -26.442 480 HE21 GLN 63 2HE2 GLN 63 -24.464 10.196 -27.229 481 HE22 GLN 63 1HE2 GLN 63 -23.843 11.728 -26.730 482 H GLU 64 H GLU 64 -25.966 6.174 -22.757 483 HA GLU 64 HA GLU 64 -24.771 6.436 -20.134 484 HB2 GLU 64 1HB GLU 64 -27.546 6.061 -21.181 485 HB3 GLU 64 2HB GLU 64 -27.210 5.667 -19.501 486 HG2 GLU 64 1HG GLU 64 -26.107 8.235 -20.201 487 HG3 GLU 64 2HG GLU 64 -27.832 8.161 -20.555 488 H LEU 65 H LEU 65 -25.781 3.899 -22.297 489 HA LEU 65 HA LEU 65 -26.017 1.760 -20.534 490 HB2 LEU 65 1HB LEU 65 -25.488 2.105 -23.403 491 HB3 LEU 65 2HB LEU 65 -24.913 0.585 -22.721 492 HG LEU 65 HG LEU 65 -27.757 1.566 -22.515 493 HD11 LEU 65 1HD1 LEU 65 -27.598 1.160 -24.771 494 HD12 LEU 65 2HD1 LEU 65 -28.036 -0.437 -24.166 495 HD13 LEU 65 3HD1 LEU 65 -26.358 -0.078 -24.573 496 HD21 LEU 65 1HD2 LEU 65 -26.576 -1.165 -22.028 497 HD22 LEU 65 2HD2 LEU 65 -28.252 -0.672 -21.786 498 HD23 LEU 65 3HD2 LEU 65 -26.980 -0.006 -20.761 499 H ILE 66 H ILE 66 -23.131 2.940 -22.247 500 HA ILE 66 HA ILE 66 -21.351 1.032 -21.171 501 HB ILE 66 HB ILE 66 -20.660 3.816 -22.112 502 HG12 ILE 66 1HG1 ILE 66 -20.846 1.249 -23.705 503 HG13 ILE 66 2HG1 ILE 66 -21.992 2.582 -23.790 504 HG21 ILE 66 1HG2 ILE 66 -18.981 1.315 -22.112 505 HG22 ILE 66 2HG2 ILE 66 -18.467 2.952 -22.517 506 HG23 ILE 66 3HG2 ILE 66 -18.912 2.553 -20.858 507 HD11 ILE 66 1HD1 ILE 66 -19.575 2.209 -25.231 508 HD12 ILE 66 2HD1 ILE 66 -20.763 3.506 -25.372 509 HD13 ILE 66 3HD1 ILE 66 -19.422 3.657 -24.236 510 H LEU 67 H LEU 67 -22.135 4.355 -20.191 511 HA LEU 67 HA LEU 67 -20.316 4.580 -18.086 512 HB2 LEU 67 1HB LEU 67 -23.057 5.805 -18.355 513 HB3 LEU 67 2HB LEU 67 -21.818 6.322 -17.212 514 HG LEU 67 HG LEU 67 -21.404 6.400 -20.192 515 HD11 LEU 67 1HD1 LEU 67 -21.824 8.995 -19.164 516 HD12 LEU 67 2HD1 LEU 67 -23.185 8.001 -18.645 517 HD13 LEU 67 3HD1 LEU 67 -22.785 8.123 -20.359 518 HD21 LEU 67 1HD2 LEU 67 -19.716 8.097 -19.547 519 HD22 LEU 67 2HD2 LEU 67 -19.376 6.491 -18.902 520 HD23 LEU 67 3HD2 LEU 67 -20.051 7.739 -17.853 521 H GLU 68 H GLU 68 -23.711 3.516 -18.034 522 HA GLU 68 HA GLU 68 -24.002 3.064 -15.327 523 HB2 GLU 68 1HB GLU 68 -25.886 2.894 -16.822 524 HB3 GLU 68 2HB GLU 68 -25.158 1.530 -17.657 525 HG2 GLU 68 1HG GLU 68 -25.319 0.225 -15.555 526 HG3 GLU 68 2HG GLU 68 -26.185 1.579 -14.831 527 H ALA 69 H ALA 69 -22.285 1.179 -17.702 528 HA ALA 69 HA ALA 69 -21.956 -1.104 -15.957 529 HB1 ALA 69 1HB ALA 69 -22.077 -1.097 -18.540 530 HB2 ALA 69 2HB ALA 69 -20.370 -0.660 -18.456 531 HB3 ALA 69 3HB ALA 69 -20.929 -2.172 -17.740 532 H VAL 70 H VAL 70 -20.071 1.676 -17.006 533 HA VAL 70 HA VAL 70 -17.558 0.920 -16.063 534 HB VAL 70 HB VAL 70 -18.745 3.698 -16.146 535 HG11 VAL 70 1HG1 VAL 70 -16.274 4.311 -16.397 536 HG12 VAL 70 2HG1 VAL 70 -16.844 3.863 -14.788 537 HG13 VAL 70 3HG1 VAL 70 -15.940 2.701 -15.761 538 HG21 VAL 70 1HG2 VAL 70 -17.719 1.881 -18.201 539 HG22 VAL 70 2HG2 VAL 70 -18.767 3.291 -18.354 540 HG23 VAL 70 3HG2 VAL 70 -17.019 3.499 -18.247 541 H ASP 71 H ASP 71 -20.356 2.145 -14.369 542 HA ASP 71 HA ASP 71 -19.179 2.985 -11.987 543 HB2 ASP 71 1HB ASP 71 -21.631 3.173 -12.756 544 HB3 ASP 71 2HB ASP 71 -21.830 1.560 -12.078 545 H LEU 72 H LEU 72 -20.331 -0.237 -12.929 546 HA LEU 72 HA LEU 72 -19.814 -1.534 -10.501 547 HB2 LEU 72 1HB LEU 72 -20.122 -2.404 -13.331 548 HB3 LEU 72 2HB LEU 72 -19.499 -3.561 -12.157 549 HG LEU 72 HG LEU 72 -21.951 -3.725 -12.585 550 HD11 LEU 72 1HD1 LEU 72 -20.697 -3.350 -9.934 551 HD12 LEU 72 2HD1 LEU 72 -21.507 -4.758 -10.621 552 HD13 LEU 72 3HD1 LEU 72 -22.459 -3.418 -9.984 553 HD21 LEU 72 1HD2 LEU 72 -22.214 -1.202 -12.767 554 HD22 LEU 72 2HD2 LEU 72 -22.185 -1.180 -11.003 555 HD23 LEU 72 3HD2 LEU 72 -23.450 -2.067 -11.854 556 H LEU 73 H LEU 73 -17.738 -0.822 -13.247 557 HA LEU 73 HA LEU 73 -15.560 -2.448 -12.561 558 HB2 LEU 73 1HB LEU 73 -16.043 -0.139 -14.310 559 HB3 LEU 73 2HB LEU 73 -14.378 -0.312 -13.758 560 HG LEU 73 HG LEU 73 -15.927 -2.478 -15.175 561 HD11 LEU 73 1HD1 LEU 73 -13.970 -1.671 -16.889 562 HD12 LEU 73 2HD1 LEU 73 -14.490 -0.139 -16.188 563 HD13 LEU 73 3HD1 LEU 73 -15.664 -1.187 -16.984 564 HD21 LEU 73 1HD2 LEU 73 -12.981 -2.413 -15.146 565 HD22 LEU 73 2HD2 LEU 73 -14.091 -3.777 -15.011 566 HD23 LEU 73 3HD2 LEU 73 -13.758 -2.768 -13.603 567 H CYS 74 H CYS 74 -16.650 0.602 -11.309 568 HA CYS 74 HA CYS 74 -14.159 1.024 -9.847 569 HB2 CYS 74 1HB CYS 74 -15.856 2.798 -11.013 570 HB3 CYS 74 2HB CYS 74 -16.441 2.831 -9.354 571 HG CYS 74 HG CYS 74 -14.645 4.430 -8.474 572 H ALA 75 H ALA 75 -17.586 0.386 -9.259 573 HA ALA 75 HA ALA 75 -17.676 0.562 -6.508 