NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | position | program | type |
628389 | 5xo9 | 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 2HA GLY 1 1.667 -0.762 -1.895 3 HA3 GLY 1 3HA GLY 1 1.952 0.963 -1.723 4 H SER 2 H SER 2 3.155 -1.520 0.460 5 HA SER 2 HA SER 2 5.888 -0.813 -0.382 6 HB2 SER 2 2HB SER 2 4.705 -1.436 2.302 7 HB3 SER 2 3HB SER 2 6.413 -1.761 2.009 8 HG SER 2 HG SER 2 5.254 0.562 2.570 9 H LYS 3 H LYS 3 3.627 -3.376 0.164 10 HA LYS 3 HA LYS 3 5.675 -5.324 -0.668 11 HB2 LYS 3 2HB LYS 3 4.718 -6.991 0.727 12 HB3 LYS 3 3HB LYS 3 4.892 -5.554 1.726 13 HG2 LYS 3 2HG LYS 3 2.321 -5.519 0.493 14 HG3 LYS 3 3HG LYS 3 2.577 -7.087 1.262 15 HD2 LYS 3 2HD LYS 3 3.045 -6.051 3.368 16 HD3 LYS 3 3HD LYS 3 3.058 -4.445 2.634 17 HE2 LYS 3 2HE LYS 3 0.971 -4.844 3.829 18 HE3 LYS 3 3HE LYS 3 0.684 -4.670 2.098 19 HZ1 LYS 3 1HZ LYS 3 -0.354 -6.609 2.164 20 HZ2 LYS 3 2HZ LYS 3 0.060 -6.846 3.786 21 HZ3 LYS 3 3HZ LYS 3 1.105 -7.367 2.563 22 H LYS 4 H LYS 4 2.702 -3.856 -1.322 23 HA LYS 4 HA LYS 4 1.354 -5.934 -2.677 24 HB2 LYS 4 2HB LYS 4 1.135 -2.979 -2.529 25 HB3 LYS 4 3HB LYS 4 0.409 -3.751 -3.932 26 HG2 LYS 4 2HG LYS 4 -1.289 -4.586 -2.744 27 HG3 LYS 4 3HG LYS 4 -0.247 -5.048 -1.397 28 HD2 LYS 4 2HD LYS 4 -0.163 -2.589 -0.796 29 HD3 LYS 4 3HD LYS 4 -1.463 -2.354 -1.966 30 HE2 LYS 4 2HE LYS 4 -1.813 -4.488 0.064 31 HE3 LYS 4 3HE LYS 4 -1.923 -2.817 0.616 32 HZ1 LYS 4 1HZ LYS 4 -3.466 -2.714 -1.539 33 HZ2 LYS 4 2HZ LYS 4 -4.058 -3.085 0.001 34 HZ3 LYS 4 3HZ LYS 4 -3.721 -4.327 -1.096 35 HA PRO 5 HA PRO 5 3.300 -4.092 -6.703 36 HB2 PRO 5 2HB PRO 5 5.344 -2.333 -6.394 37 HB3 PRO 5 3HB PRO 5 3.651 -1.832 -6.480 38 HG2 PRO 5 2HG PRO 5 5.396 -2.208 -4.076 39 HG3 PRO 5 3HG PRO 5 4.244 -0.907 -4.430 40 HD2 PRO 5 2HD PRO 5 3.651 -2.969 -2.777 41 HD3 PRO 5 3HD PRO 5 2.427 -2.170 -3.785 42 H VAL 6 H VAL 6 5.470 -4.500 -3.943 43 HA VAL 6 HA VAL 6 7.290 -6.069 -5.644 44 HB VAL 6 HB VAL 6 8.483 -4.296 -4.587 45 HG11 VAL 6 1HG1 VAL 6 8.488 -3.943 -2.167 46 HG12 VAL 6 2HG1 VAL 6 6.865 -3.767 -2.837 47 HG13 VAL 6 3HG1 VAL 6 7.309 -5.239 -1.973 48 HG21 VAL 6 1HG2 VAL 6 10.079 -5.530 -3.164 49 HG22 VAL 6 2HG2 VAL 6 8.949 -6.883 -3.105 50 HG23 VAL 6 3HG2 VAL 6 9.671 -6.403 -4.641 51 HA PRO 7 HA PRO 7 5.480 -9.567 -3.505 52 HB2 PRO 7 2HB PRO 7 6.810 -11.444 -4.946 53 HB3 PRO 7 3HB PRO 7 5.385 -10.595 -5.557 54 HG2 PRO 7 2HG PRO 7 8.282 -10.070 -6.101 55 HG3 PRO 7 3HG PRO 7 6.914 -10.077 -7.231 56 HD2 PRO 7 2HD PRO 7 7.969 -7.790 -6.235 57 HD3 PRO 7 3HD PRO 7 6.246 -7.954 -6.633 58 H ILE 8 H ILE 8 7.184 -8.386 -1.879 59 HA ILE 8 HA ILE 8 9.456 -10.174 -1.417 60 HB ILE 8 HB ILE 8 9.831 -8.401 0.497 61 HG12 ILE 8 2HG1 ILE 8 7.999 -7.001 -1.451 62 HG13 ILE 8 3HG1 ILE 8 7.808 -7.153 0.292 63 HG21 ILE 8 1HG2 ILE 8 11.436 -8.711 -1.215 64 HG22 ILE 8 2HG2 ILE 8 10.373 -8.013 -2.436 65 HG23 ILE 8 3HG2 ILE 8 11.073 -6.986 -1.185 66 HD11 ILE 8 1HD1 ILE 8 8.520 -4.979 0.051 67 HD12 ILE 8 2HD1 ILE 8 10.029 -5.826 0.391 68 HD13 ILE 8 3HD1 ILE 8 9.625 -5.375 -1.265 69 H ILE 9 H ILE 9 9.075 -11.886 -0.183 70 HA ILE 9 HA ILE 9 7.454 -11.528 2.246 71 HB ILE 9 HB ILE 9 6.775 -13.994 1.877 72 HG12 ILE 9 2HG1 ILE 9 6.525 -14.544 -0.562 73 HG13 ILE 9 3HG1 ILE 9 7.554 -13.163 -0.925 74 HG21 ILE 9 1HG2 ILE 9 5.673 -11.521 0.718 75 HG22 ILE 9 2HG2 ILE 9 5.010 -13.027 0.086 76 HG23 ILE 9 3HG2 ILE 9 4.937 -12.690 1.815 77 HD11 ILE 9 1HD1 ILE 9 8.433 -15.696 -0.610 78 HD12 ILE 9 2HD1 ILE 9 9.424 -14.257 -0.363 79 HD13 ILE 9 3HD1 ILE 9 8.668 -15.056 1.016 80 H TYR 10 H TYR 10 7.737 -13.682 3.623 81 HA TYR 10 HA TYR 10 10.369 -14.842 3.478 82 HB2 TYR 10 2HB TYR 10 10.629 -13.997 6.019 83 HB3 TYR 10 3HB TYR 10 11.304 -13.128 4.645 84 HD1 TYR 10 HD1 TYR 10 7.693 -13.199 5.283 85 HD2 TYR 10 HD2 TYR 10 11.298 -10.997 5.794 86 HE1 TYR 10 HE1 TYR 10 6.384 -11.211 5.904 87 HE2 TYR 10 HE2 TYR 10 10.000 -9.004 6.417 88 HH TYR 10 HH TYR 10 6.545 -9.145 6.925 89 H CYS 11 H CYS 11 9.568 -16.870 3.598 90 HA CYS 11 HA CYS 11 7.621 -17.549 5.657 91 HB2 CYS 11 2HB CYS 11 8.798 -19.600 3.835 92 HB3 CYS 11 3HB CYS 11 7.153 -19.454 4.444 93 H ASN 12 H ASN 12 8.393 -17.950 7.621 94 HA ASN 12 HA ASN 12 11.071 -19.009 7.981 95 HB2 ASN 12 2HB ASN 12 9.021 -18.361 10.107 96 HB3 ASN 12 3HB ASN 12 10.758 -18.559 10.326 97 HD21 ASN 12 1HD2 ASN 12 11.373 -17.116 7.860 98 HD22 ASN 12 2HD2 ASN 12 11.117 -15.444 8.214 99 H ARG 13 H ARG 13 11.088 -21.132 7.386 100 HA ARG 13 HA ARG 13 9.149 -23.046 7.696 101 HB2 ARG 13 2HB ARG 13 12.148 -23.357 7.885 102 HB3 ARG 13 3HB ARG 13 11.029 -24.707 7.750 103 HG2 ARG 13 2HG ARG 13 11.445 -22.516 5.727 104 HG3 ARG 13 3HG ARG 13 11.979 -24.193 5.594 105 HD2 ARG 13 2HD ARG 13 9.144 -23.174 5.656 106 HD3 ARG 13 3HD ARG 13 9.981 -23.925 4.297 107 HE ARG 13 HE ARG 13 10.032 -25.761 6.365 108 HH11 ARG 13 1HH1 ARG 13 7.631 -24.126 4.445 109 HH12 ARG 13 2HH1 ARG 13 6.477 -25.413 4.557 110 HH21 ARG 13 1HH2 ARG 13 8.520 -27.462 6.520 111 HH22 ARG 13 2HH2 ARG 13 6.983 -27.310 5.738 112 H ARG 14 H ARG 14 11.402 -21.832 10.096 113 HA ARG 14 HA ARG 14 11.242 -23.730 12.073 114 HB2 ARG 14 2HB ARG 14 11.392 -21.699 13.669 115 HB3 ARG 14 3HB ARG 14 12.694 -21.963 12.517 116 HG2 ARG 14 2HG ARG 14 10.649 -20.304 11.362 117 HG3 ARG 14 3HG ARG 14 11.206 -19.636 12.897 118 HD2 ARG 14 2HD ARG 14 12.752 -18.707 11.501 119 HD3 ARG 14 3HD ARG 14 13.575 -20.220 11.881 120 HE ARG 14 HE ARG 14 11.892 -20.332 9.543 121 HH11 ARG 14 1HH1 ARG 14 15.070 -19.636 10.783 122 HH12 ARG 14 2HH1 ARG 14 15.863 -19.903 9.266 123 HH21 ARG 14 1HH2 ARG 14 12.925 -20.686 7.540 124 HH22 ARG 14 2HH2 ARG 14 14.642 -20.499 7.422 125 H THR 15 H THR 15 8.899 -21.209 11.288 126 HA THR 15 HA THR 15 7.032 -22.431 13.215 127 HB THR 15 HB THR 15 7.148 -20.288 14.023 128 HG1 THR 15 HG1 THR 15 4.998 -20.470 13.515 129 HG21 THR 15 1HG2 THR 15 7.869 -19.564 11.226 130 HG22 THR 15 2HG2 THR 15 8.666 -19.143 12.742 131 HG23 THR 15 3HG2 THR 15 7.185 -18.313 12.263 132 H GLY 16 H GLY 16 7.724 -22.494 10.068 133 HA2 GLY 16 2HA GLY 16 6.544 -22.898 8.137 134 HA3 GLY 16 3HA GLY 16 5.361 -23.636 9.208 135 H LYS 17 H LYS 17 6.411 -20.285 8.583 136 HA LYS 17 HA LYS 17 3.685 -19.629 7.750 137 HB2 LYS 17 2HB LYS 17 3.738 -17.583 9.192 138 HB3 LYS 17 3HB LYS 17 3.630 -19.094 10.085 139 HG2 LYS 17 2HG LYS 17 5.183 -17.849 11.279 140 HG3 LYS 17 3HG LYS 17 6.178 -18.928 10.298 141 HD2 LYS 17 2HD LYS 17 6.982 -17.237 9.012 142 HD3 LYS 17 3HD LYS 17 5.484 -16.308 9.108 143 HE2 LYS 17 2HE LYS 17 7.582 -16.574 11.259 144 HE3 LYS 17 3HE LYS 17 7.261 -15.147 10.275 145 HZ1 LYS 17 1HZ LYS 17 4.874 -15.462 11.283 146 HZ2 LYS 17 2HZ LYS 17 6.078 -14.631 12.131 147 HZ3 LYS 17 3HZ LYS 17 5.731 -16.241 12.516 148 H CYS 18 H CYS 18 3.520 -17.656 6.552 149 HA CYS 18 HA CYS 18 6.032 -16.413 5.724 150 HB2 CYS 18 2HB CYS 18 5.311 -18.373 4.176 151 HB3 CYS 18 3HB CYS 18 4.069 -17.259 3.614 152 H GLN 19 H GLN 19 5.849 -14.282 5.221 153 HA GLN 19 HA GLN 19 3.188 -13.132 4.854 154 HB2 GLN 19 2HB GLN 19 5.058 -11.777 6.758 155 HB3 GLN 19 3HB GLN 19 3.311 -11.632 6.622 156 HG2 GLN 19 2HG GLN 19 3.252 -12.938 8.423 157 HG3 GLN 19 3HG GLN 19 3.600 -14.253 7.302 158 HE21 GLN 19 1HE2 GLN 19 6.294 -13.412 6.760 159 HE22 GLN 19 2HE2 GLN 19 7.227 -13.776 8.168 160 H ARG 20 H ARG 20 3.407 -10.703 4.367 161 HA ARG 20 HA ARG 20 5.513 -10.428 2.361 162 HB2 ARG 20 2HB ARG 20 2.800 -9.325 2.742 163 HB3 ARG 20 3HB ARG 20 3.974 -8.215 2.049 164 HG2 ARG 20 2HG ARG 20 3.699 -10.960 0.917 165 HG3 ARG 20 3HG ARG 20 2.518 -9.715 0.505 166 HD2 ARG 20 2HD ARG 20 4.019 -8.495 -0.694 167 HD3 ARG 20 3HD ARG 20 5.382 -8.982 0.313 168 HE ARG 20 HE ARG 20 5.821 -10.582 -1.237 169 HH11 ARG 20 1HH1 ARG 20 2.415 -9.869 -1.348 170 HH12 ARG 20 2HH1 ARG 20 2.094 -10.966 -2.650 171 HH21 ARG 20 1HH2 ARG 20 5.411 -12.031 -2.951 172 HH22 ARG 20 2HH2 ARG 20 3.799 -12.197 -3.560 173 H MET 21 H MET 21 6.591 -8.323 2.112 174 HA MET 21 HA MET 21 7.395 -7.302 4.726 175 HB2 MET 21 2HB MET 21 8.607 -6.692 2.028 176 HB3 MET 21 3HB MET 21 9.316 -6.375 3.606 177 HG2 MET 21 2HG MET 21 9.088 -8.963 3.894 178 HG3 MET 21 3HG MET 21 9.040 -8.944 2.133 179 HE1 MET 21 1HE MET 21 11.648 -10.594 2.629 180 HE2 MET 21 2HE MET 21 10.822 -9.888 1.240 181 HE3 MET 21 3HE MET 21 12.538 -9.571 1.500 182 H1 GLY 33 H GLY 33 23.026 -22.721 7.067 183 HA2 GLY 33 2HA GLY 33 22.767 -24.117 5.258 184 HA3 GLY 33 3HA GLY 33 23.227 -25.451 6.306 185 H SER 34 H SER 34 20.471 -23.230 6.552 186 HA SER 34 HA SER 34 18.700 -25.581 6.400 187 HB2 SER 34 2HB SER 34 18.934 -23.934 8.524 188 HB3 SER 34 3HB SER 34 17.682 -23.078 7.624 189 HG SER 34 HG SER 34 16.431 -24.948 7.660 190 H LYS 35 H LYS 35 19.416 -22.441 5.142 191 HA LYS 35 HA LYS 35 16.905 -22.130 3.759 192 HB2 LYS 35 2HB LYS 35 18.106 -20.198 2.661 193 HB3 LYS 35 3HB LYS 35 17.976 -20.111 4.413 194 HG2 LYS 35 2HG LYS 35 20.393 -21.444 3.826 195 HG3 LYS 35 3HG LYS 35 20.306 -20.024 2.782 196 HD2 LYS 35 2HD LYS 35 19.924 -18.598 4.707 197 HD3 LYS 35 3HD LYS 35 19.902 -20.005 5.773 198 HE2 LYS 35 2HE LYS 35 22.062 -19.277 6.057 199 HE3 LYS 35 3HE LYS 35 22.271 -20.437 4.746 200 HZ1 LYS 35 1HZ LYS 35 22.282 -17.491 4.622 201 HZ2 LYS 35 2HZ LYS 35 21.936 -18.406 3.242 202 HZ3 LYS 35 3HZ LYS 35 23.426 -18.585 4.023 203 H LYS 36 H LYS 36 19.544 -24.058 3.273 204 HA LYS 36 HA LYS 36 19.987 -23.841 0.495 205 HB2 LYS 36 2HB LYS 36 20.601 -25.823 2.614 206 HB3 LYS 36 3HB LYS 36 20.609 -26.420 0.959 207 HG2 LYS 36 2HG LYS 36 22.525 -25.382 0.468 208 HG3 LYS 36 3HG LYS 36 22.056 -23.907 1.317 209 HD2 LYS 36 2HD LYS 36 23.891 -24.711 2.528 210 HD3 LYS 36 3HD LYS 36 22.490 -25.231 3.467 211 HE2 LYS 36 2HE LYS 36 22.675 -27.407 2.075 212 HE3 LYS 36 3HE LYS 36 24.312 -26.852 1.728 213 HZ1 LYS 36 1HZ LYS 36 24.407 -28.262 3.616 214 HZ2 LYS 36 2HZ LYS 36 23.143 -27.445 4.389 215 HZ3 LYS 36 3HZ LYS 36 24.638 -26.682 4.176 216 HA PRO 37 HA PRO 37 16.851 -27.495 0.052 217 HB2 PRO 37 2HB PRO 37 15.325 -28.086 2.218 218 HB3 PRO 37 3HB PRO 37 16.895 -28.839 1.915 219 HG2 PRO 37 2HG PRO 37 16.205 -26.564 3.734 220 HG3 PRO 37 3HG PRO 37 17.275 -27.947 4.028 221 HD2 PRO 37 2HD PRO 37 18.214 -25.497 3.360 222 HD3 PRO 37 3HD PRO 37 19.030 -26.997 2.875 223 H VAL 38 H VAL 38 15.853 -24.928 2.284 224 HA VAL 38 HA VAL 38 13.338 -24.634 0.794 225 HB VAL 38 HB VAL 38 12.913 -24.829 3.123 226 HG11 VAL 38 1HG1 VAL 38 13.962 -23.311 4.785 227 HG12 VAL 38 2HG1 VAL 38 15.109 -24.405 4.008 228 HG13 VAL 38 3HG1 VAL 38 15.026 -22.714 3.512 229 HG21 VAL 38 1HG2 VAL 38 12.818 -21.912 2.358 230 HG22 VAL 38 2HG2 VAL 38 11.589 -23.125 2.000 231 HG23 VAL 38 3HG2 VAL 38 11.905 -22.657 3.671 232 HA PRO 39 HA PRO 39 15.348 -21.141 -1.165 233 HB2 PRO 39 2HB PRO 39 13.295 -20.598 -2.855 234 HB3 PRO 39 3HB PRO 39 14.449 -21.907 -3.135 235 HG2 PRO 39 2HG PRO 39 11.690 -22.029 -1.981 236 HG3 PRO 39 3HG PRO 39 12.459 -23.109 -3.158 237 HD2 PRO 39 2HD PRO 39 12.239 -23.735 -0.533 238 HD3 PRO 39 3HD PRO 39 13.606 -24.271 -1.531 239 H ILE 40 H ILE 40 14.654 -20.429 1.270 240 HA ILE 40 HA ILE 40 12.544 -18.404 1.101 241 HB ILE 40 HB ILE 40 13.167 -18.182 3.629 242 HG12 ILE 40 2HG1 ILE 40 14.392 -20.824 2.848 243 HG13 ILE 40 3HG1 ILE 40 15.142 -19.498 3.729 244 HG21 ILE 40 1HG2 ILE 40 11.694 -20.250 4.072 245 HG22 ILE 40 2HG2 ILE 40 11.027 -18.928 3.115 246 HG23 ILE 40 3HG2 ILE 40 11.621 -20.383 2.315 247 HD11 ILE 40 1HD1 ILE 40 13.385 -19.967 5.532 248 HD12 ILE 40 2HD1 ILE 40 13.143 -21.500 4.694 249 HD13 ILE 40 3HD1 ILE 40 14.727 -21.097 5.356 250 H ILE 41 H ILE 41 13.172 -16.463 0.434 251 HA ILE 41 HA ILE 41 15.693 -15.372 1.492 252 HB ILE 41 HB ILE 41 15.778 -14.059 -0.726 253 HG12 ILE 41 2HG1 ILE 41 14.860 -15.409 -2.648 254 HG13 ILE 41 3HG1 ILE 41 13.965 -16.360 -1.468 255 HG21 ILE 41 1HG2 ILE 41 17.571 -15.421 -0.582 256 HG22 ILE 41 2HG2 ILE 41 16.603 -16.825 -0.133 257 HG23 ILE 41 3HG2 ILE 41 16.710 -16.332 -1.823 258 HD11 ILE 41 1HD1 ILE 41 13.624 -13.435 -1.326 259 HD12 ILE 41 2HD1 ILE 41 12.939 -14.251 -2.732 260 HD13 ILE 41 3HD1 ILE 41 12.450 -14.732 -1.107 261 H TYR 42 H TYR 42 15.701 -12.868 0.891 262 HA TYR 42 HA TYR 42 13.110 -11.614 1.069 263 HB2 TYR 42 2HB TYR 42 14.123 -10.374 3.230 264 HB3 TYR 42 3HB TYR 42 13.079 -11.787 3.338 265 HD1 TYR 42 HD1 TYR 42 13.940 -12.460 5.496 266 HD2 TYR 42 HD2 TYR 42 16.544 -12.037 2.158 267 HE1 TYR 42 HE1 TYR 42 15.698 -13.666 6.722 268 HE2 TYR 42 HE2 TYR 42 18.308 -13.244 3.374 269 HH TYR 42 HH TYR 42 18.027 -14.005 6.742 270 H CYS 43 H CYS 43 13.517 -10.290 -0.614 271 HA CYS 43 HA CYS 43 16.026 -8.812 -0.734 272 HB2 CYS 43 2HB CYS 43 13.840 -8.404 -2.724 273 HB3 CYS 43 3HB CYS 43 15.583 -8.436 -2.965 274 H ASN 44 H ASN 44 16.084 -7.088 0.571 275 HA ASN 44 HA ASN 44 13.718 -5.519 1.107 276 HB2 ASN 44 2HB ASN 44 16.563 -4.936 1.945 277 HB3 ASN 44 3HB ASN 44 15.088 -4.291 2.659 278 HD21 ASN 44 1HD2 ASN 44 13.731 -6.888 2.453 279 HD22 ASN 44 2HD2 ASN 44 14.382 -7.855 3.728 280 H ARG 45 H ARG 45 13.098 -4.454 -0.726 281 HA ARG 45 HA ARG 45 14.638 -3.304 -2.681 282 HB2 ARG 45 2HB ARG 45 12.021 -2.290 -1.555 283 HB3 ARG 45 3HB ARG 45 12.727 -1.759 -3.075 284 HG2 ARG 45 2HG ARG 45 11.812 -4.549 -2.410 285 HG3 ARG 45 3HG ARG 45 10.999 -3.399 -3.474 286 HD2 ARG 45 2HD ARG 45 13.706 -4.659 -3.895 287 HD3 ARG 45 3HD ARG 45 12.230 -5.000 -4.797 288 HE ARG 45 HE ARG 45 14.039 -2.841 -5.230 289 HH11 ARG 45 1HH1 ARG 45 10.687 -3.764 -5.419 290 HH12 ARG 45 2HH1 ARG 45 10.306 -2.616 -6.660 291 HH21 ARG 45 1HH2 ARG 45 13.549 -1.325 -6.863 292 HH22 ARG 45 2HH2 ARG 45 11.935 -1.230 -7.481 293 H ARG 46 H ARG 46 13.875 -2.038 0.501 294 HA ARG 46 HA ARG 46 14.556 0.611 0.263 295 HB2 ARG 46 2HB ARG 46 15.434 0.334 2.676 296 HB3 ARG 46 3HB ARG 46 13.743 -0.024 2.354 297 HG2 ARG 46 2HG ARG 46 15.353 -2.380 2.002 298 HG3 ARG 46 3HG ARG 46 15.622 -1.668 3.595 299 HD2 ARG 46 2HD ARG 46 13.819 -3.038 4.008 300 HD3 ARG 46 3HD ARG 46 13.019 -1.509 3.649 301 HE ARG 46 HE ARG 46 13.395 -3.335 1.419 302 HH11 ARG 46 1HH1 ARG 46 11.278 -2.074 3.878 303 HH12 ARG 46 2HH1 ARG 46 9.829 -2.595 3.082 304 HH21 ARG 46 1HH2 ARG 46 11.496 -4.025 0.361 305 HH22 ARG 46 2HH2 ARG 46 9.955 -3.706 1.082 306 H THR 47 H THR 47 16.713 -2.163 0.626 307 HA THR 47 HA THR 47 19.002 -0.372 0.137 308 HB THR 47 HB THR 47 19.599 -1.311 2.138 309 HG1 THR 47 HG1 THR 47 21.333 -2.191 1.318 310 HG21 THR 47 1HG2 THR 47 19.106 -3.879 2.499 311 HG22 THR 47 2HG2 THR 47 17.860 -3.578 1.287 312 HG23 THR 47 3HG2 THR 47 17.863 -2.664 2.795 313 H GLY 48 H GLY 48 17.021 -2.327 -1.491 314 HA2 GLY 48 2HA GLY 48 17.172 -3.585 -3.408 315 HA3 GLY 48 3HA GLY 48 18.570 -2.581 -3.765 316 H LYS 49 H LYS 49 17.920 -5.130 -1.359 317 HA LYS 49 HA LYS 49 20.072 -6.728 -2.537 318 HB2 LYS 49 2HB LYS 49 20.977 -7.178 -0.247 319 HB3 LYS 49 3HB LYS 49 21.213 -5.527 -0.804 320 HG2 LYS 49 2HG LYS 49 20.548 -5.275 1.403 321 HG3 LYS 49 3HG LYS 49 19.063 -4.994 0.491 322 HD2 LYS 49 2HD LYS 49 18.089 -6.913 1.226 323 HD3 LYS 49 3HD LYS 49 19.622 -7.782 1.324 324 HE2 LYS 49 2HE LYS 49 18.593 -5.711 3.260 325 HE3 LYS 49 3HE LYS 49 18.722 -7.446 3.544 326 HZ1 LYS 49 1HZ LYS 49 20.851 -5.425 3.407 327 HZ2 LYS 49 2HZ LYS 49 21.208 -7.026 2.997 328 HZ3 LYS 49 3HZ LYS 49 20.617 -6.660 4.539 329 H CYS 50 H CYS 50 20.010 -8.966 -1.957 330 HA CYS 50 HA CYS 50 17.625 -9.890 -0.544 331 HB2 CYS 50 2HB CYS 50 17.253 -9.699 -3.103 332 HB3 CYS 50 3HB CYS 50 18.307 -11.105 -3.208 333 H GLN 51 H GLN 51 17.943 -11.727 0.597 334 HA GLN 51 HA GLN 51 20.280 -13.384 0.024 335 HB2 GLN 51 2HB GLN 51 19.796 -12.607 2.870 336 HB3 GLN 51 3HB GLN 51 21.277 -13.166 2.103 337 HG2 GLN 51 2HG GLN 51 21.903 -11.032 2.191 338 HG3 GLN 51 3HG GLN 51 20.835 -10.814 0.805 339 HE21 GLN 51 1HE2 GLN 51 18.408 -11.204 2.288 340 HE22 GLN 51 2HE2 GLN 51 18.174 -9.790 3.253 341 H ARG 52 H ARG 52 20.287 -15.331 1.591 342 HA ARG 52 HA ARG 52 17.595 -16.448 1.532 343 HB2 ARG 52 2HB ARG 52 20.347 -17.536 1.530 344 HB3 ARG 52 3HB ARG 52 19.140 -18.500 2.370 345 HG2 ARG 52 2HG ARG 52 18.563 -17.504 -0.380 346 HG3 ARG 52 3HG ARG 52 19.623 -18.898 -0.157 347 HD2 ARG 52 2HD ARG 52 17.939 -20.233 0.581 348 HD3 ARG 52 3HD ARG 52 17.069 -18.900 1.337 349 HE ARG 52 HE ARG 52 15.806 -18.796 -0.548 350 HH11 ARG 52 1HH1 ARG 52 18.922 -20.094 -1.399 351 HH12 ARG 52 2HH1 ARG 52 18.517 -20.319 -3.069 352 HH21 ARG 52 1HH2 ARG 52 15.261 -19.088 -2.743 353 HH22 ARG 52 2HH2 ARG 52 16.435 -19.746 -3.832 354 H MET 53 H MET 53 16.771 -17.684 3.348 355 HA MET 53 HA MET 53 17.388 -16.362 5.875 356 HB2 MET 53 2HB MET 53 15.161 -18.323 5.333 357 HB3 MET 53 3HB MET 53 15.287 -17.181 6.664 358 HG2 MET 53 2HG MET 53 15.397 -15.527 4.505 359 HG3 MET 53 3HG MET 53 14.317 -16.798 3.935 360 HE1 MET 53 1HE MET 53 11.166 -16.458 5.958 361 HE2 MET 53 2HE MET 53 11.857 -16.800 4.372 362 HE3 MET 53 3HE MET 53 12.366 -17.737 5.778 Start of MODEL 2 1 H1 GLY 1 H GLY 1 1.714 0.534 2.548 2 HA2 GLY 1 2HA GLY 1 1.243 -1.195 0.198 3 HA3 GLY 1 3HA GLY 1 1.348 0.555 0.074 4 H SER 2 H SER 2 3.355 -1.700 1.938 5 HA SER 2 HA SER 2 5.704 -0.604 0.556 6 HB2 SER 2 2HB SER 2 5.258 -0.786 3.223 7 HB3 SER 2 3HB SER 2 6.094 -2.313 2.941 8 HG SER 2 HG SER 2 7.388 -0.317 3.407 9 H LYS 3 H LYS 3 3.932 -3.525 1.177 10 HA LYS 3 HA LYS 3 5.944 -5.056 -0.338 11 HB2 LYS 3 2HB LYS 3 4.644 -7.049 0.754 12 HB3 LYS 3 3HB LYS 3 5.852 -6.172 1.683 13 HG2 LYS 3 2HG LYS 3 3.887 -6.571 3.027 14 HG3 LYS 3 3HG LYS 3 4.073 -4.842 2.723 15 HD2 LYS 3 2HD LYS 3 2.272 -4.773 1.269 16 HD3 LYS 3 3HD LYS 3 2.364 -6.499 0.912 17 HE2 LYS 3 2HE LYS 3 1.880 -6.396 3.638 18 HE3 LYS 3 3HE LYS 3 0.883 -5.099 2.980 19 HZ1 LYS 3 1HZ LYS 3 -0.571 -6.709 2.537 20 HZ2 LYS 3 2HZ LYS 3 0.566 -7.943 2.751 21 HZ3 LYS 3 3HZ LYS 3 0.451 -7.148 1.262 22 H LYS 4 H LYS 4 2.874 -3.713 -0.455 23 HA LYS 4 HA LYS 4 1.403 -5.611 -1.901 24 HB2 LYS 4 2HB LYS 4 1.284 -2.599 -1.825 25 HB3 LYS 4 3HB LYS 4 0.152 -3.564 -2.764 26 HG2 LYS 4 2HG LYS 4 0.493 -3.456 0.213 27 HG3 LYS 4 3HG LYS 4 -0.946 -3.109 -0.749 28 HD2 LYS 4 2HD LYS 4 -0.800 -5.574 -1.473 29 HD3 LYS 4 3HD LYS 4 0.293 -5.766 -0.100 30 HE2 LYS 4 2HE LYS 4 -2.582 -4.867 -0.059 31 HE3 LYS 4 3HE LYS 4 -1.905 -6.342 0.630 32 HZ1 LYS 4 1HZ LYS 4 -2.056 -3.718 1.754 33 HZ2 LYS 4 2HZ LYS 4 -0.483 -4.335 1.809 34 HZ3 LYS 4 3HZ LYS 4 -1.755 -5.199 2.515 35 HA PRO 5 HA PRO 5 3.038 -3.431 -5.901 36 HB2 PRO 5 2HB PRO 5 5.181 -1.790 -5.615 37 HB3 PRO 5 3HB PRO 5 3.512 -1.221 -5.492 38 HG2 PRO 5 2HG PRO 5 5.447 -1.904 -3.312 39 HG3 PRO 5 3HG PRO 5 4.329 -0.532 -3.426 40 HD2 PRO 5 2HD PRO 5 3.792 -2.728 -1.935 41 HD3 PRO 5 3HD PRO 5 2.521 -1.786 -2.740 42 H VAL 6 H VAL 6 5.537 -4.053 -3.455 43 HA VAL 6 HA VAL 6 7.095 -5.538 -5.450 44 HB VAL 6 HB VAL 6 8.458 -3.956 -4.325 45 HG11 VAL 6 1HG1 VAL 6 8.657 -3.884 -1.863 46 HG12 VAL 6 2HG1 VAL 6 7.041 -3.463 -2.432 47 HG13 VAL 6 3HG1 VAL 6 7.348 -5.059 -1.747 48 HG21 VAL 6 1HG2 VAL 6 8.855 -6.723 -3.204 49 HG22 VAL 6 2HG2 VAL 6 9.602 -6.022 -4.640 50 HG23 VAL 6 3HG2 VAL 6 10.038 -5.425 -3.039 51 HA PRO 7 HA PRO 7 5.407 -9.246 -3.622 52 HB2 PRO 7 2HB PRO 7 6.725 -10.966 -5.258 53 HB3 PRO 7 3HB PRO 7 5.289 -10.068 -5.764 54 HG2 PRO 7 2HG PRO 7 8.176 -9.477 -6.291 55 HG3 PRO 7 3HG PRO 7 6.794 -9.381 -7.398 56 HD2 PRO 7 2HD PRO 7 7.853 -7.198 -6.195 57 HD3 PRO 7 3HD PRO 7 6.126 -7.330 -6.585 58 H ILE 8 H ILE 8 7.082 -8.263 -1.878 59 HA ILE 8 HA ILE 8 9.357 -10.100 -1.621 60 HB ILE 8 HB ILE 8 9.789 -8.460 0.415 61 HG12 ILE 8 2HG1 ILE 8 8.073 -6.861 -1.490 62 HG13 ILE 8 3HG1 ILE 8 7.783 -7.148 0.222 63 HG21 ILE 8 1HG2 ILE 8 11.206 -7.111 -1.064 64 HG22 ILE 8 2HG2 ILE 8 11.312 -8.830 -1.441 65 HG23 ILE 8 3HG2 ILE 8 10.352 -7.762 -2.463 66 HD11 ILE 8 1HD1 ILE 8 10.035 -5.926 0.556 67 HD12 ILE 8 2HD1 ILE 8 9.757 -5.332 -1.081 68 HD13 ILE 8 3HD1 ILE 8 8.585 -4.990 0.192 69 H ILE 9 H ILE 9 8.875 -11.904 -0.553 70 HA ILE 9 HA ILE 9 7.296 -11.669 1.923 71 HB ILE 9 HB ILE 9 6.642 -14.118 1.415 72 HG12 ILE 9 2HG1 ILE 9 6.412 -14.537 -1.049 73 HG13 ILE 9 3HG1 ILE 9 7.422 -13.124 -1.333 74 HG21 ILE 9 1HG2 ILE 9 4.896 -13.035 -0.354 75 HG22 ILE 9 2HG2 ILE 9 4.777 -12.867 1.396 76 HG23 ILE 9 3HG2 ILE 9 5.521 -11.588 0.437 77 HD11 ILE 9 1HD1 ILE 9 8.342 -15.651 -1.162 78 HD12 ILE 9 2HD1 ILE 9 9.308 -14.216 -0.815 79 HD13 ILE 9 3HD1 ILE 9 8.553 -15.112 0.504 80 H TYR 10 H TYR 10 7.582 -13.898 3.180 81 HA TYR 10 HA TYR 10 10.237 -15.009 3.001 82 HB2 TYR 10 2HB TYR 10 10.431 -14.337 5.599 83 HB3 TYR 10 3HB TYR 10 11.115 -13.364 4.303 84 HD1 TYR 10 HD1 TYR 10 7.495 -13.551 4.880 85 HD2 TYR 10 HD2 TYR 10 11.045 -11.309 5.572 86 HE1 TYR 10 HE1 TYR 10 6.137 -11.634 5.608 87 HE2 TYR 10 HE2 TYR 10 9.696 -9.387 6.302 88 HH TYR 10 HH TYR 10 6.795 -9.454 7.314 89 H CYS 11 H CYS 11 9.479 -17.056 2.966 90 HA CYS 11 HA CYS 11 7.491 -17.913 4.912 91 HB2 CYS 11 2HB CYS 11 8.799 -19.814 3.016 92 HB3 CYS 11 3HB CYS 11 7.130 -19.759 3.574 93 H ASN 12 H ASN 12 8.182 -18.441 6.875 94 HA ASN 12 HA ASN 12 10.885 -19.323 7.345 95 HB2 ASN 12 2HB ASN 12 8.602 -19.206 9.323 96 HB3 ASN 12 3HB ASN 12 10.326 -19.239 9.684 97 HD21 ASN 12 1HD2 ASN 12 10.994 -17.408 7.529 98 HD22 ASN 12 2HD2 ASN 12 10.493 -15.840 8.055 99 H ARG 13 H ARG 13 11.277 -21.335 6.585 100 HA ARG 13 HA ARG 13 9.538 -23.476 6.429 101 HB2 ARG 13 2HB ARG 13 11.743 -24.859 6.660 102 HB3 ARG 13 3HB ARG 13 11.509 -23.809 5.269 103 HG2 ARG 13 2HG ARG 13 13.746 -23.551 6.105 104 HG3 ARG 13 3HG ARG 13 12.838 -22.067 6.399 105 HD2 ARG 13 2HD ARG 13 14.289 -22.879 8.302 106 HD3 ARG 13 3HD ARG 13 12.602 -22.552 8.697 107 HE ARG 13 HE ARG 13 12.515 -25.164 8.180 108 HH11 ARG 13 1HH1 ARG 13 14.744 -23.293 10.091 109 HH12 ARG 13 2HH1 ARG 13 15.089 -24.586 11.191 110 HH21 ARG 13 1HH2 ARG 13 12.961 -26.874 9.622 111 HH22 ARG 13 2HH2 ARG 13 14.075 -26.623 10.923 112 H ARG 14 H ARG 14 10.861 -22.050 9.208 113 HA ARG 14 HA ARG 14 11.030 -24.275 10.932 114 HB2 ARG 14 2HB ARG 14 10.349 -21.434 11.703 115 HB3 ARG 14 3HB ARG 14 11.045 -22.674 12.738 116 HG2 ARG 14 2HG ARG 14 13.043 -21.880 12.216 117 HG3 ARG 14 3HG ARG 14 12.788 -22.472 10.573 118 HD2 ARG 14 2HD ARG 14 11.477 -19.918 11.153 119 HD3 ARG 14 3HD ARG 14 13.237 -19.868 11.259 120 HE ARG 14 HE ARG 14 11.679 -20.571 8.866 121 HH11 ARG 14 1HH1 ARG 14 14.676 -19.663 10.387 122 HH12 ARG 14 2HH1 ARG 14 15.498 -19.368 8.890 123 HH21 ARG 14 1HH2 ARG 14 12.750 -20.187 6.889 124 HH22 ARG 14 2HH2 ARG 14 14.401 -19.666 6.901 125 H THR 15 H THR 15 8.362 -22.211 9.965 126 HA THR 15 HA THR 15 6.528 -24.032 11.368 127 HB THR 15 HB THR 15 6.483 -22.124 12.766 128 HG1 THR 15 HG1 THR 15 4.372 -22.004 12.699 129 HG21 THR 15 1HG2 THR 15 7.231 -20.166 12.010 130 HG22 THR 15 2HG2 THR 15 5.712 -19.964 11.136 131 HG23 THR 15 3HG2 THR 15 7.095 -20.715 10.340 132 H GLY 16 H GLY 16 7.535 -23.113 8.478 133 HA2 GLY 16 2HA GLY 16 6.637 -23.123 6.366 134 HA3 GLY 16 3HA GLY 16 5.330 -24.070 7.060 135 H LYS 17 H LYS 17 6.206 -20.759 7.909 136 HA LYS 17 HA LYS 17 3.571 -19.902 6.909 137 HB2 LYS 17 2HB LYS 17 5.222 -18.876 9.219 138 HB3 LYS 17 3HB LYS 17 3.804 -18.041 8.600 139 HG2 LYS 17 2HG LYS 17 4.004 -20.463 10.256 140 HG3 LYS 17 3HG LYS 17 2.763 -19.208 10.214 141 HD2 LYS 17 2HD LYS 17 2.053 -20.207 7.983 142 HD3 LYS 17 3HD LYS 17 3.083 -21.580 8.392 143 HE2 LYS 17 2HE LYS 17 1.344 -22.428 9.492 144 HE3 LYS 17 3HE LYS 17 1.567 -21.143 10.678 145 HZ1 LYS 17 1HZ LYS 17 0.124 -20.214 8.410 146 HZ2 LYS 17 2HZ LYS 17 -0.317 -20.190 10.043 147 HZ3 LYS 17 3HZ LYS 17 -0.642 -21.556 9.100 148 H CYS 18 H CYS 18 3.472 -18.322 5.429 149 HA CYS 18 HA CYS 18 5.925 -16.791 4.870 150 HB2 CYS 18 2HB CYS 18 5.177 -18.678 3.199 151 HB3 CYS 18 3HB CYS 18 4.005 -17.473 2.676 152 H GLN 19 H GLN 19 5.698 -14.637 4.628 153 HA GLN 19 HA GLN 19 3.028 -13.512 4.241 154 HB2 GLN 19 2HB GLN 19 4.779 -12.307 6.348 155 HB3 GLN 19 3HB GLN 19 3.037 -12.183 6.146 156 HG2 GLN 19 2HG GLN 19 2.933 -13.652 7.815 157 HG3 GLN 19 3HG GLN 19 3.348 -14.849 6.589 158 HE21 GLN 19 1HE2 GLN 19 6.051 -13.874 6.255 159 HE22 GLN 19 2HE2 GLN 19 6.932 -14.378 7.654 160 H ARG 20 H ARG 20 3.205 -11.046 3.989 161 HA ARG 20 HA ARG 20 5.380 -10.540 2.110 162 HB2 ARG 20 2HB ARG 20 2.643 -9.490 2.516 163 HB3 ARG 20 3HB ARG 20 3.832 -8.331 1.938 164 HG2 ARG 20 2HG ARG 20 3.551 -10.984 0.594 165 HG3 ARG 20 3HG ARG 20 2.420 -9.677 0.238 166 HD2 ARG 20 2HD ARG 20 3.990 -8.423 -0.824 167 HD3 ARG 20 3HD ARG 20 5.303 -9.008 0.197 168 HE ARG 20 HE ARG 20 5.770 -10.502 -1.449 169 HH11 ARG 20 1HH1 ARG 20 2.378 -9.737 -1.609 170 HH12 ARG 20 2HH1 ARG 20 2.082 -10.745 -2.987 171 HH21 ARG 20 1HH2 ARG 20 5.394 -11.832 -3.263 172 HH22 ARG 20 2HH2 ARG 20 3.798 -11.937 -3.926 173 H MET 21 H MET 21 6.543 -8.517 2.142 174 HA MET 21 HA MET 21 7.416 -7.828 4.780 175 HB2 MET 21 2HB MET 21 8.130 -6.704 2.069 176 HB3 MET 21 3HB MET 21 8.907 -6.219 3.570 177 HG2 MET 21 2HG MET 21 9.341 -8.783 3.823 178 HG3 MET 21 3HG MET 21 9.099 -8.785 2.078 179 HE1 MET 21 1HE MET 21 10.675 -6.409 4.695 180 HE2 MET 21 2HE MET 21 11.605 -7.876 5.002 181 HE3 MET 21 3HE MET 21 12.394 -6.460 4.303 182 H1 GLY 33 H GLY 33 19.070 -20.210 9.724 183 HA2 GLY 33 2HA GLY 33 17.700 -22.766 10.277 184 HA3 GLY 33 3HA GLY 33 16.978 -21.420 9.409 185 H SER 34 H SER 34 16.629 -23.530 8.047 186 HA SER 34 HA SER 34 18.916 -24.045 6.301 187 HB2 SER 34 2HB SER 34 16.199 -25.376 6.272 188 HB3 SER 34 3HB SER 34 17.663 -25.931 5.461 189 HG SER 34 HG SER 34 17.780 -27.071 7.257 190 H LYS 35 H LYS 35 19.121 -23.114 4.379 191 HA LYS 35 HA LYS 35 16.726 -21.959 3.110 192 HB2 LYS 35 2HB LYS 35 18.000 -20.066 2.374 193 HB3 LYS 35 3HB LYS 35 18.240 -20.234 4.108 194 HG2 LYS 35 2HG LYS 35 20.261 -21.711 2.732 195 HG3 LYS 35 3HG LYS 35 20.191 -20.068 2.091 196 HD2 LYS 35 2HD LYS 35 20.467 -19.141 4.294 197 HD3 LYS 35 3HD LYS 35 20.353 -20.743 5.027 198 HE2 LYS 35 2HE LYS 35 22.671 -19.994 4.908 199 HE3 LYS 35 3HE LYS 35 22.411 -21.412 3.893 200 HZ1 LYS 35 1HZ LYS 35 22.402 -20.068 1.956 201 HZ2 LYS 35 2HZ LYS 35 23.762 -19.617 2.855 202 HZ3 LYS 35 3HZ LYS 35 22.385 -18.634 2.855 203 H LYS 36 H LYS 36 19.425 -23.994 2.843 204 HA LYS 36 HA LYS 36 19.945 -23.847 0.075 205 HB2 LYS 36 2HB LYS 36 20.533 -25.755 2.267 206 HB3 LYS 36 3HB LYS 36 20.600 -26.401 0.632 207 HG2 LYS 36 2HG LYS 36 22.511 -25.344 0.165 208 HG3 LYS 36 3HG LYS 36 21.990 -23.851 0.950 209 HD2 LYS 36 2HD LYS 36 23.800 -24.578 2.242 210 HD3 LYS 36 3HD LYS 36 22.383 -25.100 3.155 211 HE2 LYS 36 2HE LYS 36 22.696 -27.325 2.620 212 HE3 LYS 36 3HE LYS 36 23.626 -26.952 1.169 213 HZ1 LYS 36 1HZ LYS 36 25.145 -25.923 3.160 214 HZ2 LYS 36 2HZ LYS 36 25.391 -27.424 2.420 215 HZ3 LYS 36 3HZ LYS 36 24.525 -27.327 3.871 216 HA PRO 37 HA PRO 37 16.899 -27.575 -0.368 217 HB2 PRO 37 2HB PRO 37 15.327 -28.152 1.769 218 HB3 PRO 37 3HB PRO 37 16.921 -28.876 1.526 219 HG2 PRO 37 2HG PRO 37 16.131 -26.577 3.273 220 HG3 PRO 37 3HG PRO 37 17.222 -27.929 3.628 221 HD2 PRO 37 2HD PRO 37 18.125 -25.473 2.930 222 HD3 PRO 37 3HD PRO 37 18.987 -26.965 2.502 223 H VAL 38 H VAL 38 15.860 -24.899 1.688 224 HA VAL 38 HA VAL 38 13.355 -24.722 0.154 