574 HB1 ALA 75 1HB ALA 75 -19.137 -1.710 -7.710 575 HB2 ALA 75 2HB ALA 75 -19.711 -0.419 -6.654 576 HB3 ALA 75 3HB ALA 75 -19.470 -0.110 -8.373 577 H LEU 76 H LEU 76 -16.515 -2.098 -8.514 578 HA LEU 76 HA LEU 76 -16.144 -3.935 -6.376 579 HB2 LEU 76 1HB LEU 76 -15.329 -3.773 -9.227 580 HB3 LEU 76 2HB LEU 76 -14.451 -4.889 -8.184 581 HG LEU 76 HG LEU 76 -17.444 -4.974 -8.349 582 HD11 LEU 76 1HD1 LEU 76 -17.117 -5.296 -10.578 583 HD12 LEU 76 2HD1 LEU 76 -16.825 -6.939 -10.008 584 HD13 LEU 76 3HD1 LEU 76 -15.464 -5.876 -10.369 585 HD21 LEU 76 1HD2 LEU 76 -16.956 -6.452 -6.728 586 HD22 LEU 76 2HD2 LEU 76 -15.272 -6.604 -7.229 587 HD23 LEU 76 3HD2 LEU 76 -16.529 -7.509 -8.074 588 H ASN 77 H ASN 77 -14.135 -1.478 -7.871 589 HA ASN 77 HA ASN 77 -11.715 -2.276 -6.578 590 HB2 ASN 77 1HB ASN 77 -12.583 -0.140 -8.387 591 HB3 ASN 77 2HB ASN 77 -11.370 0.382 -7.222 592 HD21 ASN 77 2HD2 ASN 77 -12.047 -1.617 -9.954 593 HD22 ASN 77 1HD2 ASN 77 -10.417 -2.090 -10.279 594 H SER 78 H SER 78 -11.807 -2.340 -4.396 595 HA SER 78 HA SER 78 -11.762 0.113 -2.953 596 HB2 SER 78 1HB SER 78 -13.741 -0.812 -1.424 597 HB3 SER 78 2HB SER 78 -14.052 0.237 -2.807 598 HG SER 78 HG SER 78 -15.377 -1.414 -3.190 599 H GLY 79 H GLY 79 -9.800 -0.650 -2.196 600 HA2 GLY 79 1HA GLY 79 -8.903 -1.497 -0.100 601 HA3 GLY 79 2HA GLY 79 -10.013 -2.853 -0.243 602 HA PRO 80 HA PRO 80 -6.519 -3.572 -3.522 603 HB2 PRO 80 1HB PRO 80 -4.340 -1.965 -3.320 604 HB3 PRO 80 2HB PRO 80 -5.732 -1.572 -4.336 605 HG2 PRO 80 1HG PRO 80 -5.045 -0.578 -1.597 606 HG3 PRO 80 2HG PRO 80 -5.662 0.325 -2.993 607 HD2 PRO 80 1HD PRO 80 -7.254 -0.466 -0.951 608 HD3 PRO 80 2HD PRO 80 -7.837 -0.343 -2.623 609 H SER 81 H SER 81 -5.559 -2.404 -0.326 610 HA SER 81 HA SER 81 -3.415 -4.321 -0.093 611 HB2 SER 81 1HB SER 81 -4.460 -2.906 2.309 612 HB3 SER 81 2HB SER 81 -2.795 -3.189 1.804 613 HG SER 81 HG SER 81 -4.528 -1.120 1.156 614 H SER 82 H SER 82 -6.691 -3.927 1.158 615 HA SER 82 HA SER 82 -8.102 -5.341 2.249 616 HB2 SER 82 1HB SER 82 -6.497 -7.108 0.474 617 HB3 SER 82 2HB SER 82 -7.470 -7.892 1.719 618 HG SER 82 HG SER 82 -8.672 -7.636 -0.182 619 H GLY 83 H GLY 83 -7.318 -4.682 4.313 620 HA2 GLY 83 1HA GLY 83 -6.827 -5.359 6.483 621 HA3 GLY 83 2HA GLY 83 -6.263 -6.897 5.845 Start of MODEL 20 1 H1 GLY 1 H GLY 1 -11.402 13.803 -1.245 2 HA2 GLY 1 1HA GLY 1 -10.011 12.012 -0.673 3 HA3 GLY 1 2HA GLY 1 -11.590 11.246 -0.581 4 H SER 2 H SER 2 -8.574 11.296 -2.141 5 HA SER 2 HA SER 2 -9.361 9.956 -4.547 6 HB2 SER 2 1HB SER 2 -6.598 10.077 -3.321 7 HB3 SER 2 2HB SER 2 -7.003 9.763 -5.008 8 HG SER 2 HG SER 2 -7.994 11.936 -4.936 9 H SER 3 H SER 3 -8.617 7.785 -5.136 10 HA SER 3 HA SER 3 -9.048 5.935 -2.914 11 HB2 SER 3 1HB SER 3 -9.037 4.308 -5.043 12 HB3 SER 3 2HB SER 3 -10.469 5.220 -4.563 13 HG SER 3 HG SER 3 -10.351 5.993 -6.513 14 H GLY 4 H GLY 4 -7.764 3.931 -2.832 15 HA2 GLY 4 1HA GLY 4 -4.943 4.568 -3.109 16 HA3 GLY 4 2HA GLY 4 -5.623 3.173 -2.285 17 H SER 5 H SER 5 -5.772 1.258 -3.338 18 HA SER 5 HA SER 5 -4.265 0.938 -5.733 19 HB2 SER 5 1HB SER 5 -4.172 -0.883 -4.232 20 HB3 SER 5 2HB SER 5 -5.925 -0.934 -4.052 21 HG SER 5 HG SER 5 -4.793 -2.539 -5.502 22 H SER 6 H SER 6 -4.904 0.831 -7.799 23 HA SER 6 HA SER 6 -7.696 0.364 -8.464 24 HB2 SER 6 1HB SER 6 -6.251 2.926 -9.169 25 HB3 SER 6 2HB SER 6 -7.752 2.405 -9.933 26 HG SER 6 HG SER 6 -8.726 3.272 -8.299 27 H GLY 7 H GLY 7 -7.745 -1.025 -10.095 28 HA2 GLY 7 1HA GLY 7 -5.355 -1.359 -11.749 29 HA3 GLY 7 2HA GLY 7 -6.698 -2.485 -11.629 30 H VAL 8 H VAL 8 -8.790 -0.611 -12.082 31 HA VAL 8 HA VAL 8 -8.922 -0.663 -14.884 32 HB VAL 8 HB VAL 8 -10.529 1.086 -13.017 33 HG11 VAL 8 1HG1 VAL 8 -12.222 1.009 -14.794 34 HG12 VAL 8 2HG1 VAL 8 -10.724 1.763 -15.343 35 HG13 VAL 8 3HG1 VAL 8 -11.102 0.104 -15.811 36 HG21 VAL 8 1HG2 VAL 8 -10.577 -1.317 -12.414 37 HG22 VAL 8 2HG2 VAL 8 -12.145 -0.701 -12.935 38 HG23 VAL 8 3HG2 VAL 8 -11.174 -1.679 -14.034 39 H SER 9 H SER 9 -7.607 1.666 -12.691 40 HA SER 9 HA SER 9 -7.669 3.906 -14.452 41 HB2 SER 9 1HB SER 9 -6.005 4.877 -12.847 42 HB3 SER 9 2HB SER 9 -7.480 4.292 -12.077 43 HG SER 9 HG SER 9 -5.160 3.678 -11.303 44 H LYS 10 H LYS 10 -5.553 1.197 -14.028 45 HA LYS 10 HA LYS 10 -3.594 2.398 -15.866 46 HB2 LYS 10 1HB LYS 10 -3.239 -0.053 -14.136 47 HB3 LYS 10 2HB LYS 10 -1.992 0.787 -15.047 48 HG2 LYS 10 1HG LYS 10 -3.056 2.753 -13.421 49 HG3 LYS 10 2HG LYS 10 -3.029 1.316 -12.396 50 HD2 LYS 10 1HD LYS 10 -0.636 2.066 -14.035 51 HD3 LYS 10 2HD LYS 10 -0.939 2.845 -12.480 52 HE2 LYS 10 1HE LYS 10 -1.124 0.507 -11.512 53 HE3 LYS 10 2HE LYS 10 -0.471 -0.074 -13.042 54 HZ1 LYS 10 1HZ LYS 10 1.570 0.511 -12.439 55 HZ2 LYS 10 2HZ LYS 10 0.972 0.768 -10.878 56 HZ3 LYS 10 3HZ LYS 10 1.084 2.060 -11.963 57 H TRP 11 H TRP 11 -6.223 1.101 -16.512 58 HA TRP 11 HA TRP 11 -5.633 -1.405 -17.750 59 HB2 TRP 11 1HB TRP 11 -7.962 0.366 -17.480 60 HB3 TRP 11 2HB TRP 11 -7.906 -0.521 -19.001 61 HD1 TRP 11 HD1 TRP 11 -6.560 -2.149 -15.822 62 HE1 TRP 11 HE1 TRP 11 -8.096 -4.113 -15.184 63 HE3 TRP 11 HE3 TRP 11 -10.328 -1.359 -19.186 64 HZ2 TRP 11 HZ2 TRP 11 -10.577 -5.185 -15.998 65 HZ3 TRP 11 HZ3 TRP 11 -12.246 -2.900 -19.191 66 HH2 TRP 11 HH2 TRP 11 -12.366 -4.773 -17.630 67 H SER 12 H SER 12 -4.690 -1.769 -19.643 68 HA SER 12 HA SER 12 -3.582 0.226 -21.236 69 HB2 SER 12 1HB SER 12 -3.890 -2.683 -21.381 70 HB3 SER 12 2HB SER 12 -3.841 -1.910 -22.965 71 HG SER 12 HG SER 12 -1.847 -2.268 -21.137 72 HA PRO 13 HA PRO 13 -6.720 1.653 -23.947 73 HB2 PRO 13 1HB PRO 13 -5.406 1.855 -26.314 74 HB3 PRO 13 2HB PRO 13 -5.121 2.956 -24.961 75 HG2 PRO 13 1HG PRO 13 -3.537 0.568 -25.826 76 HG3 PRO 13 2HG PRO 13 -2.962 2.160 -25.297 77 HD2 PRO 13 1HD PRO 13 -2.980 0.001 -23.663 78 HD3 PRO 13 2HD PRO 13 -3.228 1.654 -23.064 79 H SER 14 H SER 14 -5.084 -1.311 -24.710 80 HA SER 14 HA SER 14 -7.043 -2.021 -26.756 81 HB2 SER 14 1HB SER 14 -4.517 -2.493 -26.934 82 HB3 SER 14 2HB SER 14 -4.809 -3.790 -25.776 83 HG SER 14 HG SER 14 -6.291 -4.686 -27.250 84 H GLN 15 H GLN 15 -6.271 -2.642 -23.438 85 HA GLN 15 HA GLN 15 -7.664 -5.079 -23.117 86 HB2 GLN 15 1HB GLN 15 -6.698 -2.938 -21.267 87 HB3 GLN 15 2HB GLN 15 -7.799 -4.164 -20.653 88 HG2 GLN 15 1HG GLN 15 -5.539 -5.225 -22.180 89 HG3 GLN 15 2HG GLN 15 -5.093 -4.373 -20.702 90 HE21 GLN 15 2HE2 GLN 15 -6.617 -7.152 -22.059 91 HE22 GLN 15 1HE2 GLN 15 -6.862 -8.007 -20.578 92 H VAL 16 H VAL 16 -8.637 -1.699 -22.672 93 HA VAL 16 HA VAL 16 -11.160 -2.045 -21.613 94 HB VAL 16 HB VAL 16 -10.322 0.026 -23.647 95 HG11 VAL 16 1HG1 VAL 16 -12.508 0.523 -23.640 96 HG12 VAL 16 2HG1 VAL 16 -12.822 -0.444 -22.198 97 HG13 VAL 16 3HG1 VAL 16 -12.192 1.197 -22.042 98 HG21 VAL 16 1HG2 VAL 16 -10.529 0.914 -20.907 99 HG22 VAL 16 2HG2 VAL 16 -9.370 -0.407 -21.065 100 HG23 VAL 16 3HG2 VAL 16 -9.180 1.054 -22.035 101 H VAL 17 H VAL 17 -10.067 -2.528 -24.896 102 HA VAL 17 HA VAL 17 -12.565 -2.562 -26.189 103 HB VAL 17 HB VAL 17 -10.148 -4.194 -26.966 104 HG11 VAL 17 1HG1 VAL 17 -12.482 -4.475 -28.072 105 HG12 VAL 17 2HG1 VAL 17 -12.100 -2.938 -28.849 106 HG13 VAL 17 3HG1 VAL 17 -11.049 -4.334 -29.090 107 HG21 VAL 17 1HG2 VAL 17 -9.659 -2.170 -28.431 108 HG22 VAL 17 2HG2 VAL 17 -10.768 -1.283 -27.386 109 HG23 VAL 17 3HG2 VAL 17 -9.310 -2.010 -26.710 110 H ASP 18 H ASP 18 -10.666 -5.147 -24.680 111 HA ASP 18 HA ASP 18 -12.321 -7.293 -25.387 112 HB2 ASP 18 1HB ASP 18 -10.038 -7.539 -24.456 113 HB3 ASP 18 2HB ASP 18 -10.639 -7.002 -22.890 114 H TRP 19 H TRP 19 -12.599 -4.888 -22.884 115 HA TRP 19 HA TRP 19 -14.516 -6.241 -21.286 116 HB2 TRP 19 1HB TRP 19 -13.272 -4.428 -20.317 117 HB3 TRP 19 2HB TRP 19 -13.826 -3.312 -21.562 118 HD1 TRP 19 HD1 TRP 19 -15.509 -5.513 -18.828 119 HE1 TRP 19 HE1 TRP 19 -17.434 -4.149 -17.800 120 HE3 TRP 19 HE3 TRP 19 -15.124 -1.289 -21.682 121 HZ2 TRP 19 HZ2 TRP 19 -18.632 -1.618 -18.154 122 HZ3 TRP 19 HZ3 TRP 19 -16.698 0.557 -21.274 123 HH2 TRP 19 HH2 TRP 19 -18.416 0.394 -19.546 124 H MET 20 H MET 20 -14.776 -3.883 -23.919 125 HA MET 20 HA MET 20 -17.564 -3.548 -23.818 126 HB2 MET 20 1HB MET 20 -15.752 -3.344 -26.229 127 HB3 MET 20 2HB MET 20 -17.363 -2.655 -26.084 128 HG2 MET 20 1HG MET 20 -15.453 -1.857 -23.997 129 HG3 MET 20 2HG MET 20 -15.082 -1.300 -25.627 130 HE1 MET 20 1HE MET 20 -18.002 0.971 -26.571 131 HE2 MET 20 2HE MET 20 -16.480 0.210 -27.033 132 HE3 MET 20 3HE MET 20 -17.961 -0.748 -26.966 133 H LYS 21 H LYS 21 -15.601 -6.115 -25.014 134 HA LYS 21 HA LYS 21 -17.437 -7.231 -26.866 135 HB2 LYS 21 1HB LYS 21 -15.182 -8.514 -25.313 136 HB3 LYS 21 2HB LYS 21 -16.055 -9.290 -26.627 137 HG2 LYS 21 1HG LYS 21 -15.291 -7.529 -28.157 138 HG3 LYS 21 2HG LYS 21 -14.382 -6.795 -26.834 139 HD2 LYS 21 1HD LYS 21 -13.141 -8.954 -26.598 140 HD3 LYS 21 2HD LYS 21 -13.952 -9.516 -28.062 141 HE2 LYS 21 1HE LYS 21 -12.830 -8.006 -29.414 142 HE3 LYS 21 2HE LYS 21 -12.467 -6.920 -28.074 143 HZ1 LYS 21 1HZ LYS 21 -10.988 -9.189 -29.051 144 HZ2 LYS 21 2HZ LYS 21 -11.176 -9.182 -27.371 145 HZ3 LYS 21 3HZ LYS 21 -10.459 -7.861 -28.146 146 H GLY 22 H GLY 22 -17.490 -7.020 -23.501 147 HA2 GLY 22 1HA GLY 22 -19.353 -9.308 -23.326 148 HA3 GLY 22 2HA GLY 22 -18.356 -8.755 -21.989 149 H LEU 23 H LEU 23 -19.781 -6.346 -23.988 150 HA LEU 23 HA LEU 23 -21.712 -5.756 -21.846 151 HB2 LEU 23 1HB LEU 23 -20.589 -3.835 -23.875 152 HB3 LEU 23 2HB LEU 23 -21.567 -3.443 -22.462 153 HG LEU 23 HG LEU 23 -18.723 -4.451 -22.463 154 HD11 LEU 23 1HD1 LEU 23 -18.049 -2.325 -21.993 155 HD12 LEU 23 2HD1 LEU 23 -19.590 -1.875 -21.263 156 HD13 LEU 23 3HD1 LEU 23 -19.441 -1.972 -23.017 157 HD21 LEU 23 1HD2 LEU 23 -19.511 -3.505 -19.927 158 HD22 LEU 23 2HD2 LEU 23 -19.057 -5.147 -20.384 159 HD23 LEU 23 3HD2 LEU 23 -20.747 -4.646 -20.458 160 H ASP 24 H ASP 24 -23.338 -3.967 -23.078 161 HA ASP 24 HA ASP 24 -25.223 -5.517 -24.366 162 HB2 ASP 24 1HB ASP 24 -25.213 -2.995 -23.433 163 HB3 ASP 24 2HB ASP 24 -25.111 -2.659 -25.159 164 H ASP 25 H ASP 25 -25.883 -5.746 -26.525 165 HA ASP 25 HA ASP 25 -23.789 -6.072 -28.395 166 HB2 ASP 25 1HB ASP 25 -26.719 -6.441 -28.367 167 HB3 ASP 25 2HB ASP 25 -26.014 -6.137 -29.953 168 H CYS 26 H CYS 26 -25.911 -3.433 -27.666 169 HA CYS 26 HA CYS 26 -25.645 -2.043 -30.133 170 HB2 CYS 26 1HB CYS 26 -26.398 -1.077 -27.368 171 HB3 CYS 26 2HB CYS 26 -26.484 -0.083 -28.818 172 HG CYS 26 HG CYS 26 -29.054 -1.012 -28.006 173 H LEU 27 H LEU 27 -23.636 -2.394 -27.360 174 HA LEU 27 HA LEU 27 -22.012 -0.070 -28.062 175 HB2 LEU 27 1HB LEU 27 -21.440 -2.000 -25.840 176 HB3 LEU 27 2HB LEU 27 -20.942 -0.317 -25.993 177 HG LEU 27 HG LEU 27 -23.785 -1.207 -25.525 178 HD11 LEU 27 1HD1 LEU 27 -21.611 -1.192 -23.718 179 HD12 LEU 27 2HD1 LEU 27 -23.320 -1.462 -23.376 180 HD13 LEU 27 3HD1 LEU 27 -22.654 0.170 -23.309 181 HD21 LEU 27 1HD2 LEU 27 -22.410 1.420 -25.807 182 HD22 LEU 27 2HD2 LEU 27 -23.773 1.285 -24.695 183 HD23 LEU 27 3HD2 LEU 27 -23.987 0.900 -26.404 184 H GLN 28 H GLN 28 -22.225 -2.632 -29.653 185 HA GLN 28 HA GLN 28 -19.515 -3.683 -29.464 186 HB2 GLN 28 1HB GLN 28 -21.828 -4.464 -31.246 187 HB3 GLN 28 2HB GLN 28 -20.270 -5.277 -31.207 188 HG2 GLN 28 1HG GLN 28 -22.141 -5.043 -28.862 189 HG3 GLN 28 2HG GLN 28 -22.024 -6.443 -29.927 190 HE21 GLN 28 2HE2 GLN 28 -21.260 -5.544 -26.993 191 HE22 GLN 28 1HE2 GLN 28 -19.748 -6.349 -26.763 192 H GLN 29 H GLN 29 -21.602 -2.132 -31.892 193 HA GLN 29 HA GLN 29 -19.749 -1.951 -33.955 194 HB2 GLN 29 1HB GLN 29 -21.161 -0.288 -34.921 195 HB3 GLN 29 2HB GLN 29 -22.205 -1.435 -34.090 196 HG2 GLN 29 1HG GLN 29 -21.945 0.294 -32.116 197 HG3 GLN 29 2HG GLN 29 -21.601 1.397 -33.447 198 HE21 GLN 29 2HE2 GLN 29 -23.769 1.819 -31.867 199 HE22 GLN 29 1HE2 GLN 29 -25.219 1.495 -32.748 200 H TYR 30 H TYR 30 -20.005 -0.134 -31.019 201 HA TYR 30 HA TYR 30 -18.386 2.071 -31.878 202 HB2 TYR 30 1HB TYR 30 -19.188 1.149 -29.111 203 HB3 TYR 30 2HB TYR 30 -18.347 2.656 -29.459 204 HD1 TYR 30 HD2 TYR 30 -19.758 3.614 -31.848 205 HD2 TYR 30 HD1 TYR 30 -21.287 1.774 -28.329 206 HE1 TYR 30 HE2 TYR 30 -21.915 4.739 -32.204 207 HE2 TYR 30 HE1 TYR 30 -23.449 2.893 -28.676 208 HH TYR 30 HH TYR 30 -24.257 4.466 -31.588 209 H ILE 31 H ILE 31 -17.807 -1.075 -30.558 210 HA ILE 31 HA ILE 31 -15.349 -0.806 -29.337 211 HB ILE 31 HB ILE 31 -16.222 -3.094 -31.105 212 HG12 ILE 31 1HG1 ILE 31 -16.551 -2.666 -28.127 213 HG13 ILE 31 2HG1 ILE 31 -17.841 -2.599 -29.323 214 HG21 ILE 31 1HG2 ILE 31 -13.845 -3.173 -30.666 215 HG22 ILE 31 2HG2 ILE 31 -14.129 -2.949 -28.940 216 HG23 ILE 31 3HG2 ILE 31 -14.664 -4.428 -29.737 217 HD11 ILE 31 1HD1 ILE 31 -17.995 -4.704 -28.288 218 HD12 ILE 31 2HD1 ILE 31 -17.280 -4.993 -29.874 219 HD13 ILE 31 3HD1 ILE 31 -16.261 -4.989 -28.434 220 H LYS 32 H LYS 32 -16.045 -1.222 -32.790 221 HA LYS 32 HA LYS 32 -13.459 -1.450 -33.756 222 HB2 LYS 32 1HB LYS 32 -15.869 -0.120 -35.000 223 HB3 LYS 32 2HB LYS 32 -14.376 -0.447 -35.870 224 HG2 LYS 32 1HG LYS 32 -15.578 -2.747 -34.477 225 HG3 LYS 32 2HG LYS 32 -16.490 -2.102 -35.844 226 HD2 LYS 32 1HD LYS 32 -14.653 -2.430 -37.325 227 HD3 LYS 32 2HD LYS 32 -13.561 -2.796 -35.987 228 HE2 LYS 32 1HE LYS 32 -14.142 -4.946 -36.008 229 HE3 LYS 32 2HE LYS 32 -15.858 -4.544 -35.966 230 HZ1 LYS 32 1HZ LYS 32 -15.200 -3.953 -38.504 231 HZ2 LYS 32 2HZ LYS 32 -15.869 -5.424 -38.006 232 HZ3 LYS 32 3HZ LYS 32 -14.196 -5.281 -38.205 233 H ASN 33 H ASN 33 -15.144 1.347 -32.561 234 HA ASN 33 HA ASN 33 -13.250 3.237 -33.640 235 HB2 ASN 33 1HB ASN 33 -15.359 3.676 -31.516 236 HB3 ASN 33 2HB ASN 33 -14.530 4.918 -32.450 237 HD21 ASN 33 2HD2 ASN 33 -17.352 4.478 -32.238 238 HD22 ASN 33 1HD2 ASN 33 -17.932 4.143 -33.831 239 H PHE 34 H PHE 34 -13.843 1.622 -30.575 240 HA PHE 34 HA PHE 34 -11.980 3.143 -29.060 241 HB2 PHE 34 1HB PHE 34 -13.435 0.558 -28.649 242 HB3 PHE 34 2HB PHE 34 -12.119 0.991 -27.562 243 HD1 