225 HB VAL 38 HB VAL 38 12.909 -24.876 2.500 226 HG11 VAL 38 1HG1 VAL 38 14.784 -22.543 2.877 227 HG12 VAL 38 2HG1 VAL 38 13.842 -23.338 4.140 228 HG13 VAL 38 3HG1 VAL 38 15.126 -24.218 3.310 229 HG21 VAL 38 1HG2 VAL 38 12.652 -22.004 1.612 230 HG22 VAL 38 2HG2 VAL 38 11.520 -23.306 1.246 231 HG23 VAL 38 3HG2 VAL 38 11.736 -22.768 2.912 232 HA PRO 39 HA PRO 39 15.385 -21.251 -1.832 233 HB2 PRO 39 2HB PRO 39 13.399 -20.811 -3.630 234 HB3 PRO 39 3HB PRO 39 14.595 -22.100 -3.815 235 HG2 PRO 39 2HG PRO 39 11.789 -22.254 -2.783 236 HG3 PRO 39 3HG PRO 39 12.636 -23.351 -3.890 237 HD2 PRO 39 2HD PRO 39 12.311 -23.900 -1.258 238 HD3 PRO 39 3HD PRO 39 13.734 -24.433 -2.176 239 H ILE 40 H ILE 40 14.619 -20.437 0.520 240 HA ILE 40 HA ILE 40 12.475 -18.459 0.177 241 HB ILE 40 HB ILE 40 12.902 -18.189 2.739 242 HG12 ILE 40 2HG1 ILE 40 14.178 -20.853 2.118 243 HG13 ILE 40 3HG1 ILE 40 14.883 -19.495 2.988 244 HG21 ILE 40 1HG2 ILE 40 11.404 -20.240 3.118 245 HG22 ILE 40 2HG2 ILE 40 10.813 -18.964 2.055 246 HG23 ILE 40 3HG2 ILE 40 11.482 -20.444 1.368 247 HD11 ILE 40 1HD1 ILE 40 12.874 -21.494 3.911 248 HD12 ILE 40 2HD1 ILE 40 14.369 -20.964 4.681 249 HD13 ILE 40 3HD1 ILE 40 12.959 -19.905 4.671 250 H ILE 41 H ILE 41 13.145 -16.526 -0.469 251 HA ILE 41 HA ILE 41 15.574 -15.406 0.758 252 HB ILE 41 HB ILE 41 15.823 -14.139 -1.483 253 HG12 ILE 41 2HG1 ILE 41 15.087 -15.534 -3.436 254 HG13 ILE 41 3HG1 ILE 41 14.140 -16.509 -2.318 255 HG21 ILE 41 1HG2 ILE 41 17.622 -15.458 -1.164 256 HG22 ILE 41 2HG2 ILE 41 16.649 -16.861 -0.726 257 HG23 ILE 41 3HG2 ILE 41 16.873 -16.439 -2.423 258 HD11 ILE 41 1HD1 ILE 41 13.186 -14.393 -3.687 259 HD12 ILE 41 2HD1 ILE 41 12.518 -14.973 -2.160 260 HD13 ILE 41 3HD1 ILE 41 13.651 -13.621 -2.171 261 H TYR 42 H TYR 42 15.625 -12.915 0.096 262 HA TYR 42 HA TYR 42 13.032 -11.663 0.022 263 HB2 TYR 42 2HB TYR 42 13.839 -10.385 2.247 264 HB3 TYR 42 3HB TYR 42 12.787 -11.795 2.279 265 HD1 TYR 42 HD1 TYR 42 16.345 -12.074 1.432 266 HD2 TYR 42 HD2 TYR 42 13.441 -12.427 4.522 267 HE1 TYR 42 HE1 TYR 42 17.985 -13.260 2.830 268 HE2 TYR 42 HE2 TYR 42 15.073 -13.613 5.929 269 HH TYR 42 HH TYR 42 18.264 -13.579 5.470 270 H CYS 43 H CYS 43 13.580 -10.348 -1.624 271 HA CYS 43 HA CYS 43 16.098 -8.881 -1.544 272 HB2 CYS 43 2HB CYS 43 14.092 -8.493 -3.721 273 HB3 CYS 43 3HB CYS 43 15.850 -8.528 -3.810 274 H ASN 44 H ASN 44 16.065 -7.126 -0.287 275 HA ASN 44 HA ASN 44 13.663 -5.551 0.042 276 HB2 ASN 44 2HB ASN 44 16.432 -4.941 1.090 277 HB3 ASN 44 3HB ASN 44 14.899 -4.309 1.685 278 HD21 ASN 44 1HD2 ASN 44 13.574 -6.903 1.424 279 HD22 ASN 44 2HD2 ASN 44 14.145 -7.859 2.744 280 H ARG 45 H ARG 45 13.181 -4.488 -1.825 281 HA ARG 45 HA ARG 45 14.868 -3.380 -3.684 282 HB2 ARG 45 2HB ARG 45 12.194 -2.305 -2.768 283 HB3 ARG 45 3HB ARG 45 13.008 -1.851 -4.260 284 HG2 ARG 45 2HG ARG 45 11.996 -4.595 -3.542 285 HG3 ARG 45 3HG ARG 45 11.277 -3.477 -4.703 286 HD2 ARG 45 2HD ARG 45 13.963 -4.830 -4.892 287 HD3 ARG 45 3HD ARG 45 12.547 -5.128 -5.899 288 HE ARG 45 HE ARG 45 13.055 -2.493 -6.283 289 HH11 ARG 45 1HH1 ARG 45 14.983 -5.382 -6.528 290 HH12 ARG 45 2HH1 ARG 45 16.009 -4.748 -7.773 291 HH21 ARG 45 1HH2 ARG 45 14.399 -1.648 -7.921 292 HH22 ARG 45 2HH2 ARG 45 15.676 -2.624 -8.564 293 H ARG 46 H ARG 46 13.892 -2.071 -0.580 294 HA ARG 46 HA ARG 46 14.600 0.572 -0.799 295 HB2 ARG 46 2HB ARG 46 15.339 0.289 1.675 296 HB3 ARG 46 3HB ARG 46 13.659 -0.003 1.244 297 HG2 ARG 46 2HG ARG 46 15.238 -2.411 1.020 298 HG3 ARG 46 3HG ARG 46 15.345 -1.706 2.634 299 HD2 ARG 46 2HD ARG 46 13.490 -3.104 2.776 300 HD3 ARG 46 3HD ARG 46 12.784 -1.514 2.489 301 HE ARG 46 HE ARG 46 13.234 -3.327 0.228 302 HH11 ARG 46 1HH1 ARG 46 11.067 -1.577 2.317 303 HH12 ARG 46 2HH1 ARG 46 9.684 -1.820 1.302 304 HH21 ARG 46 1HH2 ARG 46 11.420 -3.653 -1.116 305 HH22 ARG 46 2HH2 ARG 46 9.886 -3.002 -0.650 306 H THR 47 H THR 47 16.716 -2.207 -0.273 307 HA THR 47 HA THR 47 19.038 -0.428 -0.636 308 HB THR 47 HB THR 47 19.504 -1.323 1.419 309 HG1 THR 47 HG1 THR 47 21.267 -2.067 0.408 310 HG21 THR 47 1HG2 THR 47 17.722 -2.652 1.997 311 HG22 THR 47 2HG2 THR 47 18.973 -3.881 1.804 312 HG23 THR 47 3HG2 THR 47 17.807 -3.599 0.512 313 H GLY 48 H GLY 48 17.164 -2.411 -2.350 314 HA2 GLY 48 2HA GLY 48 17.437 -3.715 -4.223 315 HA3 GLY 48 3HA GLY 48 18.855 -2.719 -4.511 316 H LYS 49 H LYS 49 18.048 -5.217 -2.100 317 HA LYS 49 HA LYS 49 20.269 -6.839 -3.100 318 HB2 LYS 49 2HB LYS 49 21.022 -7.237 -0.743 319 HB3 LYS 49 3HB LYS 49 21.306 -5.604 -1.329 320 HG2 LYS 49 2HG LYS 49 20.504 -5.289 0.824 321 HG3 LYS 49 3HG LYS 49 19.085 -5.019 -0.190 322 HD2 LYS 49 2HD LYS 49 18.049 -6.922 0.516 323 HD3 LYS 49 3HD LYS 49 19.569 -7.785 0.765 324 HE2 LYS 49 2HE LYS 49 18.403 -5.643 2.539 325 HE3 LYS 49 3HE LYS 49 18.486 -7.368 2.893 326 HZ1 LYS 49 1HZ LYS 49 20.308 -6.591 4.006 327 HZ2 LYS 49 2HZ LYS 49 20.634 -5.368 2.884 328 HZ3 LYS 49 3HZ LYS 49 21.019 -6.974 2.519 329 H CYS 50 H CYS 50 20.172 -9.063 -2.463 330 HA CYS 50 HA CYS 50 17.685 -9.948 -1.205 331 HB2 CYS 50 2HB CYS 50 17.545 -9.854 -3.799 332 HB3 CYS 50 3HB CYS 50 18.587 -11.272 -3.746 333 H GLN 51 H GLN 51 17.914 -11.734 0.032 334 HA GLN 51 HA GLN 51 20.324 -13.368 -0.264 335 HB2 GLN 51 2HB GLN 51 19.490 -12.558 2.492 336 HB3 GLN 51 3HB GLN 51 21.061 -13.103 1.918 337 HG2 GLN 51 2HG GLN 51 21.655 -10.965 2.001 338 HG3 GLN 51 3HG GLN 51 20.701 -10.771 0.531 339 HE21 GLN 51 1HE2 GLN 51 18.161 -11.157 1.769 340 HE22 GLN 51 2HE2 GLN 51 17.832 -9.752 2.719 341 H ARG 52 H ARG 52 20.192 -15.294 1.323 342 HA ARG 52 HA ARG 52 17.531 -16.455 0.999 343 HB2 ARG 52 2HB ARG 52 20.284 -17.496 1.168 344 HB3 ARG 52 3HB ARG 52 19.070 -18.475 1.980 345 HG2 ARG 52 2HG ARG 52 18.609 -17.549 -0.820 346 HG3 ARG 52 3HG ARG 52 19.652 -18.937 -0.501 347 HD2 ARG 52 2HD ARG 52 17.928 -20.245 0.206 348 HD3 ARG 52 3HD ARG 52 17.014 -18.880 0.847 349 HE ARG 52 HE ARG 52 15.872 -18.859 -1.117 350 HH11 ARG 52 1HH1 ARG 52 19.030 -20.198 -1.712 351 HH12 ARG 52 2HH1 ARG 52 18.729 -20.499 -3.391 352 HH21 ARG 52 1HH2 ARG 52 15.464 -19.250 -3.327 353 HH22 ARG 52 2HH2 ARG 52 16.701 -19.959 -4.309 354 H MET 53 H MET 53 16.564 -17.702 2.729 355 HA MET 53 HA MET 53 16.971 -16.403 5.313 356 HB2 MET 53 2HB MET 53 14.783 -18.345 4.581 357 HB3 MET 53 3HB MET 53 14.803 -17.194 5.910 358 HG2 MET 53 2HG MET 53 15.098 -15.540 3.784 359 HG3 MET 53 3HG MET 53 14.098 -16.816 3.094 360 HE1 MET 53 1HE MET 53 11.095 -16.829 5.681 361 HE2 MET 53 2HE MET 53 11.865 -17.691 4.349 362 HE3 MET 53 3HE MET 53 12.615 -17.684 5.946 Start of MODEL 3 1 H1 GLY 1 H GLY 1 2.538 1.831 0.358 2 HA2 GLY 1 2HA GLY 1 1.720 -0.680 -0.144 3 HA3 GLY 1 3HA GLY 1 2.064 -0.088 -1.763 4 H SER 2 H SER 2 3.337 -1.640 0.891 5 HA SER 2 HA SER 2 6.094 -0.967 0.101 6 HB2 SER 2 2HB SER 2 4.960 -1.864 2.750 7 HB3 SER 2 3HB SER 2 6.687 -1.909 2.397 8 HG SER 2 HG SER 2 6.105 0.452 1.717 9 H LYS 3 H LYS 3 3.755 -3.487 0.522 10 HA LYS 3 HA LYS 3 5.746 -5.454 -0.403 11 HB2 LYS 3 2HB LYS 3 4.592 -7.178 0.837 12 HB3 LYS 3 3HB LYS 3 5.011 -5.865 1.931 13 HG2 LYS 3 2HG LYS 3 2.311 -5.945 0.657 14 HG3 LYS 3 3HG LYS 3 2.665 -6.953 2.063 15 HD2 LYS 3 2HD LYS 3 2.513 -5.210 3.446 16 HD3 LYS 3 3HD LYS 3 3.595 -4.240 2.444 17 HE2 LYS 3 2HE LYS 3 1.880 -3.258 1.306 18 HE3 LYS 3 3HE LYS 3 0.826 -4.662 1.465 19 HZ1 LYS 3 1HZ LYS 3 0.935 -3.941 3.985 20 HZ2 LYS 3 2HZ LYS 3 -0.188 -3.267 2.914 21 HZ3 LYS 3 3HZ LYS 3 1.228 -2.423 3.296 22 H LYS 4 H LYS 4 2.668 -3.990 -0.849 23 HA LYS 4 HA LYS 4 1.391 -5.932 -2.425 24 HB2 LYS 4 2HB LYS 4 1.150 -2.919 -2.450 25 HB3 LYS 4 3HB LYS 4 0.070 -4.002 -3.319 26 HG2 LYS 4 2HG LYS 4 0.419 -3.745 -0.345 27 HG3 LYS 4 3HG LYS 4 -1.017 -3.388 -1.307 28 HD2 LYS 4 2HD LYS 4 -1.018 -5.840 -1.956 29 HD3 LYS 4 3HD LYS 4 0.191 -6.076 -0.692 30 HE2 LYS 4 2HE LYS 4 -1.298 -5.605 1.004 31 HE3 LYS 4 3HE LYS 4 -2.350 -4.652 -0.041 32 HZ1 LYS 4 1HZ LYS 4 -3.556 -6.568 0.237 33 HZ2 LYS 4 2HZ LYS 4 -2.194 -7.571 0.269 34 HZ3 LYS 4 3HZ LYS 4 -2.732 -6.923 -1.198 35 HA PRO 5 HA PRO 5 3.339 -3.617 -6.216 36 HB2 PRO 5 2HB PRO 5 5.479 -2.031 -5.690 37 HB3 PRO 5 3HB PRO 5 3.816 -1.433 -5.683 38 HG2 PRO 5 2HG PRO 5 5.548 -2.236 -3.378 39 HG3 PRO 5 3HG PRO 5 4.468 -0.838 -3.532 40 HD2 PRO 5 2HD PRO 5 3.771 -3.075 -2.176 41 HD3 PRO 5 3HD PRO 5 2.588 -2.079 -3.047 42 H VAL 6 H VAL 6 5.644 -4.340 -3.606 43 HA VAL 6 HA VAL 6 7.296 -5.834 -5.522 44 HB VAL 6 HB VAL 6 8.622 -4.270 -4.327 45 HG11 VAL 6 1HG1 VAL 6 7.099 -3.765 -2.512 46 HG12 VAL 6 2HG1 VAL 6 7.377 -5.357 -1.803 47 HG13 VAL 6 3HG1 VAL 6 8.687 -4.177 -1.866 48 HG21 VAL 6 1HG2 VAL 6 10.158 -5.718 -3.050 49 HG22 VAL 6 2HG2 VAL 6 8.946 -6.999 -3.080 50 HG23 VAL 6 3HG2 VAL 6 9.672 -6.437 -4.586 51 HA PRO 7 HA PRO 7 5.441 -9.505 -3.773 52 HB2 PRO 7 2HB PRO 7 6.771 -11.249 -5.373 53 HB3 PRO 7 3HB PRO 7 5.374 -10.315 -5.921 54 HG2 PRO 7 2HG PRO 7 8.289 -9.791 -6.351 55 HG3 PRO 7 3HG PRO 7 6.947 -9.657 -7.502 56 HD2 PRO 7 2HD PRO 7 8.017 -7.505 -6.255 57 HD3 PRO 7 3HD PRO 7 6.301 -7.594 -6.702 58 H ILE 8 H ILE 8 7.132 -8.526 -2.003 59 HA ILE 8 HA ILE 8 9.331 -10.437 -1.669 60 HB ILE 8 HB ILE 8 9.828 -8.839 0.340 61 HG12 ILE 8 2HG1 ILE 8 7.987 -7.199 -1.403 62 HG13 ILE 8 3HG1 ILE 8 7.845 -7.509 0.324 63 HG21 ILE 8 1HG2 ILE 8 11.408 -8.981 -1.369 64 HG22 ILE 8 2HG2 ILE 8 10.309 -8.305 -2.569 65 HG23 ILE 8 3HG2 ILE 8 10.996 -7.267 -1.320 66 HD11 ILE 8 1HD1 ILE 8 9.733 -5.688 -1.110 67 HD12 ILE 8 2HD1 ILE 8 8.617 -5.328 0.208 68 HD13 ILE 8 3HD1 ILE 8 10.078 -6.264 0.521 69 H ILE 9 H ILE 9 8.858 -12.202 -0.547 70 HA ILE 9 HA ILE 9 7.210 -11.923 1.874 71 HB ILE 9 HB ILE 9 6.456 -14.338 1.353 72 HG12 ILE 9 2HG1 ILE 9 6.244 -14.739 -1.122 73 HG13 ILE 9 3HG1 ILE 9 7.342 -13.387 -1.377 74 HG21 ILE 9 1HG2 ILE 9 4.773 -13.209 -0.428 75 HG22 ILE 9 2HG2 ILE 9 4.662 -12.978 1.316 76 HG23 ILE 9 3HG2 ILE 9 5.466 -11.768 0.317 77 HD11 ILE 9 1HD1 ILE 9 8.297 -15.461 0.472 78 HD12 ILE 9 2HD1 ILE 9 8.122 -15.950 -1.213 79 HD13 ILE 9 3HD1 ILE 9 9.150 -14.580 -0.794 80 H TYR 10 H TYR 10 7.390 -14.169 3.124 81 HA TYR 10 HA TYR 10 9.989 -15.400 2.970 82 HB2 TYR 10 2HB TYR 10 10.227 -14.723 5.556 83 HB3 TYR 10 3HB TYR 10 10.937 -13.775 4.254 84 HD1 TYR 10 HD1 TYR 10 7.317 -13.800 4.793 85 HD2 TYR 10 HD2 TYR 10 10.956 -11.746 5.594 86 HE1 TYR 10 HE1 TYR 10 6.038 -11.834 5.532 87 HE2 TYR 10 HE2 TYR 10 9.687 -9.775 6.337 88 HH TYR 10 HH TYR 10 7.548 -9.143 7.102 89 H CYS 11 H CYS 11 9.185 -17.419 2.986 90 HA CYS 11 HA CYS 11 7.115 -18.162 4.895 91 HB2 CYS 11 2HB CYS 11 7.301 -18.902 2.393 92 HB3 CYS 11 3HB CYS 11 8.438 -20.092 3.019 93 H ASN 12 H ASN 12 7.677 -18.761 6.873 94 HA ASN 12 HA ASN 12 10.351 -19.760 7.408 95 HB2 ASN 12 2HB ASN 12 8.099 -19.317 9.376 96 HB3 ASN 12 3HB ASN 12 9.815 -19.482 9.738 97 HD21 ASN 12 1HD2 ASN 12 10.597 -17.853 7.440 98 HD22 ASN 12 2HD2 ASN 12 10.256 -16.218 7.882 99 H ARG 13 H ARG 13 10.504 -21.837 6.695 100 HA ARG 13 HA ARG 13 8.580 -23.812 6.718 101 HB2 ARG 13 2HB ARG 13 10.577 -25.410 6.870 102 HB3 ARG 13 3HB ARG 13 10.546 -24.280 5.524 103 HG2 ARG 13 2HG ARG 13 12.742 -24.197 6.265 104 HG3 ARG 13 3HG ARG 13 12.001 -22.778 7.008 105 HD2 ARG 13 2HD ARG 13 13.504 -24.441 8.402 106 HD3 ARG 13 3HD ARG 13 12.089 -23.662 9.111 107 HE ARG 13 HE ARG 13 11.000 -25.702 9.140 108 HH11 ARG 13 1HH1 ARG 13 14.015 -25.955 7.418 109 HH12 ARG 13 2HH1 ARG 13 13.998 -27.687 7.380 110 HH21 ARG 13 1HH2 ARG 13 10.966 -27.982 9.097 111 HH22 ARG 13 2HH2 ARG 13 12.263 -28.839 8.334 112 H ARG 14 H ARG 14 10.416 -22.536 9.360 113 HA ARG 14 HA ARG 14 10.281 -24.644 11.182 114 HB2 ARG 14 2HB ARG 14 10.257 -22.711 12.909 115 HB3 ARG 14 3HB ARG 14 11.649 -22.884 11.848 116 HG2 ARG 14 2HG ARG 14 9.697 -21.201 10.604 117 HG3 ARG 14 3HG ARG 14 10.044 -20.619 12.233 118 HD2 ARG 14 2HD ARG 14 11.757 -19.577 11.198 119 HD3 ARG 14 3HD ARG 14 12.541 -21.145 11.387 120 HE ARG 14 HE ARG 14 11.096 -21.077 8.965 121 HH11 ARG 14 1HH1 ARG 14 13.970 -19.795 10.454 122 HH12 ARG 14 2HH1 ARG 14 14.827 -19.625 8.958 123 HH21 ARG 14 1HH2 ARG 14 12.214 -20.858 6.989 124 HH22 ARG 14 2HH2 ARG 14 13.827 -20.229 6.987 125 H THR 15 H THR 15 7.936 -22.106 10.439 126 HA THR 15 HA THR 15 5.975 -23.513 12.130 127 HB THR 15 HB THR 15 5.999 -21.433 13.102 128 HG1 THR 15 HG1 THR 15 4.228 -20.183 12.042 129 HG21 THR 15 1HG2 THR 15 7.549 -20.157 11.996 130 HG22 THR 15 2HG2 THR 15 6.074 -19.332 11.493 131 HG23 THR 15 3HG2 THR 15 6.852 -20.487 10.411 132 H GLY 16 H GLY 16 6.873 -23.312 9.039 133 HA2 GLY 16 2HA GLY 16 5.833 -23.614 7.013 134 HA3 GLY 16 3HA GLY 16 4.581 -24.419 7.948 135 H LYS 17 H LYS 17 5.673 -21.048 7.526 136 HA LYS 17 HA LYS 17 3.015 -20.335 6.558 137 HB2 LYS 17 2HB LYS 17 2.951 -18.380 8.141 138 HB3 LYS 17 3HB LYS 17 2.728 -19.953 8.896 139 HG2 LYS 17 2HG LYS 17 4.170 -18.842 10.335 140 HG3 LYS 17 3HG LYS 17 5.244 -19.863 9.376 141 HD2 LYS 17 2HD LYS 17 6.214 -18.097 8.339 142 HD3 LYS 17 3HD LYS 17 4.721 -17.155 8.316 143 HE2 LYS 17 2HE LYS 17 6.541 -17.594 10.681 144 HE3 LYS 17 3HE LYS 17 6.351 -16.100 9.765 145 HZ1 LYS 17 1HZ LYS 17 4.834 -15.588 11.295 146 HZ2 LYS 17 2HZ LYS 17 4.716 -17.176 11.865 147 HZ3 LYS 17 3HZ LYS 17 3.817 -16.694 10.516 148 H CYS 18 H CYS 18 2.941 -18.334 5.436 149 HA CYS 18 HA CYS 18 5.527 -17.058 4.901 150 HB2 CYS 18 2HB CYS 18 3.704 -17.483 2.584 151 HB3 CYS 18 3HB CYS 18 5.460 -17.366 2.625 152 H GLN 19 H GLN 19 5.439 -14.886 4.637 153 HA GLN 19 HA GLN 19 2.828 -13.612 4.271 154 HB2 GLN 19 2HB GLN 19 4.692 -12.465 6.307 155 HB3 GLN 19 3HB GLN 19 2.948 -12.285 6.165 156 HG2 GLN 19 2HG GLN 19 2.795 -13.764 7.809 157 HG3 GLN 19 3HG GLN 19 3.269 -14.979 6.623 158 HE21 GLN 19 1HE2 GLN 19 5.940 -14.168 6.281 159 HE22 GLN 19 2HE2 GLN 19 6.802 -14.531 7.733 160 H ARG 20 H ARG 20 3.147 -11.159 3.996 161 HA ARG 20 HA ARG 20 5.294 -10.801 2.049 162 HB2 ARG 20 2HB ARG 20 2.625 -9.621 2.496 163 HB3 ARG 20 3HB ARG 20 3.854 -8.501 1.923 164 HG2 ARG 20 2HG ARG 20 3.469 -11.119 0.543 165 HG3 ARG 20 3HG ARG 20 2.371 -9.776 0.223 166 HD2 ARG 20 2HD ARG 20 3.970 -8.539 -0.826 167 HD3 ARG 20 3HD ARG 20 5.278 -9.205 0.150 168 HE ARG 20 HE ARG 20 5.649 -10.677 -1.540 169 HH11 ARG 20 1HH1 ARG 20 2.297 -9.740 -1.633 170 HH12 ARG 20 2HH1 ARG 20 1.936 -10.687 -3.038 171 HH21 ARG 20 1HH2 ARG 20 5.185 -11.928 -3.390 172 HH22 ARG 20 2HH2 ARG 20 3.579 -11.932 -4.036 173 H MET 21 H MET 21 6.568 -8.844 2.026 174 HA MET 21 HA MET 21 7.357 -8.067 4.713 175 HB2 MET 21 2HB MET 21 8.600 -7.247 2.085 176 HB3 MET 21 3HB MET 21 9.318 -7.114 3.685 177 HG2 MET 21 2HG MET 21 8.880 -9.743 3.645 178 HG3 MET 21 3HG MET 21 9.042 -9.461 1.913 179 HE1 MET 21 1HE MET 21 11.771 -9.195 5.343 180 HE2 MET 21 2HE MET 21 11.821 -7.538 4.742 181 HE3 MET 21 3HE MET 21 10.276 -8.276 5.164 182 H1 GLY 33 H GLY 33 18.112 -20.449 9.929 183 HA2 GLY 33 2HA GLY 33 17.198 -23.174 10.600 184 HA3 GLY 33 3HA GLY 33 16.134 -22.036 9.787 185 H SER 34 H SER 34 16.457 -24.346 8.541 186 HA SER 34 HA SER 34 18.690 -24.392 6.752 187 HB2 SER 34 2HB SER 34 16.072 -25.883 6.480 188 HB3 SER 34 3HB SER 34 17.615 -26.297 5.733 189 HG SER 34 HG SER 34 16.970 -27.451 7.741 190 H LYS 35 H LYS 35 18.937 -23.324 4.908 191 HA LYS 35 HA LYS 35 16.543 -22.238 3.577 192 HB2 LYS 35 2HB LYS 35 17.792 -20.249 2.980 193 HB3 LYS 35 3HB LYS 35 17.832 -20.466 4.725 194 HG2 LYS 35 2HG LYS 35 20.083 -21.785 3.562 195 HG3 LYS 35 3HG LYS 35 19.998 -20.126 2.967 196 HD2 LYS 35 2HD LYS 35 19.919 -19.281 5.235 197 HD3 LYS 35 3HD LYS 35 19.879 -20.925 5.875 198 HE2 LYS 35 2HE LYS 35 22.095 -21.348 5.209 199 HE3 LYS 35 3HE LYS 35 22.130 -19.945 4.143 200 HZ1 LYS 35 1HZ LYS 35 22.594 -20.109 6.993 201 HZ2 LYS 35 2HZ LYS 35 21.630 -18.806 6.511 202 HZ3 LYS 35 3HZ LYS 35 23.181 -18.997 5.862 203 H LYS 36 H LYS 36 19.335 -24.127 3.339 204 HA LYS 36 HA LYS 36 20.026 -23.769 0.630 205 HB2 LYS 36 2HB LYS 36 20.544 -25.802 2.722 206 HB3 LYS 36 3HB LYS 36 20.728 -26.339 1.058 207 HG2 LYS 36 2HG LYS 36 22.629 -25.200 0.777 208 HG3 LYS 36 3HG LYS 36 22.012 -23.775 1.617 209 HD2 LYS 36 2HD LYS 36 23.768 -24.530 2.969 210 HD3 LYS 36 3HD LYS 36 22.314 -25.141 3.763 211 HE2 LYS 36 2HE LYS 36 22.947 -27.158 2.008 212 HE3 LYS 36 3HE LYS 36 24.531 -26.586 2.531 213 HZ1 LYS 36 1HZ LYS 36 22.859 -26.777 4.774 214 HZ2 LYS 36 2HZ LYS 36 24.261 -27.659 4.431 215 HZ3 LYS 36 3HZ LYS 36 22.754 -28.232 3.917 216 HA PRO 37 HA PRO 37 17.160 -27.551 -0.285 217 HB2 PRO 37 2HB PRO 37 15.487 -28.352 1.698 218 HB3 PRO 37 3HB PRO 37 17.121 -28.996 1.501 219 HG2 PRO 37 2HG PRO 37 16.135 -26.873 3.366 220 HG3 PRO 37 3HG PRO 37 17.257 -28.208 3.684 221 HD2 PRO 37 2HD PRO 37 18.099 -25.674 3.235 222 HD3 PRO 37 3HD PRO 37 19.046 -27.095 2.749 223 H VAL 38 H VAL 38 15.895 -25.080 1.895 224 HA VAL 38 HA VAL 38 13.475 -24.879 0.233 225 HB VAL 38 HB VAL 38 12.906 -25.215 2.532 226 HG11 VAL 38 1HG1 VAL 38 14.664 -22.851 3.183 227 HG12 VAL 38 2HG1 VAL 38 13.692 -23.776 4.329 228 HG13 VAL 38 3HG1 VAL 38 15.054 -24.540 3.508 229 HG21 VAL 38 1HG2 VAL 38 11.526 -23.612 1.323 230 HG22 VAL 38 2HG2 VAL 38 11.642 -23.174 3.027 231 HG23 VAL 38 3HG2 VAL 38 12.590 -22.299 1.826 232 HA PRO 39 HA PRO 39 15.473 -21.207 -1.388 233 HB2 PRO 39 2HB PRO 39 13.573 -20.710 -3.262 234 HB3 PRO 39 3HB PRO 39 14.826 -21.939 -3.468 235 HG2 PRO 39 2HG PRO 39 11.976 -22.264 -2.610 236 HG3 PRO 39 3HG PRO 39 12.924 -23.249 -3.740 237 HD2 PRO 39 2HD PRO 39 12.478 -23.996 -1.175 238 HD3 PRO 39 3HD PRO 39 13.968 -24.412 -2.045 239 H ILE 40 H ILE 40 14.557 -20.583 0.964 240 HA ILE 40 HA ILE 40 12.357 -18.666 0.640 241 HB ILE 40 HB ILE 40 12.645 -18.561 3.236 242 HG12 ILE 40 2HG1 ILE 40 14.030 -21.140 2.498 243 HG13 ILE 40 3HG1 ILE 40 14.654 -19.827 3.490 244 HG21 ILE 40 1HG2 ILE 40 11.377 -20.769 1.650 245 HG22 ILE 40 2HG2 ILE 40 11.186 -20.657 3.399 246 HG23 ILE 40 3HG2 ILE 40 10.621 -19.345 2.365 247 HD11 ILE 40 1HD1 ILE 40 12.680 -21.948 4.179 248 HD12 ILE 40 2HD1 ILE 40 14.104 -21.401 5.065 249 HD13 ILE 40 3HD1 ILE 40 12.648 -20.407 5.035 250 H ILE 41 H ILE 41 12.975 -16.666 0.174 251 HA ILE 41 HA ILE 41 15.308 -15.558 1.588 252 HB ILE 41 HB ILE 41 15.581 -14.102 -0.533 253 HG12 ILE 41 2HG1 ILE 41 14.973 -15.364 -2.617 254 HG13 ILE 41 3HG1 ILE 41 14.026 -16.459 -1.616 255 HG21 ILE 41 1HG2 ILE 41 16.492 -16.844 0.032 256 HG22 ILE 41 2HG2 ILE 41 16.758 -16.273 -1.614 257 HG23 ILE 41 3HG2 ILE 41 17.421 -15.373 -0.251 258 HD11 ILE 41 1HD1 ILE 41 13.044 -14.270 -2.851 259 HD12 ILE 41 2HD1 ILE 41 12.338 -15.003 -1.410 260 HD13 ILE 41 3HD1 ILE 41 13.414 -13.615 -1.256 261 H TYR 42 H TYR 42 15.282 -13.021 1.133 262 HA TYR 42 HA TYR 42 12.655 -11.854 1.048 263 HB2 TYR 42 2HB TYR 42 13.264 -10.757 3.412 264 HB3 TYR 42 3HB TYR 42 12.317 -12.234 3.273 265 HD1 TYR 42 HD1 TYR 42 15.896 -12.281 2.546 266 HD2 TYR 42 HD2 TYR 42 12.934 -12.924 5.532 267 HE1 TYR 42 HE1 TYR 42 17.552 -13.469 3.924 268 HE2 TYR 42 HE2 TYR 42 14.581 -14.113 6.919 269 HH TYR 42 HH TYR 42 17.957 -14.136 6.150 270 H CYS 43 H CYS 43 13.213 -10.355 -0.421 271 HA CYS 43 HA CYS 43 15.692 -8.860 -0.135 272 HB2 CYS 43 2HB CYS 43 14.555 -9.773 -2.343 273 HB3 CYS 43 3HB CYS 43 13.676 -8.249 -2.255 274 H ASN 44 H ASN 44 15.697 -7.190 1.215 275 HA ASN 44 HA ASN 44 13.277 -5.756 1.856 276 HB2 ASN 44 2HB ASN 44 16.100 -5.110 2.721 277 HB3 ASN 44 3HB ASN 44 14.604 -4.581 3.484 278 HD21 ASN 44 1HD2 ASN 44 13.334 -7.187 3.142 279 HD22 ASN 44 2HD2 ASN 44 14.045 -8.221 4.329 280 H ARG 45 H ARG 45 12.591 -4.575 0.127 281 HA ARG 45 HA ARG 45 14.021 -3.254 -1.785 282 HB2 ARG 45 2HB ARG 45 11.441 -2.412 -0.459 283 HB3 ARG 45 3HB ARG 45 12.082 -1.656 -1.912 284 HG2 ARG 45 2HG ARG 45 11.257 -4.536 -1.613 285 HG3 ARG 45 3HG ARG 45 10.383 -3.274 -2.484 286 HD2 ARG 45 2HD ARG 45 13.070 -4.455 -3.159 287 HD3 ARG 45 3HD ARG 45 11.576 -4.582 -4.087 288 HE ARG 45 HE ARG 45 12.038 -1.908 -3.962 289 HH11 ARG 45 1HH1 ARG 45 13.925 -4.652 -4.978 290 HH12 ARG 45 2HH1 ARG 45 14.826 -3.760 -6.158 291 HH21 ARG 45 1HH2 ARG 45 13.218 -0.723 -5.513 292 HH22 ARG 45 2HH2 ARG 45 14.424 -1.525 -6.461 293 H ARG 46 H ARG 46 13.474 -2.270 1.526 294 HA ARG 46 HA ARG 46 14.097 0.406 1.469 295 HB2 ARG 46 2HB ARG 46 15.077 -1.524 3.576 296 HB3 ARG 46 3HB ARG 46 14.775 0.197 3.773 297 HG2 ARG 46 2HG ARG 46 12.797 -0.430 4.583 298 HG3 ARG 46 3HG ARG 46 12.352 -0.712 2.899 299 HD2 ARG 46 2HD ARG 46 13.796 -2.920 4.192 300 HD3 ARG 46 3HD ARG 46 12.206 -2.574 4.871 301 HE ARG 46 HE ARG 46 12.790 -3.654 2.254 302 HH11 ARG 46 1HH1 ARG 46 10.442 -2.098 4.300 303 HH12 ARG 46 2HH1 ARG 46 9.083 -2.632 3.367 304 HH21 ARG 46 1HH2 ARG 46 11.009 -4.363 1.018 305 HH22 ARG 46 2HH2 ARG 46 9.406 -3.921 1.501 306 H THR 47 H THR 47 16.251 -2.343 1.195 307 HA THR 47 HA THR 47 18.444 -0.486 0.570 308 HB THR 47 HB THR 47 18.968 -1.270 2.771 309 HG1 THR 47 HG1 THR 47 20.662 -1.337 1.109 310 HG21 THR 47 1HG2 THR 47 17.598 -3.599 1.973 311 HG22 THR 47 2HG2 THR 47 18.291 -3.242 3.555 312 HG23 THR 47 3HG2 THR 47 19.250 -4.091 2.343 313 H GLY 48 H GLY 48 16.449 -2.608 -0.718 314 HA2 GLY 48 2HA GLY 48 16.503 -4.066 -2.495 315 HA3 GLY 48 3HA GLY 48 17.863 -3.093 -3.037 316 H LYS 49 H LYS 49 17.722 -5.077 -0.122 317 HA LYS 49 HA LYS 49 19.887 -6.726 -1.250 318 HB2 LYS 49 2HB LYS 49 19.308 -5.914 1.599 319 HB3 LYS 49 3HB LYS 49 20.466 -7.168 1.176 320 HG2 LYS 49 2HG LYS 49 20.679 -4.246 0.967 321 HG3 LYS 49 3HG LYS 49 21.926 -5.464 1.245 322 HD2 LYS 49 2HD LYS 49 21.671 -6.089 -1.195 323 HD3 LYS 49 3HD LYS 49 20.699 -4.626 -1.374 324 HE2 LYS 49 2HE LYS 49 22.693 -3.691 -1.865 325 HE3 LYS 49 3HE LYS 49 22.848 -3.611 -0.111 326 HZ1 LYS 49 1HZ LYS 49 23.963 -5.700 -1.900 327 HZ2 LYS 49 2HZ LYS 49 24.003 -5.777 -0.211 328 HZ3 LYS 49 3HZ LYS 49 24.832 -4.545 -1.020 329 H CYS 50 H CYS 50 19.597 -8.863 -1.419 330 HA CYS 50 HA CYS 50 17.216 -10.031 -0.131 331 HB2 CYS 50 2HB CYS 50 18.412 -11.202 -2.615 332 HB3 CYS 50 3HB CYS 50 16.756 -11.297 -2.023 333 H GLN 51 H GLN 51 17.478 -11.814 1.083 334 HA GLN 51 HA GLN 51 19.974 -13.328 0.885 335 HB2 GLN 51 2HB GLN 51 18.950 -12.616 3.606 336 HB3 GLN 51 3HB GLN 51 20.568 -13.106 3.120 337 HG2 GLN 51 2HG GLN 51 21.072 -10.947 3.319 338 HG3 GLN 51 3HG GLN 51 20.270 -10.768 1.760 339 HE21 GLN 51 1HE2 GLN 51 17.635 -11.317 2.848 340 HE22 GLN 51 2HE2 GLN 51 17.165 -9.902 3.720 341 H ARG 52 H ARG 52 19.862 -15.344 2.278 342 HA ARG 52 HA ARG 52 17.253 -16.575 1.848 343 HB2 ARG 52 2HB ARG 52 20.040 -17.532 2.072 344 HB3 ARG 52 3HB ARG 52 18.815 -18.598 2.746 345 HG2 ARG 52 2HG ARG 52 18.467 -17.489 -0.003 346 HG3 ARG 52 3HG ARG 52 19.544 -18.860 0.271 347 HD2 ARG 52 2HD ARG 52 17.838 -20.275 0.773 348 HD3 ARG 52 3HD ARG 52 16.851 -19.003 1.491 349 HE ARG 52 HE ARG 52 15.784 -18.850 -0.508 350 HH11 ARG 52 1HH1 ARG 52 19.013 -20.015 -1.088 351 HH12 ARG 52 2HH1 ARG 52 18.788 -20.174 -2.799 352 HH21 ARG 52 1HH2 ARG 52 15.476 -19.055 -2.759 353 HH22 ARG 52 2HH2 ARG 52 16.776 -19.627 -3.748 354 H MET 53 H MET 53 16.284 -17.938 3.483 355 HA MET 53 HA MET 53 16.482 -16.724 6.114 356 HB2 MET 53 2HB MET 53 14.597 -18.890 5.172 357 HB3 MET 53 3HB MET 53 14.441 -17.915 6.627 358 HG2 MET 53 2HG MET 53 14.509 -15.963 4.801 359 HG3 MET 53 3HG MET 53 13.819 -17.255 3.822 360 HE1 MET 53 1HE MET 53 13.902 -15.927 7.248 361 HE2 MET 53 2HE MET 53 12.384 -15.037 7.374 362 HE3 MET 53 3HE MET 53 12.480 -16.703 7.946 Start of MODEL 4 1 H1 GLY 1 H GLY 1 2.505 0.382 -0.951 2 HA2 GLY 1 2HA GLY 1 1.910 0.118 1.842 3 HA3 GLY 1 3HA GLY 1 1.646 -1.380 0.962 4 H SER 2 H SER 2 3.351 -2.096 2.509 5 HA SER 2 HA SER 2 6.043 -1.384 1.552 6 HB2 SER 2 2HB SER 2 4.993 -1.560 4.174 7 HB3 SER 2 3HB SER 2 6.107 -2.913 3.984 8 HG SER 2 HG SER 2 7.739 -1.566 3.843 9 H LYS 3 H LYS 3 3.751 -3.940 1.952 10 HA LYS 3 HA LYS 3 5.716 -5.847 0.861 11 HB2 LYS 3 2HB LYS 3 3.393 -6.988 2.262 12 HB3 LYS 3 3HB LYS 3 5.086 -7.461 2.315 13 HG2 LYS 3 2HG LYS 3 4.785 -6.738 4.458 14 HG3 LYS 3 3HG LYS 3 5.338 -5.245 3.695 15 HD2 LYS 3 2HD LYS 3 2.733 -4.948 3.272 16 HD3 LYS 3 3HD LYS 3 2.640 -5.992 4.692 17 HE2 LYS 3 2HE LYS 3 3.370 -4.378 6.077 18 HE3 LYS 3 3HE LYS 3 4.565 -3.792 4.921 19 HZ1 LYS 3 1HZ LYS 3 2.256 -3.048 3.768 20 HZ2 LYS 3 2HZ LYS 3 3.195 -2.049 4.758 21 HZ3 LYS 3 3HZ LYS 3 1.871 -2.878 5.407 22 H LYS 4 H LYS 4 2.594 -4.407 0.617 23 HA LYS 4 HA LYS 4 1.295 -6.267 -1.035 24 HB2 LYS 4 2HB LYS 4 1.007 -3.261 -0.900 25 HB3 LYS 4 3HB LYS 4 -0.100 -4.330 -1.751 26 HG2 LYS 4 2HG LYS 4 0.416 -4.209 1.209 27 HG3 LYS 4 3HG LYS 4 -1.070 -3.791 0.352 28 HD2 LYS 4 2HD LYS 4 -1.112 -6.209 -0.435 29 HD3 LYS 4 3HD LYS 4 0.144 -6.513 0.767 30 HE2 LYS 4 2HE LYS 4 -1.349 -6.558 2.418 31 HE3 LYS 4 3HE LYS 4 -2.045 -5.020 1.909 32 HZ1 LYS 4 1HZ LYS 4 -3.757 -6.600 1.758 33 HZ2 LYS 4 2HZ LYS 4 -2.772 -7.737 0.986 34 HZ3 LYS 4 3HZ LYS 4 -3.256 -6.341 0.163 35 HA PRO 5 HA PRO 5 3.086 -3.696 -4.738 36 HB2 PRO 5 2HB PRO 5 5.237 -2.133 -4.187 37 HB3 PRO 5 3HB PRO 5 3.572 -1.548 -4.083 38 HG2 PRO 5 2HG PRO 5 5.390 -2.486 -1.898 39 HG3 PRO 5 3HG PRO 5 4.299 -1.088 -1.923 40 HD2 PRO 5 2HD PRO 5 3.660 -3.413 -0.690 41 HD3 PRO 5 3HD PRO 5 2.442 -2.370 -1.452 42 H VAL 6 H VAL 6 5.548 -4.488 -2.288 43 HA VAL 6 HA VAL 6 7.101 -5.889 -4.347 44 HB VAL 6 HB VAL 6 8.463 -4.360 -3.142 45 HG11 VAL 6 1HG1 VAL 6 7.058 -3.961 -1.224 46 HG12 VAL 6 2HG1 VAL 6 7.348 -5.597 -0.628 47 HG13 VAL 6 3HG1 VAL 6 8.668 -4.428 -0.677 48 HG21 VAL 6 1HG2 VAL 6 9.620 -6.389 -3.566 49 HG22 VAL 6 2HG2 VAL 6 10.037 -5.904 -1.923 50 HG23 VAL 6 3HG2 VAL 6 8.859 -7.189 -2.191 51 HA PRO 7 HA PRO 7 5.381 -9.663 -2.685 52 HB2 PRO 7 2HB PRO 7 6.658 -11.313 -4.423 53 HB3 PRO 7 3HB PRO 7 5.225 -10.377 -4.864 54 HG2 PRO 7 2HG PRO 7 8.111 -9.789 -5.401 55 HG3 PRO 7 3HG PRO 7 6.715 -9.624 -6.482 56 HD2 PRO 7 2HD PRO 7 7.814 -7.514 -5.187 57 HD3 PRO 7 3HD PRO 7 6.080 -7.609 -5.559 58 H ILE 8 H ILE 8 7.056 -8.817 -0.896 59 HA ILE 8 HA ILE 8 9.356 -10.635 -0.781 60 HB ILE 8 HB ILE 8 9.673 -9.140 1.424 61 HG12 ILE 8 2HG1 ILE 8 8.084 -7.450 -0.511 62 HG13 ILE 8 3HG1 ILE 8 7.708 -7.790 1.175 63 HG21 ILE 8 1HG2 ILE 8 10.896 -9.392 -1.017 64 HG22 ILE 8 2HG2 ILE 8 10.551 -7.665 -0.932 65 HG23 ILE 8 3HG2 ILE 8 11.497 -8.439 0.339 66 HD11 ILE 8 1HD1 ILE 8 9.739 -5.938 0.025 67 HD12 ILE 8 2HD1 ILE 8 8.532 -5.649 1.279 68 HD13 ILE 8 3HD1 ILE 8 9.968 -6.606 1.641 69 H ILE 9 H ILE 9 8.631 -12.567 -0.056 70 HA ILE 9 HA ILE 9 7.321 -12.579 2.581 71 HB ILE 9 HB ILE 9 6.286 -14.808 1.761 72 HG12 ILE 9 2HG1 ILE 9 5.745 -14.733 -0.691 73 HG13 ILE 9 3HG1 ILE 9 6.913 -13.427 -0.856 74 HG21 ILE 9 1HG2 ILE 9 4.668 -13.299 2.235 75 HG22 ILE 9 2HG2 ILE 9 5.425 -12.023 1.283 76 HG23 ILE 9 3HG2 ILE 9 4.493 -13.287 0.480 77 HD11 ILE 9 1HD1 ILE 9 7.462 -16.053 -1.210 78 HD12 ILE 9 2HD1 ILE 9 8.657 -14.823 -0.798 79 HD13 ILE 9 3HD1 ILE 9 7.947 -15.823 0.469 80 H TYR 10 H TYR 10 7.417 -14.998 3.435 81 HA TYR 10 HA TYR 10 9.810 -16.430 2.744 82 HB2 TYR 10 2HB TYR 10 10.476 -16.157 5.336 83 HB3 TYR 10 3HB TYR 10 11.125 -15.127 4.066 84 HD1 TYR 10 HD1 TYR 10 11.584 -13.303 5.600 85 HD2 TYR 10 HD2 TYR 10 7.638 -14.829 5.149 86 HE1 TYR 10 HE1 TYR 10 10.693 -11.321 