PHE 34 HD2 PHE 34 -15.132 2.594 -29.077 244 HD2 PHE 34 HD1 PHE 34 -12.698 2.064 -25.626 245 HE1 PHE 34 HE2 PHE 34 -16.678 3.997 -27.776 246 HE2 PHE 34 HE1 PHE 34 -14.241 3.465 -24.319 247 HZ PHE 34 HZ PHE 34 -16.233 4.435 -25.393 248 H GLU 35 H GLU 35 -11.733 0.352 -31.124 249 HA GLU 35 HA GLU 35 -9.193 -0.542 -30.205 250 HB2 GLU 35 1HB GLU 35 -11.128 -1.388 -32.097 251 HB3 GLU 35 2HB GLU 35 -9.605 -1.218 -32.958 252 HG2 GLU 35 1HG GLU 35 -10.121 -2.899 -30.518 253 HG3 GLU 35 2HG GLU 35 -9.829 -3.469 -32.160 254 H ARG 36 H ARG 36 -10.254 1.852 -32.503 255 HA ARG 36 HA ARG 36 -7.543 2.227 -33.521 256 HB2 ARG 36 1HB ARG 36 -9.852 2.315 -34.848 257 HB3 ARG 36 2HB ARG 36 -9.787 3.999 -34.348 258 HG2 ARG 36 1HG ARG 36 -7.510 4.130 -35.370 259 HG3 ARG 36 2HG ARG 36 -7.778 2.510 -36.016 260 HD2 ARG 36 1HD ARG 36 -9.763 3.323 -37.204 261 HD3 ARG 36 2HD ARG 36 -9.475 4.942 -36.567 262 HE ARG 36 HE ARG 36 -7.900 5.244 -38.189 263 HH11 ARG 36 1HH1 ARG 36 -8.471 1.831 -37.809 264 HH12 ARG 36 2HH1 ARG 36 -7.473 1.381 -39.151 265 HH21 ARG 36 1HH2 ARG 36 -6.583 4.665 -39.959 266 HH22 ARG 36 2HH2 ARG 36 -6.399 2.994 -40.373 267 H GLU 37 H GLU 37 -9.910 3.752 -31.454 268 HA GLU 37 HA GLU 37 -8.501 6.249 -31.260 269 HB2 GLU 37 1HB GLU 37 -10.841 5.042 -29.809 270 HB3 GLU 37 2HB GLU 37 -10.111 6.545 -29.261 271 HG2 GLU 37 1HG GLU 37 -10.607 6.671 -32.080 272 HG3 GLU 37 2HG GLU 37 -12.075 6.201 -31.225 273 H LYS 38 H LYS 38 -8.316 3.182 -29.730 274 HA LYS 38 HA LYS 38 -7.007 2.344 -28.070 275 HB2 LYS 38 1HB LYS 38 -5.443 4.903 -28.459 276 HB3 LYS 38 2HB LYS 38 -4.870 3.462 -27.629 277 HG2 LYS 38 1HG LYS 38 -5.773 3.278 -30.468 278 HG3 LYS 38 2HG LYS 38 -4.170 3.912 -30.086 279 HD2 LYS 38 1HD LYS 38 -3.801 1.817 -28.725 280 HD3 LYS 38 2HD LYS 38 -5.289 1.191 -29.438 281 HE2 LYS 38 1HE LYS 38 -3.425 0.370 -30.707 282 HE3 LYS 38 2HE LYS 38 -4.295 1.550 -31.686 283 HZ1 LYS 38 1HZ LYS 38 -1.825 2.113 -30.136 284 HZ2 LYS 38 2HZ LYS 38 -2.640 3.199 -31.144 285 HZ3 LYS 38 3HZ LYS 38 -1.884 1.838 -31.804 286 H ILE 39 H ILE 39 -9.281 3.455 -27.142 287 HA ILE 39 HA ILE 39 -8.967 5.469 -25.193 288 HB ILE 39 HB ILE 39 -11.033 3.267 -25.266 289 HG12 ILE 39 1HG1 ILE 39 -11.003 4.559 -27.348 290 HG13 ILE 39 2HG1 ILE 39 -12.451 4.918 -26.413 291 HG21 ILE 39 1HG2 ILE 39 -11.098 4.234 -23.121 292 HG22 ILE 39 2HG2 ILE 39 -10.861 5.860 -23.759 293 HG23 ILE 39 3HG2 ILE 39 -12.389 5.021 -24.028 294 HD11 ILE 39 1HD1 ILE 39 -11.512 7.004 -25.679 295 HD12 ILE 39 2HD1 ILE 39 -9.980 6.631 -26.469 296 HD13 ILE 39 3HD1 ILE 39 -11.427 6.908 -27.437 297 H SER 40 H SER 40 -7.659 5.328 -23.496 298 HA SER 40 HA SER 40 -6.992 2.779 -22.312 299 HB2 SER 40 1HB SER 40 -5.621 4.261 -20.746 300 HB3 SER 40 2HB SER 40 -5.178 4.304 -22.453 301 HG SER 40 HG SER 40 -5.375 6.396 -21.386 302 H GLY 41 H GLY 41 -7.092 2.478 -19.931 303 HA2 GLY 41 1HA GLY 41 -9.737 2.702 -19.002 304 HA3 GLY 41 2HA GLY 41 -8.349 2.248 -18.025 305 H ASP 42 H ASP 42 -6.851 4.613 -18.260 306 HA ASP 42 HA ASP 42 -7.836 6.134 -16.164 307 HB2 ASP 42 1HB ASP 42 -5.472 6.103 -17.116 308 HB3 ASP 42 2HB ASP 42 -6.049 7.245 -18.326 309 H GLN 43 H GLN 43 -8.537 6.324 -19.562 310 HA GLN 43 HA GLN 43 -9.899 8.885 -19.266 311 HB2 GLN 43 1HB GLN 43 -9.026 7.200 -21.559 312 HB3 GLN 43 2HB GLN 43 -10.413 8.252 -21.804 313 HG2 GLN 43 1HG GLN 43 -8.497 9.842 -20.546 314 HG3 GLN 43 2HG GLN 43 -7.614 8.895 -21.742 315 HE21 GLN 43 2HE2 GLN 43 -9.300 8.656 -23.791 316 HE22 GLN 43 1HE2 GLN 43 -9.724 10.202 -24.436 317 H LEU 44 H LEU 44 -10.585 5.490 -19.526 318 HA LEU 44 HA LEU 44 -13.332 5.730 -20.230 319 HB2 LEU 44 1HB LEU 44 -12.136 3.678 -20.638 320 HB3 LEU 44 2HB LEU 44 -11.791 3.496 -18.919 321 HG LEU 44 HG LEU 44 -14.324 3.327 -18.611 322 HD11 LEU 44 1HD1 LEU 44 -15.510 3.790 -20.444 323 HD12 LEU 44 2HD1 LEU 44 -15.062 2.172 -20.983 324 HD13 LEU 44 3HD1 LEU 44 -14.122 3.568 -21.510 325 HD21 LEU 44 1HD2 LEU 44 -14.167 1.051 -18.659 326 HD22 LEU 44 2HD2 LEU 44 -12.456 1.465 -18.766 327 HD23 LEU 44 3HD2 LEU 44 -13.351 1.028 -20.223 328 H LEU 45 H LEU 45 -11.639 5.235 -17.147 329 HA LEU 45 HA LEU 45 -13.851 4.999 -15.483 330 HB2 LEU 45 1HB LEU 45 -11.046 5.923 -15.108 331 HB3 LEU 45 2HB LEU 45 -12.201 6.184 -13.802 332 HG LEU 45 HG LEU 45 -12.062 3.441 -14.898 333 HD11 LEU 45 1HD1 LEU 45 -10.084 3.004 -13.368 334 HD12 LEU 45 2HD1 LEU 45 -9.795 4.742 -13.418 335 HD13 LEU 45 3HD1 LEU 45 -9.740 3.796 -14.905 336 HD21 LEU 45 1HD2 LEU 45 -12.260 2.899 -12.504 337 HD22 LEU 45 2HD2 LEU 45 -13.541 3.977 -13.057 338 HD23 LEU 45 3HD2 LEU 45 -12.189 4.620 -12.124 339 H ARG 