6.751 87 HE2 TYR 10 HE2 TYR 10 6.736 -12.851 6.298 88 HH TYR 10 HH TYR 10 8.819 -10.513 7.842 89 H CYS 11 H CYS 11 8.764 -18.334 2.620 90 HA CYS 11 HA CYS 11 6.950 -19.138 4.758 91 HB2 CYS 11 2HB CYS 11 7.590 -20.926 2.455 92 HB3 CYS 11 3HB CYS 11 6.061 -20.681 3.294 93 H ASN 12 H ASN 12 7.927 -19.944 6.504 94 HA ASN 12 HA ASN 12 10.416 -21.393 6.314 95 HB2 ASN 12 2HB ASN 12 8.682 -21.002 8.759 96 HB3 ASN 12 3HB ASN 12 10.393 -21.417 8.719 97 HD21 ASN 12 1HD2 ASN 12 10.927 -19.549 6.529 98 HD22 ASN 12 2HD2 ASN 12 10.922 -17.975 7.242 99 H ARG 13 H ARG 13 10.112 -23.335 5.321 100 HA ARG 13 HA ARG 13 7.988 -25.051 5.426 101 HB2 ARG 13 2HB ARG 13 10.881 -25.924 5.447 102 HB3 ARG 13 3HB ARG 13 9.511 -26.836 4.827 103 HG2 ARG 13 2HG ARG 13 10.597 -24.261 3.706 104 HG3 ARG 13 3HG ARG 13 10.774 -25.873 3.008 105 HD2 ARG 13 2HD ARG 13 8.155 -24.445 3.453 106 HD3 ARG 13 3HD ARG 13 9.006 -24.549 1.912 107 HE ARG 13 HE ARG 13 7.419 -26.594 3.158 108 HH11 ARG 13 1HH1 ARG 13 10.010 -25.950 0.924 109 HH12 ARG 13 2HH1 ARG 13 9.795 -27.428 0.046 110 HH21 ARG 13 1HH2 ARG 13 7.126 -28.543 2.010 111 HH22 ARG 13 2HH2 ARG 13 8.154 -28.902 0.664 112 H ARG 14 H ARG 14 10.423 -24.515 7.871 113 HA ARG 14 HA ARG 14 10.221 -26.746 9.453 114 HB2 ARG 14 2HB ARG 14 10.360 -23.893 10.445 115 HB3 ARG 14 3HB ARG 14 10.837 -25.329 11.342 116 HG2 ARG 14 2HG ARG 14 12.889 -24.822 10.612 117 HG3 ARG 14 3HG ARG 14 12.355 -25.587 9.114 118 HD2 ARG 14 2HD ARG 14 11.704 -22.720 9.475 119 HD3 ARG 14 3HD ARG 14 13.398 -23.128 9.200 120 HE ARG 14 HE ARG 14 11.299 -23.171 7.279 121 HH11 ARG 14 1HH1 ARG 14 14.262 -24.746 8.206 122 HH12 ARG 14 2HH1 ARG 14 14.630 -25.286 6.601 123 HH21 ARG 14 1HH2 ARG 14 11.772 -23.877 5.162 124 HH22 ARG 14 2HH2 ARG 14 13.213 -24.791 4.870 125 H THR 15 H THR 15 7.917 -24.142 9.076 126 HA THR 15 HA THR 15 6.020 -25.656 10.735 127 HB THR 15 HB THR 15 6.669 -23.854 12.160 128 HG1 THR 15 HG1 THR 15 4.440 -24.154 12.153 129 HG21 THR 15 1HG2 THR 15 7.194 -22.479 9.798 130 HG22 THR 15 2HG2 THR 15 7.354 -21.853 11.439 131 HG23 THR 15 3HG2 THR 15 5.861 -21.594 10.537 132 H GLY 16 H GLY 16 6.679 -24.756 7.743 133 HA2 GLY 16 2HA GLY 16 5.458 -24.368 5.837 134 HA3 GLY 16 3HA GLY 16 4.156 -25.189 6.684 135 H LYS 17 H LYS 17 5.656 -22.143 7.633 136 HA LYS 17 HA LYS 17 3.068 -20.819 7.149 137 HB2 LYS 17 2HB LYS 17 5.158 -20.294 9.266 138 HB3 LYS 17 3HB LYS 17 3.789 -19.233 8.963 139 HG2 LYS 17 2HG LYS 17 3.896 -21.856 10.300 140 HG3 LYS 17 3HG LYS 17 2.869 -20.456 10.617 141 HD2 LYS 17 2HD LYS 17 1.705 -21.056 8.411 142 HD3 LYS 17 3HD LYS 17 2.527 -22.612 8.553 143 HE2 LYS 17 2HE LYS 17 1.150 -21.709 10.986 144 HE3 LYS 17 3HE LYS 17 0.091 -22.041 9.617 145 HZ1 LYS 17 1HZ LYS 17 1.455 -23.867 11.311 146 HZ2 LYS 17 2HZ LYS 17 1.872 -24.135 9.694 147 HZ3 LYS 17 3HZ LYS 17 0.248 -24.169 10.165 148 H CYS 18 H CYS 18 3.013 -18.996 5.953 149 HA CYS 18 HA CYS 18 5.580 -17.799 5.148 150 HB2 CYS 18 2HB CYS 18 4.336 -19.327 3.420 151 HB3 CYS 18 3HB CYS 18 3.278 -17.932 3.232 152 H GLN 19 H GLN 19 5.674 -15.627 5.208 153 HA GLN 19 HA GLN 19 3.179 -14.103 5.406 154 HB2 GLN 19 2HB GLN 19 5.464 -13.414 7.216 155 HB3 GLN 19 3HB GLN 19 3.763 -12.999 7.371 156 HG2 GLN 19 2HG GLN 19 3.680 -14.622 8.887 157 HG3 GLN 19 3HG GLN 19 3.706 -15.726 7.513 158 HE21 GLN 19 1HE2 GLN 19 6.435 -15.115 6.793 159 HE22 GLN 19 2HE2 GLN 19 7.441 -15.877 7.974 160 H ARG 20 H ARG 20 3.659 -11.684 5.298 161 HA ARG 20 HA ARG 20 5.532 -11.268 3.097 162 HB2 ARG 20 2HB ARG 20 3.049 -9.989 4.027 163 HB3 ARG 20 3HB ARG 20 4.272 -8.871 3.438 164 HG2 ARG 20 2HG ARG 20 3.495 -11.269 1.828 165 HG3 ARG 20 3HG ARG 20 2.526 -9.794 1.790 166 HD2 ARG 20 2HD ARG 20 4.151 -8.591 0.724 167 HD3 ARG 20 3HD ARG 20 5.462 -9.542 1.420 168 HE ARG 20 HE ARG 20 5.425 -10.793 -0.477 169 HH11 ARG 20 1HH1 ARG 20 2.253 -9.437 -0.006 170 HH12 ARG 20 2HH1 ARG 20 1.604 -10.115 -1.463 171 HH21 ARG 20 1HH2 ARG 20 4.583 -11.691 -2.397 172 HH22 ARG 20 2HH2 ARG 20 2.930 -11.397 -2.821 173 H MET 21 H MET 21 6.722 -9.138 3.080 174 HA MET 21 HA MET 21 7.961 -8.740 5.711 175 HB2 MET 21 2HB MET 21 9.010 -8.027 2.967 176 HB3 MET 21 3HB MET 21 9.881 -7.838 4.482 177 HG2 MET 21 2HG MET 21 9.252 -10.462 4.594 178 HG3 MET 21 3HG MET 21 9.412 -10.233 2.854 179 HE1 MET 21 1HE MET 21 12.209 -8.287 5.554 180 HE2 MET 21 2HE MET 21 10.746 -9.113 6.093 181 HE3 MET 21 3HE MET 21 12.310 -9.920 6.212 182 H1 GLY 33 H GLY 33 17.683 -19.535 9.590 183 HA2 GLY 33 2HA GLY 33 18.241 -21.778 10.758 184 HA3 GLY 33 3HA GLY 33 16.653 -22.230 10.158 185 H SER 34 H SER 34 17.847 -23.947 9.058 186 HA SER 34 HA SER 34 19.810 -23.549 7.132 187 HB2 SER 34 2HB SER 34 18.925 -25.700 6.124 188 HB3 SER 34 3HB SER 34 19.329 -25.781 7.838 189 HG SER 34 HG SER 34 16.912 -26.078 6.594 190 H LYS 35 H LYS 35 19.824 -22.599 5.210 191 HA LYS 35 HA LYS 35 17.249 -22.160 3.842 192 HB2 LYS 35 2HB LYS 35 18.571 -20.134 2.838 193 HB3 LYS 35 3HB LYS 35 17.825 -20.002 4.425 194 HG2 LYS 35 2HG LYS 35 20.047 -19.057 4.459 195 HG3 LYS 35 3HG LYS 35 19.984 -20.501 5.473 196 HD2 LYS 35 2HD LYS 35 21.215 -21.768 3.958 197 HD3 LYS 35 3HD LYS 35 20.857 -20.683 2.612 198 HE2 LYS 35 2HE LYS 35 22.170 -19.052 4.396 199 HE3 LYS 35 3HE LYS 35 23.010 -20.591 4.577 200 HZ1 LYS 35 1HZ LYS 35 23.196 -18.712 2.480 201 HZ2 LYS 35 2HZ LYS 35 22.657 -20.190 1.858 202 HZ3 LYS 35 3HZ LYS 35 24.106 -20.117 2.729 203 H LYS 36 H LYS 36 20.193 -23.697 3.707 204 HA LYS 36 HA LYS 36 20.959 -23.428 1.021 205 HB2 LYS 36 2HB LYS 36 21.493 -25.338 3.215 206 HB3 LYS 36 3HB LYS 36 21.745 -25.958 1.589 207 HG2 LYS 36 2HG LYS 36 23.607 -24.759 1.294 208 HG3 LYS 36 3HG LYS 36 22.911 -23.317 2.036 209 HD2 LYS 36 2HD LYS 36 24.644 -23.913 3.484 210 HD3 LYS 36 3HD LYS 36 23.201 -24.568 4.261 211 HE2 LYS 36 2HE LYS 36 23.907 -26.666 2.728 212 HE3 LYS 36 3HE LYS 36 25.494 -25.955 3.020 213 HZ1 LYS 36 1HZ LYS 36 23.575 -27.053 4.971 214 HZ2 LYS 36 2HZ LYS 36 24.741 -25.930 5.459 215 HZ3 LYS 36 3HZ LYS 36 25.219 -27.405 4.782 216 HA PRO 37 HA PRO 37 18.349 -27.381 0.087 217 HB2 PRO 37 2HB PRO 37 16.681 -28.270 2.036 218 HB3 PRO 37 3HB PRO 37 18.359 -28.806 1.889 219 HG2 PRO 37 2HG PRO 37 17.185 -26.734 3.702 220 HG3 PRO 37 3HG PRO 37 18.384 -27.988 4.066 221 HD2 PRO 37 2HD PRO 37 19.068 -25.409 3.608 222 HD3 PRO 37 3HD PRO 37 20.119 -26.769 3.164 223 H VAL 38 H VAL 38 16.807 -25.054 2.267 224 HA VAL 38 HA VAL 38 14.410 -25.046 0.580 225 HB VAL 38 HB VAL 38 13.920 -25.249 2.921 226 HG11 VAL 38 1HG1 VAL 38 15.568 -22.750 3.288 227 HG12 VAL 38 2HG1 VAL 38 14.593 -23.515 4.544 228 HG13 VAL 38 3HG1 VAL 38 15.972 -24.371 3.853 229 HG21 VAL 38 1HG2 VAL 38 12.354 -23.907 1.678 230 HG22 VAL 38 2HG2 VAL 38 12.548 -23.214 3.288 231 HG23 VAL 38 3HG2 VAL 38 13.348 -22.468 1.905 232 HA PRO 39 HA PRO 39 16.112 -21.387 -1.357 233 HB2 PRO 39 2HB PRO 39 14.098 -21.100 -3.154 234 HB3 PRO 39 3HB PRO 39 15.397 -22.283 -3.349 235 HG2 PRO 39 2HG PRO 39 12.614 -22.679 -2.321 236 HG3 PRO 39 3HG PRO 39 13.550 -23.693 -3.435 237 HD2 PRO 39 2HD PRO 39 13.270 -24.289 -0.809 238 HD3 PRO 39 3HD PRO 39 14.734 -24.694 -1.730 239 H ILE 40 H ILE 40 15.327 -20.614 0.975 240 HA ILE 40 HA ILE 40 13.022 -18.818 0.641 241 HB ILE 40 HB ILE 40 13.485 -18.571 3.241 242 HG12 ILE 40 2HG1 ILE 40 14.642 -21.269 2.520 243 HG13 ILE 40 3HG1 ILE 40 15.454 -19.951 3.357 244 HG21 ILE 40 1HG2 ILE 40 11.652 -19.912 1.652 245 HG22 ILE 40 2HG2 ILE 40 12.161 -21.113 2.838 246 HG23 ILE 40 3HG2 ILE 40 11.499 -19.569 3.375 247 HD11 ILE 40 1HD1 ILE 40 13.537 -20.291 5.103 248 HD12 ILE 40 2HD1 ILE 40 13.448 -21.893 4.371 249 HD13 ILE 40 3HD1 ILE 40 14.956 -21.338 5.098 250 H ILE 41 H ILE 41 13.648 -16.885 -0.079 251 HA ILE 41 HA ILE 41 15.944 -15.599 1.246 252 HB ILE 41 HB ILE 41 16.131 -14.290 -0.982 253 HG12 ILE 41 2HG1 ILE 41 15.534 -15.720 -2.955 254 HG13 ILE 41 3HG1 ILE 41 14.651 -16.778 -1.859 255 HG21 ILE 41 1HG2 ILE 41 17.169 -16.916 -0.190 256 HG22 ILE 41 2HG2 ILE 41 17.342 -16.540 -1.904 257 HG23 ILE 41 3HG2 ILE 41 18.026 -15.458 -0.691 258 HD11 ILE 41 1HD1 ILE 41 12.907 -15.382 -1.724 259 HD12 ILE 41 2HD1 ILE 41 13.927 -13.943 -1.691 260 HD13 ILE 41 3HD1 ILE 41 13.556 -14.727 -3.227 261 H TYR 42 H TYR 42 15.840 -13.103 0.613 262 HA TYR 42 HA TYR 42 13.170 -12.024 0.515 263 HB2 TYR 42 2HB TYR 42 13.868 -10.718 2.763 264 HB3 TYR 42 3HB TYR 42 12.908 -12.193 2.768 265 HD1 TYR 42 HD1 TYR 42 16.489 -12.220 1.969 266 HD2 TYR 42 HD2 TYR 42 13.570 -12.820 5.006 267 HE1 TYR 42 HE1 TYR 42 18.186 -13.313 3.375 268 HE2 TYR 42 HE2 TYR 42 15.259 -13.913 6.421 269 HH TYR 42 HH TYR 42 18.601 -13.813 5.706 270 H CYS 43 H CYS 43 13.684 -10.695 -1.140 271 HA CYS 43 HA CYS 43 16.085 -9.051 -1.002 272 HB2 CYS 43 2HB CYS 43 14.084 -8.800 -3.207 273 HB3 CYS 43 3HB CYS 43 15.840 -8.688 -3.271 274 H ASN 44 H ASN 44 15.958 -7.257 0.175 275 HA ASN 44 HA ASN 44 13.453 -5.888 0.589 276 HB2 ASN 44 2HB ASN 44 16.218 -5.012 1.445 277 HB3 ASN 44 3HB ASN 44 14.678 -4.466 2.102 278 HD21 ASN 44 1HD2 ASN 44 13.540 -7.162 2.014 279 HD22 ASN 44 2HD2 ASN 44 14.250 -8.014 3.339 280 H ARG 45 H ARG 45 12.760 -4.940 -1.274 281 HA ARG 45 HA ARG 45 14.217 -3.742 -3.266 282 HB2 ARG 45 2HB ARG 45 11.500 -2.958 -2.199 283 HB3 ARG 45 3HB ARG 45 12.175 -2.365 -3.711 284 HG2 ARG 45 2HG ARG 45 11.551 -5.235 -3.046 285 HG3 ARG 45 3HG ARG 45 10.624 -4.179 -4.114 286 HD2 ARG 45 2HD ARG 45 13.452 -5.140 -4.521 287 HD3 ARG 45 3HD ARG 45 12.027 -5.633 -5.434 288 HE ARG 45 HE ARG 45 12.238 -2.875 -5.670 289 HH11 ARG 45 1HH1 ARG 45 14.065 -5.704 -6.552 290 HH12 ARG 45 2HH1 ARG 45 14.775 -4.969 -7.951 291 HH21 ARG 45 1HH2 ARG 45 13.166 -1.896 -7.509 292 HH22 ARG 45 2HH2 ARG 45 14.264 -2.803 -8.494 293 H ARG 46 H ARG 46 13.480 -2.513 -0.096 294 HA ARG 46 HA ARG 46 13.888 0.213 -0.463 295 HB2 ARG 46 2HB ARG 46 14.404 -1.600 1.887 296 HB3 ARG 46 3HB ARG 46 14.693 0.133 1.971 297 HG2 ARG 46 2HG ARG 46 12.525 -0.416 2.891 298 HG3 ARG 46 3HG ARG 46 12.345 0.548 1.424 299 HD2 ARG 46 2HD ARG 46 10.750 -1.338 1.551 300 HD3 ARG 46 3HD ARG 46 11.807 -1.418 0.142 301 HE ARG 46 HE ARG 46 12.667 -3.374 0.951 302 HH11 ARG 46 1HH1 ARG 46 11.023 -1.711 3.530 303 HH12 ARG 46 2HH1 ARG 46 11.180 -3.023 4.651 304 HH21 ARG 46 1HH2 ARG 46 12.880 -5.108 2.418 305 HH22 ARG 46 2HH2 ARG 46 12.237 -4.954 4.018 306 H THR 47 H THR 47 16.184 -2.410 -0.259 307 HA THR 47 HA THR 47 18.342 -0.495 -0.832 308 HB THR 47 HB THR 47 18.682 -1.086 1.465 309 HG1 THR 47 HG1 THR 47 20.640 -1.087 0.501 310 HG21 THR 47 1HG2 THR 47 17.510 -3.538 0.725 311 HG22 THR 47 2HG2 THR 47 18.031 -3.032 2.332 312 HG23 THR 47 3HG2 THR 47 19.141 -3.911 1.282 313 H GLY 48 H GLY 48 16.574 -2.802 -2.130 314 HA2 GLY 48 2HA GLY 48 16.862 -4.385 -3.772 315 HA3 GLY 48 3HA GLY 48 18.226 -3.389 -4.260 316 H LYS 49 H LYS 49 17.900 -5.141 -1.217 317 HA LYS 49 HA LYS 49 20.213 -6.782 -2.018 318 HB2 LYS 49 2HB LYS 49 19.384 -5.760 0.700 319 HB3 LYS 49 3HB LYS 49 20.636 -6.971 0.464 320 HG2 LYS 49 2HG LYS 49 20.697 -4.067 0.000 321 HG3 LYS 49 3HG LYS 49 21.980 -5.169 0.505 322 HD2 LYS 49 2HD LYS 49 21.941 -6.046 -1.888 323 HD3 LYS 49 3HD LYS 49 20.966 -4.627 -2.274 324 HE2 LYS 49 2HE LYS 49 23.192 -4.025 -2.761 325 HE3 LYS 49 3HE LYS 49 22.813 -3.246 -1.226 326 HZ1 LYS 49 1HZ LYS 49 24.794 -5.223 -1.820 327 HZ2 LYS 49 2HZ LYS 49 23.827 -5.670 -0.507 328 HZ3 LYS 49 3HZ LYS 49 24.662 -4.200 -0.479 329 H CYS 50 H CYS 50 20.014 -8.937 -2.004 330 HA CYS 50 HA CYS 50 17.658 -10.106 -0.677 331 HB2 CYS 50 2HB CYS 50 17.683 -9.935 -3.292 332 HB3 CYS 50 3HB CYS 50 18.784 -11.305 -3.182 333 H GLN 51 H GLN 51 18.015 -11.855 0.566 334 HA GLN 51 HA GLN 51 20.534 -13.314 0.303 335 HB2 GLN 51 2HB GLN 51 19.634 -12.522 3.046 336 HB3 GLN 51 3HB GLN 51 21.234 -13.003 2.497 337 HG2 GLN 51 2HG GLN 51 21.710 -10.831 2.589 338 HG3 GLN 51 3HG GLN 51 20.823 -10.722 1.070 339 HE21 GLN 51 1HE2 GLN 51 18.255 -11.254 2.280 340 HE22 GLN 51 2HE2 GLN 51 17.807 -9.823 3.139 341 H ARG 52 H ARG 52 20.522 -15.238 1.895 342 HA ARG 52 HA ARG 52 17.929 -16.554 1.596 343 HB2 ARG 52 2HB ARG 52 20.743 -17.444 1.730 344 HB3 ARG 52 3HB ARG 52 19.577 -18.501 2.513 345 HG2 ARG 52 2HG ARG 52 19.091 -17.532 -0.270 346 HG3 ARG 52 3HG ARG 52 20.185 -18.884 0.030 347 HD2 ARG 52 2HD ARG 52 18.508 -20.275 0.683 348 HD3 ARG 52 3HD ARG 52 17.541 -18.965 1.361 349 HE ARG 52 HE ARG 52 16.402 -18.933 -0.603 350 HH11 ARG 52 1HH1 ARG 52 19.614 -20.120 -1.231 351 HH12 ARG 52 2HH1 ARG 52 19.329 -20.379 -2.920 352 HH21 ARG 52 1HH2 ARG 52 16.014 -19.271 -2.825 353 HH22 ARG 52 2HH2 ARG 52 17.281 -19.896 -3.826 354 H MET 53 H MET 53 17.035 -17.824 3.329 355 HA MET 53 HA MET 53 17.177 -16.458 5.849 356 HB2 MET 53 2HB MET 53 15.644 -18.921 5.000 357 HB3 MET 53 3HB MET 53 15.458 -18.116 6.553 358 HG2 MET 53 2HG MET 53 14.981 -16.019 5.062 359 HG3 MET 53 3HG MET 53 14.603 -17.235 3.845 360 HE1 MET 53 1HE MET 53 14.076 -16.135 7.451 361 HE2 MET 53 2HE MET 53 12.933 -15.089 6.610 362 HE3 MET 53 3HE MET 53 12.343 -16.332 7.714 Start of MODEL 5 1 H1 GLY 1 H GLY 1 0.488 0.232 1.203 2 HA2 GLY 1 2HA GLY 1 1.960 -1.156 -0.405 3 HA3 GLY 1 3HA GLY 1 2.779 0.037 0.593 4 H SER 2 H SER 2 1.623 -3.329 0.803 5 HA SER 2 HA SER 2 4.136 -3.983 2.200 6 HB2 SER 2 2HB SER 2 1.392 -5.199 2.590 7 HB3 SER 2 3HB SER 2 2.869 -5.800 3.342 8 HG SER 2 HG SER 2 1.282 -3.797 4.135 9 H LYS 3 H LYS 3 2.143 -4.556 -0.482 10 HA LYS 3 HA LYS 3 3.715 -6.950 -1.179 11 HB2 LYS 3 2HB LYS 3 0.913 -6.366 -2.140 12 HB3 LYS 3 3HB LYS 3 1.833 -7.848 -2.365 13 HG2 LYS 3 2HG LYS 3 0.847 -8.649 -0.554 14 HG3 LYS 3 3HG LYS 3 1.739 -7.459 0.396 15 HD2 LYS 3 2HD LYS 3 -0.211 -5.868 -0.356 16 HD3 LYS 3 3HD LYS 3 -1.078 -7.389 -0.584 17 HE2 LYS 3 2HE LYS 3 0.198 -7.604 1.899 18 HE3 LYS 3 3HE LYS 3 -0.469 -5.973 1.847 19 HZ1 LYS 3 1HZ LYS 3 -2.474 -7.520 0.864 20 HZ2 LYS 3 2HZ LYS 3 -2.373 -6.928 2.445 21 HZ3 LYS 3 3HZ LYS 3 -1.822 -8.487 2.090 22 H LYS 4 H LYS 4 2.124 -4.027 -2.348 23 HA LYS 4 HA LYS 4 2.941 -4.240 -5.043 24 HB2 LYS 4 2HB LYS 4 1.815 -2.128 -3.303 25 HB3 LYS 4 3HB LYS 4 2.700 -1.567 -4.715 26 HG2 LYS 4 2HG LYS 4 1.078 -2.182 -6.121 27 HG3 LYS 4 3HG LYS 4 0.811 -3.718 -5.293 28 HD2 LYS 4 2HD LYS 4 -1.190 -2.574 -4.963 29 HD3 LYS 4 3HD LYS 4 -0.306 -2.282 -3.463 30 HE2 LYS 4 2HE LYS 4 0.433 -0.108 -4.351 31 HE3 LYS 4 3HE LYS 4 -0.504 -0.402 -5.815 32 HZ1 LYS 4 1HZ LYS 4 -2.098 0.688 -4.712 33 HZ2 LYS 4 2HZ LYS 4 -1.389 0.438 -3.197 34 HZ3 LYS 4 3HZ LYS 4 -2.341 -0.774 -3.895 35 HA PRO 5 HA PRO 5 6.581 -1.296 -3.869 36 HB2 PRO 5 2HB PRO 5 7.003 -0.813 -1.231 37 HB3 PRO 5 3HB PRO 5 5.936 0.180 -2.231 38 HG2 PRO 5 2HG PRO 5 5.241 -2.027 -0.332 39 HG3 PRO 5 3HG PRO 5 4.450 -0.456 -0.559 40 HD2 PRO 5 2HD PRO 5 3.474 -2.747 -1.624 41 HD3 PRO 5 3HD PRO 5 3.287 -1.170 -2.417 42 H VAL 6 H VAL 6 6.053 -3.572 -1.169 43 HA VAL 6 HA VAL 6 8.709 -4.720 -1.736 44 HB VAL 6 HB VAL 6 8.313 -3.609 0.540 45 HG11 VAL 6 1HG1 VAL 6 6.048 -5.066 0.599 46 HG12 VAL 6 2HG1 VAL 6 7.128 -6.128 1.504 47 HG13 VAL 6 3HG1 VAL 6 6.866 -4.468 2.041 48 HG21 VAL 6 1HG2 VAL 6 9.111 -6.379 1.111 49 HG22 VAL 6 2HG2 VAL 6 9.943 -5.627 -0.250 50 HG23 VAL 6 3HG2 VAL 6 9.996 -4.871 1.343 51 HA PRO 7 HA PRO 7 5.449 -7.932 -2.660 52 HB2 PRO 7 2HB PRO 7 6.453 -8.618 -5.087 53 HB3 PRO 7 3HB PRO 7 5.292 -7.305 -4.865 54 HG2 PRO 7 2HG PRO 7 8.267 -7.171 -5.174 55 HG3 PRO 7 3HG PRO 7 7.019 -6.148 -5.908 56 HD2 PRO 7 2HD PRO 7 8.457 -5.371 -3.749 57 HD3 PRO 7 3HD PRO 7 6.774 -4.867 -4.007 58 H ILE 8 H ILE 8 7.593 -8.266 -0.906 59 HA ILE 8 HA ILE 8 8.687 -10.842 -1.825 60 HB ILE 8 HB ILE 8 10.552 -10.153 -0.034 61 HG12 ILE 8 2HG1 ILE 8 10.331 -7.522 -1.373 62 HG13 ILE 8 3HG1 ILE 8 9.165 -7.828 -0.091 63 HG21 ILE 8 1HG2 ILE 8 10.414 -9.508 -2.965 64 HG22 ILE 8 2HG2 ILE 8 11.887 -9.296 -2.020 65 HG23 ILE 8 3HG2 ILE 8 11.165 -10.897 -2.180 66 HD11 ILE 8 1HD1 ILE 8 10.692 -7.524 1.490 67 HD12 ILE 8 2HD1 ILE 8 11.860 -8.564 0.675 68 HD13 ILE 8 3HD1 ILE 8 11.722 -6.867 0.218 69 H ILE 9 H ILE 9 8.195 -12.511 -0.565 70 HA ILE 9 HA ILE 9 7.189 -11.959 2.147 71 HB ILE 9 HB ILE 9 6.168 -14.309 1.886 72 HG12 ILE 9 2HG1 ILE 9 5.636 -14.898 -0.475 73 HG13 ILE 9 3HG1 ILE 9 6.717 -13.614 -1.007 74 HG21 ILE 9 1HG2 ILE 9 4.454 -12.873 1.926 75 HG22 ILE 9 2HG2 ILE 9 5.283 -11.712 0.891 76 HG23 ILE 9 3HG2 ILE 9 4.424 -13.076 0.175 77 HD11 ILE 9 1HD1 ILE 9 8.604 -14.762 -0.376 78 HD12 ILE 9 2HD1 ILE 9 7.738 -15.751 0.800 79 HD13 ILE 9 3HD1 ILE 9 7.550 -16.065 -0.925 80 H TYR 10 H TYR 10 7.334 -14.200 3.458 81 HA TYR 10 HA TYR 10 9.824 -15.600 3.054 82 HB2 TYR 10 2HB TYR 10 10.385 -14.911 5.576 83 HB3 TYR 10 3HB TYR 10 10.979 -13.995 4.195 84 HD1 TYR 10 HD1 TYR 10 11.244 -11.992 5.575 85 HD2 TYR 10 HD2 TYR 10 7.443 -13.842 5.090 86 HE1 TYR 10 HE1 TYR 10 10.154 -9.968 6.449 87 HE2 TYR 10 HE2 TYR 10 6.342 -11.823 5.962 88 HH TYR 10 HH TYR 10 6.804 -9.894 7.270 89 H CYS 11 H CYS 11 8.910 -17.567 3.192 90 HA CYS 11 HA CYS 11 7.022 -18.157 5.333 91 HB2 CYS 11 2HB CYS 11 7.953 -20.232 3.397 92 HB3 CYS 11 3HB CYS 11 6.358 -19.996 4.105 93 H ASN 12 H ASN 12 7.900 -18.614 7.245 94 HA ASN 12 HA ASN 12 10.510 -19.802 7.485 95 HB2 ASN 12 2HB ASN 12 8.488 -19.338 9.683 96 HB3 ASN 12 3HB ASN 12 10.230 -19.537 9.857 97 HD21 ASN 12 1HD2 ASN 12 10.795 -17.890 7.511 98 HD22 ASN 12 2HD2 ASN 12 10.530 -16.256 8.005 99 H ARG 13 H ARG 13 10.514 -21.869 6.717 100 HA ARG 13 HA ARG 13 8.600 -23.803 6.828 101 HB2 ARG 13 2HB ARG 13 11.581 -24.159 7.181 102 HB3 ARG 13 3HB ARG 13 10.459 -25.466 6.831 103 HG2 ARG 13 2HG ARG 13 10.982 -23.081 5.068 104 HG3 ARG 13 3HG ARG 13 11.621 -24.709 4.827 105 HD2 ARG 13 2HD ARG 13 8.711 -23.913 4.815 106 HD3 ARG 13 3HD ARG 13 9.685 -24.313 3.401 107 HE ARG 13 HE ARG 13 9.849 -26.498 5.068 108 HH11 ARG 13 1HH1 ARG 13 7.323 -24.740 3.441 109 HH12 ARG 13 2HH1 ARG 13 6.293 -26.123 3.269 110 HH21 ARG 13 1HH2 ARG 13 8.502 -28.326 4.847 111 HH22 ARG 13 2HH2 ARG 13 6.964 -28.161 4.070 112 H ARG 14 H ARG 14 10.779 -22.826 9.413 113 HA ARG 14 HA ARG 14 10.466 -24.853 11.234 114 HB2 ARG 14 2HB ARG 14 10.615 -22.958 12.984 115 HB3 ARG 14 3HB ARG 14 11.954 -23.173 11.865 116 HG2 ARG 14 2HG ARG 14 9.995 -21.361 10.780 117 HG3 ARG 14 3HG ARG 14 10.537 -20.834 12.375 118 HD2 ARG 14 2HD ARG 14 12.125 -19.851 11.046 119 HD3 ARG 14 3HD ARG 14 12.909 -21.389 11.400 120 HE ARG 14 HE ARG 14 11.314 -21.309 8.980 121 HH11 ARG 14 1HH1 ARG 14 14.466 -21.008 10.428 122 HH12 ARG 14 2HH1 ARG 14 15.318 -21.303 8.949 123 HH21 ARG 14 1HH2 ARG 14 12.424 -21.699 7.026 124 HH22 ARG 14 2HH2 ARG 14 14.155 -21.695 7.014 125 H THR 15 H THR 15 8.260 -22.165 10.591 126 HA THR 15 HA THR 15 6.237 -23.530 12.247 127 HB THR 15 HB THR 15 6.865 -21.387 13.242 128 HG1 THR 15 HG1 THR 15 4.708 -20.463 13.200 129 HG21 THR 15 1HG2 THR 15 6.630 -20.484 10.469 130 HG22 THR 15 2HG2 THR 15 7.544 -19.795 11.810 131 HG23 THR 15 3HG2 THR 15 5.830 -19.425 11.629 132 H GLY 16 H GLY 16 7.068 -23.275 9.194 133 HA2 GLY 16 2HA GLY 16 5.981 -23.229 7.165 134 HA3 GLY 16 3HA GLY 16 4.694 -24.031 8.053 135 H LYS 17 H LYS 17 5.827 -20.747 8.621 136 HA LYS 17 HA LYS 17 3.184 -19.776 7.753 137 HB2 LYS 17 2HB LYS 17 5.047 -18.735 9.891 138 HB3 LYS 17 3HB LYS 17 3.629 -17.860 9.328 139 HG2 LYS 17 2HG LYS 17 3.831 -20.213 11.084 140 HG3 LYS 17 3HG LYS 17 2.664 -18.889 11.080 141 HD2 LYS 17 2HD LYS 17 1.734 -19.940 8.949 142 HD3 LYS 17 3HD LYS 17 2.700 -21.358 9.364 143 HE2 LYS 17 2HE LYS 17 0.760 -21.935 10.402 144 HE3 LYS 17 3HE LYS 17 1.502 -21.011 11.707 145 HZ1 LYS 17 1HZ LYS 17 -0.642 -20.172 11.567 146 HZ2 LYS 17 2HZ LYS 17 -0.666 -20.197 9.876 147 HZ3 LYS 17 3HZ LYS 17 0.261 -19.040 10.692 148 H CYS 18 H CYS 18 3.067 -18.210 6.249 149 HA CYS 18 HA CYS 18 5.581 -16.926 5.406 150 HB2 CYS 18 2HB CYS 18 4.489 -18.768 3.880 151 HB3 CYS 18 3HB CYS 18 3.387 -17.467 3.441 152 H GLN 19 H GLN 19 5.540 -14.767 5.159 153 HA GLN 19 HA GLN 19 2.958 -13.396 5.009 154 HB2 GLN 19 2HB GLN 19 5.051 -12.316 6.856 155 HB3 GLN 19 3HB GLN 19 3.317 -12.023 6.849 156 HG2 GLN 19 2HG GLN 19 3.255 -13.437 8.565 157 HG3 GLN 19 3HG GLN 19 3.434 -14.701 7.349 158 HE21 GLN 19 1HE2 GLN 19 6.159 -13.989 6.701 159 HE22 GLN 19 2HE2 GLN 19 7.136 -14.525 8.021 160 H ARG 20 H ARG 20 3.329 -10.971 4.638 161 HA ARG 20 HA ARG 20 5.331 -10.726 2.524 162 HB2 ARG 20 2HB ARG 20 2.677 -9.690 2.966 163 HB3 ARG 20 3HB ARG 20 3.800 -8.370 2.666 164 HG2 ARG 20 2HG ARG 20 3.466 -10.777 0.889 165 HG3 ARG 20 3HG ARG 20 2.706 -9.207 0.623 166 HD2 ARG 20 2HD ARG 20 4.627 -8.247 -0.084 167 HD3 ARG 20 3HD ARG 20 5.623 -9.171 1.040 168 HE ARG 20 HE ARG 20 6.064 -10.594 -0.675 169 HH11 ARG 20 1HH1 ARG 20 2.985 -9.085 -1.278 170 HH12 ARG 20 2HH1 ARG 20 2.753 -9.870 -2.806 171 HH21 ARG 20 1HH2 ARG 20 5.770 -11.633 -2.684 172 HH22 ARG 20 2HH2 ARG 20 4.337 -11.320 -3.604 173 H MET 21 H MET 21 6.937 -9.199 2.506 174 HA MET 21 HA MET 21 7.931 -8.316 5.003 175 HB2 MET 21 2HB MET 21 8.699 -7.810 2.147 176 HB3 MET 21 3HB MET 21 9.478 -6.917 3.447 177 HG2 MET 21 2HG MET 21 9.398 -9.783 3.930 178 HG3 MET 21 3HG MET 21 10.261 -9.351 2.455 179 HE1 MET 21 1HE MET 21 11.229 -7.527 6.554 180 HE2 MET 21 2HE MET 21 10.446 -6.534 5.325 181 HE3 MET 21 3HE MET 21 9.637 -7.975 5.941 182 H1 GLY 33 H GLY 33 22.492 -21.577 8.367 183 HA2 GLY 33 2HA GLY 33 22.402 -22.852 6.461 184 HA3 GLY 33 3HA GLY 33 22.911 -24.196 7.472 185 H SER 34 H SER 34 19.924 -22.284 7.577 186 HA SER 34 HA SER 34 18.421 -24.794 7.310 187 HB2 SER 34 2HB SER 34 17.417 -22.128 8.329 188 HB3 SER 34 3HB SER 34 16.590 -23.683 8.428 189 HG SER 34 HG SER 34 18.237 -22.638 10.185 190 H LYS 35 H LYS 35 19.030 -21.742 5.817 191 HA LYS 35 HA LYS 35 16.715 -21.841 4.090 192 HB2 LYS 35 2HB LYS 35 18.120 -19.932 2.939 193 HB3 LYS 35 3HB LYS 35 17.281 -19.643 4.457 194 HG2 LYS 35 2HG LYS 35 19.590 -18.747 4.391 195 HG3 LYS 35 3HG LYS 35 19.307 -19.895 5.702 196 HD2 LYS 35 2HD LYS 35 21.454 -20.322 4.640 197 HD3 LYS 35 3HD LYS 35 20.347 -21.668 4.359 198 HE2 LYS 35 2HE LYS 35 20.833 -21.461 2.195 199 HE3 LYS 35 3HE LYS 35 19.893 -19.970 2.220 200 HZ1 LYS 35 1HZ LYS 35 22.825 -20.260 2.538 201 HZ2 LYS 35 2HZ LYS 35 22.000 -18.823 2.873 202 HZ3 LYS 35 3HZ LYS 35 21.994 -19.456 1.304 203 H LYS 36 H LYS 36 19.434 -23.612 4.181 204 HA LYS 36 HA LYS 36 20.362 -23.534 1.504 205 HB2 LYS 36 2HB LYS 36 20.725 -25.307 3.852 206 HB3 LYS 36 3HB LYS 36 21.047 -26.021 2.278 207 HG2 LYS 36 2HG LYS 36 22.959 -24.896 2.030 208 HG3 LYS 36 3HG LYS 36 22.264 -23.393 2.640 209 HD2 LYS 36 2HD LYS 36 22.422 -24.400 4.950 210 HD3 LYS 36 3HD LYS 36 23.375 -25.699 4.228 211 HE2 LYS 36 2HE LYS 36 24.414 -23.195 3.346 212 HE3 LYS 36 3HE LYS 36 24.246 -23.150 5.100 213 HZ1 LYS 36 1HZ LYS 36 25.478 -25.270 5.181 214 HZ2 LYS 36 2HZ LYS 36 26.395 -24.001 4.541 215 HZ3 LYS 36 3HZ LYS 36 25.733 -25.170 3.512 216 HA PRO 37 HA PRO 37 17.598 -27.436 0.825 217 HB2 PRO 37 2HB PRO 37 15.811 -28.053 2.773 218 HB3 PRO 37 3HB PRO 37 17.462 -28.683 2.750 219 HG2 PRO 37 2HG PRO 37 16.329 -26.392 4.310 220 HG3 PRO 37 3HG PRO 37 17.445 -27.664 4.840 221 HD2 PRO 37 2HD PRO 37 18.282 -25.176 4.175 222 HD3 PRO 37 3HD PRO 37 19.277 -26.622 3.906 223 H VAL 38 H VAL 38 16.151 -24.784 2.655 224 HA VAL 38 HA VAL 38 13.843 -24.807 0.831 225 HB VAL 38 HB VAL 38 13.122 -24.895 3.104 226 HG11 VAL 38 1HG1 VAL 38 13.781 -23.199 4.765 227 HG12 VAL 38 2HG1 VAL 38 15.153 -24.153 4.198 228 HG13 VAL 38 3HG1 VAL 38 14.908 -22.514 3.594 229 HG21 VAL 38 1HG2 VAL 38 11.893 -22.746 3.329 230 HG22 VAL 38 2HG2 VAL 38 12.856 -22.101 1.999 231 HG23 VAL 38 3HG2 VAL 38 11.772 -23.464 1.722 232 HA PRO 39 HA PRO 39 15.858 -21.295 -1.081 233 HB2 PRO 39 2HB PRO 39 14.020 -21.005 -3.058 234 HB3 PRO 39 3HB PRO 39 15.283 -22.241 -3.095 235 HG2 PRO 39 2HG PRO 39 12.407 -22.495 -2.303 236 HG3 PRO 39 3HG PRO 39 13.395 -23.585 -3.293 237 HD2 PRO 39 2HD PRO 39 12.865 -24.067 -0.681 238 HD3 PRO 39 3HD PRO 39 14.385 -24.561 -1.454 239 H ILE 40 H ILE 40 14.889 -20.416 1.150 240 HA ILE 40 HA ILE 40 12.666 -18.585 0.581 241 HB ILE 40 HB ILE 40 13.028 -18.173 3.178 242 HG12 ILE 40 2HG1 ILE 40 14.198 -20.909 2.661 243 HG13 ILE 40 3HG1 ILE 40 14.952 -19.559 3.502 244 HG21 ILE 40 1HG2 ILE 40 10.972 -18.959 2.151 245 HG22 ILE 40 2HG2 ILE 40 11.639 -20.585 2.019 246 HG23 ILE 40 3HG2 ILE 40 11.325 -19.887 3.608 247 HD11 ILE 40 1HD1 ILE 40 12.946 -19.829 5.138 248 HD12 ILE 40 2HD1 ILE 40 12.858 -21.449 4.447 249 HD13 ILE 40 3HD1 ILE 40 14.336 -20.909 5.244 250 H ILE 41 H ILE 41 13.250 -16.642 -0.115 251 HA ILE 41 HA ILE 41 15.559 -15.334 1.160 252 HB ILE 41 HB ILE 41 15.800 -14.124 -1.113 253 HG12 ILE 41 2HG1 ILE 41 15.212 -15.638 -3.037 254 HG13 ILE 41 3HG1 ILE 41 14.273 -16.609 -1.909 255 HG21 ILE 41 1HG2 ILE 41 16.772 -16.753 -0.228 256 HG22 ILE 41 2HG2 ILE 41 16.999 -16.404 -1.941 257 HG23 ILE 41 3HG2 ILE 41 17.668 -15.317 -0.725 258 HD11 ILE 41 1HD1 ILE 41 13.631 -13.756 -1.874 259 HD12 ILE 41 2HD1 ILE 41 13.290 -14.575 -3.399 260 HD13 ILE 41 3HD1 ILE 41 12.570 -15.164 -1.901 261 H TYR 42 H TYR 42 15.486 -12.867 0.426 262 HA TYR 42 HA TYR 42 12.829 -11.771 0.232 263 HB2 TYR 42 2HB TYR 42 13.479 -10.386 2.442 264 HB3 TYR 42 3HB TYR 42 12.519 -11.861 2.485 265 HD1 TYR 42 HD1 TYR 42 16.109 -11.945 1.752 266 HD2 TYR 42 HD2 TYR 42 13.142 -12.369 4.772 267 HE1 TYR 42 HE1 TYR 42 17.776 -12.980 3.236 268 HE2 TYR 42 HE2 TYR 42 14.800 -13.404 6.264 269 HH TYR 42 HH TYR 42 18.173 -13.421 5.534 270 H CYS 43 H CYS 43 13.336 -10.454 -1.419 271 HA CYS 43 HA CYS 43 15.778 -8.869 -1.336 272 HB2 CYS 43 2HB CYS 43 13.752 -8.620 -3.521 273 HB3 CYS 43 3HB CYS 43 15.507 -8.523 -3.609 274 H ASN 44 H ASN 44 15.695 -7.068 -0.160 275 HA ASN 44 HA ASN 44 13.240 -5.634 0.273 276 HB2 ASN 44 2HB ASN 44 16.042 -4.775 1.016 277 HB3 ASN 44 3HB ASN 44 14.530 -4.202 1.715 278 HD21 ASN 44 1HD2 ASN 44 13.363 -6.883 1.728 279 HD22 ASN 44 2HD2 ASN 44 14.113 -7.718 3.041 280 H ARG 45 H ARG 45 12.495 -4.706 -1.577 281 HA ARG 45 HA ARG 45 13.909 -3.582 -3.647 282 HB2 ARG 45 2HB ARG 45 11.256 -2.649 -2.534 283 HB3 ARG 45 3HB ARG 45 11.887 -2.250 -4.126 284 HG2 ARG 45 2HG ARG 45 11.162 -4.998 -3.132 285 HG3 ARG 45 3HG ARG 45 10.249 -4.020 -4.283 286 HD2 ARG 45 2HD ARG 45 13.012 -5.166 -4.664 287 HD3 ARG 45 3HD ARG 45 11.532 -5.677 -5.476 288 HE ARG 45 HE ARG 45 11.925 -2.955 -5.987 289 HH11 ARG 45 1HH1 ARG 45 13.384 -6.030 -6.720 290 HH12 ARG 45 2HH1 ARG 45 14.036 -5.506 -8.237 291 HH21 ARG 45 1HH2 ARG 45 12.779 -2.254 -7.983 292 HH22 ARG 45 2HH2 ARG 45 13.692 -3.358 -8.954 293 H ARG 46 H ARG 46 13.397 -2.326 -0.466 294 HA ARG 46 HA ARG 46 13.800 0.407 -0.916 295 HB2 ARG 46 2HB ARG 46 14.346 -1.360 1.461 296 HB3 ARG 46 3HB ARG 46 14.666 0.369 1.496 297 HG2 ARG 46 2HG ARG 46 12.512 -0.134 2.487 298 HG3 ARG 46 3HG ARG 46 12.314 0.817 1.014 299 HD2 ARG 46 2HD ARG 46 10.684 -1.028 1.191 300 HD3 ARG 46 3HD ARG 46 11.717 -1.161 -0.232 301 HE ARG 46 HE ARG 46 12.540 -3.123 0.602 302 HH11 ARG 46 1HH1 ARG 46 10.980 -1.369 3.173 303 HH12 ARG 46 2HH1 ARG 46 11.123 -2.663 4.317 304 HH21 ARG 46 1HH2 ARG 46 12.733 -4.833 2.099 305 HH22 ARG 46 2HH2 ARG 46 12.121 -4.632 3.705 306 H THR 47 H THR 47 16.046 -2.259 -0.709 307 HA THR 47 HA THR 47 18.226 -0.403 -1.383 308 HB THR 47 HB THR 47 18.623 -0.950 0.913 309 HG1 THR 47 HG1 THR 47 20.621 -1.157 0.252 310 HG21 THR 47 1HG2 THR 47 17.900 -2.845 1.833 311 HG22 THR 47 2HG2 THR 47 19.012 -3.777 0.831 312 HG23 THR 47 3HG2 THR 47 17.391 -3.409 0.242 313 H GLY 48 H GLY 48 16.376 -2.695 -2.587 314 HA2 GLY 48 2HA GLY 48 16.585 -4.315 -4.203 315 HA3 GLY 48 3HA GLY 48 17.958 -3.362 -4.746 316 H LYS 49 H LYS 49 17.691 -5.024 -1.651 317 HA LYS 49 HA LYS 49 19.931 -6.749 -2.483 318 HB2 LYS 49 2HB LYS 49 19.219 -5.626 0.228 319 HB3 LYS 49 3HB LYS 49 20.423 -6.886 -0.007 320 HG2 LYS 49 2HG LYS 49 20.569 -4.001 -0.553 321 HG3 LYS 49 3HG LYS 49 21.831 -5.136 -0.068 322 HD2 LYS 49 2HD LYS 49 21.690 -6.065 -2.430 323 HD3 LYS 49 3HD LYS 49 20.726 -4.640 -2.822 324 HE2 LYS 49 2HE LYS 49 23.514 -4.599 -1.671 325 HE3 LYS 49 3HE LYS 49 23.111 -4.351 -3.369 326 HZ1 LYS 49 1HZ LYS 49 22.366 -2.623 -1.077 327 HZ2 LYS 49 2HZ LYS 49 21.727 -2.436 -2.632 328 HZ3 LYS 49 3HZ LYS 49 23.386 -2.232 -2.369 329 H CYS 50 H CYS 50 19.692 -8.899 -2.384 330 HA CYS 50 HA CYS 50 17.323 -9.963 -0.990 331 HB2 CYS 50 2HB CYS 50 17.394 -9.914 -3.625 332 HB3 CYS 50 3HB CYS 50 18.417 -11.331 -3.415 333 H GLN 51 H GLN 51 17.646 -11.657 0.336 334 HA GLN 51 HA GLN 51 20.134 -13.179 0.145 335 HB2 GLN 51 2HB GLN 51 19.257 -12.248 2.850 336 HB3 GLN 51 3HB GLN 51 20.849 -12.769 2.314 337 HG2 GLN 51 2HG GLN 51 21.341 -10.597 2.322 338 HG3 GLN 51 3HG GLN 51 20.465 -10.550 0.793 339 HE21 GLN 51 1HE2 GLN 51 17.887 -11.012 2.028 340 HE22 GLN 51 2HE2 GLN 51 17.446 -9.537 2.810 341 H ARG 52 H ARG 52 20.087 -15.037 1.793 342 HA ARG 52 HA ARG 52 17.475 -16.318 1.552 343 HB2 ARG 52 2HB ARG 52 20.274 -17.244 1.808 344 HB3 ARG 52 3HB ARG 52 19.059 -18.243 2.594 345 HG2 ARG 52 2HG ARG 52 18.658 -17.389 -0.236 346 HG3 ARG 52 3HG ARG 52 19.758 -18.718 0.136 347 HD2 ARG 52 2HD ARG 52 18.083 -20.111 0.749 348 HD3 ARG 52 3HD ARG 52 17.116 -18.811 1.446 349 HE ARG 52 HE ARG 52 15.951 -18.783 -0.503 350 HH11 ARG 52 1HH1 ARG 52 19.173 -19.914 -1.182 351 HH12 ARG 52 2HH1 ARG 52 18.872 -20.157 -2.871 352 HH21 ARG 52 1HH2 ARG 52 15.542 -19.100 -2.725 353 HH22 ARG 52 2HH2 ARG 52 16.807 -19.693 -3.747 354 H MET 53 H MET 53 16.593 -17.548 3.353 355 HA MET 53 HA MET 53 16.741 -16.030 5.807 356 HB2 MET 53 2HB MET 53 15.087 -18.464 5.110 357 HB3 MET 53 3HB MET 53 14.894 -17.473 6.550 358 HG2 MET 53 2HG MET 53 14.574 -15.541 4.829 359 HG3 MET 53 3HG MET 53 14.201 -16.858 3.720 360 HE1 MET 53 1HE MET 53 11.888 -14.879 6.884 361 HE2 MET 53 2HE MET 53 12.659 -16.209 7.750 362 HE3 MET 53 3HE MET 53 13.641 -15.069 6.830 Start of MODEL 6 1 H1 GLY 1 H GLY 1 3.833 2.153 -1.620 2 HA2 GLY 1 2HA GLY 1 3.392 -0.606 -2.203 3 HA3 GLY 1 3HA GLY 1 4.477 0.477 -3.062 4 H SER 2 H SER 2 4.231 -1.214 0.065 5 HA SER 2 HA SER 2 7.119 -1.331 0.278 6 HB2 SER 2 2HB SER 2 5.796 -0.929 2.299 7 HB3 SER 2 3HB SER 2 4.953 -2.461 2.070 8 HG SER 2 HG SER 2 7.128 -2.101 3.427 9 H LYS 3 H LYS 3 4.539 -3.794 0.429 10 HA LYS 3 HA LYS 3 6.389 -5.664 -0.901 11 HB2 LYS 3 2HB LYS 3 4.906 -7.425 0.326 12 HB3 LYS 3 3HB LYS 3 6.186 -6.601 1.207 13 HG2 LYS 3 2HG LYS 3 4.199 -6.700 2.559 14 HG3 LYS 3 3HG LYS 3 4.521 -5.025 2.105 15 HD2 LYS 3 2HD LYS 3 2.754 -4.973 0.583 16 HD3 LYS 3 3HD LYS 3 2.665 -6.733 0.483 17 HE2 LYS 3 2HE LYS 3 2.116 -6.473 3.064 18 HE3 LYS 3 3HE LYS 3 1.574 -4.882 2.535 19 HZ1 LYS 3 1HZ LYS 3 0.440 -7.504 1.994 20 HZ2 LYS 3 2HZ LYS 3 0.419 -6.410 0.704 21 HZ3 LYS 3 3HZ LYS 3 -0.328 -6.006 2.167 22 H LYS 4 H LYS 4 3.584 -3.934 -1.229 23 HA LYS 4 HA LYS 4 1.839 -5.752 -2.479 24 HB2 LYS 4 2HB LYS 4 2.104 -2.809 -2.313 25 HB3 LYS 4 3HB LYS 4 1.196 -3.421 -3.689 26 HG2 LYS 4 2HG LYS 4 -0.558 -3.987 -2.428 27 HG3 LYS 4 3HG LYS 4 0.456 -4.657 -1.148 28 HD2 LYS 4 2HD LYS 4 0.971 -2.291 -0.464 29 HD3 LYS 4 3HD LYS 4 -0.273 -1.768 -1.603 30 HE2 LYS 4 2HE LYS 4 -1.951 -3.028 -0.400 31 HE3 LYS 4 3HE LYS 4 -0.725 -3.682 0.685 32 HZ1 LYS 4 1HZ LYS 4 -1.901 -1.867 1.727 33 HZ2 LYS 4 2HZ LYS 4 -1.505 -0.826 0.454 34 HZ3 LYS 4 3HZ LYS 4 -0.288 -1.424 1.466 35 HA PRO 5 HA PRO 5 3.696 -4.259 -6.679 36 HB2 PRO 5 2HB PRO 5 5.958 -2.762 -6.583 37 HB3 PRO 5 3HB PRO 5 4.338 -2.057 -6.549 38 HG2 PRO 5 2HG PRO 5 6.214 -2.602 -4.281 39 HG3 PRO 5 3HG PRO 5 5.205 -1.175 -4.580 40 HD2 PRO 5 2HD PRO 5 4.502 -3.115 -2.827 41 HD3 PRO 5 3HD PRO 5 3.306 -2.190 -3.757 42 H VAL 6 H VAL 6 6.036 -4.863 -4.096 43 HA VAL 6 HA VAL 6 7.543 -6.636 -5.892 44 HB VAL 6 HB VAL 6 8.986 -5.053 -4.851 45 HG11 VAL 6 1HG1 VAL 6 7.760 -5.887 -2.225 46 HG12 VAL 6 2HG1 VAL 6 9.128 -4.788 -2.409 47 HG13 VAL 6 3HG1 VAL 6 7.543 -4.338 -3.038 48 HG21 VAL 6 1HG2 VAL 6 9.150 -7.751 -3.523 49 HG22 VAL 6 2HG2 VAL 6 9.980 -7.215 -4.984 50 HG23 VAL 6 3HG2 VAL 6 10.422 -6.533 -3.418 51 HA PRO 7 HA PRO 7 5.454 -9.980 -3.781 52 HB2 PRO 7 2HB PRO 7 6.596 -11.957 -5.251 53 HB3 PRO 7 3HB PRO 7 5.258 -10.967 -5.847 54 HG2 PRO 7 2HG PRO 7 8.191 -10.714 -6.391 55 HG3 PRO 7 3HG PRO 7 6.829 -10.575 -7.517 56 HD2 PRO 7 2HD PRO 7 8.099 -8.414 -6.493 57 HD3 PRO 7 3HD PRO 7 6.368 -8.406 -6.889 58 H ILE 8 H ILE 8 7.235 -9.009 -2.123 59 HA ILE 8 HA ILE 8 9.310 -11.037 -1.684 60 HB ILE 8 HB ILE 8 9.901 -9.287 0.212 61 HG12 ILE 8 2HG1 ILE 8 8.339 -7.683 -1.819 62 HG13 ILE 8 3HG1 ILE 8 8.021 -7.815 -0.093 63 HG21 ILE 8 1HG2 ILE 8 10.511 -8.924 -2.718 64 HG22 ILE 8 2HG2 ILE 8 11.401 -8.160 -1.402 65 HG23 ILE 8 3HG2 ILE 8 11.404 -9.916 -1.565 66 HD11 ILE 8 1HD1 ILE 8 10.118 -6.261 -1.520 67 HD12 ILE 8 2HD1 ILE 8 9.031 -5.766 -0.222 68 HD13 ILE 8 3HD1 ILE 8 10.411 -6.804 0.131 69 H ILE 9 H ILE 9 8.674 -12.686 -0.462 70 HA ILE 9 HA ILE 9 7.104 -12.097 1.960 71 HB ILE 9 HB ILE 9 6.233 -14.512 1.657 72 HG12 ILE 9 2HG1 ILE 9 5.988 -15.126 -0.765 73 HG13 ILE 9 3HG1 ILE 9 7.130 -13.844 -1.153 74 HG21 ILE 9 1HG2 ILE 9 5.357 -11.990 0.436 75 HG22 ILE 9 2HG2 ILE 9 4.609 -13.441 -0.230 76 HG23 ILE 9 3HG2 ILE 9 4.491 -13.102 1.496 77 HD11 ILE 9 1HD1 ILE 9 8.033 -15.777 0.868 78 HD12 ILE 9 2HD1 ILE 9 7.820 -16.408 -0.765 79 HD13 ILE 9 3HD1 ILE 9 8.902 -15.045 -0.481 80 H TYR 10 H TYR 10 7.178 -14.238 3.400 81 HA TYR 10 HA TYR 10 9.727 -15.583 3.358 82 HB2 TYR 10 2HB TYR 10 9.959 -14.715 5.894 83 HB3 TYR 10 3HB TYR 10 10.733 -13.913 4.531 84 HD1 TYR 10 HD1 TYR 10 10.831 -11.766 5.638 85 HD2 TYR 10 HD2 TYR 10 7.107 -13.742 5.064 86 HE1 TYR 10 HE1 TYR 10 9.646 -9.682 6.190 87 HE2 TYR 10 HE2 TYR 10 5.912 -11.664 5.613 88 HH TYR 10 HH TYR 10 6.780 -9.400 7.167 89 H CYS 11 H CYS 11 8.830 -17.561 3.509 90 HA CYS 11 HA CYS 11 6.745 -18.073 5.478 91 HB2 CYS 11 2HB CYS 11 7.899 -20.235 3.774 92 HB3 CYS 11 3HB CYS 11 6.235 -19.986 4.294 93 H ASN 12 H ASN 12 7.482 -18.337 7.493 94 HA ASN 12 HA ASN 12 10.043 -19.571 8.014 95 HB2 ASN 12 2HB ASN 12 7.945 -18.746 10.027 96 HB3 ASN 12 3HB ASN 12 9.662 -19.007 10.318 97 HD21 ASN 12 1HD2 ASN 12 10.419 -17.685 7.819 98 HD22 ASN 12 2HD2 ASN 12 10.225 -15.992 8.105 99 H ARG 13 H ARG 13 9.986 -21.715 7.520 100 HA ARG 13 HA ARG 13 7.934 -23.513 7.783 101 HB2 ARG 13 2HB ARG 13 10.875 -24.038 8.253 102 HB3 ARG 13 3HB ARG 13 9.662 -25.270 7.931 103 HG2 ARG 13 2HG ARG 13 10.526 -23.075 6.060 104 HG3 ARG 13 3HG ARG 13 10.916 -24.791 5.928 105 HD2 ARG 13 2HD ARG 13 8.201 -23.506 5.685 106 HD3 ARG 13 3HD ARG 13 9.127 -24.297 4.410 107 HE ARG 13 HE ARG 13 8.781 -26.215 6.336 108 HH11 ARG 13 1HH1 ARG 13 6.689 -24.193 4.425 109 HH12 ARG 13 2HH1 ARG 13 5.390 -25.339 4.398 110 HH21 ARG 13 1HH2 ARG 13 7.078 -27.732 6.308 111 HH22 ARG 13 2HH2 ARG 13 5.612 -27.351 5.470 112 H ARG 14 H ARG 14 10.095 -22.312 10.273 113 HA ARG 14 HA ARG 14 9.715 -24.111 12.309 114 HB2 ARG 14 2HB ARG 14 9.847 -22.000 13.820 115 HB3 ARG 14 3HB ARG 14 11.220 -22.416 12.804 116 HG2 ARG 14 2HG ARG 14 9.364 -20.694 11.413 117 HG3 ARG 14 3HG ARG 14 9.914 -19.975 12.929 118 HD2 ARG 14 2HD ARG 14 11.522 -19.268 11.417 119 HD3 ARG 14 3HD ARG 14 12.268 -20.693 12.138 120 HE ARG 14 HE ARG 14 10.797 -20.991 9.625 121 HH11 ARG 14 1HH1 ARG 14 13.817 -20.958 11.356 122 HH12 ARG 14 2HH1 ARG 14 14.709 -21.712 10.076 123 HH21 ARG 14 1HH2 ARG 14 11.960 -21.985 7.933 124 HH22 ARG 14 2HH2 ARG 14 13.652 -22.295 8.129 125 H THR 15 H THR 15 7.557 -21.516 11.274 126 HA THR 15 HA THR 15 5.514 -22.561 13.125 127 HB THR 15 HB THR 15 5.658 -20.401 13.857 128 HG1 THR 15 HG1 THR 15 3.714 -19.781 13.320 129 HG21 THR 15 1HG2 THR 15 5.991 -18.494 12.072 130 HG22 THR 15 2HG2 THR 15 6.651 -19.814 11.106 131 HG23 THR 15 3HG2 THR 15 7.366 -19.421 12.669 132 H GLY 16 H GLY 16 6.396 -22.795 10.034 133 HA2 GLY 16 2HA GLY 16 5.319 -23.220 8.048 134 HA3 GLY 16 3HA GLY 16 4.040 -23.860 9.069 135 H LYS 17 H LYS 17 5.262 -20.565 8.490 136 HA LYS 17 HA LYS 17 2.630 -19.829 7.432 137 HB2 LYS 17 2HB LYS 17 2.701 -17.732 8.802 138 HB3 LYS 17 3HB LYS 17 2.466 -19.202 9.737 139 HG2 LYS 17 2HG LYS 17 4.008 -17.996 10.981 140 HG3 LYS 17 3HG LYS 17 5.006 -19.148 10.090 141 HD2 LYS 17 2HD LYS 17 5.930 -17.535 8.769 142 HD3 LYS 17 3HD LYS 17 4.492 -16.513 8.824 143 HE2 LYS 17 2HE LYS 17 6.524 -16.890 11.021 144 HE3 LYS 17 3HE LYS 17 6.309 -15.453 10.023 145 HZ1 LYS 17 1HZ LYS 17 5.030 -14.782 11.716 146 HZ2 LYS 17 2HZ LYS 17 4.803 -16.344 12.323 147 HZ3 LYS 17 3HZ LYS 17 3.851 -15.789 11.039 148 H CYS 18 H CYS 18 2.625 -17.897 6.157 149 HA CYS 18 HA CYS 18 5.243 -16.819 5.422 150 HB2 CYS 18 2HB CYS 18 4.458 -18.779 3.896 151 HB3 CYS 18 3HB CYS 18 3.328 -17.596 3.244 152 H GLN 19 H GLN 19 5.212 -14.688 4.942 153 HA GLN 19 HA GLN 19 2.657 -13.390 4.364 154 HB2 GLN 19 2HB GLN 19 4.448 -12.095 6.376 155 HB3 GLN 19 3HB GLN 19 2.716 -11.904 6.136 156 HG2 GLN 19 2HG GLN 19 2.498 -13.196 7.931 157 HG3 GLN 19 3HG GLN 19 2.912 -14.531 6.857 158 HE21 GLN 19 1HE2 GLN 19 5.640 -13.799 6.491 159 HE22 GLN 19 2HE2 GLN 19 6.466 -14.125 7.973 160 H ARG 20 H ARG 20 3.076 -10.963 3.918 161 HA ARG 20 HA ARG 20 5.304 -10.844 2.033 162 HB2 ARG 20 2HB ARG 20 2.680 -9.500 2.297 163 HB3 ARG 20 3HB ARG 20 3.982 -8.522 1.633 164 HG2 ARG 20 2HG ARG 20 3.478 -11.247 0.531 165 HG3 ARG 20 3HG ARG 20 2.442 -9.899 0.056 166 HD2 ARG 20 2HD ARG 20 4.094 -8.863 -1.110 167 HD3 ARG 20 3HD ARG 20 5.365 -9.444 -0.035 168 HE ARG 20 HE ARG 20 5.721 -11.112 -1.535 169 HH11 ARG 20 1HH1 ARG 20 2.393 -10.121 -1.784 170 HH12 ARG 20 2HH1 ARG 20 2.025 -11.225 -3.068 171 HH21 ARG 20 1HH2 ARG 20 5.249 -12.570 -3.224 172 HH22 ARG 20 2HH2 ARG 20 3.650 -12.618 -3.885 173 H MET 21 H MET 21 6.650 -8.938 1.900 174 HA MET 21 HA MET 21 7.554 -8.095 4.487 175 HB2 MET 21 2HB MET 21 8.430 -7.298 1.706 176 HB3 MET 21 3HB MET 21 9.237 -6.793 3.185 177 HG2 MET 21 2HG MET 21 9.335 -9.383 3.622 178 HG3 MET 21 3HG MET 21 9.172 -9.454 1.869 179 HE1 MET 21 1HE MET 21 10.864 -8.059 4.829 180 HE2 MET 21 2HE MET 21 12.587 -8.097 4.454 181 HE3 MET 21 3HE MET 21 11.620 -6.688 4.017 182 H1 GLY 33 H GLY 33 23.606 -21.372 5.040 183 HA2 GLY 33 2HA GLY 33 23.568 -23.123 3.513 184 HA3 GLY 33 3HA GLY 33 24.024 -24.222 4.806 185 H SER 34 H SER 34 21.282 -22.042 4.972 186 HA SER 34 HA SER 34 19.522 -24.389 5.118 187 HB2 SER 34 2HB SER 34 19.757 -22.154 6.776 188 HB3 SER 34 3HB SER 34 18.277 -21.871 5.861 189 HG SER 34 HG SER 34 18.818 -23.735 7.803 190 H LYS 35 H LYS 35 20.393 -21.854 3.081 191 HA LYS 35 HA LYS 35 17.998 -21.112 1.868 192 HB2 LYS 35 2HB LYS 35 19.463 -20.690 -0.170 193 HB3 LYS 35 3HB LYS 35 19.924 -19.864 1.313 194 HG2 LYS 35 2HG LYS 35 21.209 -22.453 1.038 195 HG3 LYS 35 3HG LYS 35 21.573 -21.362 -0.301 196 HD2 LYS 35 2HD LYS 35 21.853 -20.647 2.617 197 HD3 LYS 35 3HD LYS 35 23.180 -21.193 1.588 198 HE2 LYS 35 2HE LYS 35 21.775 -19.060 0.294 199 HE3 LYS 35 3HE LYS 35 22.207 -18.569 1.931 200 HZ1 LYS 35 1HZ LYS 35 23.893 -18.151 0.097 201 HZ2 LYS 35 2HZ LYS 35 24.183 -19.817 0.121 202 HZ3 LYS 35 3HZ LYS 35 24.463 -18.890 1.508 203 H LYS 36 H LYS 36 20.021 -23.942 1.383 204 HA LYS 36 HA LYS 36 18.784 -24.885 -0.974 205 HB2 LYS 36 2HB LYS 36 20.343 -26.278 1.200 206 HB3 LYS 36 3HB LYS 36 19.740 -27.121 -0.221 207 HG2 LYS 36 2HG LYS 36 21.820 -24.971 -0.062 208 HG3 LYS 36 3HG LYS 36 21.957 -26.599 -0.729 209 HD2 LYS 36 2HD LYS 36 20.390 -24.291 -1.875 210 HD3 LYS 36 3HD LYS 36 21.857 -25.013 -2.540 211 HE2 LYS 36 2HE LYS 36 20.201 -27.176 -2.316 212 HE3 LYS 36 3HE LYS 36 19.068 -25.889 -2.725 213 HZ1 LYS 36 1HZ LYS 36 21.554 -26.204 -4.271 214 HZ2 LYS 36 2HZ LYS 36 20.082 -25.518 -4.744 215 HZ3 LYS 36 3HZ LYS 36 20.225 -27.198 -4.603 216 HA PRO 37 HA PRO 37 16.118 -27.668 1.945 217 HB2 PRO 37 2HB PRO 37 16.152 -27.077 4.594 218 HB3 PRO 37 3HB PRO 37 17.287 -28.208 3.848 219 HG2 PRO 37 2HG PRO 37 17.684 -25.332 4.578 220 HG3 PRO 37 3HG PRO 37 18.782 -26.705 4.804 221 HD2 PRO 37 2HD PRO 37 19.060 -24.937 2.773 222 HD3 PRO 37 3HD PRO 37 19.507 -26.648 2.617 223 H VAL 38 H VAL 38 16.413 -24.470 3.512 224 HA VAL 38 HA VAL 38 13.565 -24.014 2.899 225 HB VAL 38 HB VAL 38 13.946 -24.371 5.323 226 HG11 VAL 38 1HG1 VAL 38 16.277 -23.159 5.080 227 HG12 VAL 38 2HG1 VAL 38 15.322 -21.741 5.520 228 HG13 VAL 38 3HG1 VAL 38 15.384 -23.134 6.600 229 HG21 VAL 38 1HG2 VAL 38 12.646 -22.507 6.066 230 HG22 VAL 38 2HG2 VAL 38 13.193 -21.517 4.713 231 HG23 VAL 38 3HG2 VAL 38 12.137 -22.899 4.423 232 HA PRO 39 HA PRO 39 15.813 -20.703 0.711 233 HB2 PRO 39 2HB PRO 39 13.881 -20.355 -1.165 234 HB3 PRO 39 3HB PRO 39 15.115 -21.616 -1.279 235 HG2 PRO 39 2HG PRO 39 12.279 -21.820 -0.342 236 HG3 PRO 39 3HG PRO 39 13.193 -22.919 -1.392 237 HD2 PRO 39 2HD PRO 39 12.788 -23.418 1.238 238 HD3 PRO 39 3HD PRO 39 14.256 -23.934 0.383 239 H ILE 40 H ILE 40 15.009 -19.802 2.982 240 HA ILE 40 HA ILE 40 12.770 -17.950 2.573 241 HB ILE 40 HB ILE 40 13.221 -17.515 5.104 242 HG12 ILE 40 2HG1 ILE 40 14.660 -20.120 4.601 243 HG13 ILE 40 3HG1 ILE 40 15.279 -18.677 5.397 244 HG21 ILE 40 1HG2 ILE 40 12.051 -20.139 4.187 245 HG22 ILE 40 2HG2 ILE 40 11.688 -19.296 5.692 246 HG23 ILE 40 3HG2 ILE 40 11.220 -18.583 4.148 247 HD11 ILE 40 1HD1 ILE 40 14.807 -19.732 7.294 248 HD12 ILE 40 2HD1 ILE 40 13.121 -19.348 6.947 249 HD13 ILE 40 3HD1 ILE 40 13.782 -20.915 6.483 250 H ILE 41 H ILE 41 13.377 -16.068 1.724 251 HA ILE 41 HA ILE 41 15.677 -14.687 2.926 252 HB ILE 41 HB ILE 41 15.981 -13.669 0.553 253 HG12 ILE 41 2HG1 ILE 41 15.505 -15.358 -1.236 254 HG13 ILE 41 3HG1 ILE 41 14.573 -16.275 -0.058 255 HG21 ILE 41 1HG2 ILE 41 17.261 -15.999 0.014 256 HG22 ILE 41 2HG2 ILE 41 17.862 -14.759 1.113 257 HG23 ILE 41 3HG2 ILE 41 16.988 -16.152 1.749 258 HD11 ILE 41 1HD1 ILE 41 12.807 -14.919 -0.225 259 HD12 ILE 41 2HD1 ILE 41 13.801 -13.463 -0.289 260 HD13 ILE 41 3HD1 ILE 41 13.549 -14.424 -1.746 261 H TYR 42 H TYR 42 15.642 -12.290 1.988 262 HA TYR 42 HA TYR 42 12.991 -11.218 1.614 263 HB2 TYR 42 2HB TYR 42 13.594 -9.634 3.702 264 HB3 TYR 42 3HB TYR 42 12.626 -11.095 3.857 265 HD1 TYR 42 HD1 TYR 42 16.237 -11.239 3.230 266 HD2 TYR 42 HD2 TYR 42 13.185 -11.412 6.189 267 HE1 TYR 42 HE1 TYR 42 17.861 -12.138 4.844 268 HE2 TYR 42 HE2 TYR 42 14.800 -12.311 7.811 269 HH TYR 42 HH TYR 42 18.196 -12.854 6.914 270 H CYS 43 H CYS 43 13.619 -10.140 -0.185 271 HA CYS 43 HA CYS 43 16.020 -8.495 -0.138 272 HB2 CYS 43 2HB CYS 43 14.159 -8.512 -2.469 273 HB3 CYS 43 3HB CYS 43 15.919 -8.467 -2.439 274 H ASN 44 H ASN 44 15.828 -6.575 0.818 275 HA ASN 44 HA ASN 44 13.328 -5.155 0.912 276 HB2 ASN 44 2HB ASN 44 16.055 -4.142 1.733 277 HB3 ASN 44 3HB ASN 44 14.487 -3.543 2.267 278 HD21 ASN 44 1HD2 ASN 44 13.384 -6.238 2.510 279 HD22 ASN 44 2HD2 ASN 44 14.068 -6.900 3.952 280 H ARG 45 H ARG 45 12.714 -4.495 -1.101 281 HA ARG 45 HA ARG 45 14.223 -3.594 -3.193 282 HB2 ARG 45 2HB ARG 45 11.503 -2.626 -2.302 283 HB3 ARG 45 3HB ARG 45 12.219 -2.245 -3.862 284 HG2 ARG 45 2HG ARG 45 11.523 -4.992 -2.844 285 HG3 ARG 45 3HG ARG 45 10.648 -4.071 -4.069 286 HD2 ARG 45 2HD ARG 45 13.456 -5.149 -4.259 287 HD3 ARG 45 3HD ARG 45 12.043 -5.699 -5.159 288 HE ARG 45 HE ARG 45 12.392 -2.986 -5.696 289 HH11 ARG 45 1HH1 ARG 45 14.047 -6.003 -6.230 290 HH12 ARG 45 2HH1 ARG 45 14.809 -5.476 -7.694 291 HH21 ARG 45 1HH2 ARG 45 13.390 -2.281 -7.622 292 HH22 ARG 45 2HH2 ARG 45 14.435 -3.358 -8.484 293 H ARG 46 H ARG 46 13.415 -1.896 -0.257 294 HA ARG 46 HA ARG 46 13.879 0.735 -0.967 295 HB2 ARG 46 2HB ARG 46 14.753 -0.523 1.636 296 HB3 ARG 46 3HB ARG 46 14.337 1.162 1.357 297 HG2 ARG 46 2HG ARG 46 12.332 0.605 2.150 298 HG3 ARG 46 3HG ARG 46 12.062 -0.122 0.565 299 HD2 ARG 46 2HD ARG 46 13.503 -1.826 2.471 300 HD3 ARG 46 3HD ARG 46 11.849 -1.435 2.940 301 HE ARG 46 HE ARG 46 12.692 -3.085 0.720 302 HH11 ARG 46 1HH1 ARG 46 10.111 -1.250 2.167 303 HH12 ARG 46 2HH1 ARG 46 8.859 -2.096 1.320 304 HH21 ARG 46 1HH2 ARG 46 11.052 -4.207 -0.401 305 HH22 ARG 46 2HH2 ARG 46 9.395 -3.778 -0.140 306 H THR 47 H THR 47 16.170 -1.844 -0.371 307 HA THR 47 HA THR 47 18.326 -0.055 -1.264 308 HB THR 47 HB THR 47 18.687 -0.242 1.093 309 HG1 THR 47 HG1 THR 47 20.670 -0.450 0.310 310 HG21 THR 47 1HG2 THR 47 18.018 -1.997 2.293 311 HG22 THR 47 2HG2 THR 47 19.112 -3.061 1.410 312 HG23 THR 47 3HG2 THR 47 17.482 -2.771 0.802 313 H GLY 48 H GLY 48 16.554 -2.551 -2.142 314 HA2 GLY 48 2HA GLY 48 16.834 -4.379 -3.505 315 HA3 GLY 48 3HA GLY 48 18.210 -3.492 -4.143 316 H LYS 49 H LYS 49 17.850 -4.707 -0.852 317 HA LYS 49 HA LYS 49 20.162 -6.466 -1.345 318 HB2 LYS 49 2HB LYS 49 19.284 -5.011 1.149 319 HB3 LYS 49 3HB LYS 49 20.510 -6.272 1.158 320 HG2 LYS 49 2HG LYS 49 20.670 -3.485 0.253 321 HG3 LYS 49 3HG LYS 49 21.915 -4.540 0.925 322 HD2 LYS 49 2HD LYS 49 21.913 -5.744 -1.299 323 HD3 LYS 49 3HD LYS 49 20.913 -4.425 -1.913 324 HE2 LYS 49 2HE LYS 49 23.010 -3.143 -0.637 325 HE3 LYS 49 3HE LYS 49 23.773 -4.523 -1.426 326 HZ1 LYS 49 1HZ LYS 49 21.954 -3.346 -3.210 327 HZ2 LYS 49 2HZ LYS 49 23.635 -3.469 -3.350 328 HZ3 LYS 49 3HZ LYS 49 22.946 -2.127 -2.585 329 H CYS 50 H CYS 50 19.932 -8.591 -1.047 330 HA CYS 50 HA CYS 50 17.548 -9.542 0.402 331 HB2 CYS 50 2HB CYS 50 17.686 -9.783 -2.219 332 HB3 CYS 50 3HB CYS 50 18.730 -11.146 -1.829 333 H GLN 51 H GLN 51 17.842 -11.132 1.871 334 HA GLN 51 HA GLN 51 20.389 -12.566 1.937 335 HB2 GLN 51 2HB GLN 51 19.333 -11.412 4.493 336 HB3 GLN 51 3HB GLN 51 20.961 -11.956 4.110 337 HG2 GLN 51 2HG GLN 51 21.429 -9.786 3.931 338 HG3 GLN 51 3HG GLN 51 20.649 -9.905 2.354 339 HE21 GLN 51 1HE2 GLN 51 18.006 -10.297 3.497 340 HE22 GLN 51 2HE2 GLN 51 17.501 -8.755 4.090 341 H ARG 52 H ARG 52 20.335 -14.312 3.664 342 HA ARG 52 HA ARG 52 17.831 -15.746 3.384 343 HB2 ARG 52 2HB ARG 52 20.625 -16.428 4.054 344 HB3 ARG 52 3HB ARG 52 19.399 -17.395 4.863 345 HG2 ARG 52 2HG ARG 52 19.471 -16.981 1.886 346 HG3 ARG 52 3HG ARG 52 20.268 -18.326 2.705 347 HD2 ARG 52 2HD ARG 52 17.406 -17.837 2.194 348 HD3 ARG 52 3HD ARG 52 18.297 -19.355 2.296 349 HE ARG 52 HE ARG 52 16.787 -18.165 4.355 350 HH11 ARG 52 1HH1 ARG 52 19.794 -19.836 3.820 351 HH12 ARG 52 2HH1 ARG 52 19.862 -20.495 5.421 352 HH21 ARG 52 1HH2 ARG 52 16.865 -19.027 6.465 353 HH22 ARG 52 2HH2 ARG 52 18.196 -20.036 6.924 354 H MET 53 H MET 53 16.689 -16.683 5.155 355 HA MET 53 HA MET 53 16.625 -14.939 7.472 356 HB2 MET 53 2HB MET 53 14.860 -17.289 6.764 357 HB3 MET 53 3HB MET 53 14.569 -16.133 8.056 358 HG2 MET 53 2HG MET 53 14.788 -14.462 5.954 359 HG3 MET 53 3HG MET 53 14.129 -15.892 5.162 360 HE1 MET 53 1HE MET 53 12.448 -14.556 9.049 361 HE2 MET 53 2HE MET 53 14.050 -14.179 8.414 362 HE3 MET 53 3HE MET 53 12.711 -13.061 8.151 Start of MODEL 7 1 H1 GLY 1 H GLY 1 0.486 1.348 -2.068 2 HA2 GLY 1 2HA GLY 1 0.964 -0.798 -0.590 3 HA3 GLY 1 3HA GLY 1 1.450 -0.772 -2.279 4 H SER 2 H SER 2 2.554 -1.846 0.435 5 HA SER 2 HA SER 2 5.290 -0.807 0.100 6 HB2 SER 2 2HB SER 2 3.686 -1.393 2.449 7 HB3 SER 2 3HB SER 2 5.219 -2.263 2.484 8 HG SER 2 HG SER 2 5.310 -0.126 3.401 9 H LYS 3 H LYS 3 3.287 -3.657 0.164 10 HA LYS 3 HA LYS 3 5.634 -5.272 -0.590 11 HB2 LYS 3 2HB LYS 3 3.435 -6.855 0.432 12 HB3 LYS 3 3HB LYS 3 5.120 -6.829 0.934 13 HG2 LYS 3 2HG LYS 3 4.012 -6.216 2.859 14 HG3 LYS 3 3HG LYS 3 4.470 -4.655 2.174 15 HD2 LYS 3 2HD LYS 3 2.051 -5.070 1.000 16 HD3 LYS 3 3HD LYS 3 1.813 -5.842 2.570 17 HE2 LYS 3 2HE LYS 3 3.166 -3.355 2.944 18 HE3 LYS 3 3HE LYS 3 1.741 -3.087 1.941 19 HZ1 LYS 3 1HZ LYS 3 1.708 -3.194 4.616 20 HZ2 LYS 3 2HZ LYS 3 1.306 -4.792 4.235 21 HZ3 LYS 3 3HZ LYS 3 0.367 -3.518 3.638 22 H LYS 4 H LYS 4 2.650 -4.043 -1.523 23 HA LYS 4 HA LYS 4 1.625 -6.106 -3.135 24 HB2 LYS 4 2HB LYS 4 1.235 -3.180 -2.902 25 HB3 LYS 4 3HB LYS 4 0.773 -3.900 -4.438 26 HG2 LYS 4 2HG LYS 4 -1.043 -4.869 -3.573 27 HG3 LYS 4 3HG LYS 4 -0.196 -5.372 -2.108 28 HD2 LYS 4 2HD LYS 4 -1.723 -3.852 -1.275 29 HD3 LYS 4 3HD LYS 4 -0.296 -2.838 -1.508 30 HE2 LYS 4 2HE LYS 4 -1.986 -3.011 -3.878 31 HE3 LYS 4 3HE LYS 4 -2.820 -2.331 -2.481 32 HZ1 LYS 4 1HZ LYS 4 -1.712 -0.635 -3.828 33 HZ2 LYS 4 2HZ LYS 4 -0.217 -1.372 -3.541 34 HZ3 LYS 4 3HZ LYS 4 -1.085 -0.692 -2.257 35 HA PRO 5 HA PRO 5 3.985 -4.043 -6.813 36 HB2 PRO 5 2HB PRO 5 5.847 -2.165 -6.198 37 HB3 PRO 5 3HB PRO 5 4.151 -1.772 -6.504 38 HG2 PRO 5 2HG PRO 5 5.579 -2.100 -3.893 39 HG3 PRO 5 3HG PRO 5 4.400 -0.866 -4.377 40 HD2 PRO 5 2HD PRO 5 3.730 -3.004 -2.857 41 HD3 PRO 5 3HD PRO 5 2.601 -2.259 -4.007 42 H VAL 6 H VAL 6 5.813 -4.346 -3.797 43 HA VAL 6 HA VAL 6 7.960 -5.725 -5.257 44 HB VAL 6 HB VAL 6 8.815 -3.930 -3.926 45 HG11 VAL 6 1HG1 VAL 6 7.339 -5.169 -1.605 46 HG12 VAL 6 2HG1 VAL 6 8.451 -3.803 -1.497 47 HG13 VAL 6 3HG1 VAL 6 6.945 -3.647 -2.403 48 HG21 VAL 6 1HG2 VAL 6 10.197 -5.905 -3.943 49 HG22 VAL 6 2HG2 VAL 6 10.289 -5.151 -2.351 50 HG23 VAL 6 3HG2 VAL 6 9.298 -6.590 -2.590 51 HA PRO 7 HA PRO 7 6.119 -9.466 -3.617 52 HB2 PRO 7 2HB PRO 7 7.805 -11.153 -4.913 53 HB3 PRO 7 3HB PRO 7 6.433 -10.370 -5.706 54 HG2 PRO 7 2HG PRO 7 9.329 -9.611 -5.742 55 HG3 PRO 7 3HG PRO 7 8.164 -9.644 -7.079 56 HD2 PRO 7 2HD PRO 7 8.862 -7.355 -5.812 57 HD3 PRO 7 3HD PRO 7 7.243 -7.614 -6.494 58 H ILE 8 H ILE 8 7.412 -8.298 -1.662 59 HA ILE 8 HA ILE 8 9.712 -9.962 -0.924 60 HB ILE 8 HB ILE 8 9.654 -8.250 1.094 61 HG12 ILE 8 2HG1 ILE 8 8.155 -6.851 -1.124 62 HG13 ILE 8 3HG1 ILE 8 7.631 -7.095 0.539 63 HG21 ILE 8 1HG2 ILE 8 11.506 -8.523 -0.448 64 HG22 ILE 8 2HG2 ILE 8 10.656 -7.576 -1.668 65 HG23 ILE 8 3HG2 ILE 8 11.191 -6.809 -0.173 66 HD11 ILE 8 1HD1 ILE 8 9.728 -5.685 1.126 67 HD12 ILE 8 2HD1 ILE 8 9.615 -5.162 -0.555 68 HD13 ILE 8 3HD1 ILE 8 8.265 -4.889 0.546 69 H ILE 9 H ILE 9 9.089 -11.804 0.020 70 HA ILE 9 HA ILE 9 7.199 -11.612 2.269 71 HB ILE 9 HB ILE 9 6.585 -14.044 1.624 72 HG12 ILE 9 2HG1 ILE 9 6.625 -14.392 -0.859 73 HG13 ILE 9 3HG1 ILE 9 7.665 -12.978 -0.993 74 HG21 ILE 9 1HG2 ILE 9 4.765 -12.717 1.472 75 HG22 ILE 9 2HG2 ILE 9 5.611 -11.479 0.545 76 HG23 ILE 9 3HG2 ILE 9 5.022 -12.934 -0.259 77 HD11 ILE 9 1HD1 ILE 9 8.587 -15.021 0.897 78 HD12 ILE 9 2HD1 ILE 9 8.552 -15.515 -0.796 79 HD13 ILE 9 3HD1 ILE 9 9.480 -14.096 -0.310 80 H TYR 10 H TYR 10 7.311 -13.868 3.500 81 HA TYR 10 HA TYR 10 9.922 -15.064 3.588 82 HB2 TYR 10 2HB TYR 10 9.944 -14.370 6.180 83 HB3 TYR 10 3HB TYR 10 10.752 -13.424 4.935 84 HD1 TYR 10 HD1 TYR 10 10.647 -11.396 6.281 85 HD2 TYR 10 HD2 TYR 10 7.102 -13.464 5.158 86 HE1 TYR 10 HE1 TYR 10 9.309 -9.429 6.907 87 HE2 TYR 10 HE2 TYR 10 5.755 -11.502 5.779 88 HH TYR 10 HH TYR 10 5.767 -9.453 6.626 89 H CYS 11 H CYS 11 9.207 -17.104 3.617 90 HA CYS 11 HA CYS 11 6.962 -17.843 5.327 91 HB2 CYS 11 2HB CYS 11 7.454 -18.613 2.839 92 HB3 CYS 11 3HB CYS 11 8.426 -19.835 3.652 93 H ASN 12 H ASN 12 7.310 -18.513 7.329 94 HA ASN 12 HA ASN 12 9.947 -19.293 8.201 95 HB2 ASN 12 2HB ASN 12 7.385 -19.335 9.803 96 HB3 ASN 12 3HB ASN 12 9.033 -19.290 10.423 97 HD21 ASN 12 1HD2 ASN 12 9.954 -17.369 8.475 98 HD22 ASN 12 2HD2 ASN 12 9.281 -15.844 8.931 99 H ARG 13 H ARG 13 10.464 -21.255 7.311 100 HA ARG 13 HA ARG 13 8.897 -23.451 6.873 101 HB2 ARG 13 2HB ARG 13 11.045 -24.790 7.355 102 HB3 ARG 13 3HB ARG 13 11.086 -23.592 6.068 103 HG2 ARG 13 2HG ARG 13 13.079 -23.258 7.215 104 HG3 ARG 13 3HG ARG 13 12.015 -21.996 7.841 105 HD2 ARG 13 2HD ARG 13 13.459 -23.504 9.452 106 HD3 ARG 13 3HD ARG 13 11.838 -22.973 9.897 107 HE ARG 13 HE ARG 13 11.079 -25.145 9.666 108 HH11 ARG 13 1HH1 ARG 13 14.362 -24.876 8.538 109 HH12 ARG 13 2HH1 ARG 13 14.610 -26.588 8.448 110 HH21 ARG 13 1HH2 ARG 13 11.393 -27.401 9.552 111 HH22 ARG 13 2HH2 ARG 13 12.920 -28.024 9.025 112 H ARG 14 H ARG 14 10.007 -22.215 9.911 113 HA ARG 14 HA ARG 14 9.752 -24.520 11.495 114 HB2 ARG 14 2HB ARG 14 9.314 -22.777 13.353 115 HB3 ARG 14 3HB ARG 14 10.867 -22.751 12.528 116 HG2 ARG 14 2HG ARG 14 8.995 -21.072 11.149 117 HG3 ARG 14 3HG ARG 14 9.066 -20.638 12.858 118 HD2 ARG 14 2HD ARG 14 10.853 -19.424 12.249 119 HD3 ARG 14 3HD ARG 14 11.699 -20.970 12.286 120 HE ARG 14 HE ARG 14 10.602 -20.711 9.753 121 HH11 ARG 14 1HH1 ARG 14 12.943 -19.067 11.738 122 HH12 ARG 14 2HH1 ARG 14 13.884 -18.509 10.394 123 HH21 ARG 14 1HH2 ARG 14 11.833 -19.982 7.976 124 HH22 ARG 14 2HH2 ARG 14 13.251 -19.029 8.255 125 H THR 15 H THR 15 7.412 -21.999 10.642 126 HA THR 15 HA THR 15 5.278 -23.733 11.708 127 HB THR 15 HB THR 15 5.404 -21.686 13.007 128 HG1 THR 15 HG1 THR 15 3.291 -22.613 12.093 129 HG21 THR 15 1HG2 THR 15 4.596 -19.618 11.406 130 HG22 THR 15 2HG2 THR 15 5.726 -20.476 10.359 131 HG23 THR 15 3HG2 THR 15 6.252 -19.899 11.940 132 H GLY 16 H GLY 16 6.657 -23.068 8.927 133 HA2 GLY 16 2HA GLY 16 5.996 -22.942 6.728 134 HA3 GLY 16 3HA GLY 16 4.633 -23.911 7.268 135 H LYS 17 H LYS 17 5.406 -20.589 8.194 136 HA LYS 17 HA LYS 17 2.851 -19.758 6.986 137 HB2 LYS 17 2HB LYS 17 4.330 -18.704 9.397 138 HB3 LYS 17 3HB LYS 17 2.973 -17.863 8.659 139 HG2 LYS 17 2HG LYS 17 3.018 -20.251 10.368 140 HG3 LYS 17 3HG LYS 17 1.787 -18.999 10.189 141 HD2 LYS 17 2HD LYS 17 1.241 -20.042 7.948 142 HD3 LYS 17 3HD LYS 17 2.270 -21.393 8.428 143 HE2 LYS 17 2HE LYS 17 0.192 -22.135 9.093 144 HE3 LYS 17 3HE LYS 17 0.791 -21.391 10.575 145 HZ1 LYS 17 1HZ LYS 17 -0.410 -19.313 9.437 146 HZ2 LYS 17 2HZ LYS 17 -1.195 -20.367 10.502 147 HZ3 LYS 17 3HZ LYS 17 -1.378 -20.562 8.831 148 H CYS 18 H CYS 18 2.898 -18.311 5.393 149 HA CYS 18 HA CYS 18 5.394 -16.805 4.960 150 HB2 CYS 18 2HB CYS 18 3.464 -17.379 2.741 151 HB3 CYS 18 3HB CYS 18 5.195 -17.068 2.658 152 H GLN 19 H GLN 19 5.282 -14.640 4.739 153 HA GLN 19 HA GLN 19 2.681 -13.373 4.325 154 HB2 GLN 19 2HB GLN 19 4.469 -12.310 6.483 155 HB3 GLN 19 3HB GLN 19 2.747 -12.046 6.240 156 HG2 GLN 19 2HG GLN 19 2.495 -13.519 7.892 157 HG3 GLN 19 3HG GLN 19 2.825 -14.729 6.653 158 HE21 GLN 19 1HE2 GLN 19 5.617 -13.922 6.401 159 HE22 GLN 19 2HE2 GLN 19 6.424 -14.546 7.795 160 H ARG 20 H ARG 20 2.943 -10.960 4.010 161 HA ARG 20 HA ARG 20 5.223 -10.532 2.239 162 HB2 ARG 20 2HB ARG 20 2.486 -9.462 2.460 163 HB3 ARG 20 3HB ARG 20 3.706 -8.282 2.003 164 HG2 ARG 20 2HG ARG 20 3.522 -10.906 0.582 165 HG3 ARG 20 3HG ARG 20 2.452 -9.568 0.158 166 HD2 ARG 20 2HD ARG 20 4.144 -8.310 -0.710 167 HD3 ARG 20 3HD ARG 20 5.353 -8.990 0.379 168 HE ARG 20 HE ARG 20 5.883 -10.445 -1.282 