46 H ARG 46 -12.313 7.864 -16.812 340 HA ARG 46 HA ARG 46 -14.375 9.521 -15.516 341 HB2 ARG 46 1HB ARG 46 -12.857 11.414 -15.764 342 HB3 ARG 46 2HB ARG 46 -12.080 10.113 -14.870 343 HG2 ARG 46 1HG ARG 46 -11.027 9.421 -17.068 344 HG3 ARG 46 2HG ARG 46 -11.595 10.965 -17.706 345 HD2 ARG 46 1HD ARG 46 -10.211 11.202 -15.148 346 HD3 ARG 46 2HD ARG 46 -9.202 10.533 -16.430 347 HE ARG 46 HE ARG 46 -10.549 12.795 -17.406 348 HH11 ARG 46 1HH1 ARG 46 -8.028 11.930 -15.167 349 HH12 ARG 46 2HH1 ARG 46 -7.184 13.434 -15.333 350 HH21 ARG 46 1HH2 ARG 46 -9.447 14.780 -17.634 351 HH22 ARG 46 2HH2 ARG 46 -7.993 15.054 -16.736 352 H ILE 47 H ILE 47 -14.886 8.032 -17.881 353 HA ILE 47 HA ILE 47 -14.647 9.746 -20.166 354 HB ILE 47 HB ILE 47 -14.752 7.289 -20.383 355 HG12 ILE 47 1HG1 ILE 47 -17.092 7.717 -21.931 356 HG13 ILE 47 2HG1 ILE 47 -16.206 9.238 -21.899 357 HG21 ILE 47 1HG2 ILE 47 -16.683 7.308 -18.550 358 HG22 ILE 47 2HG2 ILE 47 -17.689 7.281 -19.998 359 HG23 ILE 47 3HG2 ILE 47 -16.505 6.003 -19.723 360 HD11 ILE 47 1HD1 ILE 47 -15.531 6.676 -23.174 361 HD12 ILE 47 2HD1 ILE 47 -15.163 8.329 -23.667 362 HD13 ILE 47 3HD1 ILE 47 -14.193 7.544 -22.421 363 H THR 48 H THR 48 -16.038 11.225 -20.923 364 HA THR 48 HA THR 48 -18.618 11.518 -19.525 365 HB THR 48 HB THR 48 -16.998 13.353 -19.049 366 HG1 THR 48 HG1 THR 48 -18.603 15.030 -19.968 367 HG21 THR 48 1HG2 THR 48 -16.284 14.863 -20.716 368 HG22 THR 48 2HG2 THR 48 -17.403 14.201 -21.908 369 HG23 THR 48 3HG2 THR 48 -16.002 13.261 -21.395 370 H HIS 49 H HIS 49 -20.248 12.782 -20.854 371 HA HIS 49 HA HIS 49 -20.929 11.400 -23.146 372 HB2 HIS 49 1HB HIS 49 -21.731 14.064 -22.040 373 HB3 HIS 49 2HB HIS 49 -22.293 13.593 -23.642 374 HD1 HIS 49 HD1 HIS 49 -23.497 13.630 -20.383 375 HD2 HIS 49 HD2 HIS 49 -23.390 10.688 -23.315 376 HE1 HIS 49 HE1 HIS 49 -25.284 11.979 -19.745 377 H GLN 50 H GLN 50 -19.104 14.412 -22.840 378 HA GLN 50 HA GLN 50 -18.952 15.088 -25.543 379 HB2 GLN 50 1HB GLN 50 -17.969 16.130 -23.188 380 HB3 GLN 50 2HB GLN 50 -16.507 15.650 -24.038 381 HG2 GLN 50 1HG GLN 50 -17.258 16.956 -25.993 382 HG3 GLN 50 2HG GLN 50 -18.651 17.497 -25.058 383 HE21 GLN 50 2HE2 GLN 50 -18.354 19.540 -24.540 384 HE22 GLN 50 1HE2 GLN 50 -16.901 20.228 -23.908 385 H GLU 51 H GLU 51 -16.842 13.022 -23.581 386 HA GLU 51 HA GLU 51 -14.953 12.495 -25.614 387 HB2 GLU 51 1HB GLU 51 -15.684 11.111 -23.049 388 HB3 GLU 51 2HB GLU 51 -14.496 10.416 -24.142 389 HG2 GLU 51 1HG GLU 51 -13.786 13.113 -23.807 390 HG3 GLU 51 2HG GLU 51 -14.177 12.489 -22.205 391 H LEU 52 H LEU 52 -17.721 10.596 -24.429 392 HA LEU 52 HA LEU 52 -17.496 8.409 -26.107 393 HB2 LEU 52 1HB LEU 52 -19.844 9.770 -24.844 394 HB3 LEU 52 2HB LEU 52 -20.079 8.387 -25.912 395 HG LEU 52 HG LEU 52 -18.361 8.305 -23.437 396 HD11 LEU 52 1HD1 LEU 52 -21.192 8.444 -23.615 397 HD12 LEU 52 2HD1 LEU 52 -20.186 8.191 -22.190 398 HD13 LEU 52 3HD1 LEU 52 -20.744 6.808 -23.131 399 HD21 LEU 52 1HD2 LEU 52 -18.089 6.640 -25.383 400 HD22 LEU 52 2HD2 LEU 52 -19.644 5.997 -24.855 401 HD23 LEU 52 3HD2 LEU 52 -18.269 6.001 -23.750 402 H GLU 53 H GLU 53 -19.150 11.491 -26.701 403 HA GLU 53 HA GLU 53 -20.294 10.913 -29.161 404 HB2 GLU 53 1HB GLU 53 -19.953 13.188 -27.563 405 HB3 GLU 53 2HB GLU 53 -19.245 13.608 -29.116 406 HG2 GLU 53 1HG GLU 53 -21.307 13.056 -30.247 407 HG3 GLU 53 2HG GLU 53 -22.023 12.518 -28.729 408 H ASP 54 H ASP 54 -16.996 11.830 -28.371 409 HA ASP 54 HA ASP 54 -16.101 12.332 -30.997 410 HB2 ASP 54 1HB ASP 54 -14.946 12.877 -28.760 411 HB3 ASP 54 2HB ASP 54 -14.351 11.220 -28.814 412 H LEU 55 H LEU 55 -16.043 9.396 -29.005 413 HA LEU 55 HA LEU 55 -14.658 7.738 -30.762 414 HB2 LEU 55 1HB LEU 55 -16.647 7.280 -28.590 415 HB3 LEU 55 2HB LEU 55 -16.182 5.928 -29.621 416 HG LEU 55 HG LEU 55 -14.927 6.011 -27.498 417 HD11 LEU 55 1HD1 LEU 55 -13.505 4.872 -28.773 418 HD12 LEU 55 2HD1 LEU 55 -12.611 6.380 -28.962 419 HD13 LEU 55 3HD1 LEU 55 -13.807 5.908 -30.169 420 HD21 LEU 55 1HD2 LEU 55 -14.856 8.415 -27.176 421 HD22 LEU 55 2HD2 LEU 55 -13.847 8.599 -28.611 422 HD23 LEU 55 3HD2 LEU 55 -13.221 7.753 -27.195 423 H GLY 56 H GLY 56 -17.990 8.784 -30.772 424 HA2 GLY 56 1HA GLY 56 -18.804 8.718 -33.209 425 HA3 GLY 56 2HA GLY 56 -18.553 6.987 -33.038 426 H VAL 57 H VAL 57 -19.451 7.356 -30.123 427 HA VAL 57 HA VAL 57 -22.110 6.518 -30.482 428 HB VAL 57 HB VAL 57 -20.951 7.683 -27.950 429 HG11 VAL 57 1HG1 VAL 57 -23.112 5.619 -28.351 430 HG12 VAL 57 2HG1 VAL 57 -22.577 6.310 -26.818 431 HG13 VAL 57 3HG1 VAL 57 -23.400 7.323 -28.004 432 HG21 VAL 57 1HG2 VAL 57 -20.166 5.342 -29.409 433 HG22 