169 HH11 ARG 20 1HH1 ARG 20 2.562 -9.485 -1.698 170 HH12 ARG 20 2HH1 ARG 20 2.340 -10.409 -3.146 171 HH21 ARG 20 1HH2 ARG 20 5.602 -11.667 -3.188 172 HH22 ARG 20 2HH2 ARG 20 4.070 -11.651 -3.992 173 H MET 21 H MET 21 6.363 -8.463 2.275 174 HA MET 21 HA MET 21 6.908 -7.648 5.023 175 HB2 MET 21 2HB MET 21 8.384 -6.931 2.484 176 HB3 MET 21 3HB MET 21 8.926 -6.622 4.128 177 HG2 MET 21 2HG MET 21 8.586 -9.274 4.267 178 HG3 MET 21 3HG MET 21 8.962 -9.112 2.553 179 HE1 MET 21 1HE MET 21 11.231 -6.806 5.518 180 HE2 MET 21 2HE MET 21 9.710 -7.640 5.835 181 HE3 MET 21 3HE MET 21 11.241 -8.405 6.262 182 H1 GLY 33 H GLY 33 24.460 -24.648 5.924 183 HA2 GLY 33 2HA GLY 33 23.304 -24.061 3.331 184 HA3 GLY 33 3HA GLY 33 23.023 -25.500 4.299 185 H SER 34 H SER 34 21.707 -22.624 3.204 186 HA SER 34 HA SER 34 19.574 -22.755 5.235 187 HB2 SER 34 2HB SER 34 19.679 -20.233 3.791 188 HB3 SER 34 3HB SER 34 19.673 -20.529 5.530 189 HG SER 34 HG SER 34 21.951 -21.015 5.301 190 H LYS 35 H LYS 35 20.404 -22.507 1.855 191 HA LYS 35 HA LYS 35 17.854 -21.985 0.801 192 HB2 LYS 35 2HB LYS 35 18.782 -23.047 -1.290 193 HB3 LYS 35 3HB LYS 35 19.741 -21.729 -0.628 194 HG2 LYS 35 2HG LYS 35 20.784 -23.987 0.583 195 HG3 LYS 35 3HG LYS 35 20.451 -24.498 -1.073 196 HD2 LYS 35 2HD LYS 35 21.717 -22.575 -1.915 197 HD3 LYS 35 3HD LYS 35 22.052 -22.072 -0.256 198 HE2 LYS 35 2HE LYS 35 23.967 -23.241 -1.114 199 HE3 LYS 35 3HE LYS 35 23.196 -24.242 0.115 200 HZ1 LYS 35 1HZ LYS 35 23.104 -24.581 -2.825 201 HZ2 LYS 35 2HZ LYS 35 22.038 -25.383 -1.787 202 HZ3 LYS 35 3HZ LYS 35 23.702 -25.662 -1.669 203 H LYS 36 H LYS 36 18.990 -24.682 2.450 204 HA LYS 36 HA LYS 36 17.105 -26.514 1.156 205 HB2 LYS 36 2HB LYS 36 18.537 -27.684 3.364 206 HB3 LYS 36 3HB LYS 36 18.565 -28.127 1.663 207 HG2 LYS 36 2HG LYS 36 20.187 -25.864 2.794 208 HG3 LYS 36 3HG LYS 36 20.781 -27.522 2.679 209 HD2 LYS 36 2HD LYS 36 19.670 -26.097 0.284 210 HD3 LYS 36 3HD LYS 36 21.351 -25.882 0.777 211 HE2 LYS 36 2HE LYS 36 21.946 -27.903 0.016 212 HE3 LYS 36 3HE LYS 36 20.514 -28.677 0.693 213 HZ1 LYS 36 1HZ LYS 36 20.811 -28.601 -1.847 214 HZ2 LYS 36 2HZ LYS 36 20.291 -26.997 -1.717 215 HZ3 LYS 36 3HZ LYS 36 19.287 -28.256 -1.199 216 HA PRO 37 HA PRO 37 15.656 -26.730 5.744 217 HB2 PRO 37 2HB PRO 37 16.881 -25.106 7.542 218 HB3 PRO 37 3HB PRO 37 17.462 -26.732 7.164 219 HG2 PRO 37 2HG PRO 37 18.433 -24.090 6.145 220 HG3 PRO 37 3HG PRO 37 19.371 -25.497 6.678 221 HD2 PRO 37 2HD PRO 37 18.938 -24.941 4.064 222 HD3 PRO 37 3HD PRO 37 19.092 -26.601 4.674 223 H VAL 38 H VAL 38 16.916 -23.434 5.195 224 HA VAL 38 HA VAL 38 14.166 -22.426 5.540 225 HB VAL 38 HB VAL 38 15.741 -21.686 7.316 226 HG11 VAL 38 1HG1 VAL 38 17.103 -19.805 5.503 227 HG12 VAL 38 2HG1 VAL 38 17.712 -20.664 6.919 228 HG13 VAL 38 3HG1 VAL 38 17.594 -21.493 5.367 229 HG21 VAL 38 1HG2 VAL 38 13.765 -20.329 6.353 230 HG22 VAL 38 2HG2 VAL 38 14.921 -19.513 7.404 231 HG23 VAL 38 3HG2 VAL 38 15.017 -19.301 5.656 232 HA PRO 39 HA PRO 39 15.671 -21.538 1.194 233 HB2 PRO 39 2HB PRO 39 13.517 -22.615 -0.058 234 HB3 PRO 39 3HB PRO 39 14.945 -23.560 0.379 235 HG2 PRO 39 2HG PRO 39 12.317 -23.335 1.794 236 HG3 PRO 39 3HG PRO 39 13.300 -24.778 1.483 237 HD2 PRO 39 2HD PRO 39 13.285 -23.514 3.878 238 HD3 PRO 39 3HD PRO 39 14.722 -24.343 3.245 239 H ILE 40 H ILE 40 14.646 -19.640 2.910 240 HA ILE 40 HA ILE 40 12.670 -18.315 1.187 241 HB ILE 40 HB ILE 40 11.910 -17.279 3.522 242 HG12 ILE 40 2HG1 ILE 40 13.628 -18.997 4.560 243 HG13 ILE 40 3HG1 ILE 40 12.097 -18.658 5.359 244 HG21 ILE 40 1HG2 ILE 40 10.221 -18.110 2.212 245 HG22 ILE 40 2HG2 ILE 40 10.990 -19.686 2.030 246 HG23 ILE 40 3HG2 ILE 40 10.193 -19.264 3.545 247 HD11 ILE 40 1HD1 ILE 40 11.954 -20.836 3.425 248 HD12 ILE 40 2HD1 ILE 40 13.056 -21.134 4.770 249 HD13 ILE 40 3HD1 ILE 40 11.365 -20.744 5.085 250 H ILE 41 H ILE 41 13.359 -16.391 0.541 251 HA ILE 41 HA ILE 41 15.338 -14.976 2.206 252 HB ILE 41 HB ILE 41 15.970 -13.891 -0.069 253 HG12 ILE 41 2HG1 ILE 41 15.735 -15.513 -1.962 254 HG13 ILE 41 3HG1 ILE 41 14.655 -16.468 -0.952 255 HG21 ILE 41 1HG2 ILE 41 17.783 -15.006 0.596 256 HG22 ILE 41 2HG2 ILE 41 16.825 -16.332 1.252 257 HG23 ILE 41 3HG2 ILE 41 17.237 -16.307 -0.462 258 HD11 ILE 41 1HD1 ILE 41 12.926 -15.093 -1.295 259 HD12 ILE 41 2HD1 ILE 41 13.925 -13.642 -1.200 260 HD13 ILE 41 3HD1 ILE 41 13.856 -14.569 -2.699 261 H TYR 42 H TYR 42 15.440 -12.552 1.349 262 HA TYR 42 HA TYR 42 12.880 -11.444 0.632 263 HB2 TYR 42 2HB TYR 42 13.161 -9.948 2.848 264 HB3 TYR 42 3HB TYR 42 12.175 -11.405 2.795 265 HD1 TYR 42 HD1 TYR 42 12.373 -11.800 5.177 266 HD2 TYR 42 HD2 TYR 42 15.837 -11.573 2.717 267 HE1 TYR 42 HE1 TYR 42 13.717 -12.778 6.990 268 HE2 TYR 42 HE2 TYR 42 17.190 -12.551 4.523 269 HH TYR 42 HH TYR 42 16.012 -12.901 7.719 270 H CYS 43 H CYS 43 13.771 -10.296 -1.004 271 HA CYS 43 HA CYS 43 16.137 -8.666 -0.516 272 HB2 CYS 43 2HB CYS 43 14.677 -8.617 -3.119 273 HB3 CYS 43 3HB CYS 43 16.408 -8.554 -2.803 274 H ASN 44 H ASN 44 15.775 -6.781 0.463 275 HA ASN 44 HA ASN 44 13.293 -5.339 0.060 276 HB2 ASN 44 2HB ASN 44 15.700 -4.504 1.689 277 HB3 ASN 44 3HB ASN 44 14.064 -3.862 1.805 278 HD21 ASN 44 1HD2 ASN 44 12.894 -6.543 1.484 279 HD22 ASN 44 2HD2 ASN 44 13.103 -7.324 3.011 280 H ARG 45 H ARG 45 13.249 -4.477 -1.964 281 HA ARG 45 HA ARG 45 15.324 -3.441 -3.448 282 HB2 ARG 45 2HB ARG 45 12.487 -2.396 -3.399 283 HB3 ARG 45 3HB ARG 45 13.645 -2.198 -4.707 284 HG2 ARG 45 2HG ARG 45 12.454 -4.795 -3.758 285 HG3 ARG 45 3HG ARG 45 12.050 -3.932 -5.243 286 HD2 ARG 45 2HD ARG 45 14.683 -5.213 -4.531 287 HD3 ARG 45 3HD ARG 45 13.550 -5.727 -5.780 288 HE ARG 45 HE ARG 45 14.191 -3.174 -6.473 289 HH11 ARG 45 1HH1 ARG 45 16.021 -6.060 -5.810 290 HH12 ARG 45 2HH1 ARG 45 17.315 -5.644 -6.884 291 HH21 ARG 45 1HH2 ARG 45 15.889 -2.614 -7.891 292 HH22 ARG 45 2HH2 ARG 45 17.239 -3.683 -8.067 293 H ARG 46 H ARG 46 13.518 -1.938 -0.850 294 HA ARG 46 HA ARG 46 14.075 0.722 -1.150 295 HB2 ARG 46 2HB ARG 46 14.288 0.679 1.453 296 HB3 ARG 46 3HB ARG 46 12.759 0.256 0.694 297 HG2 ARG 46 2HG ARG 46 14.490 -2.046 1.040 298 HG3 ARG 46 3HG ARG 46 14.126 -1.233 2.564 299 HD2 ARG 46 2HD ARG 46 12.415 -2.822 2.285 300 HD3 ARG 46 3HD ARG 46 11.694 -1.278 1.830 301 HE ARG 46 HE ARG 46 12.692 -3.208 -0.163 302 HH11 ARG 46 1HH1 ARG 46 10.271 -1.008 1.028 303 HH12 ARG 46 2HH1 ARG 46 9.241 -1.188 -0.354 304 HH21 ARG 46 1HH2 ARG 46 11.345 -3.454 -1.987 305 HH22 ARG 46 2HH2 ARG 46 9.852 -2.580 -2.068 306 H THR 47 H THR 47 16.230 -1.794 0.072 307 HA THR 47 HA THR 47 18.442 0.154 -0.027 308 HB THR 47 HB THR 47 18.452 -0.372 2.212 309 HG1 THR 47 HG1 THR 47 20.337 -1.345 2.360 310 HG21 THR 47 1HG2 THR 47 18.133 -2.954 2.820 311 HG22 THR 47 2HG2 THR 47 17.202 -2.910 1.323 312 HG23 THR 47 3HG2 THR 47 16.773 -1.844 2.659 313 H GLY 48 H GLY 48 17.137 -2.239 -1.738 314 HA2 GLY 48 2HA GLY 48 17.909 -3.745 -3.291 315 HA3 GLY 48 3HA GLY 48 19.326 -2.709 -3.376 316 H LYS 49 H LYS 49 17.982 -4.957 -0.953 317 HA LYS 49 HA LYS 49 20.474 -6.490 -1.073 318 HB2 LYS 49 2HB LYS 49 20.533 -6.581 1.422 319 HB3 LYS 49 3HB LYS 49 20.864 -4.986 0.759 320 HG2 LYS 49 2HG LYS 49 19.449 -4.589 2.567 321 HG3 LYS 49 3HG LYS 49 18.392 -4.497 1.156 322 HD2 LYS 49 2HD LYS 49 17.137 -6.177 1.909 323 HD3 LYS 49 3HD LYS 49 18.554 -7.204 2.137 324 HE2 LYS 49 2HE LYS 49 17.342 -6.871 4.235 325 HE3 LYS 49 3HE LYS 49 18.962 -6.177 4.309 326 HZ1 LYS 49 1HZ LYS 49 18.160 -4.091 4.456 327 HZ2 LYS 49 2HZ LYS 49 16.791 -4.870 5.072 328 HZ3 LYS 49 3HZ LYS 49 16.833 -4.391 3.450 329 H CYS 50 H CYS 50 20.293 -8.652 -0.382 330 HA CYS 50 HA CYS 50 17.626 -9.616 0.329 331 HB2 CYS 50 2HB CYS 50 18.061 -9.677 -2.224 332 HB3 CYS 50 3HB CYS 50 19.161 -11.001 -1.855 333 H GLN 51 H GLN 51 17.644 -11.318 1.700 334 HA GLN 51 HA GLN 51 20.112 -12.843 2.056 335 HB2 GLN 51 2HB GLN 51 18.707 -11.843 4.503 336 HB3 GLN 51 3HB GLN 51 20.367 -12.393 4.320 337 HG2 GLN 51 2HG GLN 51 20.918 -10.243 4.332 338 HG3 GLN 51 3HG GLN 51 20.281 -10.193 2.689 339 HE21 GLN 51 1HE2 GLN 51 17.558 -10.481 3.312 340 HE22 GLN 51 2HE2 GLN 51 17.027 -9.035 4.095 341 H ARG 52 H ARG 52 19.672 -14.602 3.826 342 HA ARG 52 HA ARG 52 17.157 -15.893 3.059 343 HB2 ARG 52 2HB ARG 52 19.857 -16.828 3.744 344 HB3 ARG 52 3HB ARG 52 18.564 -17.776 4.466 345 HG2 ARG 52 2HG ARG 52 18.591 -17.128 1.540 346 HG3 ARG 52 3HG ARG 52 19.461 -18.515 2.198 347 HD2 ARG 52 2HD ARG 52 17.570 -19.678 2.588 348 HD3 ARG 52 3HD ARG 52 16.673 -18.246 3.090 349 HE ARG 52 HE ARG 52 15.792 -18.187 0.997 350 HH11 ARG 52 1HH1 ARG 52 18.888 -19.770 0.829 351 HH12 ARG 52 2HH1 ARG 52 18.774 -20.099 -0.869 352 HH21 ARG 52 1HH2 ARG 52 15.630 -18.614 -1.238 353 HH22 ARG 52 2HH2 ARG 52 16.921 -19.439 -2.044 354 H MET 53 H MET 53 15.924 -17.059 4.677 355 HA MET 53 HA MET 53 15.656 -15.509 7.100 356 HB2 MET 53 2HB MET 53 14.078 -17.719 5.820 357 HB3 MET 53 3HB MET 53 13.765 -17.252 7.487 358 HG2 MET 53 2HG MET 53 13.875 -15.004 5.626 359 HG3 MET 53 3HG MET 53 12.588 -16.159 5.289 360 HE1 MET 53 1HE MET 53 13.088 -14.312 9.477 361 HE2 MET 53 2HE MET 53 13.739 -15.892 9.042 362 HE3 MET 53 3HE MET 53 14.373 -14.435 8.276 Start of MODEL 8 1 H1 GLY 1 H GLY 1 0.153 -5.810 0.940 2 HA2 GLY 1 2HA GLY 1 -1.371 -4.012 -0.165 3 HA3 GLY 1 3HA GLY 1 -0.697 -3.004 1.107 4 H SER 2 H SER 2 1.789 -4.901 0.596 5 HA SER 2 HA SER 2 2.841 -3.275 -1.627 6 HB2 SER 2 2HB SER 2 3.747 -3.288 0.974 7 HB3 SER 2 3HB SER 2 4.838 -4.428 0.186 8 HG SER 2 HG SER 2 4.267 -1.839 -0.820 9 H LYS 3 H LYS 3 2.034 -6.362 -0.629 10 HA LYS 3 HA LYS 3 4.011 -8.019 -1.623 11 HB2 LYS 3 2HB LYS 3 1.835 -9.456 -2.266 12 HB3 LYS 3 3HB LYS 3 2.421 -9.289 -0.616 13 HG2 LYS 3 2HG LYS 3 -0.001 -8.969 -0.784 14 HG3 LYS 3 3HG LYS 3 0.823 -7.526 -0.189 15 HD2 LYS 3 2HD LYS 3 0.418 -6.337 -2.111 16 HD3 LYS 3 3HD LYS 3 0.333 -7.786 -3.116 17 HE2 LYS 3 2HE LYS 3 -1.743 -7.048 -1.062 18 HE3 LYS 3 3HE LYS 3 -1.851 -6.599 -2.763 19 HZ1 LYS 3 1HZ LYS 3 -1.682 -9.017 -3.279 20 HZ2 LYS 3 2HZ LYS 3 -3.096 -8.575 -2.462 21 HZ3 LYS 3 3HZ LYS 3 -1.839 -9.337 -1.625 22 H LYS 4 H LYS 4 1.816 -5.983 -3.332 23 HA LYS 4 HA LYS 4 2.027 -7.330 -5.857 24 HB2 LYS 4 2HB LYS 4 0.779 -4.835 -4.846 25 HB3 LYS 4 3HB LYS 4 1.188 -4.873 -6.556 26 HG2 LYS 4 2HG LYS 4 -0.501 -6.243 -7.042 27 HG3 LYS 4 3HG LYS 4 -0.179 -7.282 -5.652 28 HD2 LYS 4 2HD LYS 4 -1.222 -5.426 -4.242 29 HD3 LYS 4 3HD LYS 4 -1.809 -4.758 -5.767 30 HE2 LYS 4 2HE LYS 4 -2.789 -7.073 -6.203 31 HE3 LYS 4 3HE LYS 4 -2.474 -7.401 -4.500 32 HZ1 LYS 4 1HZ LYS 4 -4.657 -6.646 -4.550 33 HZ2 LYS 4 2HZ LYS 4 -4.330 -5.430 -5.679 34 HZ3 LYS 4 3HZ LYS 4 -3.786 -5.272 -4.085 35 HA PRO 5 HA PRO 5 4.974 -3.681 -6.968 36 HB2 PRO 5 2HB PRO 5 5.683 -1.976 -4.978 37 HB3 PRO 5 3HB PRO 5 4.254 -1.731 -5.989 38 HG2 PRO 5 2HG PRO 5 4.450 -2.888 -3.235 39 HG3 PRO 5 3HG PRO 5 3.265 -1.740 -3.884 40 HD2 PRO 5 2HD PRO 5 2.735 -4.381 -3.607 41 HD3 PRO 5 3HD PRO 5 2.033 -3.398 -4.908 42 H VAL 6 H VAL 6 5.469 -4.524 -3.535 43 HA VAL 6 HA VAL 6 8.159 -5.490 -4.258 44 HB VAL 6 HB VAL 6 8.219 -3.414 -2.883 45 HG11 VAL 6 1HG1 VAL 6 7.355 -4.946 -0.490 46 HG12 VAL 6 2HG1 VAL 6 7.259 -3.216 -0.824 47 HG13 VAL 6 3HG1 VAL 6 6.105 -4.325 -1.568 48 HG21 VAL 6 1HG2 VAL 6 9.273 -5.874 -1.491 49 HG22 VAL 6 2HG2 VAL 6 10.054 -5.048 -2.839 50 HG23 VAL 6 3HG2 VAL 6 9.867 -4.226 -1.290 51 HA PRO 7 HA PRO 7 5.920 -9.144 -2.668 52 HB2 PRO 7 2HB PRO 7 7.372 -10.918 -4.123 53 HB3 PRO 7 3HB PRO 7 5.979 -10.050 -4.779 54 HG2 PRO 7 2HG PRO 7 8.898 -9.461 -5.092 55 HG3 PRO 7 3HG PRO 7 7.610 -9.416 -6.311 56 HD2 PRO 7 2HD PRO 7 8.560 -7.181 -5.113 57 HD3 PRO 7 3HD PRO 7 6.871 -7.340 -5.637 58 H ILE 8 H ILE 8 7.427 -8.097 -0.824 59 HA ILE 8 HA ILE 8 9.712 -9.866 -0.325 60 HB ILE 8 HB ILE 8 9.976 -8.230 1.696 61 HG12 ILE 8 2HG1 ILE 8 8.125 -6.738 -0.160 62 HG13 ILE 8 3HG1 ILE 8 7.934 -7.019 1.567 63 HG21 ILE 8 1HG2 ILE 8 10.526 -7.262 -1.105 64 HG22 ILE 8 2HG2 ILE 8 11.390 -6.811 0.363 65 HG23 ILE 8 3HG2 ILE 8 11.494 -8.461 -0.249 66 HD11 ILE 8 1HD1 ILE 8 8.566 -4.704 1.004 67 HD12 ILE 8 2HD1 ILE 8 9.730 -5.506 2.060 68 HD13 ILE 8 3HD1 ILE 8 10.085 -5.310 0.343 69 H ILE 9 H ILE 9 9.095 -11.706 0.627 70 HA ILE 9 HA ILE 9 7.472 -11.497 3.069 71 HB ILE 9 HB ILE 9 6.608 -13.854 2.385 72 HG12 ILE 9 2HG1 ILE 9 6.285 -14.022 -0.096 73 HG13 ILE 9 3HG1 ILE 9 7.394 -12.669 -0.285 74 HG21 ILE 9 1HG2 ILE 9 4.857 -12.455 2.547 75 HG22 ILE 9 2HG2 ILE 9 5.681 -11.160 1.681 76 HG23 ILE 9 3HG2 ILE 9 4.914 -12.470 0.785 77 HD11 ILE 9 1HD1 ILE 9 8.099 -15.286 -0.346 78 HD12 ILE 9 2HD1 ILE 9 9.194 -13.953 0.025 79 HD13 ILE 9 3HD1 ILE 9 8.443 -14.867 1.332 80 H TYR 10 H TYR 10 7.541 -13.827 4.170 81 HA TYR 10 HA TYR 10 10.074 -15.175 3.896 82 HB2 TYR 10 2HB TYR 10 10.341 -14.699 6.531 83 HB3 TYR 10 3HB TYR 10 11.112 -13.711 5.295 84 HD1 TYR 10 HD1 TYR 10 7.493 -13.587 5.895 85 HD2 TYR 10 HD2 TYR 10 11.246 -11.749 6.698 86 HE1 TYR 10 HE1 TYR 10 6.329 -11.601 6.762 87 HE2 TYR 10 HE2 TYR 10 10.092 -9.759 7.568 88 HH TYR 10 HH TYR 10 7.680 -9.351 8.639 89 H CYS 11 H CYS 11 9.065 -17.112 3.702 90 HA CYS 11 HA CYS 11 7.046 -17.903 5.645 91 HB2 CYS 11 2HB CYS 11 8.071 -19.778 3.562 92 HB3 CYS 11 3HB CYS 11 6.433 -19.568 4.174 93 H ASN 12 H ASN 12 7.815 -18.557 7.552 94 HA ASN 12 HA ASN 12 10.366 -19.897 7.773 95 HB2 ASN 12 2HB ASN 12 8.329 -19.432 9.957 96 HB3 ASN 12 3HB ASN 12 10.050 -19.756 10.149 97 HD21 ASN 12 1HD2 ASN 12 10.749 -18.004 7.904 98 HD22 ASN 12 2HD2 ASN 12 10.590 -16.392 8.503 99 H ARG 13 H ARG 13 10.237 -21.904 6.865 100 HA ARG 13 HA ARG 13 8.147 -23.692 6.903 101 HB2 ARG 13 2HB ARG 13 11.094 -24.354 7.059 102 HB3 ARG 13 3HB ARG 13 9.821 -25.458 6.554 103 HG2 ARG 13 2HG ARG 13 10.518 -22.889 5.147 104 HG3 ARG 13 3HG ARG 13 11.091 -24.490 4.673 105 HD2 ARG 13 2HD ARG 13 8.234 -23.530 4.746 106 HD3 ARG 13 3HD ARG 13 9.196 -23.888 3.312 107 HE ARG 13 HE ARG 13 7.767 -25.753 4.922 108 HH11 ARG 13 1HH1 ARG 13 10.613 -25.367 2.953 109 HH12 ARG 13 2HH1 ARG 13 10.719 -27.048 2.548 110 HH21 ARG 13 1HH2 ARG 13 7.896 -27.969 4.394 111 HH22 ARG 13 2HH2 ARG 13 9.173 -28.527 3.367 112 H ARG 14 H ARG 14 10.305 -22.836 9.476 113 HA ARG 14 HA ARG 14 10.135 -25.044 11.142 114 HB2 ARG 14 2HB ARG 14 10.128 -22.154 12.026 115 HB3 ARG 14 3HB ARG 14 10.650 -23.540 12.974 116 HG2 ARG 14 2HG ARG 14 12.697 -22.985 12.283 117 HG3 ARG 14 3HG ARG 14 12.229 -23.759 10.768 118 HD2 ARG 14 2HD ARG 14 11.389 -20.958 11.044 119 HD3 ARG 14 3HD ARG 14 13.133 -21.208 10.986 120 HE ARG 14 HE ARG 14 11.248 -21.586 8.839 121 HH11 ARG 14 1HH1 ARG 14 14.405 -22.369 10.081 122 HH12 ARG 14 2HH1 ARG 14 15.064 -22.756 8.526 123 HH21 ARG 14 1HH2 ARG 14 12.104 -22.093 6.786 124 HH22 ARG 14 2HH2 ARG 14 13.754 -22.597 6.653 125 H THR 15 H THR 15 7.777 -22.561 10.474 126 HA THR 15 HA THR 15 5.874 -23.970 12.225 127 HB THR 15 HB THR 15 6.017 -22.046 13.453 128 HG1 THR 15 HG1 THR 15 3.966 -21.647 13.104 129 HG21 THR 15 1HG2 THR 15 6.936 -20.830 10.905 130 HG22 THR 15 2HG2 THR 15 7.617 -20.709 12.527 131 HG23 THR 15 3HG2 THR 15 6.195 -19.761 12.094 132 H GLY 16 H GLY 16 6.642 -23.437 9.144 133 HA2 GLY 16 2HA GLY 16 5.500 -23.455 7.153 134 HA3 GLY 16 3HA GLY 16 4.226 -24.263 8.055 135 H LYS 17 H LYS 17 5.547 -20.952 8.073 136 HA LYS 17 HA LYS 17 2.905 -19.946 7.306 137 HB2 LYS 17 2HB LYS 17 3.093 -18.171 9.062 138 HB3 LYS 17 3HB LYS 17 2.846 -19.792 9.697 139 HG2 LYS 17 2HG LYS 17 4.469 -18.881 11.087 140 HG3 LYS 17 3HG LYS 17 5.392 -19.874 9.956 141 HD2 LYS 17 2HD LYS 17 6.370 -18.080 8.971 142 HD3 LYS 17 3HD LYS 17 4.945 -17.057 9.174 143 HE2 LYS 17 2HE LYS 17 6.939 -17.811 11.309 144 HE3 LYS 17 3HE LYS 17 6.774 -16.234 10.538 145 HZ1 LYS 17 1HZ LYS 17 5.195 -17.435 12.645 146 HZ2 LYS 17 2HZ LYS 17 4.295 -16.641 11.453 147 HZ3 LYS 17 3HZ LYS 17 5.491 -15.803 12.307 148 H CYS 18 H CYS 18 2.924 -17.809 6.430 149 HA CYS 18 HA CYS 18 5.544 -16.656 5.839 150 HB2 CYS 18 2HB CYS 18 4.677 -18.285 3.991 151 HB3 CYS 18 3HB CYS 18 3.579 -16.968 3.594 152 H GLN 19 H GLN 19 5.539 -14.461 5.639 153 HA GLN 19 HA GLN 19 2.979 -13.062 5.468 154 HB2 GLN 19 2HB GLN 19 4.944 -12.160 7.538 155 HB3 GLN 19 3HB GLN 19 3.215 -11.854 7.438 156 HG2 GLN 19 2HG GLN 19 3.038 -13.405 9.023 157 HG3 GLN 19 3HG GLN 19 3.288 -14.563 7.718 158 HE21 GLN 19 1HE2 GLN 19 6.049 -13.847 7.301 159 HE22 GLN 19 2HE2 GLN 19 6.937 -14.498 8.632 160 H ARG 20 H ARG 20 3.350 -10.639 5.274 161 HA ARG 20 HA ARG 20 5.419 -10.228 3.281 162 HB2 ARG 20 2HB ARG 20 2.915 -8.871 4.078 163 HB3 ARG 20 3HB ARG 20 4.191 -7.822 3.475 164 HG2 ARG 20 2HG ARG 20 3.249 -10.254 1.985 165 HG3 ARG 20 3HG ARG 20 2.529 -8.657 1.774 166 HD2 ARG 20 2HD ARG 20 5.154 -9.694 0.902 167 HD3 ARG 20 3HD ARG 20 4.083 -8.525 0.130 168 HE ARG 20 HE ARG 20 6.304 -7.935 1.765 169 HH11 ARG 20 1HH1 ARG 20 3.039 -6.900 1.142 170 HH12 ARG 20 2HH1 ARG 20 3.326 -5.263 1.629 171 HH21 ARG 20 1HH2 ARG 20 6.695 -5.782 2.409 172 HH22 ARG 20 2HH2 ARG 20 5.406 -4.628 2.349 173 H MET 21 H MET 21 6.885 -8.429 3.340 174 HA MET 21 HA MET 21 7.937 -7.984 6.007 175 HB2 MET 21 2HB MET 21 8.998 -7.126 3.309 176 HB3 MET 21 3HB MET 21 9.850 -6.962 4.839 177 HG2 MET 21 2HG MET 21 9.267 -9.612 4.839 178 HG3 MET 21 3HG MET 21 9.490 -9.302 3.119 179 HE1 MET 21 1HE MET 21 10.699 -7.994 6.344 180 HE2 MET 21 2HE MET 21 11.941 -9.203 6.671 181 HE3 MET 21 3HE MET 21 12.397 -7.611 6.064 182 H1 GLY 33 H GLY 33 22.182 -24.691 6.601 183 HA2 GLY 33 2HA GLY 33 20.609 -25.648 5.230 184 HA3 GLY 33 3HA GLY 33 20.449 -26.898 6.454 185 H SER 34 H SER 34 19.763 -23.437 6.748 186 HA SER 34 HA SER 34 17.039 -24.132 7.579 187 HB2 SER 34 2HB SER 34 18.011 -21.339 7.833 188 HB3 SER 34 3HB SER 34 17.069 -22.313 8.962 189 HG SER 34 HG SER 34 19.146 -23.530 9.207 190 H LYS 35 H LYS 35 18.839 -22.393 5.160 191 HA LYS 35 HA LYS 35 16.301 -21.662 3.850 192 HB2 LYS 35 2HB LYS 35 18.504 -20.087 2.887 193 HB3 LYS 35 3HB LYS 35 17.000 -19.554 3.626 194 HG2 LYS 35 2HG LYS 35 18.615 -18.669 5.023 195 HG3 LYS 35 3HG LYS 35 18.142 -20.150 5.857 196 HD2 LYS 35 2HD LYS 35 20.120 -21.141 4.376 197 HD3 LYS 35 3HD LYS 35 20.676 -19.468 4.471 198 HE2 LYS 35 2HE LYS 35 19.958 -19.990 7.058 199 HE3 LYS 35 3HE LYS 35 20.591 -21.548 6.529 200 HZ1 LYS 35 1HZ LYS 35 22.358 -20.242 7.448 201 HZ2 LYS 35 2HZ LYS 35 22.004 -18.939 6.429 202 HZ3 LYS 35 3HZ LYS 35 22.609 -20.380 5.780 203 H LYS 36 H LYS 36 19.077 -23.526 3.694 204 HA LYS 36 HA LYS 36 19.721 -23.493 0.966 205 HB2 LYS 36 2HB LYS 36 20.170 -25.325 3.244 206 HB3 LYS 36 3HB LYS 36 20.280 -26.053 1.647 207 HG2 LYS 36 2HG LYS 36 22.234 -25.068 1.202 208 HG3 LYS 36 3HG LYS 36 21.723 -23.525 1.892 209 HD2 LYS 36 2HD LYS 36 22.041 -24.571 4.166 210 HD3 LYS 36 3HD LYS 36 22.805 -25.933 3.344 211 HE2 LYS 36 2HE LYS 36 24.546 -24.480 4.058 212 HE3 LYS 36 3HE LYS 36 24.397 -24.290 2.312 213 HZ1 LYS 36 1HZ LYS 36 23.306 -22.238 2.576 214 HZ2 LYS 36 2HZ LYS 36 24.624 -22.184 3.634 215 HZ3 LYS 36 3HZ LYS 36 23.069 -22.470 4.235 216 HA PRO 37 HA PRO 37 16.672 -27.197 0.408 217 HB2 PRO 37 2HB PRO 37 15.006 -27.764 2.475 218 HB3 PRO 37 3HB PRO 37 16.608 -28.492 2.305 219 HG2 PRO 37 2HG PRO 37 15.746 -26.186 4.008 220 HG3 PRO 37 3HG PRO 37 16.817 -27.538 4.416 221 HD2 PRO 37 2HD PRO 37 17.754 -25.087 3.751 222 HD3 PRO 37 3HD PRO 37 18.632 -26.581 3.366 223 H VAL 38 H VAL 38 15.493 -24.568 2.467 224 HA VAL 38 HA VAL 38 13.084 -24.367 0.792 225 HB VAL 38 HB VAL 38 12.524 -24.552 3.113 226 HG11 VAL 38 1HG1 VAL 38 14.411 -22.243 3.572 227 HG12 VAL 38 2HG1 VAL 38 13.347 -22.948 4.791 228 HG13 VAL 38 3HG1 VAL 38 14.648 -23.912 4.091 229 HG21 VAL 38 1HG2 VAL 38 11.421 -22.333 3.512 230 HG22 VAL 38 2HG2 VAL 38 12.261 -21.733 2.082 231 HG23 VAL 38 3HG2 VAL 38 11.098 -23.050 1.933 232 HA PRO 39 HA PRO 39 15.169 -20.861 -1.058 233 HB2 PRO 39 2HB PRO 39 13.237 -20.374 -2.902 234 HB3 PRO 39 3HB PRO 39 14.430 -21.667 -3.079 235 HG2 PRO 39 2HG PRO 39 11.595 -21.822 -2.128 236 HG3 PRO 39 3HG PRO 39 12.466 -22.903 -3.231 237 HD2 PRO 39 2HD PRO 39 12.064 -23.500 -0.621 238 HD3 PRO 39 3HD PRO 39 13.509 -24.025 -1.508 239 H ILE 40 H ILE 40 14.398 -20.042 1.261 240 HA ILE 40 HA ILE 40 12.253 -18.064 0.912 241 HB ILE 40 HB ILE 40 12.752 -17.849 3.515 242 HG12 ILE 40 2HG1 ILE 40 13.651 -20.640 2.783 243 HG13 ILE 40 3HG1 ILE 40 14.585 -19.405 3.619 244 HG21 ILE 40 1HG2 ILE 40 11.196 -20.255 3.123 245 HG22 ILE 40 2HG2 ILE 40 10.682 -18.654 3.652 246 HG23 ILE 40 3HG2 ILE 40 10.798 -19.018 1.931 247 HD11 ILE 40 1HD1 ILE 40 13.972 -20.716 5.374 248 HD12 ILE 40 2HD1 ILE 40 12.623 -19.580 5.359 249 HD13 ILE 40 3HD1 ILE 40 12.437 -21.178 4.638 250 H ILE 41 H ILE 41 13.038 -16.197 0.165 251 HA ILE 41 HA ILE 41 15.420 -15.080 1.491 252 HB ILE 41 HB ILE 41 15.690 -13.791 -0.745 253 HG12 ILE 41 2HG1 ILE 41 14.993 -15.192 -2.708 254 HG13 ILE 41 3HG1 ILE 41 14.042 -16.178 -1.603 255 HG21 ILE 41 1HG2 ILE 41 17.500 -15.088 -0.424 256 HG22 ILE 41 2HG2 ILE 41 16.540 -16.490 0.044 257 HG23 ILE 41 3HG2 ILE 41 16.759 -16.102 -1.662 258 HD11 ILE 41 1HD1 ILE 41 12.395 -14.672 -1.490 259 HD12 ILE 41 2HD1 ILE 41 13.508 -13.305 -1.440 260 HD13 ILE 41 3HD1 ILE 41 13.099 -14.054 -2.983 261 H TYR 42 H TYR 42 15.505 -12.585 0.864 262 HA TYR 42 HA TYR 42 12.940 -11.294 0.739 263 HB2 TYR 42 2HB TYR 42 13.676 -10.081 3.025 264 HB3 TYR 42 3HB TYR 42 12.602 -11.475 2.981 265 HD1 TYR 42 HD1 TYR 42 13.153 -12.177 5.229 266 HD2 TYR 42 HD2 TYR 42 16.190 -11.781 2.275 267 HE1 TYR 42 HE1 TYR 42 14.709 -13.423 6.670 268 HE2 TYR 42 HE2 TYR 42 17.754 -13.027 3.707 269 HH TYR 42 HH TYR 42 17.303 -13.533 6.914 270 H CYS 43 H CYS 43 13.554 -9.930 -0.837 271 HA CYS 43 HA CYS 43 16.091 -8.502 -0.614 272 HB2 CYS 43 2HB CYS 43 14.208 -8.053 -2.885 273 HB3 CYS 43 3HB CYS 43 15.967 -8.116 -2.883 274 H ASN 44 H ASN 44 15.999 -6.774 0.679 275 HA ASN 44 HA ASN 44 13.606 -5.208 0.981 276 HB2 ASN 44 2HB ASN 44 16.380 -4.549 1.985 277 HB3 ASN 44 3HB ASN 44 14.849 -3.929 2.594 278 HD21 ASN 44 1HD2 ASN 44 13.555 -6.546 2.369 279 HD22 ASN 44 2HD2 ASN 44 14.153 -7.481 3.693 280 H ARG 45 H ARG 45 13.074 -4.161 -0.880 281 HA ARG 45 HA ARG 45 14.656 -3.062 -2.806 282 HB2 ARG 45 2HB ARG 45 12.058 -1.975 -1.710 283 HB3 ARG 45 3HB ARG 45 12.802 -1.430 -3.207 284 HG2 ARG 45 2HG ARG 45 11.844 -4.225 -2.624 285 HG3 ARG 45 3HG ARG 45 11.026 -3.031 -3.635 286 HD2 ARG 45 2HD ARG 45 13.717 -4.297 -4.134 287 HD3 ARG 45 3HD ARG 45 12.229 -4.581 -5.037 288 HE ARG 45 HE ARG 45 14.038 -2.369 -5.328 289 HH11 ARG 45 1HH1 ARG 45 10.761 -3.460 -5.767 290 HH12 ARG 45 2HH1 ARG 45 10.406 -2.308 -7.011 291 HH21 ARG 45 1HH2 ARG 45 13.582 -0.847 -6.966 292 HH22 ARG 45 2HH2 ARG 45 12.011 -0.823 -7.693 293 H ARG 46 H ARG 46 13.818 -1.651 0.313 294 HA ARG 46 HA ARG 46 14.653 0.940 0.029 295 HB2 ARG 46 2HB ARG 46 15.439 0.688 2.482 296 HB3 ARG 46 3HB ARG 46 13.741 0.421 2.109 297 HG2 ARG 46 2HG ARG 46 15.268 -2.023 1.898 298 HG3 ARG 46 3HG ARG 46 15.430 -1.282 3.492 299 HD2 ARG 46 2HD ARG 46 13.550 -2.598 3.758 300 HD3 ARG 46 3HD ARG 46 12.851 -1.031 3.353 301 HE ARG 46 HE ARG 46 13.294 -2.944 1.189 302 HH11 ARG 46 1HH1 ARG 46 11.092 -1.296 3.324 303 HH12 ARG 46 2HH1 ARG 46 9.689 -1.673 2.380 304 HH21 ARG 46 1HH2 ARG 46 11.454 -3.447 -0.062 305 HH22 ARG 46 2HH2 ARG 46 9.896 -2.898 0.455 306 H THR 47 H THR 47 16.661 -1.918 0.561 307 HA THR 47 HA THR 47 19.035 -0.263 -0.005 308 HB THR 47 HB THR 47 19.099 -1.095 2.291 309 HG1 THR 47 HG1 THR 47 21.124 -2.278 2.062 310 HG21 THR 47 1HG2 THR 47 19.553 -3.770 2.226 311 HG22 THR 47 2HG2 THR 47 18.321 -3.610 0.975 312 HG23 THR 47 3HG2 THR 47 17.996 -3.038 2.611 313 H GLY 48 H GLY 48 17.050 -2.236 -1.512 314 HA2 GLY 48 2HA GLY 48 17.204 -3.789 -3.206 315 HA3 GLY 48 3HA GLY 48 18.640 -2.877 -3.647 316 H LYS 49 H LYS 49 18.242 -4.713 -0.673 317 HA LYS 49 HA LYS 49 20.375 -6.521 -1.601 318 HB2 LYS 49 2HB LYS 49 19.717 -5.529 1.174 319 HB3 LYS 49 3HB LYS 49 20.857 -6.830 0.855 320 HG2 LYS 49 2HG LYS 49 21.146 -3.925 0.490 321 HG3 LYS 49 3HG LYS 49 22.348 -5.148 0.912 322 HD2 LYS 49 2HD LYS 49 22.163 -5.929 -1.507 323 HD3 LYS 49 3HD LYS 49 21.295 -4.423 -1.810 324 HE2 LYS 49 2HE LYS 49 23.362 -3.631 -2.241 325 HE3 LYS 49 3HE LYS 49 23.444 -3.477 -0.487 326 HZ1 LYS 49 1HZ LYS 49 25.275 -4.749 -1.888 327 HZ2 LYS 49 2HZ LYS 49 24.222 -6.046 -1.625 328 HZ3 LYS 49 3HZ LYS 49 24.871 -5.204 -0.309 329 H CYS 50 H CYS 50 20.044 -8.671 -1.558 330 HA CYS 50 HA CYS 50 17.590 -9.658 -0.262 331 HB2 CYS 50 2HB CYS 50 17.648 -9.477 -2.875 332 HB3 CYS 50 3HB CYS 50 18.644 -10.925 -2.766 333 H GLN 51 H GLN 51 17.799 -11.430 0.979 334 HA GLN 51 HA GLN 51 20.234 -13.044 0.753 335 HB2 GLN 51 2HB GLN 51 19.232 -12.279 3.471 336 HB3 GLN 51 3HB GLN 51 20.826 -12.853 2.997 337 HG2 GLN 51 2HG GLN 51 21.455 -10.728 3.147 338 HG3 GLN 51 3HG GLN 51 20.612 -10.501 1.615 339 HE21 GLN 51 1HE2 GLN 51 17.986 -10.889 2.735 340 HE22 GLN 51 2HE2 GLN 51 17.618 -9.468 3.646 341 H ARG 52 H ARG 52 20.043 -15.012 2.283 342 HA ARG 52 HA ARG 52 17.409 -16.185 1.802 343 HB2 ARG 52 2HB ARG 52 20.155 -17.192 1.952 344 HB3 ARG 52 3HB ARG 52 18.995 -18.199 2.808 345 HG2 ARG 52 2HG ARG 52 18.522 -17.307 -0.014 346 HG3 ARG 52 3HG ARG 52 19.470 -18.746 0.365 347 HD2 ARG 52 2HD ARG 52 17.659 -19.920 1.074 348 HD3 ARG 52 3HD ARG 52 16.839 -18.488 1.694 349 HE ARG 52 HE ARG 52 15.686 -18.445 -0.262 350 HH11 ARG 52 1HH1 ARG 52 18.785 -19.915 -0.862 351 HH12 ARG 52 2HH1 ARG 52 18.469 -20.202 -2.542 352 HH21 ARG 52 1HH2 ARG 52 15.259 -18.818 -2.471 353 HH22 ARG 52 2HH2 ARG 52 16.464 -19.577 -3.456 354 H MET 53 H MET 53 16.360 -17.461 3.443 355 HA MET 53 HA MET 53 17.161 -16.854 6.199 356 HB2 MET 53 2HB MET 53 15.283 -15.731 6.729 357 HB3 MET 53 3HB MET 53 15.136 -15.473 4.995 358 HG2 MET 53 2HG MET 53 13.055 -16.260 5.466 359 HG3 MET 53 3HG MET 53 13.877 -17.770 5.081 360 HE1 MET 53 1HE MET 53 12.693 -16.268 9.252 361 HE2 MET 53 2HE MET 53 14.241 -15.724 8.605 362 HE3 MET 53 3HE MET 53 12.744 -15.334 7.756 Start of MODEL 9 1 H1 GLY 1 H GLY 1 -0.504 -3.663 3.000 2 HA2 GLY 1 2HA GLY 1 -0.881 -3.739 0.227 3 HA3 GLY 1 3HA GLY 1 -0.664 -2.057 0.690 4 H SER 2 H SER 2 0.831 -5.258 0.850 5 HA SER 2 HA SER 2 3.456 -3.922 0.973 6 HB2 SER 2 2HB SER 2 3.427 -6.719 1.839 7 HB3 SER 2 3HB SER 2 4.140 -5.306 2.618 8 HG SER 2 HG SER 2 1.908 -4.781 3.240 9 H LYS 3 H LYS 3 1.524 -6.486 -0.425 10 HA LYS 3 HA LYS 3 3.502 -7.800 -1.905 11 HB2 LYS 3 2HB LYS 3 1.525 -8.368 -3.451 12 HB3 LYS 3 3HB LYS 3 1.443 -8.905 -1.778 13 HG2 LYS 3 2HG LYS 3 0.292 -6.292 -2.017 14 HG3 LYS 3 3HG LYS 3 -0.438 -7.387 -3.193 15 HD2 LYS 3 2HD LYS 3 -0.765 -9.022 -1.309 16 HD3 LYS 3 3HD LYS 3 -0.267 -7.738 -0.204 17 HE2 LYS 3 2HE LYS 3 -2.169 -6.498 -0.576 18 HE3 LYS 3 3HE LYS 3 -2.437 -7.191 -2.174 19 HZ1 LYS 3 1HZ LYS 3 -2.660 -9.306 -0.454 20 HZ2 LYS 3 2HZ LYS 3 -3.936 -8.485 -1.201 21 HZ3 LYS 3 3HZ LYS 3 -3.441 -8.043 0.355 22 H LYS 4 H LYS 4 2.330 -4.656 -2.211 23 HA LYS 4 HA LYS 4 2.983 -4.470 -5.057 24 HB2 LYS 4 2HB LYS 4 2.264 -1.953 -3.851 25 HB3 LYS 4 3HB LYS 4 1.453 -2.843 -5.133 26 HG2 LYS 4 2HG LYS 4 1.102 -3.510 -2.226 27 HG3 LYS 4 3HG LYS 4 0.088 -2.339 -3.072 28 HD2 LYS 4 2HD LYS 4 -0.475 -4.120 -4.721 29 HD3 LYS 4 3HD LYS 4 0.417 -5.268 -3.719 30 HE2 LYS 4 2HE LYS 4 -1.974 -5.382 -3.261 31 HE3 LYS 4 3HE LYS 4 -1.088 -4.806 -1.849 32 HZ1 LYS 4 1HZ LYS 4 -2.388 -2.968 -3.773 33 HZ2 LYS 4 2HZ LYS 4 -1.811 -2.614 -2.224 34 HZ3 LYS 4 3HZ LYS 4 -3.189 -3.577 -2.413 35 HA PRO 5 HA PRO 5 5.990 -1.193 -3.205 36 HB2 PRO 5 2HB PRO 5 6.081 -0.936 -0.504 37 HB3 PRO 5 3HB PRO 5 4.965 -0.016 -1.520 38 HG2 PRO 5 2HG PRO 5 4.463 -2.493 0.084 39 HG3 PRO 5 3HG PRO 5 3.452 -1.046 -0.085 40 HD2 PRO 5 2HD PRO 5 2.964 -3.331 -1.453 41 HD3 PRO 5 3HD PRO 5 2.599 -1.725 -2.115 42 H VAL 6 H VAL 6 5.608 -3.757 -0.748 43 HA VAL 6 HA VAL 6 8.432 -4.478 -1.197 44 HB VAL 6 HB VAL 6 7.951 -3.569 1.076 45 HG11 VAL 6 1HG1 VAL 6 6.731 -5.949 2.141 46 HG12 VAL 6 2HG1 VAL 6 6.224 -4.265 2.292 47 HG13 VAL 6 3HG1 VAL 6 5.703 -5.223 0.905 48 HG21 VAL 6 1HG2 VAL 6 9.702 -5.381 0.445 49 HG22 VAL 6 2HG2 VAL 6 9.374 -5.048 2.146 50 HG23 VAL 6 3HG2 VAL 6 8.658 -6.460 1.369 51 HA PRO 7 HA PRO 7 5.672 -8.048 -2.426 52 HB2 PRO 7 2HB PRO 7 6.807 -8.427 -4.862 53 HB3 PRO 7 3HB PRO 7 5.464 -7.310 -4.592 54 HG2 PRO 7 2HG PRO 7 8.393 -6.732 -4.814 55 HG3 PRO 7 3HG PRO 7 7.022 -5.853 -5.517 56 HD2 PRO 7 2HD PRO 7 8.295 -5.017 -3.278 57 HD3 PRO 7 3HD PRO 7 6.562 -4.744 -3.549 58 H ILE 8 H ILE 8 7.795 -8.195 -0.634 59 HA ILE 8 HA ILE 8 9.187 -10.584 -1.627 60 HB ILE 8 HB ILE 8 11.084 -9.699 0.010 61 HG12 ILE 8 2HG1 ILE 8 9.526 -7.580 0.279 62 HG13 ILE 8 3HG1 ILE 8 11.278 -7.414 0.229 63 HG21 ILE 8 1HG2 ILE 8 10.603 -9.175 -2.887 64 HG22 ILE 8 2HG2 ILE 8 12.046 -8.520 -2.114 65 HG23 ILE 8 3HG2 ILE 8 11.760 -10.261 -2.117 66 HD11 ILE 8 1HD1 ILE 8 11.207 -6.215 -1.640 67 HD12 ILE 8 2HD1 ILE 8 10.057 -7.312 -2.405 68 HD13 ILE 8 3HD1 ILE 8 9.482 -6.047 -1.320 69 H ILE 9 H ILE 9 8.349 -12.180 -0.448 70 HA ILE 9 HA ILE 9 7.924 -11.732 2.431 71 HB ILE 9 HB ILE 9 6.578 -13.949 2.166 72 HG12 ILE 9 2HG1 ILE 9 5.509 -14.133 -0.069 73 HG13 ILE 9 3HG1 ILE 9 6.605 -12.894 -0.671 74 HG21 ILE 9 1HG2 ILE 9 5.892 -11.154 1.762 75 HG22 ILE 9 2HG2 ILE 9 4.738 -12.253 1.010 76 HG23 ILE 9 3HG2 ILE 9 5.089 -12.387 2.733 77 HD11 ILE 9 1HD1 ILE 9 7.886 -15.203 0.621 78 HD12 ILE 9 2HD1 ILE 9 7.047 -15.531 -0.896 79 HD13 ILE 9 3HD1 ILE 9 8.329 -14.320 -0.840 80 H TYR 10 H TYR 10 7.988 -14.037 3.592 81 HA TYR 10 HA TYR 10 10.067 -15.789 2.669 82 HB2 TYR 10 2HB TYR 10 11.277 -15.264 5.013 83 HB3 TYR 10 3HB TYR 10 11.726 -14.475 3.505 84 HD1 TYR 10 HD1 TYR 10 8.578 -13.682 5.209 85 HD2 TYR 10 HD2 TYR 10 12.631 -12.526 4.624 86 HE1 TYR 10 HE1 TYR 10 8.092 -11.491 6.215 87 HE2 TYR 10 HE2 TYR 10 12.157 -10.332 5.629 88 HH TYR 10 HH TYR 10 10.356 -9.441 7.338 89 H CYS 11 H CYS 11 8.902 -17.583 3.039 90 HA CYS 11 HA CYS 11 7.452 -17.903 5.544 91 HB2 CYS 11 2HB CYS 11 6.656 -18.595 3.145 92 HB3 CYS 11 3HB CYS 11 7.634 -20.029 3.439 93 H ASN 12 H ASN 12 8.649 -18.501 7.235 94 HA ASN 12 HA ASN 12 11.002 -20.144 6.921 95 HB2 ASN 12 2HB ASN 12 9.696 -19.252 9.497 96 HB3 ASN 12 3HB ASN 12 11.357 -19.792 9.273 97 HD21 ASN 12 1HD2 ASN 12 11.631 -18.330 6.754 98 HD22 ASN 12 2HD2 ASN 12 11.813 -16.668 7.191 99 H ARG 13 H ARG 13 10.455 -22.190 6.322 100 HA ARG 13 HA ARG 13 8.295 -23.711 7.001 101 HB2 ARG 13 2HB ARG 13 11.113 -24.784 6.799 102 HB3 ARG 13 3HB ARG 13 9.622 -25.672 6.511 103 HG2 ARG 13 2HG ARG 13 10.732 -23.419 4.853 104 HG3 ARG 13 3HG ARG 13 10.641 -25.125 4.410 105 HD2 ARG 13 2HD ARG 13 8.329 -23.246 4.872 106 HD3 ARG 13 3HD ARG 13 8.858 -23.910 3.326 107 HE ARG 13 HE ARG 13 8.297 -26.062 4.984 108 HH11 ARG 13 1HH1 ARG 13 6.593 -23.386 3.552 109 HH12 ARG 13 2HH1 ARG 13 5.080 -24.225 3.467 110 HH21 ARG 13 1HH2 ARG 13 6.311 -27.178 4.878 111 HH22 ARG 13 2HH2 ARG 13 4.920 -26.382 4.222 112 H ARG 14 H ARG 14 11.178 -23.121 8.930 113 HA ARG 14 HA ARG 14 10.944 -25.022 10.899 114 HB2 ARG 14 2HB ARG 14 11.886 -23.167 12.433 115 HB3 ARG 14 3HB ARG 14 12.839 -23.673 11.045 116 HG2 ARG 14 2HG ARG 14 11.034 -21.491 10.409 117 HG3 ARG 14 3HG ARG 14 12.161 -21.090 11.707 118 HD2 ARG 14 2HD ARG 14 13.288 -20.483 9.749 119 HD3 ARG 14 3HD ARG 14 13.975 -22.047 10.184 120 HE ARG 14 HE ARG 14 11.845 -21.811 8.165 121 HH11 ARG 14 1HH1 ARG 14 14.997 -22.897 9.167 122 HH12 ARG 14 2HH1 ARG 14 15.277 -23.826 7.732 123 HH21 ARG 14 1HH2 ARG 14 12.201 -23.031 6.271 124 HH22 ARG 14 2HH2 ARG 14 13.686 -23.901 6.084 125 H THR 15 H THR 15 9.182 -21.978 10.588 126 HA THR 15 HA THR 15 7.435 -22.847 12.799 127 HB THR 15 HB THR 15 8.668 -20.826 13.411 128 HG1 THR 15 HG1 THR 15 6.901 -19.842 14.195 129 HG21 THR 15 1HG2 THR 15 9.237 -19.500 11.679 130 HG22 THR 15 2HG2 THR 15 7.662 -18.756 11.955 131 HG23 THR 15 3HG2 THR 15 7.847 -19.996 10.715 132 H GLY 16 H GLY 16 7.502 -22.879 9.620 133 HA2 GLY 16 2HA GLY 16 5.967 -22.683 7.912 134 HA3 GLY 16 3HA GLY 16 4.835 -23.235 9.139 135 H LYS 17 H LYS 17 6.576 -20.174 9.184 136 HA LYS 17 HA LYS 17 3.986 -18.795 8.923 137 HB2 LYS 17 2HB LYS 17 6.459 -18.032 10.481 138 HB3 LYS 17 3HB LYS 17 5.102 -16.943 10.219 139 HG2 LYS 17 2HG LYS 17 5.355 -19.259 12.019 140 HG3 LYS 17 3HG LYS 17 4.455 -17.753 12.216 141 HD2 LYS 17 2HD LYS 17 2.870 -18.674 10.435 142 HD3 LYS 17 3HD LYS 17 3.660 -20.229 10.707 143 HE2 LYS 17 2HE LYS 17 2.828 -18.846 13.154 144 HE3 LYS 17 3HE LYS 17 1.498 -19.299 12.089 145 HZ1 LYS 17 1HZ LYS 17 1.929 -21.515 12.340 146 HZ2 LYS 17 2HZ LYS 17 2.395 -20.956 13.867 147 HZ3 LYS 17 3HZ LYS 17 3.568 -21.289 12.694 148 H CYS 18 H CYS 18 3.750 -17.253 7.405 149 HA CYS 18 HA CYS 18 6.140 -16.497 5.853 150 HB2 CYS 18 2HB CYS 18 3.387 -16.574 4.656 151 HB3 CYS 18 3HB CYS 18 4.948 -16.636 3.844 152 H GLN 19 H GLN 19 6.527 -14.383 5.621 153 HA GLN 19 HA GLN 19 4.356 -12.465 6.016 154 HB2 GLN 19 2HB GLN 19 6.973 -11.933 7.367 155 HB3 GLN 19 3HB GLN 19 5.382 -11.274 7.723 156 HG2 GLN 19 2HG GLN 19 5.386 -12.695 9.435 157 HG3 GLN 19 3HG GLN 19 5.008 -13.922 8.228 158 HE21 GLN 19 1HE2 GLN 19 7.618 -13.807 6.989 159 HE22 GLN 19 2HE2 GLN 19 8.711 -14.598 8.068 160 H ARG 20 H ARG 20 5.218 -10.166 5.567 161 HA ARG 20 HA ARG 20 6.907 -10.321 3.163 162 HB2 ARG 20 2HB ARG 20 4.425 -9.415 3.207 163 HB3 ARG 20 3HB ARG 20 5.204 -7.943 3.772 164 HG2 ARG 20 2HG ARG 20 5.539 -7.421 1.646 165 HG3 ARG 20 3HG ARG 20 6.718 -8.732 1.584 166 HD2 ARG 20 2HD ARG 20 4.250 -9.987 1.317 167 HD3 ARG 20 3HD ARG 20 4.112 -8.523 0.343 168 HE ARG 20 HE ARG 20 6.555 -9.750 -0.248 169 HH11 ARG 20 1HH1 ARG 20 3.141 -10.320 -0.623 170 HH12 ARG 20 2HH1 ARG 20 3.324 -11.263 -2.065 171 HH21 ARG 20 1HH2 ARG 20 6.809 -10.990 -2.146 172 HH22 ARG 20 2HH2 ARG 20 5.411 -11.644 -2.930 173 H MET 21 H MET 21 8.300 -8.452 2.719 174 HA MET 21 HA MET 21 9.783 -7.724 5.078 175 HB2 MET 21 2HB MET 21 10.159 -7.239 2.133 176 HB3 MET 21 3HB MET 21 11.183 -6.452 3.327 177 HG2 MET 21 2HG MET 21 10.919 -9.340 3.693 178 HG3 MET 21 3HG MET 21 11.677 -8.864 2.175 179 HE1 MET 21 1HE MET 21 13.189 -7.622 6.342 180 HE2 MET 21 2HE MET 21 12.097 -6.559 5.455 181 HE3 MET 21 3HE MET 21 11.559 -8.166 5.943 182 H1 GLY 33 H GLY 33 16.867 -22.018 9.853 183 HA2 GLY 33 2HA GLY 33 19.039 -23.933 10.289 184 HA3 GLY 33 3HA GLY 33 17.569 -24.226 9.371 185 H SER 34 H SER 34 18.842 -25.091 7.667 186 HA SER 34 HA SER 34 20.735 -23.365 6.321 187 HB2 SER 34 2HB SER 34 19.681 -26.052 5.415 188 HB3 SER 34 3HB SER 34 21.142 -25.238 4.856 189 HG SER 34 HG SER 34 21.959 -25.452 7.000 190 H LYS 35 H LYS 35 20.267 -22.000 4.735 191 HA LYS 35 HA LYS 35 17.570 -21.816 3.733 192 HB2 LYS 35 2HB LYS 35 18.469 -19.850 2.472 193 HB3 LYS 35 3HB LYS 35 18.697 -19.756 4.213 194 HG2 LYS 35 2HG LYS 35 21.005 -20.983 3.283 195 HG3 LYS 35 3HG LYS 35 20.652 -19.732 2.088 196 HD2 LYS 35 2HD LYS 35 20.475 -18.080 3.912 197 HD3 LYS 35 3HD LYS 35 20.904 -19.341 5.071 198 HE2 LYS 35 2HE LYS 35 22.894 -18.142 4.617 199 HE3 LYS 35 3HE LYS 35 23.025 -19.671 3.750 200 HZ1 LYS 35 1HZ LYS 35 22.241 -17.063 2.565 201 HZ2 LYS 35 2HZ LYS 35 22.334 -18.529 1.727 202 HZ3 LYS 35 3HZ LYS 35 23.735 -17.832 2.370 203 H LYS 36 H LYS 36 20.159 -23.677 2.903 204 HA LYS 36 HA LYS 36 20.206 -23.503 0.087 205 HB2 LYS 36 2HB LYS 36 21.162 -25.424 2.131 206 HB3 LYS 36 3HB LYS 36 20.944 -26.062 0.507 207 HG2 LYS 36 2HG LYS 36 22.747 -25.004 -0.277 208 HG3 LYS 36 3HG LYS 36 22.368 -23.513 0.589 209 HD2 LYS 36 2HD LYS 36 23.178 -24.646 2.682 210 HD3 LYS 36 3HD LYS 36 23.753 -25.966 1.661 211 HE2 LYS 36 2HE LYS 36 24.645 -23.463 0.592 212 HE3 LYS 36 3HE LYS 36 25.072 -23.558 2.300 213 HZ1 LYS 36 1HZ LYS 36 25.594 -25.978 0.828 214 HZ2 LYS 36 2HZ LYS 36 26.586 -25.132 1.905 215 HZ3 LYS 36 3HZ LYS 36 26.492 -24.651 0.286 216 HA PRO 37 HA PRO 37 17.133 -27.234 0.130 217 HB2 PRO 37 2HB PRO 37 15.955 -27.845 2.498 218 HB3 PRO 37 3HB PRO 37 17.485 -28.559 1.974 219 HG2 PRO 37 2HG PRO 37 17.004 -26.285 3.861 220 HG3 PRO 37 3HG PRO 37 18.142 -27.637 4.005 221 HD2 PRO 37 2HD PRO 37 18.906 -25.169 3.194 222 HD3 PRO 37 3HD PRO 37 19.685 -26.651 2.604 223 H VAL 38 H VAL 38 16.436 -24.621 2.409 224 HA VAL 38 HA VAL 38 13.696 -24.448 1.367 225 HB VAL 38 HB VAL 38 13.747 -24.538 3.760 226 HG11 VAL 38 1HG1 VAL 38 16.045 -23.875 4.141 227 HG12 VAL 38 2HG1 VAL 38 15.680 -22.225 3.631 228 HG13 VAL 38 3HG1 VAL 38 14.963 -22.872 5.107 229 HG21 VAL 38 1HG2 VAL 38 12.715 -22.364 4.344 230 HG22 VAL 38 2HG2 VAL 38 13.252 -21.724 2.791 231 HG23 VAL 38 3HG2 VAL 38 12.086 -23.046 2.845 232 HA PRO 39 HA PRO 39 15.238 -21.032 -1.089 233 HB2 PRO 39 2HB PRO 39 12.907 -20.620 -2.419 234 HB3 PRO 39 3HB PRO 39 14.031 -21.921 -2.831 235 HG2 PRO 39 2HG PRO 39 11.519 -22.031 -1.206 236 HG3 PRO 39 3HG PRO 39 12.101 -23.159 -2.443 237 HD2 PRO 39 2HD PRO 39 12.359 -23.645 0.208 238 HD3 PRO 39 3HD PRO 39 13.545 -24.209 -0.986 239 H ILE 40 H ILE 40 15.030 -20.137 1.333 240 HA ILE 40 HA ILE 40 12.848 -18.176 1.447 241 HB ILE 40 HB ILE 40 13.992 -17.829 3.819 242 HG12 ILE 40 2HG1 ILE 40 14.782 -20.617 2.972 243 HG13 ILE 40 3HG1 ILE 40 15.830 -19.335 3.570 244 HG21 ILE 40 1HG2 ILE 40 11.668 -18.498 3.380 245 HG22 ILE 40 2HG2 ILE 40 12.198 -20.168 3.188 246 HG23 ILE 40 3HG2 ILE 40 12.362 -19.365 4.749 247 HD11 ILE 40 1HD1 ILE 40 14.528 -19.504 5.742 248 HD12 ILE 40 2HD1 ILE 40 13.873 -21.010 5.099 249 HD13 ILE 40 3HD1 ILE 40 15.611 -20.837 5.345 250 H ILE 41 H ILE 41 13.359 -16.321 0.479 251 HA ILE 41 HA ILE 41 15.960 -15.101 1.121 252 HB ILE 41 HB ILE 41 15.725 -13.995 -1.208 253 HG12 ILE 41 2HG1 ILE 41 14.653 -15.546 -2.869 254 HG13 ILE 41 3HG1 ILE 41 13.968 -16.436 -1.514 255 HG21 ILE 41 1HG2 ILE 41 16.637 -16.326 -2.184 256 HG22 ILE 41 2HG2 ILE 41 17.587 -15.269 -1.141 257 HG23 ILE 41 3HG2 ILE 41 16.743 -16.658 -0.456 258 HD11 ILE 41 1HD1 ILE 41 12.718 -14.438 -2.824 259 HD12 ILE 41 2HD1 ILE 41 12.373 -14.905 -1.158 260 HD13 ILE 41 3HD1 ILE 41 13.452 -13.550 -1.489 261 H TYR 42 H TYR 42 15.836 -12.664 0.305 262 HA TYR 42 HA TYR 42 13.266 -11.419 0.629 263 HB2 TYR 42 2HB TYR 42 14.399 -10.019 2.613 264 HB3 TYR 42 3HB TYR 42 13.422 -11.453 2.904 265 HD1 TYR 42 HD1 TYR 42 16.757 -11.762 1.439 266 HD2 TYR 42 HD2 TYR 42 14.507 -11.858 5.050 267 HE1 TYR 42 HE1 TYR 42 18.657 -12.819 2.588 268 HE2 TYR 42 HE2 TYR 42 16.402 -12.914 6.209 269 HH TYR 42 HH TYR 42 18.977 -12.972 5.853 270 H CYS 43 H CYS 43 13.457 -10.115 -1.085 271 HA CYS 43 HA CYS 43 15.961 -8.704 -1.582 272 HB2 CYS 43 2HB CYS 43 14.393 -9.891 -3.341 273 HB3 CYS 43 3HB CYS 43 13.530 -8.357 -3.289 274 H ASN 44 H ASN 44 16.280 -6.801 -0.655 275 HA ASN 44 HA ASN 44 14.072 -5.238 0.357 276 HB2 ASN 44 2HB ASN 44 17.009 -4.520 0.334 277 HB3 ASN 44 3HB ASN 44 15.752 -3.824 1.353 278 HD21 ASN 44 1HD2 ASN 44 14.479 -6.400 1.826 279 HD22 ASN 44 2HD2 ASN 44 15.494 -7.236 2.947 280 H ARG 45 H ARG 45 12.947 -4.468 -1.409 281 HA ARG 45 HA ARG 45 13.806 -3.475 -3.780 282 HB2 ARG 45 2HB ARG 45 11.584 -2.466 -2.007 283 HB3 ARG 45 3HB ARG 45 11.840 -1.868 -3.641 284 HG2 ARG 45 2HG ARG 45 11.190 -4.693 -2.833 285 HG3 ARG 45 3HG ARG 45 10.134 -3.553 -3.669 286 HD2 ARG 45 2HD ARG 45 12.649 -4.844 -4.705 287 HD3 ARG 45 3HD ARG 45 11.003 -5.054 -5.302 288 HE ARG 45 HE ARG 45 11.564 -2.366 -5.549 289 HH11 ARG 45 1HH1 ARG 45 12.871 -5.356 -6.762 290 HH12 ARG 45 2HH1 ARG 45 13.436 -4.659 -8.245 291 HH21 ARG 45 1HH2 ARG 45 12.303 -1.437 -7.497 292 HH22 ARG 45 2HH2 ARG 45 13.113 -2.429 -8.661 293 H ARG 46 H ARG 46 13.949 -1.858 -0.664 294 HA ARG 46 HA ARG 46 14.503 0.737 -1.402 295 HB2 ARG 46 2HB ARG 46 15.981 0.732 0.721 296 HB3 ARG 46 3HB ARG 46 14.263 0.394 0.890 297 HG2 ARG 46 2HG ARG 46 15.709 -2.044 0.439 298 HG3 ARG 46 3HG ARG 46 16.410 -1.153 1.791 299 HD2 ARG 46 2HD ARG 46 14.792 -2.106 3.011 300 HD3 ARG 46 3HD ARG 46 13.734 -0.904 2.272 301 HE ARG 46 HE ARG 46 13.771 -3.014 0.518 302 HH11 ARG 46 1HH1 ARG 46 12.932 -2.554 3.865 303 HH12 ARG 46 2HH1 ARG 46 11.736 -3.808 3.873 304 HH21 ARG 46 1HH2 ARG 46 12.199 -4.667 0.515 305 HH22 ARG 46 2HH2 ARG 46 11.321 -5.010 1.967 306 H THR 47 H THR 47 16.737 -2.001 -1.188 307 HA THR 47 HA THR 47 18.734 -0.379 -2.629 308 HB THR 47 HB THR 47 19.540 -0.865 -0.387 309 HG1 THR 47 HG1 THR 47 21.272 -0.937 -1.662 310 HG21 THR 47 1HG2 THR 47 18.468 -3.523 -0.995 311 HG22 THR 47 2HG2 THR 47 18.726 -2.734 0.561 312 HG23 THR 47 3HG2 THR 47 20.065 -3.547 -0.248 313 H GLY 48 H GLY 48 16.529 -2.585 -3.226 314 HA2 GLY 48 2HA GLY 48 16.277 -4.335 -4.698 315 HA3 GLY 48 3HA GLY 48 17.499 -3.485 -5.632 316 H LYS 49 H LYS 49 17.896 -5.001 -2.465 317 HA LYS 49 HA LYS 49 19.872 -6.813 -3.685 318 HB2 LYS 49 2HB LYS 49 19.741 -5.607 -0.920 319 HB3 LYS 49 3HB LYS 49 20.840 -6.912 -1.347 320 HG2 LYS 49 2HG LYS 49 20.962 -4.049 -1.989 321 HG3 LYS 49 3HG LYS 49 22.260 -5.221 -1.750 322 HD2 LYS 49 2HD LYS 49 21.638 -6.178 -4.007 323 HD3 LYS 49 3HD LYS 49 20.610 -4.760 -4.227 324 HE2 LYS 49 2HE LYS 49 22.362 -3.542 -4.845 325 HE3 LYS 49 3HE LYS 49 23.198 -3.925 -3.341 326 HZ1 LYS 49 1HZ LYS 49 24.150 -4.619 -5.685 327 HZ2 LYS 49 2HZ LYS 49 23.172 -5.974 -5.422 328 HZ3 LYS 49 3HZ LYS 49 24.384 -5.577 -4.310 329 H CYS 50 H CYS 50 19.528 -8.937 -3.571 330 HA CYS 50 HA CYS 50 17.456 -9.908 -1.712 331 HB2 CYS 50 2HB CYS 50 18.145 -11.372 -4.233 332 HB3 CYS 50 3HB CYS 50 16.642 -11.380 -3.316 333 H GLN 51 H GLN 51 17.960 -11.551 -0.380 334 HA GLN 51 HA GLN 51 20.359 -13.138 -0.894 335 HB2 GLN 51 2HB GLN 51 19.949 -12.041 1.863 336 HB3 GLN 51 3HB GLN 51 21.419 -12.658 1.121 337 HG2 GLN 51 2HG GLN 51 21.976 -10.508 0.929 338 HG3 GLN 51 3HG GLN 51 20.887 -10.516 -0.458 339 HE21 GLN 51 1HE2 GLN 51 18.517 -10.821 1.214 340 HE22 GLN 51 2HE2 GLN 51 18.238 -9.276 1.935 341 H ARG 52 H ARG 52 20.545 -14.951 0.755 342 HA ARG 52 HA ARG 52 17.898 -16.141 1.059 343 HB2 ARG 52 2HB ARG 52 20.660 -17.154 0.790 344 HB3 ARG 52 3HB ARG 52 19.615 -18.083 1.856 345 HG2 ARG 52 2HG ARG 52 18.659 -17.330 -0.868 346 HG3 ARG 52 3HG ARG 52 19.770 -18.686 -0.662 347 HD2 ARG 52 2HD ARG 52 18.225 -19.967 0.412 348 HD3 ARG 52 3HD ARG 52 17.409 -18.577 1.125 349 HE ARG 52 HE ARG 52 15.942 -18.679 -0.606 350 HH11 ARG 52 1HH1 ARG 52 18.968 -20.038 -1.664 351 HH12 ARG 52 2HH1 ARG 52 18.382 -20.446 -3.242 352 HH21 ARG 52 1HH2 ARG 52 15.159 -19.212 -2.681 353 HH22 ARG 52 2HH2 ARG 52 16.216 -19.976 -3.820 354 H MET 53 H MET 53 17.375 -17.335 3.038 355 HA MET 53 HA MET 53 18.134 -15.780 5.381 356 HB2 MET 53 2HB MET 53 16.053 -17.956 5.112 357 HB3 MET 53 3HB MET 53 16.258 -16.876 6.485 358 HG2 MET 53 2HG MET 53 15.922 -15.033 4.621 359 HG3 MET 53 3HG MET 53 15.081 -16.356 3.816 360 HE1 MET 53 1HE MET 53 14.341 -15.010 8.038 361 HE2 MET 53 2HE MET 53 15.713 -14.632 6.997 362 HE3 MET 53 3HE MET 53 14.273 -13.613 6.964 Start of MODEL 10 1 H1 GLY 1 H GLY 1 9.022 -1.781 4.875 2 HA2 GLY 1 2HA GLY 1 7.085 -0.372 4.471 3 HA3 GLY 1 3HA GLY 1 8.179 -0.195 3.107 4 H SER 2 H SER 2 7.274 -0.385 1.179 5 HA SER 2 HA SER 2 4.574 -1.243 0.878 6 HB2 SER 2 2HB SER 2 4.930 -0.817 -1.521 7 HB3 SER 2 3HB SER 2 5.533 0.519 -0.539 8 HG SER 2 HG SER 2 7.032 -1.531 -1.797 9 H LYS 3 H LYS 3 3.770 -3.175 0.342 10 HA LYS 3 HA LYS 3 5.653 -5.269 -0.527 11 HB2 LYS 3 2HB LYS 3 4.572 -6.874 0.830 12 HB3 LYS 3 3HB LYS 3 4.799 -5.466 1.859 13 HG2 LYS 3 2HG LYS 3 2.234 -6.074 0.410 14 HG3 LYS 3 3HG LYS 3 2.575 -6.580 2.066 15 HD2 LYS 3 2HD LYS 3 3.202 -3.886 2.059 16 HD3 LYS 3 3HD LYS 3 1.763 -3.984 1.040 17 HE2 LYS 3 2HE LYS 3 2.075 -4.963 3.873 18 HE3 LYS 3 3HE LYS 3 1.066 -3.633 3.306 19 HZ1 LYS 3 1HZ LYS 3 -0.501 -5.236 3.385 20 HZ2 LYS 3 2HZ LYS 3 0.598 -6.504 3.176 21 HZ3 LYS 3 3HZ LYS 3 0.087 -5.600 1.841 22 H LYS 4 H LYS 4 2.665 -3.651 -1.013 23 HA LYS 4 HA LYS 4 1.288 -5.582 -2.532 24 HB2 LYS 4 2HB LYS 4 1.077 -2.614 -2.990 25 HB3 LYS 4 3HB LYS 4 -0.172 -3.839 -3.177 26 HG2 LYS 4 2HG LYS 4 1.002 -2.820 -0.601 27 HG3 LYS 4 3HG LYS 4 -0.633 -2.559 -1.212 28 HD2 LYS 4 2HD LYS 4 0.557 -5.226 -0.445 29 HD3 LYS 4 3HD LYS 4 -0.578 -4.287 0.528 30 HE2 LYS 4 2HE LYS 4 -1.763 -4.503 -1.993 31 HE3 LYS 4 3HE LYS 4 -1.088 -6.097 -1.660 32 HZ1 LYS 4 1HZ LYS 4 -3.327 -5.952 -0.826 33 HZ2 LYS 4 2HZ LYS 4 -2.948 -4.581 0.089 34 HZ3 LYS 4 3HZ LYS 4 -2.256 -6.074 0.478 35 HA PRO 5 HA PRO 5 3.298 -3.394 -6.367 36 HB2 PRO 5 2HB PRO 5 5.514 -1.905 -5.876 37 HB3 PRO 5 3HB PRO 5 3.880 -1.230 -5.862 38 HG2 PRO 5 2HG PRO 5 5.594 -2.090 -3.563 39 HG3 PRO 5 3HG PRO 5 4.579 -0.644 -3.722 40 HD2 PRO 5 2HD PRO 5 3.790 -2.833 -2.337 41 HD3 PRO 5 3HD PRO 5 2.647 -1.791 -3.208 42 H VAL 6 H VAL 6 5.584 -4.205 -3.768 43 HA VAL 6 HA VAL 6 7.158 -5.782 -5.682 44 HB VAL 6 HB VAL 6 8.558 -4.284 -4.491 45 HG11 VAL 6 1HG1 VAL 6 7.253 -5.299 -1.968 46 HG12 VAL 6 2HG1 VAL 6 8.628 -4.194 -2.027 47 HG13 VAL 6 3HG1 VAL 6 7.066 -3.696 -2.679 48 HG21 VAL 6 1HG2 VAL 6 9.520 -6.481 -4.743 49 HG22 VAL 6 2HG2 VAL 6 10.012 -5.810 -3.187 50 HG23 VAL 6 3HG2 VAL 6 8.742 -7.031 -3.259 51 HA PRO 7 HA PRO 7 5.141 -9.365 -3.934 52 HB2 PRO 7 2HB PRO 7 6.408 -11.170 -5.517 53 HB3 PRO 7 3HB PRO 7 5.057 -10.179 -6.081 54 HG2 PRO 7 2HG PRO 7 7.996 -9.782 -6.487 55 HG3 PRO 7 3HG PRO 7 6.671 -9.595 -7.650 56 HD2 PRO 7 2HD PRO 7 7.822 -7.486 -6.401 57 HD3 PRO 7 3HD PRO 7 6.107 -7.504 -6.862 58 H ILE 8 H ILE 8 6.844 -8.464 -2.145 59 HA ILE 8 HA ILE 8 8.960 -10.464 -1.788 60 HB ILE 8 HB ILE 8 9.489 -8.871 0.230 61 HG12 ILE 8 2HG1 ILE 8 7.793 -7.162 -1.592 62 HG13 ILE 8 3HG1 ILE 8 7.575 -7.443 0.132 63 HG21 ILE 8 1HG2 ILE 8 10.823 -7.422 -1.373 64 HG22 ILE 8 2HG2 ILE 8 11.076 -9.164 -1.482 65 HG23 ILE 8 3HG2 ILE 8 10.064 -8.344 -2.671 66 HD11 ILE 8 1HD1 ILE 8 9.859 -6.315 0.397 67 HD12 ILE 8 2HD1 ILE 8 9.607 -5.745 -1.253 68 HD13 ILE 8 3HD1 ILE 8 8.464 -5.306 0.016 69 H ILE 9 H ILE 9 8.368 -12.209 -0.688 70 HA ILE 9 HA ILE 9 6.732 -11.846 1.731 71 HB ILE 9 HB ILE 9 5.864 -14.225 1.197 72 HG12 ILE 9 2HG1 ILE 9 5.632 -14.604 -1.273 73 HG13 ILE 9 3HG1 ILE 9 6.771 -13.288 -1.531 74 HG21 ILE 9 1HG2 ILE 9 4.145 -12.763 1.188 75 HG22 ILE 9 2HG2 ILE 9 4.997 -11.603 0.171 76 HG23 ILE 9 3HG2 ILE 9 4.223 -13.010 -0.556 77 HD11 ILE 9 1HD1 ILE 9 7.687 -15.387 0.303 78 HD12 ILE 9 2HD1 ILE 9 7.458 -15.886 -1.374 79 HD13 ILE 9 3HD1 ILE 9 8.542 -14.548 -0.992 80 H TYR 10 H TYR 10 6.787 -14.100 2.978 81 HA TYR 10 HA TYR 10 9.304 -15.483 2.832 82 HB2 TYR 10 2HB TYR 10 9.619 -14.793 5.402 83 HB3 TYR 10 3HB TYR 10 10.362 -13.896 4.082 84 HD1 TYR 10 HD1 TYR 10 6.755 -13.702 4.651 85 HD2 TYR 10 HD2 TYR 10 10.516 -11.871 5.429 86 HE1 TYR 10 HE1 TYR 10 5.601 -11.662 5.394 87 HE2 TYR 10 HE2 TYR 10 9.372 -9.826 6.175 88 HH TYR 10 HH TYR 10 6.587 -9.539 7.185 89 H CYS 11 H CYS 11 8.399 -17.453 2.902 90 HA CYS 11 HA CYS 11 6.274 -18.037 4.800 91 HB2 CYS 11 2HB CYS 11 6.529 -18.871 2.308 92 HB3 CYS 11 3HB CYS 11 7.512 -20.126 3.056 93 H ASN 12 H ASN 12 6.803 -18.547 6.814 94 HA ASN 12 HA ASN 12 9.409 -19.564 7.490 95 HB2 ASN 12 2HB ASN 12 7.004 -19.269 9.298 96 HB3 ASN 12 3HB ASN 12 8.692 -19.390 9.784 97 HD21 ASN 12 1HD2 ASN 12 9.599 -17.661 7.617 98 HD22 ASN 12 2HD2 ASN 12 9.163 -16.054 8.076 99 H ARG 13 H ARG 13 9.710 -21.611 6.747 100 HA ARG 13 HA ARG 13 7.885 -23.664 6.553 101 HB2 ARG 13 2HB ARG 13 10.046 -25.122 7.027 102 HB3 ARG 13 3HB ARG 13 9.861 -24.211 5.534 103 HG2 ARG 13 2HG ARG 13 11.652 -22.980 5.971 104 HG3 ARG 13 3HG ARG 13 11.074 -22.597 7.594 105 HD2 ARG 13 2HD ARG 13 12.697 -24.964 6.699 106 HD3 ARG 13 3HD ARG 13 13.128 -23.729 7.881 107 HE ARG 13 HE ARG 13 10.825 -25.048 8.772 108 HH11 ARG 13 1HH1 ARG 13 14.209 -25.670 8.236 109 HH12 ARG 13 2HH1 ARG 13 14.316 -26.879 9.472 110 HH21 ARG 13 1HH2 ARG 13 10.954 -26.639 10.402 111 HH22 ARG 13 2HH2 ARG 13 12.464 -27.430 10.703 112 H ARG 14 H ARG 14 9.387 -22.371 9.383 113 HA ARG 14 HA ARG 14 9.147 -24.564 11.120 114 HB2 ARG 14 2HB ARG 14 9.171 -21.588 11.594 115 HB3 ARG 14 3HB ARG 14 9.059 -22.743 12.915 116 HG2 ARG 14 2HG ARG 14 11.345 -22.027 12.620 117 HG3 ARG 14 3HG ARG 14 11.188 -23.737 12.213 118 HD2 ARG 14 2HD ARG 14 12.598 -22.470 10.617 119 HD3 ARG 14 3HD ARG 14 11.198 -23.232 9.863 120 HE ARG 14 HE ARG 14 10.447 -21.157 9.284 121 HH11 ARG 14 1HH1 ARG 14 12.768 -20.827 11.858 122 HH12 ARG 14 2HH1 ARG 14 12.783 -19.096 11.798 123 HH21 ARG 14 1HH2 ARG 14 10.458 -18.878 9.196 124 HH22 ARG 14 2HH2 ARG 14 11.468 -17.988 10.284 125 H THR 15 H THR 15 6.830 -22.203 10.002 126 HA THR 15 HA THR 15 4.729 -23.651 11.464 127 HB THR 15 HB THR 15 5.001 -21.619 12.704 128 HG1 THR 15 HG1 THR 15 2.921 -21.000 12.609 129 HG21 THR 15 1HG2 THR 15 4.331 -19.636 10.745 130 HG22 THR 15 2HG2 THR 15 5.759 -20.527 10.219 131 HG23 THR 15 3HG2 THR 15 5.746 -19.729 11.791 132 H GLY 16 H GLY 16 5.911 -23.129 8.555 133 HA2 GLY 16 2HA GLY 16 5.075 -23.053 6.415 134 HA3 GLY 16 3HA GLY 16 3.703 -23.911 7.102 135 H LYS 17 H LYS 17 4.748 -20.622 7.853 136 HA LYS 17 HA LYS 17 2.176 -19.660 6.786 137 HB2 LYS 17 2HB LYS 17 3.848 -18.660 9.091 138 HB3 LYS 17 3HB LYS 17 2.507 -17.747 8.411 139 HG2 LYS 17 2HG LYS 17 2.497 -20.111 10.156 140 HG3 LYS 17 3HG LYS 17 1.344 -18.780 10.031 141 HD2 LYS 17 2HD LYS 17 0.610 -19.812 7.833 142 HD3 LYS 17 3HD LYS 17 1.558 -21.229 8.293 143 HE2 LYS 17 2HE LYS 17 -0.078 -20.460 10.498 144 HE3 LYS 17 3HE LYS 17 -1.085 -20.553 9.054 145 HZ1 LYS 17 1HZ LYS 17 -1.151 -22.715 9.642 146 HZ2 LYS 17 2HZ LYS 17 0.318 -22.667 10.478 147 HZ3 LYS 17 3HZ LYS 17 0.309 -22.785 8.790 148 H CYS 18 H CYS 18 2.198 -18.185 5.210 149 HA CYS 18 HA CYS 18 4.766 -16.882 4.578 150 HB2 CYS 18 2HB CYS 18 2.629 -17.339 2.522 151 HB3 CYS 18 3HB CYS 18 4.359 -17.111 2.291 152 H GLN 19 H GLN 19 4.803 -14.717 4.386 153 HA GLN 19 HA GLN 19 2.285 -13.253 4.130 154 HB2 GLN 19 2HB GLN 19 4.273 -12.322 6.167 155 HB3 GLN 19 3HB GLN 19 2.557 -11.957 6.041 156 HG2 GLN 19 2HG GLN 19 2.330 -13.419 7.706 157 HG3 GLN 19 3HG GLN 19 2.508 -14.642 6.449 158 HE21 GLN 19 1HE2 GLN 19 5.316 -14.008 6.007 159 HE22 GLN 19 2HE2 GLN 19 6.177 -14.676 7.347 160 H ARG 20 H ARG 20 2.719 -10.860 3.811 161 HA ARG 20 HA ARG 20 4.903 -10.600 1.893 162 HB2 ARG 20 2HB ARG 20 2.291 -9.287 2.321 163 HB3 ARG 20 3HB ARG 20 3.579 -8.239 1.741 164 HG2 ARG 20 2HG ARG 20 3.063 -10.846 0.384 165 HG3 ARG 20 3HG ARG 20 2.033 -9.453 0.050 166 HD2 ARG 20 2HD ARG 20 3.691 -8.307 -1.009 167 HD3 ARG 20 3HD ARG 20 4.964 -9.026 -0.023 168 HE ARG 20 HE ARG 20 5.265 -10.533 -1.696 169 HH11 ARG 20 1HH1 ARG 20 1.965 -9.429 -1.810 170 HH12 ARG 20 2HH1 ARG 20 1.561 -10.371 -3.207 171 HH21 ARG 20 1HH2 ARG 20 4.745 -11.777 -3.536 172 HH22 ARG 20 2HH2 ARG 20 3.143 -11.706 -4.188 173 H MET 21 H MET 21 6.247 -8.680 1.873 174 HA MET 21 HA MET 21 7.082 -7.965 4.560 175 HB2 MET 21 2HB MET 21 8.305 -7.164 1.915 176 HB3 MET 21 3HB MET 21 9.046 -7.013 3.503 177 HG2 MET 21 2HG MET 21 8.631 -9.619 3.553 178 HG3 MET 21 3HG MET 21 8.665 -9.413 1.804 179 HE1 MET 21 1HE MET 21 10.155 -8.390 5.004 180 HE2 MET 21 2HE MET 21 11.792 -9.043 4.942 181 HE3 MET 21 3HE MET 21 11.482 -7.387 4.418 182 H1 GLY 33 H GLY 33 21.485 -26.272 9.137 183 HA2 GLY 33 2HA GLY 33 20.877 -25.603 6.339 184 HA3 GLY 33 3HA GLY 33 20.456 -27.107 7.144 185 H SER 34 H SER 34 19.832 -23.611 7.467 186 HA SER 34 HA SER 34 17.052 -24.282 8.178 187 HB2 SER 34 2HB SER 34 18.523 -21.714 8.807 188 HB3 SER 34 3HB SER 34 16.942 -22.210 9.411 189 HG SER 34 HG SER 34 17.906 -23.303 10.915 190 H LYS 35 H LYS 35 19.114 -22.538 6.013 191 HA LYS 35 HA LYS 35 16.736 -21.521 4.600 192 HB2 LYS 35 2HB LYS 35 18.628 -19.889 3.650 193 HB3 LYS 35 3HB LYS 35 17.706 -19.523 5.102 194 HG2 LYS 35 2HG LYS 35 20.035 -19.089 5.498 195 HG3 LYS 35 3HG LYS 35 19.527 -20.478 6.463 196 HD2 LYS 35 2HD LYS 35 20.764 -21.959 5.231 197 HD3 LYS 35 3HD LYS 35 20.661 -20.987 3.760 198 HE2 LYS 35 2HE LYS 35 22.073 -19.509 5.750 199 HE3 LYS 35 3HE LYS 35 22.775 -21.122 5.637 200 HZ1 LYS 35 1HZ LYS 35 22.959 -18.945 3.811 201 HZ2 LYS 35 2HZ LYS 35 22.383 -20.336 3.041 202 HZ3 LYS 35 3HZ LYS 35 23.859 -20.376 3.867 203 H LYS 36 H LYS 36 19.637 -23.353 4.451 204 HA LYS 36 HA LYS 36 20.131 -23.306 1.682 205 HB2 LYS 36 2HB LYS 36 20.678 -25.476 3.715 206 HB3 LYS 36 3HB LYS 36 21.333 -25.447 2.083 207 HG2 LYS 36 2HG LYS 36 21.897 -23.516 4.317 208 HG3 LYS 36 3HG LYS 36 23.016 -24.651 3.559 209 HD2 LYS 36 2HD LYS 36 21.724 -22.264 2.238 210 HD3 LYS 36 3HD LYS 36 23.408 -22.388 2.751 211 HE2 LYS 36 2HE LYS 36 23.092 -24.611 1.173 212 HE3 LYS 36 3HE LYS 36 22.089 -23.414 0.354 213 HZ1 LYS 36 1HZ LYS 36 23.885 -22.063 -0.061 214 HZ2 LYS 36 2HZ LYS 36 24.587 -23.593 -0.219 215 HZ3 LYS 36 3HZ LYS 36 24.816 -22.701 1.200 216 HA PRO 37 HA PRO 37 17.354 -27.278 1.507 217 HB2 PRO 37 2HB PRO 37 15.680 -27.671 3.609 218 HB3 PRO 37 3HB PRO 37 17.316 -28.339 3.545 219 HG2 PRO 37 2HG PRO 37 16.324 -25.889 4.950 220 HG3 PRO 37 3HG PRO 37 17.448 -27.133 5.528 221 HD2 PRO 37 2HD PRO 37 18.287 -24.737 4.585 222 HD3 PRO 37 3HD PRO 37 19.236 -26.225 4.392 223 H VAL 38 H VAL 38 15.933 -24.575 3.328 224 HA VAL 38 HA VAL 38 13.621 -24.620 1.512 225 HB VAL 38 HB VAL 38 12.900 -24.729 3.778 226 HG11 VAL 38 1HG1 VAL 38 14.933 -23.996 4.876 227 HG12 VAL 38 2HG1 VAL 38 14.676 -22.347 4.300 228 HG13 VAL 38 3HG1 VAL 38 13.558 -23.061 5.464 229 HG21 VAL 38 1HG2 VAL 38 11.638 -22.623 4.028 230 HG22 VAL 38 2HG2 VAL 38 12.625 -21.903 2.756 231 HG23 VAL 38 3HG2 VAL 38 11.567 -23.265 2.387 232 HA PRO 39 HA PRO 39 15.540 -21.064 -0.404 233 HB2 PRO 39 2HB PRO 39 13.642 -20.756 -2.320 234 HB3 PRO 39 3HB PRO 39 14.907 -21.987 -2.411 235 HG2 PRO 39 2HG PRO 39 12.058 -22.261 -1.536 236 HG3 PRO 39 3HG PRO 39 13.019 -23.335 -2.569 237 HD2 PRO 39 2HD PRO 39 12.570 -23.852 0.050 238 HD3 PRO 39 3HD PRO 39 14.068 -24.330 -0.774 239 H ILE 40 H ILE 40 14.634 -20.219 1.868 240 HA ILE 40 HA ILE 40 12.409 -18.366 1.370 241 HB ILE 40 HB ILE 40 12.739 -18.029 3.963 242 HG12 ILE 40 2HG1 ILE 40 14.011 -20.708 3.405 243 HG13 ILE 40 3HG1 ILE 40 14.697 -19.352 4.294 244 HG21 ILE 40 1HG2 ILE 40 11.130 -19.895 4.342 245 HG22 ILE 40 2HG2 ILE 40 10.697 -18.828 3.007 246 HG23 ILE 40 3HG2 ILE 40 11.410 -20.407 2.678 247 HD11 ILE 40 1HD1 ILE 40 12.737 -19.722 5.921 248 HD12 ILE 40 2HD1 ILE 40 12.607 -21.303 5.151 249 HD13 