VAL 57 2HG2 VAL 57 -19.504 5.995 -27.911 434 HG23 VAL 57 3HG2 VAL 57 -20.867 4.878 -27.859 435 H SER 58 H SER 58 -23.463 7.889 -31.525 436 HA SER 58 HA SER 58 -23.619 10.679 -30.687 437 HB2 SER 58 1HB SER 58 -25.380 10.702 -32.605 438 HB3 SER 58 2HB SER 58 -23.672 10.554 -33.020 439 HG SER 58 HG SER 58 -25.124 9.030 -34.078 440 H ARG 59 H ARG 59 -25.495 7.716 -30.632 441 HA ARG 59 HA ARG 59 -27.958 8.814 -29.822 442 HB2 ARG 59 1HB ARG 59 -26.726 6.134 -29.896 443 HB3 ARG 59 2HB ARG 59 -27.996 6.339 -28.698 444 HG2 ARG 59 1HG ARG 59 -29.253 5.659 -30.460 445 HG3 ARG 59 2HG ARG 59 -29.272 7.399 -30.755 446 HD2 ARG 59 1HD ARG 59 -27.018 6.717 -32.065 447 HD3 ARG 59 2HD ARG 59 -27.946 5.229 -32.251 448 HE ARG 59 HE ARG 59 -29.663 7.275 -32.921 449 HH11 ARG 59 1HH1 ARG 59 -26.595 6.074 -34.045 450 HH12 ARG 59 2HH1 ARG 59 -26.851 6.576 -35.683 451 HH21 ARG 59 1HH2 ARG 59 -30.013 7.940 -35.074 452 HH22 ARG 59 2HH2 ARG 59 -28.795 7.638 -36.267 453 H ILE 60 H ILE 60 -28.960 8.288 -27.636 454 HA ILE 60 HA ILE 60 -27.106 9.200 -25.552 455 HB ILE 60 HB ILE 60 -30.126 9.219 -25.539 456 HG12 ILE 60 1HG1 ILE 60 -29.248 10.768 -27.205 457 HG13 ILE 60 2HG1 ILE 60 -29.886 11.663 -25.830 458 HG21 ILE 60 1HG2 ILE 60 -29.594 10.923 -23.645 459 HG22 ILE 60 2HG2 ILE 60 -29.551 9.194 -23.306 460 HG23 ILE 60 3HG2 ILE 60 -28.048 10.077 -23.573 461 HD11 ILE 60 1HD1 ILE 60 -27.965 12.775 -25.879 462 HD12 ILE 60 2HD1 ILE 60 -27.245 11.329 -25.172 463 HD13 ILE 60 3HD1 ILE 60 -27.197 11.575 -26.917 464 H GLY 61 H GLY 61 -29.762 6.881 -26.057 465 HA2 GLY 61 1HA GLY 61 -29.704 5.581 -23.619 466 HA3 GLY 61 2HA GLY 61 -30.137 4.810 -25.138 467 H HIS 62 H HIS 62 -27.460 5.310 -26.283 468 HA HIS 62 HA HIS 62 -26.206 2.921 -25.289 469 HB2 HIS 62 1HB HIS 62 -25.298 4.901 -27.389 470 HB3 HIS 62 2HB HIS 62 -24.528 3.352 -27.059 471 HD1 HIS 62 HD1 HIS 62 -25.971 4.301 -29.776 472 HD2 HIS 62 HD2 HIS 62 -27.465 1.675 -26.924 473 HE1 HIS 62 HE1 HIS 62 -27.665 2.888 -30.985 474 H GLN 63 H GLN 63 -25.360 6.370 -25.389 475 HA GLN 63 HA GLN 63 -22.855 6.269 -24.237 476 HB2 GLN 63 1HB GLN 63 -25.025 8.350 -23.976 477 HB3 GLN 63 2HB GLN 63 -23.393 8.581 -23.363 478 HG2 GLN 63 1HG GLN 63 -22.479 8.405 -25.579 479 HG3 GLN 63 2HG GLN 63 -24.065 8.004 -26.238 480 HE21 GLN 63 2HE2 GLN 63 -22.181 10.224 -26.797 481 HE22 GLN 63 1HE2 GLN 63 -23.107 11.667 -26.588 482 H GLU 64 H GLU 64 -26.015 6.296 -22.648 483 HA GLU 64 HA GLU 64 -24.906 6.331 -20.003 484 HB2 GLU 64 1HB GLU 64 -27.661 5.970 -21.134 485 HB3 GLU 64 2HB GLU 64 -27.351 5.636 -19.436 486 HG2 GLU 64 1HG GLU 64 -26.207 8.065 -19.668 487 HG3 GLU 64 2HG GLU 64 -27.491 8.197 -20.868 488 H LEU 65 H LEU 65 -25.845 3.891 -22.297 489 HA LEU 65 HA LEU 65 -26.152 1.701 -20.578 490 HB2 LEU 65 1HB LEU 65 -25.791 2.151 -23.426 491 HB3 LEU 65 2HB LEU 65 -25.030 0.659 -22.879 492 HG LEU 65 HG LEU 65 -27.904 1.294 -22.271 493 HD11 LEU 65 1HD1 LEU 65 -27.118 -0.472 -24.542 494 HD12 LEU 65 2HD1 LEU 65 -27.218 1.271 -24.788 495 HD13 LEU 65 3HD1 LEU 65 -28.636 0.374 -24.246 496 HD21 LEU 65 1HD2 LEU 65 -26.493 -0.529 -21.093 497 HD22 LEU 65 2HD2 LEU 65 -26.661 -1.407 -22.614 498 HD23 LEU 65 3HD2 LEU 65 -28.097 -0.943 -21.700 499 H ILE 66 H ILE 66 -23.272 2.913 -22.268 500 HA ILE 66 HA ILE 66 -21.511 0.928 -21.288 501 HB ILE 66 HB ILE 66 -20.806 3.724 -22.182 502 HG12 ILE 66 1HG1 ILE 66 -20.909 1.188 -23.826 503 HG13 ILE 66 2HG1 ILE 66 -22.160 2.427 -23.841 504 HG21 ILE 66 1HG2 ILE 66 -18.739 3.138 -21.616 505 HG22 ILE 66 2HG2 ILE 66 -19.247 1.492 -21.242 506 HG23 ILE 66 3HG2 ILE 66 -18.801 1.923 -22.893 507 HD11 ILE 66 1HD1 ILE 66 -20.997 3.728 -25.220 508 HD12 ILE 66 2HD1 ILE 66 -19.491 3.476 -24.337 509 HD13 ILE 66 3HD1 ILE 66 -20.021 2.292 -25.531 510 H LEU 67 H LEU 67 -22.255 4.218 -20.189 511 HA LEU 67 HA LEU 67 -20.390 4.318 -18.092 512 HB2 LEU 67 1HB LEU 67 -23.063 5.692 -18.321 513 HB3 LEU 67 2HB LEU 67 -21.782 6.126 -17.191 514 HG LEU 67 HG LEU 67 -21.377 6.215 -20.168 515 HD11 LEU 67 1HD1 LEU 67 -21.927 8.718 -18.702 516 HD12 LEU 67 2HD1 LEU 67 -23.312 7.681 -19.040 517 HD13 LEU 67 3HD1 LEU 67 -22.305 8.265 -20.364 518 HD21 LEU 67 1HD2 LEU 67 -20.017 7.623 -17.873 519 HD22 LEU 67 2HD2 LEU 67 -19.594 7.760 -19.580 520 HD23 LEU 67 3HD2 LEU 67 -19.385 6.223 -18.739 521 H GLU 68 H GLU 68 -23.772 3.263 -18.167 522 HA GLU 68 HA GLU 68 -24.218 2.854 -15.474 523 HB2 GLU 68 1HB GLU 68 -25.984 2.613 -17.122 524 HB3 GLU 68 2HB GLU 68 -25.188 1.208 -17.815 525 HG2 GLU 68 1HG GLU 68 -25.739 -0.153 -16.025 526 HG3 GLU 68 2HG GLU 68 -26.017 1.213 -14.945 527 H ALA 69 H ALA 69 -22.318 0.965 -17.703 528 HA ALA 69 HA ALA 69 -22.026 -1.254 -15.861 529 HB1 ALA 69 1HB ALA 69 -20.624 -2.248 -17.576 530 HB2 ALA 69 2HB ALA 69 -22.130 -1.657 -18.280 531 HB3 ALA 69 3HB ALA 69 -20.639 -0.739 -18.489 532 H VAL 70 H VAL 70 -20.162 1.512 -16.979 533 HA VAL 70 HA VAL 70 -17.668 0.824 -15.911 534 HB VAL 70 HB VAL 70 -18.857 3.582 -16.241 535 HG11 VAL 70 1HG1 VAL 70 -16.007 2.682 -15.851 536 HG12 VAL 70 2HG1 VAL 70 -16.484 4.310 -16.337 537 HG13 VAL 70 3HG1 VAL 70 -16.966 3.682 -14.761 538 HG21 VAL 70 1HG2 VAL 70 -17.737 1.628 -18.117 539 HG22 VAL 70 2HG2 VAL 70 -18.801 3.003 -18.411 540 HG23 VAL 70 3HG2 VAL 70 -17.062 3.251 -18.258 541 H ASP 71 H ASP 71 -20.476 2.361 -14.445 542 HA ASP 71 HA ASP 71 -19.355 3.262 -12.069 543 HB2 ASP 71 1HB ASP 71 -21.816 3.387 -13.062 544 HB3 ASP 71 2HB ASP 71 -22.064 2.019 -11.981 545 H LEU 72 H LEU 72 -20.070 0.036 -13.111 546 HA LEU 72 HA LEU 72 -19.884 -1.100 -10.457 547 HB2 LEU 72 1HB LEU 72 -20.463 -2.085 -13.182 548 HB3 LEU 72 2HB LEU 72 -19.719 -3.237 -12.075 549 HG LEU 72 HG LEU 72 -22.208 -1.731 -11.331 550 HD11 LEU 72 1HD1 LEU 72 -22.098 -3.369 -13.526 551 HD12 LEU 72 2HD1 LEU 72 -23.539 -3.024 -12.570 552 HD13 LEU 72 3HD1 LEU 72 -22.590 -4.474 -12.241 553 HD21 LEU 72 1HD2 LEU 72 -21.302 -4.461 -10.468 554 HD22 LEU 72 2HD2 LEU 72 -22.480 -3.396 -9.700 555 HD23 LEU 72 3HD2 LEU 72 -20.763 -2.992 -9.653 556 H LEU 73 H LEU 73 -17.796 -0.472 -13.155 557 HA LEU 73 HA LEU 73 -15.733 -2.303 -12.489 558 HB2 LEU 73 1HB LEU 73 -16.105 -0.052 -14.335 559 HB3 LEU 73 2HB LEU 73 -14.443 -0.304 -13.806 560 HG LEU 73 HG LEU 73 -16.186 -2.350 -15.179 561 HD11 LEU 73 1HD1 LEU 73 -13.740 -0.972 -16.254 562 HD12 LEU 73 2HD1 LEU 73 -15.378 -0.395 -16.556 563 HD13 LEU 73 3HD1 LEU 73 -14.889 -1.993 -17.119 564 HD21 LEU 73 1HD2 LEU 73 -13.855 -3.459 -15.389 565 HD22 LEU 73 2HD2 LEU 73 -14.748 -3.613 -13.875 566 HD23 LEU 73 3HD2 LEU 73 -13.433 -2.444 -14.010 567 H CYS 74 H CYS 74 -16.256 1.128 -11.765 568 HA CYS 74 HA CYS 74 -13.831 1.337 -10.232 569 HB2 CYS 74 1HB CYS 74 -14.632 3.300 -11.391 570 HB3 CYS 74 2HB CYS 74 -16.181 3.209 -10.560 571 HG CYS 74 HG CYS 74 -14.833 3.603 -7.999 572 H ALA 75 H ALA 75 -17.269 0.962 -9.551 573 HA ALA 75 HA ALA 75 -17.183 1.346 -6.775 574 HB1 ALA 75 1HB ALA 75 -19.045 -0.361 -8.422 575 HB2 ALA 75 2HB ALA 75 -19.301 0.076 -6.732 576 HB3 ALA 75 3HB ALA 75 -19.278 1.329 -7.973 577 H LEU 76 H LEU 76 -16.932 -1.642 -8.690 578 HA LEU 76 HA LEU 76 -16.715 -3.448 -6.584 579 HB2 LEU 76 1HB LEU 76 -15.875 -3.425 -9.431 580 HB3 LEU 76 2HB LEU 76 -15.198 -4.674 -8.388 581 HG LEU 76 HG LEU 76 -18.150 -4.211 -8.806 582 HD11 LEU 76 1HD1 LEU 76 -18.125 -6.134 -10.246 583 HD12 LEU 76 2HD1 LEU 76 -16.396 -6.359 -9.986 584 HD13 LEU 76 3HD1 LEU 76 -16.979 -4.944 -10.863 585 HD21 LEU 76 1HD2 LEU 76 -16.562 -6.329 -7.374 586 HD22 LEU 76 2HD2 LEU 76 -18.254 -6.530 -7.828 587 HD23 LEU 76 3HD2 LEU 76 -17.787 -5.251 -6.706 588 H ASN 77 H ASN 77 -14.169 -1.663 -8.296 589 HA ASN 77 HA ASN 77 -11.991 -2.781 -6.911 590 HB2 ASN 77 1HB ASN 77 -12.444 -0.540 -8.739 591 HB3 ASN 77 2HB ASN 77 -11.158 -0.236 -7.575 592 HD21 ASN 77 2HD2 ASN 77 -12.199 -2.143 -10.267 593 HD22 ASN 77 1HD2 ASN 77 -10.678 -2.896 -10.589 594 H SER 78 H SER 78 -13.723 0.288 -6.394 595 HA SER 78 HA SER 78 -13.564 0.124 -3.578 596 HB2 SER 78 1HB SER 78 -12.063 2.306 -3.490 597 HB3 SER 78 2HB SER 78 -11.332 0.701 -3.501 598 HG SER 78 HG SER 78 -11.808 2.211 -5.851 599 H GLY 79 H GLY 79 -15.775 0.610 -3.936 600 HA2 GLY 79 1HA GLY 79 -16.417 3.242 -5.033 601 HA3 GLY 79 2HA GLY 79 -17.568 1.986 -4.602 602 HA PRO 80 HA PRO 80 -17.373 5.350 -1.309 603 HB2 PRO 80 1HB PRO 80 -19.937 6.201 -1.579 604 HB3 PRO 80 2HB PRO 80 -18.596 6.886 -2.504 605 HG2 PRO 80 1HG PRO 80 -20.613 4.833 -3.329 606 HG3 PRO 80 2HG PRO 80 -19.988 6.219 -4.243 607 HD2 PRO 80 1HD PRO 80 -19.097 3.693 -4.638 608 HD3 PRO 80 2HD PRO 80 -18.054 5.115 -4.838 609 H SER 81 H SER 81 -17.395 4.123 0.489 610 HA SER 81 HA SER 81 -18.124 2.786 2.182 611 HB2 SER 81 1HB SER 81 -20.885 3.727 1.385 612 HB3 SER 81 2HB SER 81 -20.368 3.158 2.972 613 HG SER 81 HG SER 81 -20.358 5.625 2.096 614 H SER 82 H SER 82 -17.484 1.164 0.324 615 HA SER 82 HA SER 82 -19.505 -0.343 -0.937 616 HB2 SER 82 1HB SER 82 -17.687 -2.084 -1.174 617 HB3 SER 82 2HB SER 82 -17.272 -0.485 -1.791 618 HG SER 82 HG SER 82 -15.932 -0.165 -0.115 619 H GLY 83 H GLY 83 -19.856 -2.719 -0.503 620 HA2 GLY 83 1HA GLY 83 -19.868 -3.307 2.384 621 HA3 GLY 83 2HA GLY 83 -21.352 -3.451 1.454
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