ILE 40 3HD1 ILE 40 14.103 -20.837 5.959 250 H ILE 41 H ILE 41 13.023 -16.418 0.712 251 HA ILE 41 HA ILE 41 15.322 -15.155 2.046 252 HB ILE 41 HB ILE 41 15.632 -13.924 -0.210 253 HG12 ILE 41 2HG1 ILE 41 15.084 -15.404 -2.163 254 HG13 ILE 41 3HG1 ILE 41 14.126 -16.401 -1.073 255 HG21 ILE 41 1HG2 ILE 41 17.479 -15.132 0.231 256 HG22 ILE 41 2HG2 ILE 41 16.561 -16.570 0.674 257 HG23 ILE 41 3HG2 ILE 41 16.847 -16.196 -1.025 258 HD11 ILE 41 1HD1 ILE 41 13.473 -13.545 -1.023 259 HD12 ILE 41 2HD1 ILE 41 13.150 -14.364 -2.551 260 HD13 ILE 41 3HD1 ILE 41 12.417 -14.958 -1.061 261 H TYR 42 H TYR 42 15.294 -12.680 1.343 262 HA TYR 42 HA TYR 42 12.660 -11.550 1.077 263 HB2 TYR 42 2HB TYR 42 13.242 -10.209 3.331 264 HB3 TYR 42 3HB TYR 42 12.267 -11.674 3.316 265 HD1 TYR 42 HD1 TYR 42 12.807 -12.202 5.625 266 HD2 TYR 42 HD2 TYR 42 15.876 -11.803 2.704 267 HE1 TYR 42 HE1 TYR 42 14.399 -13.278 7.160 268 HE2 TYR 42 HE2 TYR 42 17.476 -12.879 4.231 269 HH TYR 42 HH TYR 42 17.735 -13.227 6.679 270 H CYS 43 H CYS 43 13.263 -10.232 -0.547 271 HA CYS 43 HA CYS 43 15.706 -8.663 -0.331 272 HB2 CYS 43 2HB CYS 43 14.796 -9.867 -2.463 273 HB3 CYS 43 3HB CYS 43 13.761 -8.450 -2.606 274 H ASN 44 H ASN 44 15.537 -6.911 0.920 275 HA ASN 44 HA ASN 44 13.067 -5.424 1.114 276 HB2 ASN 44 2HB ASN 44 15.757 -4.716 2.297 277 HB3 ASN 44 3HB ASN 44 14.179 -4.120 2.803 278 HD21 ASN 44 1HD2 ASN 44 12.952 -6.765 2.486 279 HD22 ASN 44 2HD2 ASN 44 13.473 -7.687 3.851 280 H ARG 45 H ARG 45 12.642 -4.396 -0.789 281 HA ARG 45 HA ARG 45 14.396 -3.219 -2.551 282 HB2 ARG 45 2HB ARG 45 11.650 -2.162 -1.856 283 HB3 ARG 45 3HB ARG 45 12.526 -1.897 -3.358 284 HG2 ARG 45 2HG ARG 45 11.503 -4.544 -2.352 285 HG3 ARG 45 3HG ARG 45 10.789 -3.569 -3.637 286 HD2 ARG 45 2HD ARG 45 13.535 -4.815 -3.660 287 HD3 ARG 45 3HD ARG 45 12.129 -5.383 -4.559 288 HE ARG 45 HE ARG 45 12.517 -2.749 -5.300 289 HH11 ARG 45 1HH1 ARG 45 14.297 -5.738 -5.449 290 HH12 ARG 45 2HH1 ARG 45 15.158 -5.305 -6.889 291 HH21 ARG 45 1HH2 ARG 45 13.645 -2.168 -7.196 292 HH22 ARG 45 2HH2 ARG 45 14.787 -3.274 -7.881 293 H ARG 46 H ARG 46 13.342 -2.068 0.547 294 HA ARG 46 HA ARG 46 13.830 0.654 0.348 295 HB2 ARG 46 2HB ARG 46 14.409 -1.107 2.737 296 HB3 ARG 46 3HB ARG 46 14.153 0.632 2.764 297 HG2 ARG 46 2HG ARG 46 12.051 0.082 3.296 298 HG3 ARG 46 3HG ARG 46 11.873 -0.203 1.563 299 HD2 ARG 46 2HD ARG 46 12.957 -2.446 3.143 300 HD3 ARG 46 3HD ARG 46 11.274 -2.025 3.455 301 HE ARG 46 HE ARG 46 12.325 -3.298 1.122 302 HH11 ARG 46 1HH1 ARG 46 9.805 -1.203 2.298 303 HH12 ARG 46 2HH1 ARG 46 8.694 -1.613 1.033 304 HH21 ARG 46 1HH2 ARG 46 10.871 -3.845 -0.549 305 HH22 ARG 46 2HH2 ARG 46 9.301 -3.116 -0.585 306 H THR 47 H THR 47 16.070 -2.008 0.606 307 HA THR 47 HA THR 47 18.296 -0.087 0.410 308 HB THR 47 HB THR 47 18.806 -0.875 2.488 309 HG1 THR 47 HG1 THR 47 20.480 -2.253 2.238 310 HG21 THR 47 1HG2 THR 47 18.349 -3.444 2.973 311 HG22 THR 47 2HG2 THR 47 17.156 -3.219 1.693 312 HG23 THR 47 3HG2 THR 47 17.085 -2.228 3.150 313 H GLY 48 H GLY 48 16.592 -2.239 -1.277 314 HA2 GLY 48 2HA GLY 48 16.988 -3.559 -3.115 315 HA3 GLY 48 3HA GLY 48 18.380 -2.517 -3.374 316 H LYS 49 H LYS 49 17.598 -4.945 -0.888 317 HA LYS 49 HA LYS 49 19.912 -6.516 -1.765 318 HB2 LYS 49 2HB LYS 49 20.556 -6.829 0.643 319 HB3 LYS 49 3HB LYS 49 20.828 -5.211 0.012 320 HG2 LYS 49 2HG LYS 49 19.912 -4.843 2.112 321 HG3 LYS 49 3HG LYS 49 18.540 -4.644 1.020 322 HD2 LYS 49 2HD LYS 49 17.520 -6.556 1.732 323 HD3 LYS 49 3HD LYS 49 19.047 -7.359 2.108 324 HE2 LYS 49 2HE LYS 49 17.714 -5.182 3.715 325 HE3 LYS 49 3HE LYS 49 17.821 -6.888 4.146 326 HZ1 LYS 49 1HZ LYS 49 19.572 -6.088 5.318 327 HZ2 LYS 49 2HZ LYS 49 19.874 -4.813 4.250 328 HZ3 LYS 49 3HZ LYS 49 20.376 -6.380 3.858 329 H CYS 50 H CYS 50 19.857 -8.727 -1.136 330 HA CYS 50 HA CYS 50 17.334 -9.677 0.017 331 HB2 CYS 50 2HB CYS 50 18.445 -11.185 -2.303 332 HB3 CYS 50 3HB CYS 50 16.780 -11.047 -1.748 333 H GLN 51 H GLN 51 17.547 -11.380 1.364 334 HA GLN 51 HA GLN 51 20.057 -12.893 1.343 335 HB2 GLN 51 2HB GLN 51 18.906 -12.048 3.972 336 HB3 GLN 51 3HB GLN 51 20.553 -12.521 3.578 337 HG2 GLN 51 2HG GLN 51 21.039 -10.359 3.607 338 HG3 GLN 51 3HG GLN 51 20.174 -10.248 2.075 339 HE21 GLN 51 1HE2 GLN 51 17.579 -10.715 3.112 340 HE22 GLN 51 2HE2 GLN 51 17.118 -9.319 4.020 341 H ARG 52 H ARG 52 19.890 -14.794 2.930 342 HA ARG 52 HA ARG 52 17.326 -16.101 2.428 343 HB2 ARG 52 2HB ARG 52 20.108 -16.984 2.775 344 HB3 ARG 52 3HB ARG 52 18.921 -18.008 3.571 345 HG2 ARG 52 2HG ARG 52 18.558 -17.205 0.714 346 HG3 ARG 52 3HG ARG 52 19.623 -18.543 1.150 347 HD2 ARG 52 2HD ARG 52 17.905 -19.882 1.789 348 HD3 ARG 52 3HD ARG 52 16.927 -18.533 2.366 349 HE ARG 52 HE ARG 52 15.860 -18.593 0.362 350 HH11 ARG 52 1HH1 ARG 52 19.088 -19.814 -0.092 351 HH12 ARG 52 2HH1 ARG 52 18.866 -20.148 -1.777 352 HH21 ARG 52 1HH2 ARG 52 15.554 -19.028 -1.856 353 HH22 ARG 52 2HH2 ARG 52 16.855 -19.700 -2.780 354 H MET 53 H MET 53 16.329 -17.409 4.113 355 HA MET 53 HA MET 53 16.479 -16.054 6.699 356 HB2 MET 53 2HB MET 53 14.432 -18.083 5.804 357 HB3 MET 53 3HB MET 53 14.313 -16.965 7.157 358 HG2 MET 53 2HG MET 53 14.676 -15.244 5.100 359 HG3 MET 53 3HG MET 53 13.794 -16.545 4.303 360 HE1 MET 53 1HE MET 53 11.454 -17.123 7.318 361 HE2 MET 53 2HE MET 53 10.625 -16.956 5.770 362 HE3 MET 53 3HE MET 53 12.163 -17.816 5.859 Start of MODEL 11 1 H1 GLY 1 H GLY 1 8.272 1.551 -5.331 2 HA2 GLY 1 2HA GLY 1 9.618 -0.370 -4.033 3 HA3 GLY 1 3HA GLY 1 9.803 1.323 -3.599 4 H SER 2 H SER 2 6.847 -0.509 -3.134 5 HA SER 2 HA SER 2 7.243 -0.257 -0.225 6 HB2 SER 2 2HB SER 2 4.834 0.052 -1.969 7 HB3 SER 2 3HB SER 2 4.614 -0.531 -0.319 8 HG SER 2 HG SER 2 4.480 1.738 -0.415 9 H LYS 3 H LYS 3 7.124 -2.027 1.028 10 HA LYS 3 HA LYS 3 7.449 -4.577 0.024 11 HB2 LYS 3 2HB LYS 3 6.178 -3.948 2.690 12 HB3 LYS 3 3HB LYS 3 7.094 -5.386 2.259 13 HG2 LYS 3 2HG LYS 3 8.819 -4.355 3.217 14 HG3 LYS 3 3HG LYS 3 8.884 -3.385 1.743 15 HD2 LYS 3 2HD LYS 3 6.917 -2.210 3.368 16 HD3 LYS 3 3HD LYS 3 8.278 -2.574 4.431 17 HE2 LYS 3 2HE LYS 3 9.602 -1.540 2.337 18 HE3 LYS 3 3HE LYS 3 8.076 -0.671 2.178 19 HZ1 LYS 3 1HZ LYS 3 9.459 0.634 3.544 20 HZ2 LYS 3 2HZ LYS 3 9.919 -0.685 4.497 21 HZ3 LYS 3 3HZ LYS 3 8.340 -0.086 4.589 22 H LYS 4 H LYS 4 4.459 -3.062 1.206 23 HA LYS 4 HA LYS 4 2.679 -5.111 1.064 24 HB2 LYS 4 2HB LYS 4 2.524 -2.204 0.733 25 HB3 LYS 4 3HB LYS 4 1.229 -3.070 -0.082 26 HG2 LYS 4 2HG LYS 4 0.209 -3.578 1.835 27 HG3 LYS 4 3HG LYS 4 1.723 -4.014 2.632 28 HD2 LYS 4 2HD LYS 4 2.201 -1.561 2.857 29 HD3 LYS 4 3HD LYS 4 0.563 -1.254 2.272 30 HE2 LYS 4 2HE LYS 4 0.048 -1.294 4.464 31 HE3 LYS 4 3HE LYS 4 0.058 -3.041 4.232 32 HZ1 LYS 4 1HZ LYS 4 2.665 -2.428 4.722 33 HZ2 LYS 4 2HZ LYS 4 1.573 -3.074 5.841 34 HZ3 LYS 4 3HZ LYS 4 1.826 -1.403 5.775 35 HA PRO 5 HA PRO 5 1.864 -4.539 -3.638 36 HB2 PRO 5 2HB PRO 5 3.331 -2.691 -4.981 37 HB3 PRO 5 3HB PRO 5 1.805 -2.306 -4.177 38 HG2 PRO 5 2HG PRO 5 4.610 -1.869 -3.228 39 HG3 PRO 5 3HG PRO 5 3.213 -0.782 -3.127 40 HD2 PRO 5 2HD PRO 5 4.057 -2.266 -1.026 41 HD3 PRO 5 3HD PRO 5 2.348 -1.858 -1.282 42 H VAL 6 H VAL 6 4.890 -4.763 -2.166 43 HA VAL 6 HA VAL 6 6.156 -5.946 -4.533 44 HB VAL 6 HB VAL 6 7.258 -4.981 -1.907 45 HG11 VAL 6 1HG1 VAL 6 9.437 -5.847 -2.537 46 HG12 VAL 6 2HG1 VAL 6 8.273 -7.166 -2.400 47 HG13 VAL 6 3HG1 VAL 6 8.751 -6.571 -3.991 48 HG21 VAL 6 1HG2 VAL 6 8.581 -4.270 -4.412 49 HG22 VAL 6 2HG2 VAL 6 6.903 -3.734 -4.320 50 HG23 VAL 6 3HG2 VAL 6 8.054 -3.245 -3.077 51 HA PRO 7 HA PRO 7 5.117 -9.956 -2.911 52 HB2 PRO 7 2HB PRO 7 6.446 -11.384 -4.799 53 HB3 PRO 7 3HB PRO 7 4.887 -10.607 -5.102 54 HG2 PRO 7 2HG PRO 7 7.640 -9.667 -5.807 55 HG3 PRO 7 3HG PRO 7 6.161 -9.629 -6.784 56 HD2 PRO 7 2HD PRO 7 7.100 -7.451 -5.478 57 HD3 PRO 7 3HD PRO 7 5.367 -7.736 -5.735 58 H ILE 8 H ILE 8 6.937 -8.825 -1.314 59 HA ILE 8 HA ILE 8 9.291 -10.587 -1.342 60 HB ILE 8 HB ILE 8 10.124 -8.955 0.453 61 HG12 ILE 8 2HG1 ILE 8 7.760 -7.446 -0.657 62 HG13 ILE 8 3HG1 ILE 8 8.133 -7.790 1.029 63 HG21 ILE 8 1HG2 ILE 8 10.583 -7.192 -1.436 64 HG22 ILE 8 2HG2 ILE 8 11.283 -8.808 -1.519 65 HG23 ILE 8 3HG2 ILE 8 9.845 -8.421 -2.463 66 HD11 ILE 8 1HD1 ILE 8 9.054 -5.623 -0.701 67 HD12 ILE 8 2HD1 ILE 8 8.890 -5.691 1.054 68 HD13 ILE 8 3HD1 ILE 8 10.319 -6.370 0.274 69 H ILE 9 H ILE 9 8.357 -12.418 -0.424 70 HA ILE 9 HA ILE 9 7.337 -12.121 2.320 71 HB ILE 9 HB ILE 9 6.619 -14.584 1.900 72 HG12 ILE 9 2HG1 ILE 9 6.050 -14.976 -0.509 73 HG13 ILE 9 3HG1 ILE 9 7.003 -13.553 -0.918 74 HG21 ILE 9 1HG2 ILE 9 4.735 -13.404 2.116 75 HG22 ILE 9 2HG2 ILE 9 5.389 -12.034 1.220 76 HG23 ILE 9 3HG2 ILE 9 4.682 -13.398 0.354 77 HD11 ILE 9 1HD1 ILE 9 8.939 -14.650 -0.718 78 HD12 ILE 9 2HD1 ILE 9 8.411 -15.531 0.715 79 HD13 ILE 9 3HD1 ILE 9 7.939 -16.092 -0.889 80 H TYR 10 H TYR 10 7.738 -14.348 3.555 81 HA TYR 10 HA TYR 10 10.314 -15.532 3.077 82 HB2 TYR 10 2HB TYR 10 10.896 -14.771 5.590 83 HB3 TYR 10 3HB TYR 10 11.417 -13.870 4.171 84 HD1 TYR 10 HD1 TYR 10 11.593 -11.774 5.366 85 HD2 TYR 10 HD2 TYR 10 7.912 -13.904 5.254 86 HE1 TYR 10 HE1 TYR 10 10.420 -9.780 6.202 87 HE2 TYR 10 HE2 TYR 10 6.729 -11.916 6.088 88 HH TYR 10 HH TYR 10 7.954 -9.554 7.615 89 H CYS 11 H CYS 11 9.588 -17.565 3.282 90 HA CYS 11 HA CYS 11 7.775 -18.286 5.434 91 HB2 CYS 11 2HB CYS 11 7.817 -19.160 2.943 92 HB3 CYS 11 3HB CYS 11 8.987 -20.304 3.592 93 H ASN 12 H ASN 12 8.638 -18.585 7.382 94 HA ASN 12 HA ASN 12 11.362 -19.489 7.706 95 HB2 ASN 12 2HB ASN 12 9.293 -19.056 9.866 96 HB3 ASN 12 3HB ASN 12 11.045 -19.086 10.051 97 HD21 ASN 12 1HD2 ASN 12 11.477 -17.556 7.603 98 HD22 ASN 12 2HD2 ASN 12 11.063 -15.923 7.985 99 H ARG 13 H ARG 13 11.547 -21.595 7.081 100 HA ARG 13 HA ARG 13 9.775 -23.665 7.361 101 HB2 ARG 13 2HB ARG 13 12.789 -23.729 7.560 102 HB3 ARG 13 3HB ARG 13 11.787 -25.166 7.409 103 HG2 ARG 13 2HG ARG 13 12.023 -22.930 5.408 104 HG3 ARG 13 3HG ARG 13 12.696 -24.555 5.261 105 HD2 ARG 13 2HD ARG 13 9.785 -23.776 5.324 106 HD3 ARG 13 3HD ARG 13 10.684 -24.440 3.960 107 HE ARG 13 HE ARG 13 10.907 -26.308 5.960 108 HH11 ARG 13 1HH1 ARG 13 8.301 -24.782 4.228 109 HH12 ARG 13 2HH1 ARG 13 7.239 -26.144 4.364 110 HH21 ARG 13 1HH2 ARG 13 9.517 -28.108 6.147 111 HH22 ARG 13 2HH2 ARG 13 7.931 -28.035 5.457 112 H ARG 14 H ARG 14 11.725 -22.169 9.817 113 HA ARG 14 HA ARG 14 11.786 -24.136 11.770 114 HB2 ARG 14 2HB ARG 14 11.382 -21.188 12.288 115 HB3 ARG 14 3HB ARG 14 12.112 -22.366 13.370 116 HG2 ARG 14 2HG ARG 14 14.054 -21.623 12.572 117 HG3 ARG 14 3HG ARG 14 13.678 -22.587 11.143 118 HD2 ARG 14 2HD ARG 14 12.447 -19.926 11.182 119 HD3 ARG 14 3HD ARG 14 14.209 -19.916 11.132 120 HE ARG 14 HE ARG 14 12.408 -20.809 9.052 121 HH11 ARG 14 1HH1 ARG 14 15.659 -20.821 10.296 122 HH12 ARG 14 2HH1 ARG 14 16.382 -21.200 8.768 123 HH21 ARG 14 1HH2 ARG 14 13.347 -21.308 7.035 124 HH22 ARG 14 2HH2 ARG 14 15.066 -21.476 6.913 125 H THR 15 H THR 15 9.171 -22.035 10.780 126 HA THR 15 HA THR 15 7.383 -23.494 12.603 127 HB THR 15 HB THR 15 7.648 -21.354 13.643 128 HG1 THR 15 HG1 THR 15 5.555 -21.232 13.898 129 HG21 THR 15 1HG2 THR 15 6.600 -19.591 11.637 130 HG22 THR 15 2HG2 THR 15 8.024 -20.423 11.013 131 HG23 THR 15 3HG2 THR 15 8.128 -19.497 12.510 132 H GLY 16 H GLY 16 8.152 -23.137 9.534 133 HA2 GLY 16 2HA GLY 16 7.055 -23.313 7.523 134 HA3 GLY 16 3HA GLY 16 5.835 -24.175 8.448 135 H LYS 17 H LYS 17 6.738 -20.788 8.829 136 HA LYS 17 HA LYS 17 4.010 -20.059 7.987 137 HB2 LYS 17 2HB LYS 17 5.849 -18.777 10.010 138 HB3 LYS 17 3HB LYS 17 4.371 -18.019 9.432 139 HG2 LYS 17 2HG LYS 17 4.747 -20.243 11.319 140 HG3 LYS 17 3HG LYS 17 3.495 -19.000 11.255 141 HD2 LYS 17 2HD LYS 17 2.589 -20.234 9.225 142 HD3 LYS 17 3HD LYS 17 3.671 -21.555 9.675 143 HE2 LYS 17 2HE LYS 17 1.510 -22.006 10.601 144 HE3 LYS 17 3HE LYS 17 2.596 -21.579 11.922 145 HZ1 LYS 17 1HZ LYS 17 1.179 -20.001 12.501 146 HZ2 LYS 17 2HZ LYS 17 0.171 -20.365 11.193 147 HZ3 LYS 17 3HZ LYS 17 1.410 -19.227 11.014 148 H CYS 18 H CYS 18 3.741 -18.604 6.395 149 HA CYS 18 HA CYS 18 6.150 -17.254 5.361 150 HB2 CYS 18 2HB CYS 18 3.807 -17.983 3.625 151 HB3 CYS 18 3HB CYS 18 5.463 -17.621 3.148 152 H GLN 19 H GLN 19 6.059 -15.105 5.162 153 HA GLN 19 HA GLN 19 3.469 -13.769 4.991 154 HB2 GLN 19 2HB GLN 19 5.454 -12.659 6.929 155 HB3 GLN 19 3HB GLN 19 3.707 -12.460 6.882 156 HG2 GLN 19 2HG GLN 19 3.719 -13.893 8.592 157 HG3 GLN 19 3HG GLN 19 3.911 -15.120 7.342 158 HE21 GLN 19 1HE2 GLN 19 6.622 -14.294 6.700 159 HE22 GLN 19 2HE2 GLN 19 7.620 -14.862 7.991 160 H ARG 20 H ARG 20 3.823 -11.330 4.688 161 HA ARG 20 HA ARG 20 6.047 -10.987 2.795 162 HB2 ARG 20 2HB ARG 20 3.440 -10.663 2.275 163 HB3 ARG 20 3HB ARG 20 3.797 -9.047 2.871 164 HG2 ARG 20 2HG ARG 20 4.672 -8.489 0.920 165 HG3 ARG 20 3HG ARG 20 5.828 -9.817 1.026 166 HD2 ARG 20 2HD ARG 20 3.326 -10.946 0.372 167 HD3 ARG 20 3HD ARG 20 3.546 -9.543 -0.673 168 HE ARG 20 HE ARG 20 5.922 -10.843 -0.837 169 HH11 ARG 20 1HH1 ARG 20 2.607 -11.801 -1.297 170 HH12 ARG 20 2HH1 ARG 20 2.984 -13.012 -2.478 171 HH21 ARG 20 1HH2 ARG 20 6.431 -12.433 -2.391 172 HH22 ARG 20 2HH2 ARG 20 5.160 -13.371 -3.099 173 H MET 21 H MET 21 6.975 -8.788 2.647 174 HA MET 21 HA MET 21 7.685 -7.850 5.271 175 HB2 MET 21 2HB MET 21 8.444 -6.681 2.590 176 HB3 MET 21 3HB MET 21 9.242 -6.392 4.130 177 HG2 MET 21 2HG MET 21 9.358 -9.115 3.915 178 HG3 MET 21 3HG MET 21 9.541 -8.591 2.243 179 HE1 MET 21 1HE MET 21 11.796 -8.216 5.912 180 HE2 MET 21 2HE MET 21 11.801 -6.506 5.482 181 HE3 MET 21 3HE MET 21 10.272 -7.372 5.640 182 H1 GLY 33 H GLY 33 18.156 -20.218 9.082 183 HA2 GLY 33 2HA GLY 33 19.331 -22.293 10.786 184 HA3 GLY 33 3HA GLY 33 17.675 -22.514 10.244 185 H SER 34 H SER 34 17.309 -23.375 8.281 186 HA SER 34 HA SER 34 19.671 -23.909 6.607 187 HB2 SER 34 2HB SER 34 18.370 -25.833 5.715 188 HB3 SER 34 3HB SER 34 18.647 -25.946 7.453 189 HG SER 34 HG SER 34 16.437 -26.374 6.648 190 H LYS 35 H LYS 35 19.783 -22.980 4.678 191 HA LYS 35 HA LYS 35 17.295 -21.982 3.452 192 HB2 LYS 35 2HB LYS 35 18.514 -20.076 2.589 193 HB3 LYS 35 3HB LYS 35 18.708 -20.151 4.335 194 HG2 LYS 35 2HG LYS 35 20.778 -21.475 2.682 195 HG3 LYS 35 3HG LYS 35 20.739 -19.710 2.686 196 HD2 LYS 35 2HD LYS 35 20.808 -21.411 5.176 197 HD3 LYS 35 3HD LYS 35 22.238 -20.707 4.415 198 HE2 LYS 35 2HE LYS 35 20.449 -18.590 4.661 199 HE3 LYS 35 3HE LYS 35 20.283 -19.490 6.168 200 HZ1 LYS 35 1HZ LYS 35 23.006 -19.288 5.559 201 HZ2 LYS 35 2HZ LYS 35 22.172 -18.605 6.862 202 HZ3 LYS 35 3HZ LYS 35 22.332 -17.743 5.415 203 H LYS 36 H LYS 36 20.190 -23.783 3.099 204 HA LYS 36 HA LYS 36 20.487 -23.713 0.297 205 HB2 LYS 36 2HB LYS 36 21.170 -26.099 2.000 206 HB3 LYS 36 3HB LYS 36 21.976 -25.529 0.544 207 HG2 LYS 36 2HG LYS 36 22.019 -24.238 3.263 208 HG3 LYS 36 3HG LYS 36 23.355 -25.052 2.444 209 HD2 LYS 36 2HD LYS 36 23.323 -23.345 0.693 210 HD3 LYS 36 3HD LYS 36 21.978 -22.536 1.500 211 HE2 LYS 36 2HE LYS 36 23.611 -21.308 2.445 212 HE3 LYS 36 3HE LYS 36 23.754 -22.690 3.530 213 HZ1 LYS 36 1HZ LYS 36 25.827 -22.943 2.843 214 HZ2 LYS 36 2HZ LYS 36 25.668 -21.659 1.754 215 HZ3 LYS 36 3HZ LYS 36 25.285 -23.233 1.267 216 HA PRO 37 HA PRO 37 17.796 -27.748 0.327 217 HB2 PRO 37 2HB PRO 37 16.296 -28.179 2.549 218 HB3 PRO 37 3HB PRO 37 17.937 -28.810 2.360 219 HG2 PRO 37 2HG PRO 37 16.999 -26.382 3.840 220 HG3 PRO 37 3HG PRO 37 18.191 -27.600 4.330 221 HD2 PRO 37 2HD PRO 37 18.900 -25.186 3.329 222 HD3 PRO 37 3HD PRO 37 19.866 -26.651 3.063 223 H VAL 38 H VAL 38 16.483 -25.045 2.219 224 HA VAL 38 HA VAL 38 14.024 -25.164 0.608 225 HB VAL 38 HB VAL 38 13.499 -25.249 2.929 226 HG11 VAL 38 1HG1 VAL 38 15.256 -22.820 3.266 227 HG12 VAL 38 2HG1 VAL 38 14.266 -23.550 4.531 228 HG13 VAL 38 3HG1 VAL 38 15.609 -24.453 3.830 229 HG21 VAL 38 1HG2 VAL 38 12.224 -23.157 3.252 230 HG22 VAL 38 2HG2 VAL 38 13.082 -22.449 1.883 231 HG23 VAL 38 3HG2 VAL 38 12.022 -23.836 1.638 232 HA PRO 39 HA PRO 39 15.716 -21.607 -1.512 233 HB2 PRO 39 2HB PRO 39 13.664 -21.366 -3.274 234 HB3 PRO 39 3HB PRO 39 14.942 -22.575 -3.447 235 HG2 PRO 39 2HG PRO 39 12.178 -22.887 -2.341 236 HG3 PRO 39 3HG PRO 39 13.074 -23.960 -3.432 237 HD2 PRO 39 2HD PRO 39 12.847 -24.441 -0.777 238 HD3 PRO 39 3HD PRO 39 14.283 -24.905 -1.713 239 H ILE 40 H ILE 40 14.968 -20.750 0.819 240 HA ILE 40 HA ILE 40 12.683 -18.937 0.465 241 HB ILE 40 HB ILE 40 13.175 -18.564 3.020 242 HG12 ILE 40 2HG1 ILE 40 14.483 -21.220 2.424 243 HG13 ILE 40 3HG1 ILE 40 15.200 -19.823 3.220 244 HG21 ILE 40 1HG2 ILE 40 11.686 -20.533 3.520 245 HG22 ILE 40 2HG2 ILE 40 11.094 -19.427 2.281 246 HG23 ILE 40 3HG2 ILE 40 11.820 -20.966 1.816 247 HD11 ILE 40 1HD1 ILE 40 13.257 -21.817 4.288 248 HD12 ILE 40 2HD1 ILE 40 14.777 -21.246 4.978 249 HD13 ILE 40 3HD1 ILE 40 13.355 -20.203 4.993 250 H ILE 41 H ILE 41 13.203 -16.978 -0.231 251 HA ILE 41 HA ILE 41 15.599 -15.684 0.889 252 HB ILE 41 HB ILE 41 15.658 -14.432 -1.379 253 HG12 ILE 41 2HG1 ILE 41 14.944 -15.903 -3.278 254 HG13 ILE 41 3HG1 ILE 41 14.132 -16.939 -2.110 255 HG21 ILE 41 1HG2 ILE 41 16.716 -17.070 -0.616 256 HG22 ILE 41 2HG2 ILE 41 16.834 -16.666 -2.327 257 HG23 ILE 41 3HG2 ILE 41 17.562 -15.608 -1.119 258 HD11 ILE 41 1HD1 ILE 41 12.396 -15.541 -1.892 259 HD12 ILE 41 2HD1 ILE 41 13.411 -14.100 -1.966 260 HD13 ILE 41 3HD1 ILE 41 12.945 -14.928 -3.452 261 H TYR 42 H TYR 42 15.461 -13.204 0.196 262 HA TYR 42 HA TYR 42 12.814 -12.097 0.180 263 HB2 TYR 42 2HB TYR 42 13.495 -10.805 2.414 264 HB3 TYR 42 3HB TYR 42 12.602 -12.321 2.445 265 HD1 TYR 42 HD1 TYR 42 16.125 -12.355 1.517 266 HD2 TYR 42 HD2 TYR 42 13.373 -12.742 4.739 267 HE1 TYR 42 HE1 TYR 42 17.893 -13.363 2.898 268 HE2 TYR 42 HE2 TYR 42 15.133 -13.750 6.129 269 HH TYR 42 HH TYR 42 18.464 -13.998 4.983 270 H CYS 43 H CYS 43 13.140 -10.576 -1.303 271 HA CYS 43 HA CYS 43 15.658 -9.141 -1.442 272 HB2 CYS 43 2HB CYS 43 13.211 -8.712 -3.157 273 HB3 CYS 43 3HB CYS 43 14.875 -8.272 -3.526 274 H ASN 44 H ASN 44 15.970 -7.448 -0.163 275 HA ASN 44 HA ASN 44 13.768 -5.962 0.949 276 HB2 ASN 44 2HB ASN 44 16.721 -5.345 1.154 277 HB3 ASN 44 3HB ASN 44 15.437 -4.767 2.213 278 HD21 ASN 44 1HD2 ASN 44 14.082 -7.350 2.231 279 HD22 ASN 44 2HD2 ASN 44 15.021 -8.373 3.259 280 H ARG 45 H ARG 45 12.724 -4.800 -0.604 281 HA ARG 45 HA ARG 45 13.685 -3.537 -2.816 282 HB2 ARG 45 2HB ARG 45 11.506 -2.620 -0.937 283 HB3 ARG 45 3HB ARG 45 11.804 -1.889 -2.508 284 HG2 ARG 45 2HG ARG 45 11.006 -4.744 -1.982 285 HG3 ARG 45 3HG ARG 45 9.991 -3.469 -2.659 286 HD2 ARG 45 2HD ARG 45 12.390 -4.796 -3.895 287 HD3 ARG 45 3HD ARG 45 10.730 -4.775 -4.488 288 HE ARG 45 HE ARG 45 11.504 -2.144 -4.417 289 HH11 ARG 45 1HH1 ARG 45 12.652 -5.049 -5.955 290 HH12 ARG 45 2HH1 ARG 45 13.305 -4.219 -7.328 291 HH21 ARG 45 1HH2 ARG 45 12.360 -1.041 -6.220 292 HH22 ARG 45 2HH2 ARG 45 13.140 -1.939 -7.478 293 H ARG 46 H ARG 46 13.943 -2.475 0.509 294 HA ARG 46 HA ARG 46 14.586 0.179 0.257 295 HB2 ARG 46 2HB ARG 46 16.055 -1.716 2.091 296 HB3 ARG 46 3HB ARG 46 15.764 0.000 2.337 297 HG2 ARG 46 2HG ARG 46 14.001 -0.582 3.547 298 HG3 ARG 46 3HG ARG 46 13.230 -1.080 2.040 299 HD2 ARG 46 2HD ARG 46 15.081 -3.053 3.167 300 HD3 ARG 46 3HD ARG 46 13.684 -2.704 4.184 301 HE ARG 46 HE ARG 46 13.631 -3.860 1.493 302 HH11 ARG 46 1HH1 ARG 46 11.961 -2.877 4.384 303 HH12 ARG 46 2HH1 ARG 46 10.508 -3.736 3.994 304 HH21 ARG 46 1HH2 ARG 46 11.724 -4.995 0.967 305 HH22 ARG 46 2HH2 ARG 46 10.374 -4.941 2.050 306 H THR 47 H THR 47 16.601 -2.616 -0.426 307 HA THR 47 HA THR 47 18.572 -0.813 -1.654 308 HB THR 47 HB THR 47 19.600 -1.496 0.406 309 HG1 THR 47 HG1 THR 47 21.362 -2.801 -0.505 310 HG21 THR 47 1HG2 THR 47 19.849 -4.319 0.064 311 HG22 THR 47 2HG2 THR 47 18.139 -3.888 0.006 312 HG23 THR 47 3HG2 THR 47 19.119 -3.429 1.399 313 H GLY 48 H GLY 48 16.331 -2.965 -2.323 314 HA2 GLY 48 2HA GLY 48 15.959 -4.510 -3.983 315 HA3 GLY 48 3HA GLY 48 17.159 -3.591 -4.880 316 H LYS 49 H LYS 49 17.715 -5.407 -1.909 317 HA LYS 49 HA LYS 49 19.526 -7.165 -3.428 318 HB2 LYS 49 2HB LYS 49 19.675 -6.184 -0.576 319 HB3 LYS 49 3HB LYS 49 20.696 -7.468 -1.210 320 HG2 LYS 49 2HG LYS 49 20.822 -4.560 -1.638 321 HG3 LYS 49 3HG LYS 49 22.114 -5.762 -1.580 322 HD2 LYS 49 2HD LYS 49 21.281 -6.552 -3.845 323 HD3 LYS 49 3HD LYS 49 20.301 -5.084 -3.886 324 HE2 LYS 49 2HE LYS 49 22.783 -4.140 -3.187 325 HE3 LYS 49 3HE LYS 49 23.168 -5.445 -4.309 326 HZ1 LYS 49 1HZ LYS 49 22.217 -2.870 -4.889 327 HZ2 LYS 49 2HZ LYS 49 21.051 -3.987 -5.391 328 HZ3 LYS 49 3HZ LYS 49 22.636 -4.104 -5.968 329 H CYS 50 H CYS 50 19.293 -9.328 -3.286 330 HA CYS 50 HA CYS 50 17.140 -10.328 -1.541 331 HB2 CYS 50 2HB CYS 50 18.163 -11.716 -4.014 332 HB3 CYS 50 3HB CYS 50 16.653 -11.996 -3.154 333 H GLN 51 H GLN 51 17.548 -11.937 -0.130 334 HA GLN 51 HA GLN 51 20.106 -13.358 -0.306 335 HB2 GLN 51 2HB GLN 51 19.138 -12.379 2.358 336 HB3 GLN 51 3HB GLN 51 20.756 -12.877 1.882 337 HG2 GLN 51 2HG GLN 51 21.206 -10.703 1.783 338 HG3 GLN 51 3HG GLN 51 20.320 -10.726 0.259 339 HE21 GLN 51 1HE2 GLN 51 17.767 -11.225 1.574 340 HE22 GLN 51 2HE2 GLN 51 17.296 -9.726 2.291 341 H ARG 52 H ARG 52 20.174 -15.229 1.257 342 HA ARG 52 HA ARG 52 17.611 -16.617 1.123 343 HB2 ARG 52 2HB ARG 52 20.450 -17.413 1.192 344 HB3 ARG 52 3HB ARG 52 19.363 -18.460 2.095 345 HG2 ARG 52 2HG ARG 52 18.732 -17.681 -0.723 346 HG3 ARG 52 3HG ARG 52 19.858 -18.995 -0.375 347 HD2 ARG 52 2HD ARG 52 18.229 -20.361 0.428 348 HD3 ARG 52 3HD ARG 52 17.272 -19.024 1.065 349 HE ARG 52 HE ARG 52 16.049 -19.132 -0.846 350 HH11 ARG 52 1HH1 ARG 52 19.253 -20.303 -1.541 351 HH12 ARG 52 2HH1 ARG 52 18.902 -20.668 -3.198 352 HH21 ARG 52 1HH2 ARG 52 15.574 -19.609 -3.026 353 HH22 ARG 52 2HH2 ARG 52 16.809 -20.272 -4.041 354 H MET 53 H MET 53 16.822 -17.857 2.938 355 HA MET 53 HA MET 53 17.139 -16.400 5.429 356 HB2 MET 53 2HB MET 53 15.313 -18.726 4.807 357 HB3 MET 53 3HB MET 53 15.213 -17.656 6.199 358 HG2 MET 53 2HG MET 53 15.026 -15.829 4.274 359 HG3 MET 53 3HG MET 53 14.382 -17.215 3.397 360 HE1 MET 53 1HE MET 53 14.506 -15.540 6.676 361 HE2 MET 53 2HE MET 53 12.862 -14.960 6.944 362 HE3 MET 53 3HE MET 53 13.344 -16.551 7.536 Start of MODEL 12 1 H1 GLY 1 H GLY 1 5.357 -2.453 -6.598 2 HA2 GLY 1 2HA GLY 1 6.894 -0.468 -6.210 3 HA3 GLY 1 3HA GLY 1 5.608 -0.641 -5.026 4 H SER 2 H SER 2 6.103 -1.096 -2.932 5 HA SER 2 HA SER 2 8.969 -1.163 -2.284 6 HB2 SER 2 2HB SER 2 6.559 -0.115 -0.828 7 HB3 SER 2 3HB SER 2 8.030 -0.515 0.059 8 HG SER 2 HG SER 2 7.493 1.621 -1.543 9 H LYS 3 H LYS 3 6.119 -2.182 -0.431 10 HA LYS 3 HA LYS 3 7.348 -4.847 -0.160 11 HB2 LYS 3 2HB LYS 3 5.588 -3.787 1.999 12 HB3 LYS 3 3HB LYS 3 6.939 -4.908 2.103 13 HG2 LYS 3 2HG LYS 3 7.926 -3.117 3.060 14 HG3 LYS 3 3HG LYS 3 8.281 -2.726 1.375 15 HD2 LYS 3 2HD LYS 3 6.251 -1.323 1.306 16 HD3 LYS 3 3HD LYS 3 5.974 -1.673 3.014 17 HE2 LYS 3 2HE LYS 3 8.667 -0.696 2.424 18 HE3 LYS 3 3HE LYS 3 7.391 0.456 2.031 19 HZ1 LYS 3 1HZ LYS 3 7.039 -0.815 4.585 20 HZ2 LYS 3 2HZ LYS 3 6.974 0.824 4.176 21 HZ3 LYS 3 3HZ LYS 3 8.466 0.089 4.486 22 H LYS 4 H LYS 4 4.231 -3.253 0.537 23 HA LYS 4 HA LYS 4 2.562 -5.404 0.345 24 HB2 LYS 4 2HB LYS 4 2.277 -2.507 -0.042 25 HB3 LYS 4 3HB LYS 4 1.056 -3.462 -0.872 26 HG2 LYS 4 2HG LYS 4 0.010 -3.984 1.028 27 HG3 LYS 4 3HG LYS 4 1.521 -4.310 1.880 28 HD2 LYS 4 2HD LYS 4 1.854 -1.850 2.093 29 HD3 LYS 4 3HD LYS 4 0.253 -1.616 1.387 30 HE2 LYS 4 2HE LYS 4 0.499 -3.436 3.723 31 HE3 LYS 4 3HE LYS 4 0.638 -1.703 4.009 32 HZ1 LYS 4 1HZ LYS 4 -1.606 -2.048 4.230 33 HZ2 LYS 4 2HZ LYS 4 -1.669 -3.242 3.034 34 HZ3 LYS 4 3HZ LYS 4 -1.516 -1.615 2.597 35 HA PRO 5 HA PRO 5 2.041 -4.843 -4.415 36 HB2 PRO 5 2HB PRO 5 3.663 -3.059 -5.662 37 HB3 PRO 5 3HB PRO 5 2.094 -2.617 -4.980 38 HG2 PRO 5 2HG PRO 5 4.831 -2.254 -3.824 39 HG3 PRO 5 3HG PRO 5 3.466 -1.123 -3.842 40 HD2 PRO 5 2HD PRO 5 4.101 -2.606 -1.668 41 HD3 PRO 5 3HD PRO 5 2.430 -2.149 -2.057 42 H VAL 6 H VAL 6 4.962 -5.103 -2.728 43 HA VAL 6 HA VAL 6 6.332 -6.404 -4.976 44 HB VAL 6 HB VAL 6 7.320 -5.341 -2.341 45 HG11 VAL 6 1HG1 VAL 6 8.282 -7.603 -2.781 46 HG12 VAL 6 2HG1 VAL 6 8.955 -6.966 -4.283 47 HG13 VAL 6 3HG1 VAL 6 9.473 -6.304 -2.733 48 HG21 VAL 6 1HG2 VAL 6 7.883 -3.593 -3.589 49 HG22 VAL 6 2HG2 VAL 6 8.942 -4.630 -4.545 50 HG23 VAL 6 3HG2 VAL 6 7.263 -4.396 -5.032 51 HA PRO 7 HA PRO 7 5.155 -10.323 -3.240 52 HB2 PRO 7 2HB PRO 7 6.605 -11.852 -4.952 53 HB3 PRO 7 3HB PRO 7 5.082 -11.079 -5.408 54 HG2 PRO 7 2HG PRO 7 7.890 -10.196 -5.950 55 HG3 PRO 7 3HG PRO 7 6.488 -10.195 -7.035 56 HD2 PRO 7 2HD PRO 7 7.352 -7.963 -5.770 57 HD3 PRO 7 3HD PRO 7 5.640 -8.247 -6.142 58 H ILE 8 H ILE 8 7.027 -8.983 -1.708 59 HA ILE 8 HA ILE 8 9.317 -10.785 -1.442 60 HB ILE 8 HB ILE 8 9.951 -9.071 0.390 61 HG12 ILE 8 2HG1 ILE 8 7.771 -7.607 -1.102 62 HG13 ILE 8 3HG1 ILE 8 7.876 -7.903 0.630 63 HG21 ILE 8 1HG2 ILE 8 11.347 -9.013 -1.417 64 HG22 ILE 8 2HG2 ILE 8 10.035 -8.747 -2.563 65 HG23 ILE 8 3HG2 ILE 8 10.610 -7.418 -1.557 66 HD11 ILE 8 1HD1 ILE 8 8.716 -5.855 0.775 67 HD12 ILE 8 2HD1 ILE 8 10.191 -6.521 0.075 68 HD13 ILE 8 3HD1 ILE 8 8.989 -5.757 -0.964 69 H ILE 9 H ILE 9 8.800 -12.572 -0.330 70 HA ILE 9 HA ILE 9 7.376 -12.230 2.229 71 HB ILE 9 HB ILE 9 6.823 -14.721 1.929 72 HG12 ILE 9 2HG1 ILE 9 6.604 -15.360 -0.503 73 HG13 ILE 9 3HG1 ILE 9 7.597 -13.961 -0.893 74 HG21 ILE 9 1HG2 ILE 9 5.596 -12.382 0.591 75 HG22 ILE 9 2HG2 ILE 9 4.987 -13.976 0.148 76 HG23 ILE 9 3HG2 ILE 9 4.944 -13.452 1.832 77 HD11 ILE 9 1HD1 ILE 9 8.556 -16.444 -0.501 78 HD12 ILE 9 2HD1 ILE 9 9.491 -14.970 -0.244 79 HD13 ILE 9 3HD1 ILE 9 8.721 -15.776 1.123 80 H TYR 10 H TYR 10 7.830 -14.342 3.628 81 HA TYR 10 HA TYR 10 10.543 -15.305 3.441 82 HB2 TYR 10 2HB TYR 10 10.659 -14.418 6.025 83 HB3 TYR 10 3HB TYR 10 11.411 -13.612 4.653 84 HD1 TYR 10 HD1 TYR 10 7.773 -13.732 5.298 85 HD2 TYR 10 HD2 TYR 10 11.315 -11.380 5.463 86 HE1 TYR 10 HE1 TYR 10 6.415 -11.729 5.737 87 HE2 TYR 10 HE2 TYR 10 9.967 -9.371 5.904 88 HH TYR 10 HH TYR 10 7.451 -9.049 7.012 89 H CYS 11 H CYS 11 9.879 -17.388 3.546 90 HA CYS 11 HA CYS 11 8.020 -18.225 5.624 91 HB2 CYS 11 2HB CYS 11 8.110 -19.045 3.135 92 HB3 CYS 11 3HB CYS 11 9.368 -20.121 3.736 93 H ASN 12 H ASN 12 8.625 -19.056 7.510 94 HA ASN 12 HA ASN 12 11.453 -19.752 7.881 95 HB2 ASN 12 2HB ASN 12 9.370 -19.223 10.009 96 HB3 ASN 12 3HB ASN 12 11.110 -19.365 10.242 97 HD21 ASN 12 1HD2 ASN 12 11.747 -17.869 7.840 98 HD22 ASN 12 2HD2 ASN 12 11.413 -16.212 8.197 99 H ARG 13 H ARG 13 11.593 -21.865 7.271 100 HA ARG 13 HA ARG 13 9.765 -23.888 7.557 101 HB2 ARG 13 2HB ARG 13 12.776 -24.040 7.763 102 HB3 ARG 13 3HB ARG 13 11.728 -25.442 7.591 103 HG2 ARG 13 2HG ARG 13 12.037 -23.192 5.613 104 HG3 ARG 13 3HG ARG 13 12.680 -24.828 5.456 105 HD2 ARG 13 2HD ARG 13 9.779 -24.012 5.527 106 HD3 ARG 13 3HD ARG 13 10.672 -24.635 4.140 107 HE ARG 13 HE ARG 13 10.877 -26.566 6.091 108 HH11 ARG 13 1HH1 ARG 13 8.304 -24.986 4.359 109 HH12 ARG 13 2HH1 ARG 13 7.238 -26.349 4.437 110 HH21 ARG 13 1HH2 ARG 13 9.482 -28.368 6.200 111 HH22 ARG 13 2HH2 ARG 13 7.909 -28.272 5.486 112 H ARG 14 H ARG 14 11.931 -22.566 9.978 113 HA ARG 14 HA ARG 14 11.869 -24.494 11.935 114 HB2 ARG 14 2HB ARG 14 11.918 -22.478 13.551 115 HB3 ARG 14 3HB ARG 14 13.230 -22.659 12.395 116 HG2 ARG 14 2HG ARG 14 11.103 -21.095 11.260 117 HG3 ARG 14 3HG ARG 14 11.621 -20.419 12.805 118 HD2 ARG 14 2HD ARG 14 13.120 -19.392 11.428 119 HD3 ARG 14 3HD ARG 14 14.019 -20.866 11.782 120 HE ARG 14 HE ARG 14 12.344 -21.035 9.444 121 HH11 ARG 14 1HH1 ARG 14 15.476 -20.161 10.688 122 HH12 ARG 14 2HH1 ARG 14 16.279 -20.353 9.165 123 HH21 ARG 14 1HH2 ARG 14 13.390 -21.291 7.433 124 HH22 ARG 14 2HH2 ARG 14 15.091 -20.995 7.314 125 H THR 15 H THR 15 9.416 -22.059 11.197 126 HA THR 15 HA THR 15 7.598 -23.417 13.080 127 HB THR 15 HB THR 15 7.637 -21.296 13.958 128 HG1 THR 15 HG1 THR 15 5.722 -20.286 13.313 129 HG21 THR 15 1HG2 THR 15 8.313 -20.459 11.183 130 HG22 THR 15 2HG2 THR 15 9.085 -20.035 12.711 131 HG23 THR 15 3HG2 THR 15 7.565 -19.271 12.249 132 H GLY 16 H GLY 16 8.296 -23.342 9.934 133 HA2 GLY 16 2HA GLY 16 7.136 -23.717 7.985 134 HA3 GLY 16 3HA GLY 16 5.992 -24.554 9.024 135 H LYS 17 H LYS 17 6.883 -21.145 8.466 136 HA LYS 17 HA LYS 17 4.119 -20.589 7.695 137 HB2 LYS 17 2HB LYS 17 4.113 -18.572 9.194 138 HB3 LYS 17 3HB LYS 17 4.043 -20.116 10.034 139 HG2 LYS 17 2HG LYS 17 5.562 -18.876 11.275 140 HG3 LYS 17 3HG LYS 17 6.587 -19.890 10.257 141 HD2 LYS 17 2HD LYS 17 7.353 -18.130 9.046 142 HD3 LYS 17 3HD LYS 17 5.824 -17.254 9.153 143 HE2 LYS 17 2HE LYS 17 7.902 -17.523 11.324 144 HE3 LYS 17 3HE LYS 17 7.555 -16.076 10.377 145 HZ1 LYS 17 1HZ LYS 17 6.313 -15.633 12.202 146 HZ2 LYS 17 2HZ LYS 17 6.051 -17.260 12.582 147 HZ3 LYS 17 3HZ LYS 17 5.157 -16.525 11.348 148 H CYS 18 H CYS 18 3.851 -18.647 6.503 149 HA CYS 18 HA CYS 18 6.316 -17.292 5.671 150 HB2 CYS 18 2HB CYS 18 4.272 -17.992 3.596 151 HB3 CYS 18 3HB CYS 18 5.984 -17.633 3.396 152 H GLN 19 H GLN 19 6.086 -15.147 5.159 153 HA GLN 19 HA GLN 19 3.391 -14.010 5.100 154 HB2 GLN 19 2HB GLN 19 5.530 -12.761 6.808 155 HB3 GLN 19 3HB GLN 19 3.806 -12.414 6.790 156 HG2 GLN 19 2HG GLN 19 3.688 -13.722 8.581 157 HG3 GLN 19 3HG GLN 19 3.869 -15.068 7.457 158 HE21 GLN 19 1HE2 GLN 19 6.606 -14.448 6.796 159 HE22 GLN 19 2HE2 GLN 19 7.561 -14.896 8.164 160 H ARG 20 H ARG 20 3.471 -11.638 4.505 161 HA ARG 20 HA ARG 20 5.622 -11.211 2.537 162 HB2 ARG 20 2HB ARG 20 3.786 -11.301 1.176 163 HB3 ARG 20 3HB ARG 20 2.689 -10.760 2.440 164 HG2 ARG 20 2HG ARG 20 2.669 -8.966 1.013 165 HG3 ARG 20 3HG ARG 20 3.925 -8.486 2.155 166 HD2 ARG 20 2HD ARG 20 4.662 -8.057 -0.109 167 HD3 ARG 20 3HD ARG 20 5.632 -9.345 0.605 168 HE ARG 20 HE ARG 20 4.917 -10.694 -1.079 169 HH11 ARG 20 1HH1 ARG 20 2.551 -8.182 -0.615 170 HH12 ARG 20 2HH1 ARG 20 1.548 -8.705 -1.927 171 HH21 ARG 20 1HH2 ARG 20 3.604 -11.392 -2.808 172 HH22 ARG 20 2HH2 ARG 20 2.147 -10.532 -3.173 173 H MET 21 H MET 21 6.470 -9.118 2.283 174 HA MET 21 HA MET 21 6.590 -7.600 4.709 175 HB2 MET 21 2HB MET 21 7.703 -6.805 2.020 176 HB3 MET 21 3HB MET 21 8.239 -6.266 3.605 177 HG2 MET 21 2HG MET 21 8.540 -8.973 3.788 178 HG3 MET 21 3HG MET 21 8.936 -8.663 2.100 179 HE1 MET 21 1HE MET 21 10.387 -5.867 5.143 180 HE2 MET 21 2HE MET 21 9.099 -7.045 5.393 181 HE3 MET 21 3HE MET 21 10.741 -7.405 5.930 182 H1 GLY 33 H GLY 33 20.625 -21.520 10.657 183 HA2 GLY 33 2HA GLY 33 19.347 -23.438 10.489 184 HA3 GLY 33 3HA GLY 33 18.070 -22.475 9.762 185 H SER 34 H SER 34 17.563 -23.779 8.065 186 HA SER 34 HA SER 34 19.731 -24.439 6.186 187 HB2 SER 34 2HB SER 34 16.984 -25.695 6.251 188 HB3 SER 34 3HB SER 34 18.423 -26.282 5.417 189 HG SER 34 HG SER 34 19.265 -26.234 7.772 190 H LYS 35 H LYS 35 19.797 -23.412 4.305 191 HA LYS 35 HA LYS 35 17.337 -22.125 3.316 192 HB2 LYS 35 2HB LYS 35 19.876 -20.903 2.479 193 HB3 LYS 35 3HB LYS 35 18.380 -20.144 3.008 194 HG2 LYS 35 2HG LYS 35 19.750 -19.527 4.713 195 HG3 LYS 35 3HG LYS 35 19.152 -21.057 5.358 196 HD2 LYS 35 2HD LYS 35 21.506 -21.052 5.676 197 HD3 LYS 35 3HD LYS 35 21.177 -22.153 4.337 198 HE2 LYS 35 2HE LYS 35 22.515 -20.973 3.016 199 HE3 LYS 35 3HE LYS 35 21.537 -19.531 3.287 200 HZ1 LYS 35 1HZ LYS 35 24.045 -20.334 4.530 201 HZ2 LYS 35 2HZ LYS 35 22.923 -19.562 5.532 202 HZ3 LYS 35 3HZ LYS 35 23.479 -18.790 4.133 203 H LYS 36 H LYS 36 20.158 -24.007 2.626 204 HA LYS 36 HA LYS 36 20.192 -23.818 -0.178 205 HB2 LYS 36 2HB LYS 36 20.935 -26.317 1.324 206 HB3 LYS 36 3HB LYS 36 21.640 -25.677 -0.155 207 HG2 LYS 36 2HG LYS 36 21.965 -24.615 2.639 208 HG3 LYS 36 3HG LYS 36 23.200 -25.335 1.603 209 HD2 LYS 36 2HD LYS 36 22.432 -23.345 0.001 210 HD3 LYS 36 3HD LYS 36 22.019 -22.615 1.554 211 HE2 LYS 36 2HE LYS 36 24.174 -21.938 1.477 212 HE3 LYS 36 3HE LYS 36 24.465 -23.547 2.136 213 HZ1 LYS 36 1HZ LYS 36 25.455 -24.216 0.262 214 HZ2 LYS 36 2HZ LYS 36 25.621 -22.569 -0.085 215 HZ3 LYS 36 3HZ LYS 36 24.334 -23.447 -0.745 216 HA PRO 37 HA PRO 37 17.366 -27.761 -0.093 217 HB2 PRO 37 2HB PRO 37 16.034 -28.233 2.225 218 HB3 PRO 37 3HB PRO 37 17.628 -28.913 1.878 219 HG2 PRO 37 2HG PRO 37 16.907 -26.519 3.525 220 HG3 PRO 37 3HG PRO 37 18.087 -27.798 3.867 221 HD2 PRO 37 2HD PRO 37 18.807 -25.370 2.908 222 HD3 PRO 37 3HD PRO 37 19.691 -26.856 2.505 223 H VAL 38 H VAL 38 16.280 -25.143 2.056 224 HA VAL 38 HA VAL 38 13.718 -25.079 0.614 225 HB VAL 38 HB VAL 38 13.359 -25.296 2.960 226 HG11 VAL 38 1HG1 VAL 38 15.201 -22.933 3.311 227 HG12 VAL 38 2HG1 VAL 38 14.287 -23.720 4.599 228 HG13 VAL 38 3HG1 VAL 38 15.553 -24.605 3.747 229 HG21 VAL 38 1HG2 VAL 38 12.163 -23.206 3.494 230 HG22 VAL 38 2HG2 VAL 38 12.952 -22.425 2.124 231 HG23 VAL 38 3HG2 VAL 38 11.840 -23.768 1.853 232 HA PRO 39 HA PRO 39 15.387 -21.449 -1.401 233 HB2 PRO 39 2HB PRO 39 13.239 -21.050 -3.012 234 HB3 PRO 39 3HB PRO 39 14.468 -22.278 -3.337 235 HG2 PRO 39 2HG PRO 39 11.769 -22.585 -2.079 236 HG3 PRO 39 3HG PRO 39 12.564 -23.613 -3.285 237 HD2 PRO 39 2HD PRO 39 12.487 -24.248 -0.654 238 HD3 PRO 39 3HD PRO 39 13.849 -24.692 -1.704 239 H ILE 40 H ILE 40 14.812 -20.714 1.018 240 HA ILE 40 HA ILE 40 12.562 -18.828 0.918 241 HB ILE 40 HB ILE 40 13.222 -18.619 3.452 242 HG12 ILE 40 2HG1 ILE 40 14.428 -21.259 2.621 243 HG13 ILE 40 3HG1 ILE 40 15.222 -19.928 3.455 244 HG21 ILE 40 1HG2 ILE 40 11.078 -19.387 2.834 245 HG22 ILE 40 2HG2 ILE 40 11.723 -20.892 2.179 246 HG23 ILE 40 3HG2 ILE 40 11.733 -20.612 3.920 247 HD11 ILE 40 1HD1 ILE 40 13.307 -21.951 4.516 248 HD12 ILE 40 2HD1 ILE 40 14.874 -21.444 5.148 249 HD13 ILE 40 3HD1 ILE 40 13.473 -20.384 5.309 250 H ILE 41 H ILE 41 13.141 -16.880 0.214 251 HA ILE 41 HA ILE 41 15.586 -15.675 1.325 252 HB ILE 41 HB ILE 41 15.654 -14.377 -0.914 253 HG12 ILE 41 2HG1 ILE 41 14.873 -15.784 -2.837 254 HG13 ILE 41 3HG1 ILE 41 14.042 -16.819 -1.681 255 HG21 ILE 41 1HG2 ILE 41 17.526 -15.615 -0.705 256 HG22 ILE 41 2HG2 ILE 41 16.642 -17.063 -0.228 257 HG23 ILE 41 3HG2 ILE 41 16.753 -16.620 -1.931 258 HD11 ILE 41 1HD1 ILE 41 12.893 -14.756 -2.963 259 HD12 ILE 41 2HD1 ILE 41 12.362 -15.361 -1.394 260 HD13 ILE 41 3HD1 ILE 41 13.422 -13.954 -1.484 261 H TYR 42 H TYR 42 15.504 -13.178 0.687 262 HA TYR 42 HA TYR 42 12.872 -12.019 0.757 263 HB2 TYR 42 2HB TYR 42 13.702 -10.751 2.970 264 HB3 TYR 42 3HB TYR 42 12.735 -12.221 3.024 265 HD1 TYR 42 HD1 TYR 42 16.242 -12.344 1.992 266 HD2 TYR 42 HD2 TYR 42 13.543 -12.781 5.252 267 HE1 TYR 42 HE1 TYR 42 18.008 -13.452 3.297 268 HE2 TYR 42 HE2 TYR 42 15.302 -13.890 6.567 269 HH TYR 42 HH TYR 42 18.521 -13.792 5.783 270 H CYS 43 H CYS 43 13.268 -10.616 -0.848 271 HA CYS 43 HA CYS 43 15.754 -9.096 -0.886 272 HB2 CYS 43 2HB CYS 43 13.578 -8.697 -2.897 273 HB3 CYS 43 3HB CYS 43 15.324 -8.639 -3.113 274 H ASN 44 H ASN 44 15.814 -7.339 0.352 275 HA ASN 44 HA ASN 44 13.427 -5.877 1.035 276 HB2 ASN 44 2HB ASN 44 16.293 -5.122 1.628 277 HB3 ASN 44 3HB ASN 44 14.847 -4.555 2.457 278 HD21 ASN 44 1HD2 ASN 44 13.613 -7.202 2.420 279 HD22 ASN 44 2HD2 ASN 44 14.431 -8.123 3.632 280 H ARG 45 H ARG 45 12.598 -4.868 -0.744 281 HA ARG 45 HA ARG 45 13.837 -3.698 -2.862 282 HB2 ARG 45 2HB ARG 45 11.379 -2.749 -1.385 283 HB3 ARG 45 3HB ARG 45 11.884 -2.109 -2.943 284 HG2 ARG 45 2HG ARG 45 11.103 -4.954 -2.346 285 HG3 ARG 45 3HG ARG 45 10.156 -3.764 -3.241 286 HD2 ARG 45 2HD ARG 45 12.798 -4.974 -4.040 287 HD3 ARG 45 3HD ARG 45 11.232 -5.229 -4.809 288 HE ARG 45 HE ARG 45 11.584 -2.558 -5.012 289 HH11 ARG 45 1HH1 ARG 45 13.572 -5.296 -5.835 290 HH12 ARG 45 2HH1 ARG 45 14.360 -4.493 -7.152 291 HH21 ARG 45 1HH2 ARG 45 12.614 -1.490 -6.744 292 HH22 ARG 45 2HH2 ARG 45 13.815 -2.328 -7.668 293 H ARG 46 H ARG 46 13.389 -2.307 0.349 294 HA ARG 46 HA ARG 46 14.077 0.306 -0.022 295 HB2 ARG 46 2HB ARG 46 15.233 0.090 2.273 296 HB3 ARG 46 3HB ARG 46 13.518 -0.285 2.166 297 HG2 ARG 46 2HG ARG 46 15.078 -2.644 1.678 298 HG3 ARG 46 3HG ARG 46 15.558 -1.890 3.199 299 HD2 ARG 46 2HD ARG 46 13.831 -3.170 3.954 300 HD3 ARG 46 3HD ARG 46 12.936 -1.717 3.514 301 HE ARG 46 HE ARG 46 13.139 -3.631 1.382 302 HH11 ARG 46 1HH1 ARG 46 11.340 -2.674 4.205 303 HH12 ARG 46 2HH1 ARG 46 9.875 -3.444 3.693 304 HH21 ARG 46 1HH2 ARG 46 11.216 -4.649 0.697 305 HH22 ARG 46 2HH2 ARG 46 9.806 -4.568 1.698 306 H THR 47 H THR 47 16.271 -2.460 0.174 307 HA THR 47 HA THR 47 18.439 -0.706 -0.784 308 HB THR 47 HB THR 47 18.911 -1.447 1.495 309 HG1 THR 47 HG1 THR 47 20.681 -1.288 0.057 310 HG21 THR 47 1HG2 THR 47 18.131 -3.439 2.141 311 HG22 THR 47 2HG2 THR 47 19.483 -4.158 1.266 312 HG23 THR 47 3HG2 THR 47 17.919 -3.971 0.474 313 H GLY 48 H GLY 48 16.353 -2.814 -1.912 314 HA2 GLY 48 2HA GLY 48 16.320 -4.411 -3.570 315 HA3 GLY 48 3HA GLY 48 17.637 -3.463 -4.244 316 H LYS 49 H LYS 49 17.714 -5.248 -1.207 317 HA LYS 49 HA LYS 49 19.798 -6.972 -2.374 318 HB2 LYS 49 2HB LYS 49 19.433 -5.975 0.453 319 HB3 LYS 49 3HB LYS 49 20.584 -7.230 0.010 320 HG2 LYS 49 2HG LYS 49 20.697 -4.320 -0.411 321 HG3 LYS 49 3HG LYS 49 21.994 -5.484 -0.127 322 HD2 LYS 49 2HD LYS 49 21.568 -6.302 -2.497 323 HD3 LYS 49 3HD LYS 49 20.584 -4.852 -2.709 324 HE2 LYS 49 2HE LYS 49 23.176 -4.274 -1.531 325 HE3 LYS 49 3HE LYS 49 23.316 -5.064 -3.101 326 HZ1 LYS 49 1HZ LYS 49 21.489 -2.779 -2.737 327 HZ2 LYS 49 2HZ LYS 49 22.216 -3.345 -4.156 328 HZ3 LYS 49 3HZ LYS 49 23.139 -2.518 -3.005 329 H CYS 50 H CYS 50 19.533 -9.123 -2.332 330 HA CYS 50 HA CYS 50 17.292 -10.202 -0.751 331 HB2 CYS 50 2HB CYS 50 17.162 -10.088 -3.388 332 HB3 CYS 50 3HB CYS 50 18.162 -11.533 -3.282 333 H GLN 51 H GLN 51 17.700 -11.929 0.505 334 HA GLN 51 HA GLN 51 20.178 -13.435 0.091 335 HB2 GLN 51 2HB GLN 51 19.410 -12.641 2.875 336 HB3 GLN 51 3HB GLN 51 20.977 -13.142 2.256 337 HG2 GLN 51 2HG GLN 51 21.494 -10.981 2.310 338 HG3 GLN 51 3HG GLN 51 20.513 -10.848 0.851 339 HE21 GLN 51 1HE2 GLN 51 18.020 -11.353 2.222 340 HE22 GLN 51 2HE2 GLN 51 17.650 -9.921 3.116 341 H ARG 52 H ARG 52 20.230 -15.383 1.624 342 HA ARG 52 HA ARG 52 17.622 -16.680 1.446 343 HB2 ARG 52 2HB ARG 52 20.430 -17.569 1.444 344 HB3 ARG 52 3HB ARG 52 19.328 -18.616 2.328 345 HG2 ARG 52 2HG ARG 52 18.679 -17.714 -0.450 346 HG3 ARG 52 3HG ARG 52 19.761 -19.079 -0.165 347 HD2 ARG 52 2HD ARG 52 18.094 -20.410 0.629 348 HD3 ARG 52 3HD ARG 52 17.188 -19.057 1.304 349 HE ARG 52 HE ARG 52 15.951 -19.074 -0.600 350 HH11 ARG 52 1HH1 ARG 52 19.107 -20.343 -1.345 351 HH12 ARG 52 2HH1 ARG 52 18.732 -20.656 -3.007 352 HH21 ARG 52 1HH2 ARG 52 15.446 -19.482 -2.787 353 HH22 ARG 52 2HH2 ARG 52 16.650 -20.165 -3.827 354 H MET 53 H MET 53 16.818 -17.989 3.214 355 HA MET 53 HA MET 53 17.237 -16.664 5.772 356 HB2 MET 53 2HB MET 53 15.235 -18.807 5.044 357 HB3 MET 53 3HB MET 53 15.229 -17.818 6.498 358 HG2 MET 53 2HG MET 53 15.191 -15.894 4.618 359 HG3 MET 53 3HG MET 53 14.342 -17.183 3.767 360 HE1 MET 53 1HE MET 53 13.597 -16.607 7.972 361 HE2 MET 53 2HE MET 53 14.860 -15.726 7.113 362 HE3 MET 53 3HE MET 53 13.336 -14.927 7.501 Start of MODEL 13 1 H1 GLY 1 H GLY 1 9.107 0.566 3.252 2 HA2 GLY 1 2HA GLY 1 7.878 -1.111 4.227 3 HA3 GLY 1 3HA GLY 1 6.921 0.189 4.922 4 H SER 2 H SER 2 7.335 -1.078 1.615 5 HA SER 2 HA SER 2 4.403 -1.356 1.479 6 HB2 SER 2 2HB SER 2 6.279 -0.729 -0.813 7 HB3 SER 2 3HB SER 2 4.519 -0.818 -0.891 8 HG SER 2 HG SER 2 4.696 0.899 0.848 9 H LYS 3 H LYS 3 3.607 -3.295 0.958 10 HA LYS 3 HA LYS 3 5.482 -5.332 -0.053 11 HB2 LYS 3 2HB LYS 3 3.653 -6.862 1.170 12 HB3 LYS 3 3HB LYS 3 5.083 -6.248 1.990 13 HG2 LYS 3 2HG LYS 3 3.173 -5.912 3.393 14 HG3 LYS 3 3HG LYS 3 3.739 -4.343 2.817 15 HD2 LYS 3 2HD LYS 3 1.908 -4.023 1.476 16 HD3 LYS 3 3HD LYS 3 1.639 -5.752 1.247 17 HE2 LYS 3 2HE LYS 3 1.334 -4.881 4.017 18 HE3 LYS 3 3HE LYS 3 0.201 -4.106 2.911 19 HZ1 LYS 3 1HZ LYS 3 0.184 -6.743 2.185 20 HZ2 LYS 3 2HZ LYS 3 -1.004 -5.946 3.086 21 HZ3 LYS 3 3HZ LYS 3 0.231 -6.789 3.876 22 H LYS 4 H LYS 4 2.431 -3.774 -0.374 23 HA LYS 4 HA LYS 4 1.047 -5.686 -1.903 24 HB2 LYS 4 2HB LYS 4 0.849 -2.669 -1.937 25 HB3 LYS 4 3HB LYS 4 -0.307 -3.757 -2.694 26 HG2 LYS 4 2HG LYS 4 0.281 -3.465 0.241 27 HG3 LYS 4 3HG LYS 4 -1.212 -3.057 -0.609 28 HD2 LYS 4 2HD LYS 4 -0.058 -5.824 -0.258 29 HD3 LYS 4 3HD LYS 4 -1.453 -5.160 0.596 30 HE2 LYS 4 2HE LYS 4 -1.219 -5.684 -2.365 31 HE3 LYS 4 3HE LYS 4 -2.206 -6.577 -1.209 32 HZ1 LYS 4 1HZ LYS 4 -2.762 -4.110 -2.558 33 HZ2 LYS 4 2HZ LYS 4 -3.011 -4.002 -0.888 34 HZ3 LYS 4 3HZ LYS 4 -3.822 -5.182 -1.789 35 HA PRO 5 HA PRO 5 2.877 -3.361 -5.748 36 HB2 PRO 5 2HB PRO 5 5.082 -1.844 -5.295 37 HB3 PRO 5 3HB PRO 5 3.439 -1.200 -5.205 38 HG2 PRO 5 2HG PRO 5 5.249 -2.087 -2.992 39 HG3 PRO 5 3HG PRO 5 4.203 -0.658 -3.077 40 HD2 PRO 5 2HD PRO 5 3.503 -2.896 -1.724 41 HD3 PRO 5 3HD PRO 5 2.311 -1.853 -2.526 42 H VAL 6 H VAL 6 5.311 -4.143 -3.271 43 HA VAL 6 HA VAL 6 6.784 -5.710 -5.276 44 HB VAL 6 HB VAL 6 8.232 -4.144 -4.235 45 HG11 VAL 6 1HG1 VAL 6 7.156 -5.139 -1.599 46 HG12 VAL 6 2HG1 VAL 6 8.508 -4.019 -1.780 47 HG13 VAL 6 3HG1 VAL 6 6.894 -3.550 -2.316 48 HG21 VAL 6 1HG2 VAL 6 9.367 -6.180 -4.516 49 HG22 VAL 6 2HG2 VAL 6 9.753 -5.674 -2.871 50 HG23 VAL 6 3HG2 VAL 6 8.544 -6.927 -3.147 51 HA PRO 7 HA PRO 7 5.007 -9.293 -3.283 52 HB2 PRO 7 2HB PRO 7 6.186 -11.109 -4.920 53 HB3 PRO 7 3HB PRO 7 4.769 -10.165 -5.395 54 HG2 PRO 7 2HG PRO 7 7.655 -9.710 -6.050 55 HG3 PRO 7 3HG PRO 7 6.235 -9.585 -7.105 56 HD2 PRO 7 2HD PRO 7 7.430 -7.417 -6.006 57 HD3 PRO 7 3HD PRO 7 5.685 -7.487 -6.324 58 H ILE 8 H ILE 8 6.792 -8.333 -1.635 59 HA ILE 8 HA ILE 8 9.024 -10.222 -1.429 60 HB ILE 8 HB ILE 8 9.464 -8.566 0.632 61 HG12 ILE 8 2HG1 ILE 8 7.880 -6.967 -1.385 62 HG13 ILE 8 3HG1 ILE 8 7.513 -7.191 0.322 63 HG21 ILE 8 1HG2 ILE 8 10.544 -9.013 -1.881 64 HG22 ILE 8 2HG2 ILE 8 10.331 -7.265 -1.804 65 HG23 ILE 8 3HG2 ILE 8 11.279 -8.092 -0.569 66 HD11 ILE 8 1HD1 ILE 8 9.819 -6.052 0.685 67 HD12 ILE 8 2HD1 ILE 8 9.576 -5.470 -0.962 68 HD13 ILE 8 3HD1 ILE 8 8.402 -5.078 0.295 69 H ILE 9 H ILE 9 8.462 -12.042 -0.411 70 HA ILE 9 HA ILE 9 7.060 -11.792 2.166 71 HB ILE 9 HB ILE 9 6.180 -14.163 1.619 72 HG12 ILE 9 2HG1 ILE 9 5.737 -14.449 -0.838 73 HG13 ILE 9 3HG1 ILE 9 6.841 -13.111 -1.139 74 HG21 ILE 9 1HG2 ILE 9 4.456 -12.717 1.821 75 HG22 ILE 9 2HG2 ILE 9 5.193 -11.521 0.756 76 HG23 ILE 9 3HG2 ILE 9 4.370 -12.923 0.072 77 HD11 ILE 9 1HD1 ILE 9 7.549 -15.714 -1.131 78 HD12 ILE 9 2HD1 ILE 9 8.656 -14.379 -0.811 79 HD13 ILE 9 3HD1 ILE 9 7.928 -15.262 0.530 80 H TYR 10 H TYR 10 7.257 -14.080 3.324 81 HA TYR 10 HA TYR 10 9.767 -15.421 2.903 82 HB2 TYR 10 2HB TYR 10 10.281 -14.810 5.471 83 HB3 TYR 10 3HB TYR 10 10.924 -13.884 4.119 84 HD1 TYR 10 HD1 TYR 10 11.183 -11.872 5.449 85 HD2 TYR 10 HD2 TYR 10 7.375 -13.719 5.015 86 HE1 TYR 10 HE1 TYR 10 10.105 -9.842 6.326 87 HE2 TYR 10 HE2 TYR 10 6.286 -11.695 5.890 88 HH TYR 10 HH TYR 10 7.127 -9.706 7.504 89 H CYS 11 H CYS 11 8.863 -17.397 2.963 90 HA CYS 11 HA CYS 11 6.984 -18.077 5.089 91 HB2 CYS 11 2HB CYS 11 7.890 -20.057 3.043 92 HB3 CYS 11 3HB CYS 11 6.307 -19.863 3.788 93 H ASN 12 H ASN 12 7.878 -18.630 6.968 94 HA ASN 12 HA ASN 12 10.489 -19.835 7.120 95 HB2 ASN 12 2HB ASN 12 8.493 -19.441 9.356 96 HB3 ASN 12 3HB ASN 12 10.230 -19.686 9.510 97 HD21 ASN 12 1HD2 ASN 12 10.803 -17.948 7.224 98 HD22 ASN 12 2HD2 ASN 12 10.584 -16.332 7.796 99 H ARG 13 H ARG 13 10.472 -21.867 6.265 100 HA ARG 13 HA ARG 13 8.515 -23.787 6.379 101 HB2 ARG 13 2HB ARG 13 11.514 -24.149 6.444 102 HB3 ARG 13 3HB ARG 13 10.372 -25.457 6.163 103 HG2 ARG 13 2HG ARG 13 10.762 -23.023 4.434 104 HG3 ARG 13 3HG ARG 13 11.282 -24.670 4.070 105 HD2 ARG 13 2HD ARG 13 8.449 -23.679 4.360 106 HD3 ARG 13 3HD ARG 13 9.246 -24.192 2.873 107 HE ARG 13 HE ARG 13 9.407 -26.364 4.517 108 HH11 ARG 13 1HH1 ARG 13 6.817 -24.366 3.325 109 HH12 ARG 13 2HH1 ARG 13 5.646 -25.642 3.350 110 HH21 ARG 13 1HH2 ARG 13 7.874 -28.053 4.554 111 HH22 ARG 13 2HH2 ARG 13 6.248 -27.739 4.050 112 H ARG 14 H ARG 14 10.712 -22.789 8.889 113 HA ARG 14 HA ARG 14 10.607 -24.971 10.605 114 HB2 ARG 14 2HB ARG 14 10.859 -22.016 11.128 115 HB3 ARG 14 3HB ARG 14 10.903 -23.195 12.431 116 HG2 ARG 14 2HG ARG 14 13.144 -22.582 11.767 117 HG3 ARG 14 3HG ARG 14 12.834 -24.275 11.378 118 HD2 ARG 14 2HD ARG 14 14.024 -23.058 9.580 119 HD3 ARG 14 3HD ARG 14 12.478 -23.730 9.063 120 HE ARG 14 HE ARG 14 11.742 -21.607 8.657 121 HH11 ARG 14 1HH1 ARG 14 14.530 -21.452 10.735 122 HH12 ARG 14 2HH1 ARG 14 14.644 -19.725 10.671 123 HH21 ARG 14 1HH2 ARG 14 11.882 -19.332 8.564 124 HH22 ARG 14 2HH2 ARG 14 13.137 -18.520 9.437 125 H THR 15 H THR 15 8.239 -22.486 9.971 126 HA THR 15 HA THR 15 6.365 -23.893 11.749 127 HB THR 15 HB THR 15 6.941 -21.905 12.959 128 HG1 THR 15 HG1 THR 15 4.900 -21.123 13.202 129 HG21 THR 15 1HG2 THR 15 7.307 -20.779 10.410 130 HG22 THR 15 2HG2 THR 15 7.567 -20.006 11.974 131 HG23 THR 15 3HG2 THR 15 6.006 -19.861 11.167 132 H GLY 16 H GLY 16 7.038 -23.347 8.689 133 HA2 GLY 16 2HA GLY 16 5.843 -23.188 6.732 134 HA3 GLY 16 3HA GLY 16 4.573 -23.997 7.637 135 H LYS 17 H LYS 17 5.882 -20.784 8.275 136 HA LYS 17 HA LYS 17 3.224 -19.675 7.652 137 HB2 LYS 17 2HB LYS 17 5.274 -18.814 9.695 138 HB3 LYS 17 3HB LYS 17 3.866 -17.849 9.271 139 HG2 LYS 17 2HG LYS 17 4.071 -20.285 10.908 140 HG3 LYS 17 3HG LYS 17 2.967 -18.915 11.035 141 HD2 LYS 17 2HD LYS 17 1.858 -19.832 8.927 142 HD3 LYS 17 3HD LYS 17 2.782 -21.307 9.223 143 HE2 LYS 17 2HE LYS 17 1.706 -21.670 11.302 144 HE3 LYS 17 3HE LYS 17 1.006 -20.052 11.302 145 HZ1 LYS 17 1HZ LYS 17 0.256 -22.366 9.617 146 HZ2 LYS 17 2HZ LYS 17 -0.213 -20.788 9.230 147 HZ3 LYS 17 3HZ LYS 17 -0.719 -21.487 10.685 148 H CYS 18 H CYS 18 3.076 -18.121 6.156 149 HA CYS 18 HA CYS 18 5.557 -16.808 5.262 150 HB2 CYS 18 2HB CYS 18 4.482 -18.639 3.730 151 HB3 CYS 18 3HB CYS 18 3.317 -17.375 3.351 152 H GLN 19 H GLN 19 5.483 -14.646 5.050 153 HA GLN 19 HA GLN 19 2.883 -13.305 4.968 154 HB2 GLN 19 2HB GLN 19 4.997 -12.244 6.807 155 HB3 GLN 19 3HB GLN 19 3.263 -11.950 6.822 156 HG2 GLN 19 2HG GLN 19 3.216 -13.392 8.514 157 HG3 GLN 19 3HG GLN 19 3.384 -14.636 7.277 158 HE21 GLN 19 1HE2 GLN 19 6.103 -13.909 6.616 159 HE22 GLN 19 2HE2 GLN 19 7.093 -14.468 7.918 160 H ARG 20 H ARG 20 3.220 -10.870 4.634 161 HA ARG 20 HA ARG 20 5.169 -10.566 2.483 162 HB2 ARG 20 2HB ARG 20 2.574 -9.360 3.167 163 HB3 ARG 20 3HB ARG 20 3.756 -8.228 2.524 164 HG2 ARG 20 2HG ARG 20 3.203 -10.817 1.131 165 HG3 ARG 20 3HG ARG 20 2.156 -9.415 0.899 166 HD2 ARG 20 2HD ARG 20 3.748 -8.240 -0.230 167 HD3 ARG 20 3HD ARG 20 5.080 -8.993 0.647 168 HE ARG 20 HE ARG 20 5.264 -10.439 -1.094 169 HH11 ARG 20 1HH1 ARG 20 1.958 -9.362 -0.924 170 HH12 ARG 20 2HH1 ARG 20 1.454 -10.269 -2.311 171 HH21 ARG 20 1HH2 ARG 20 4.612 -11.639 -2.921 172 HH22 ARG 20 2HH2 ARG 20 2.964 -11.565 -3.446 173 H MET 21 H MET 21 6.326 -8.472 2.295 174 HA MET 21 HA MET 21 7.371 -7.691 4.921 175 HB2 MET 21 2HB MET 21 8.550 -7.173 2.187 176 HB3 MET 21 3HB MET 21 9.332 -6.888 3.736 177 HG2 MET 21 2HG MET 21 8.696 -9.528 3.917 178 HG3 MET 21 3HG MET 21 9.038 -9.354 2.197 179 HE1 MET 21 1HE MET 21 12.389 -8.223 1.764 180 HE2 MET 21 2HE MET 21 10.784 -7.498 1.669 181 HE3 MET 21 3HE MET 21 11.949 -6.908 2.854 182 H1 GLY 33 H GLY 33 20.929 -24.137 10.272 183 HA2 GLY 33 2HA GLY 33 21.820 -23.865 8.105 184 HA3 GLY 33 3HA GLY 33 22.254 -25.568 8.094 185 H SER 34 H SER 34 19.256 -23.662 8.430 186 HA SER 34 HA SER 34 17.965 -25.556 6.586 187 HB2 SER 34 2HB SER 34 17.110 -24.939 9.037 188 HB3 SER 34 3HB SER 34 16.357 -23.604 8.164 189 HG SER 34 HG SER 34 15.248 -25.811 8.405 190 H LYS 35 H LYS 35 18.753 -22.207 7.117 191 HA LYS 35 HA LYS 35 17.060 -20.993 5.254 192 HB2 LYS 35 2HB LYS 35 18.818 -19.198 5.174 193 HB3 LYS 35 3HB LYS 35 18.267 -19.620 6.789 194 HG2 LYS 35 2HG LYS 35 20.546 -21.212 6.014 195 HG3 LYS 35 3HG LYS 35 20.891 -19.484 5.897 196 HD2 LYS 35 2HD LYS 35 19.729 -20.863 8.318 197 HD3 LYS 35 3HD LYS 35 21.426 -20.418 8.121 198 HE2 LYS 35 2HE LYS 35 20.095 -18.075 7.562 199 HE3 LYS 35 3HE LYS 35 19.129 -18.780 8.857 200 HZ1 LYS 35 1HZ LYS 35 20.703 -18.335 10.343 201 HZ2 LYS 35 2HZ LYS 35 21.420 -17.348 9.173 202 HZ3 LYS 35 3HZ LYS 35 21.941 -18.946 9.366 203 H LYS 36 H LYS 36 20.148 -22.624 4.851 204 HA LYS 36 HA LYS 36 20.733 -21.838 2.234 205 HB2 LYS 36 2HB LYS 36 21.436 -24.231 3.894 206 HB3 LYS 36 3HB LYS 36 21.877 -24.195 2.192 207 HG2 LYS 36 2HG LYS 36 22.860 -22.500 4.439 208 HG3 LYS 36 3HG LYS 36 23.771 -23.371 3.203 209 HD2 LYS 36 2HD LYS 36 22.740 -21.744 1.532 210 HD3 LYS 36 3HD LYS 36 22.249 -20.791 2.934 211 HE2 LYS 36 2HE LYS 36 25.065 -21.639 2.918 212 HE3 LYS 36 3HE LYS 36 24.615 -20.515 1.636 213 HZ1 LYS 36 1HZ LYS 36 24.860 -20.066 4.476 214 HZ2 LYS 36 2HZ LYS 36 23.458 -19.408 3.796 215 HZ3 LYS 36 3HZ LYS 36 24.977 -18.970 3.192 216 HA PRO 37 HA PRO 37 18.407 -25.765 0.670 217 HB2 PRO 37 2HB PRO 37 16.941 -27.162 2.479 218 HB3 PRO 37 3HB PRO 37 18.647 -27.498 2.160 219 HG2 PRO 37 2HG PRO 37 17.411 -25.927 4.388 220 HG3 PRO 37 3HG PRO 37 18.732 -27.108 4.451 221 HD2 PRO 37 2HD PRO 37 19.164 -24.435 4.472 222 HD3 PRO 37 3HD PRO 37 20.300 -25.580 3.729 223 H VAL 38 H VAL 38 16.916 -23.840 3.200 224 HA VAL 38 HA VAL 38 14.285 -23.999 1.988 225 HB VAL 38 HB VAL 38 15.301 -22.422 4.354 226 HG11 VAL 38 1HG1 VAL 38 13.026 -21.799 4.808 227 HG12 VAL 38 2HG1 VAL 38 13.431 -21.293 3.167 228 HG13 VAL 38 3HG1 VAL 38 12.449 -22.734 3.429 229 HG21 VAL 38 1HG2 VAL 38 14.888 -24.239 5.563 230 HG22 VAL 38 2HG2 VAL 38 13.246 -24.336 4.927 231 HG23 VAL 38 3HG2 VAL 38 14.571 -25.122 4.069 232 HA PRO 39 HA PRO 39 15.161 -20.558 -0.704 233 HB2 PRO 39 2HB PRO 39 12.681 -20.429 -1.801 234 HB3 PRO 39 3HB PRO 39 13.873 -21.650 -2.262 235 HG2 PRO 39 2HG PRO 39 11.558 -21.881 -0.379 236 HG3 PRO 39 3HG PRO 39 12.115 -23.026 -1.613 237 HD2 PRO 39 2HD PRO 39 12.681 -23.330 1.017 238 HD3 PRO 39 3HD PRO 39 13.789 -23.859 -0.265 239 H ILE 40 H ILE 40 14.887 -19.773 1.894 240 HA ILE 40 HA ILE 40 12.674 -17.855 1.968 241 HB ILE 40 HB ILE 40 13.753 -17.462 4.346 242 HG12 ILE 40 2HG1 ILE 40 14.777 -20.169 3.495 243 HG13 ILE 40 3HG1 ILE 40 15.694 -18.821 4.159 244 HG21 ILE 40 1HG2 ILE 40 12.178 -18.996 5.265 245 HG22 ILE 40 2HG2 ILE 40 11.487 -18.362 3.772 246 HG23 ILE 40 3HG2 ILE 40 12.192 -19.978 3.800 247 HD11 ILE 40 1HD1 ILE 40 15.224 -20.810 5.677 248 HD12 ILE 40 2HD1 ILE 40 14.901 -19.199 6.318 249 HD13 ILE 40 3HD1 ILE 40 13.569 -20.205 5.749 250 H ILE 41 H ILE 41 13.206 -16.074 0.839 251 HA ILE 41 HA ILE 41 15.664 -14.668 1.638 252 HB ILE 41 HB ILE 41 15.634 -13.756 -0.786 253 HG12 ILE 41 2HG1 ILE 41 14.847 -15.496 -2.420 254 HG13 ILE 41 3HG1 ILE 41 14.061 -16.322 -1.078 255 HG21 ILE 41 1HG2 ILE 41 16.684 -16.316 0.260 256 HG22 ILE 41 2HG2 ILE 41 16.803 -16.052 -1.478 257 HG23 ILE 41 3HG2 ILE 41 17.542 -14.906 -0.360 258 HD11 ILE 41 1HD1 ILE 41 13.375 -13.490 -1.316 259 HD12 ILE 41 2HD1 ILE 41 12.880 -14.487 -2.684 260 HD13 ILE 41 3HD1 ILE 41 12.344 -14.897 -1.055 261 H TYR 42 H TYR 42 15.520 -12.309 0.661 262 HA TYR 42 HA TYR 42 12.877 -11.189 0.554 263 HB2 TYR 42 2HB TYR 42 13.653 -9.619 2.583 264 HB3 TYR 42 3HB TYR 42 12.709 -11.084 2.826 265 HD1 TYR 42 HD1 TYR 42 16.227 -11.304 1.862 266 HD2 TYR 42 HD2 TYR 42 13.496 -11.303 5.125 267 HE1 TYR 42 HE1 TYR 42 17.989 -12.192 3.330 268 HE2 TYR 42 HE2 TYR 42 15.251 -12.190 6.602 269 HH TYR 42 HH TYR 42 18.339 -12.046 6.082 270 H CYS 43 H CYS 43 13.338 -10.079 -1.265 271 HA CYS 43 HA CYS 43 15.782 -8.510 -1.448 272 HB2 CYS 43 2HB CYS 43 13.666 -8.452 -3.557 273 HB3 CYS 43 3HB CYS 43 15.418 -8.404 -3.728 274 H ASN 44 H ASN 44 15.755 -6.608 -0.438 275 HA ASN 44 HA ASN 44 13.321 -5.103 -0.091 276 HB2 ASN 44 2HB ASN 44 16.137 -4.213 0.549 277 HB3 ASN 44 3HB ASN 44 14.635 -3.593 1.230 278 HD21 ASN 44 1HD2 ASN 44 13.460 -6.246 1.479 279 HD22 ASN 44 2HD2 ASN 44 14.240 -6.990 2.828 280 H ARG 45 H ARG 45 12.587 -4.351 -2.029 281 HA ARG 45 HA ARG 45 13.943 -3.459 -4.214 282 HB2 ARG 45 2HB ARG 45 11.389 -2.370 -3.026 283 HB3 ARG 45 3HB ARG 45 11.983 -1.927 -4.621 284 HG2 ARG 45 2HG ARG 45 11.209 -4.690 -3.708 285 HG3 ARG 45 3HG ARG 45 10.290 -3.644 -4.792 286 HD2 ARG 45 2HD ARG 45 13.002 -4.858 -5.302 287 HD3 ARG 45 3HD ARG 45 11.484 -5.283 -6.092 288 HE ARG 45 HE ARG 45 11.817 -2.611 -6.588 289 HH11 ARG 45 1HH1 ARG 45 13.674 -5.499 -7.162 290 HH12 ARG 45 2HH1 ARG 45 14.429 -4.886 -8.596 291 HH21 ARG 45 1HH2 ARG 45 12.804 -1.792 -8.474 292 HH22 ARG 45 2HH2 ARG 45 13.933 -2.777 -9.341 293 H ARG 46 H ARG 46 13.343 -1.693 -1.230 294 HA ARG 46 HA ARG 46 14.020 0.872 -1.928 295 HB2 ARG 46 2HB ARG 46 15.015 0.984 0.453 296 HB3 ARG 46 3HB ARG 46 13.309 0.596 0.275 297 HG2 ARG 46 2HG ARG 46 14.914 -1.796 0.241 298 HG3 ARG 46 3HG ARG 46 15.226 -0.837 1.690 299 HD2 ARG 46 2HD ARG 46 13.444 -2.125 2.372 300 HD3 ARG 46 3HD ARG 46 12.625 -0.674 1.795 301 HE ARG 46 HE ARG 46 12.946 -2.848 -0.112 302 HH11 ARG 46 1HH1 ARG 46 10.892 -1.157 2.133 303 HH12 ARG 46 2HH1 ARG 46 9.423 -1.787 1.465 304 HH21 ARG 46 1HH2 ARG 46 11.019 -3.684 -1.001 305 HH22 ARG 46 2HH2 ARG 46 9.497 -3.225 -0.318 306 H THR 47 H THR 47 16.197 -1.814 -1.187 307 HA THR 47 HA THR 47 18.435 -0.176 -2.189 308 HB THR 47 HB THR 47 18.731 -0.680 0.183 309 HG1 THR 47 HG1 THR 47 20.546 -0.766 -1.374 310 HG21 THR 47 1HG2 THR 47 19.293 -3.303 0.475 311 HG22 THR 47 2HG2 THR 47 17.995 -3.394 -0.716 312 HG23 THR 47 3HG2 THR 47 17.718 -2.597 0.833 313 H GLY 48 H GLY 48 16.421 -2.410 -3.227 314 HA2 GLY 48 2HA GLY 48 16.503 -4.169 -4.709 315 HA3 GLY 48 3HA GLY 48 17.861 -3.286 -5.390 316 H LYS 49 H LYS 49 17.766 -4.715 -2.175 317 HA LYS 49 HA LYS 49 19.899 -6.561 -3.024 318 HB2 LYS 49 2HB LYS 49 19.400 -5.237 -0.356 319 HB3 LYS 49 3HB LYS 49 20.568 -6.530 -0.593 320 HG2 LYS 49 2HG LYS 49 20.705 -3.690 -1.347 321 HG3 LYS 49 3HG LYS 49 21.986 -4.805 -0.866 322 HD2 LYS 49 2HD LYS 49 21.664 -5.901 -3.143 323 HD3 LYS 49 3HD LYS 49 20.709 -4.479 -3.569 324 HE2 LYS 49 2HE LYS 49 22.531 -3.215 -3.839 325 HE3 LYS 49 3HE LYS 49 23.251 -3.792 -2.337 326 HZ1 LYS 49 1HZ LYS 49 24.696 -4.511 -3.993 327 HZ2 LYS 49 2HZ LYS 49 23.448 -4.970 -5.038 328 HZ3 LYS 49 3HZ LYS 49 23.774 -5.889 -3.656 329 H CYS 50 H CYS 50 19.663 -8.697 -2.680 330 HA CYS 50 HA CYS 50 17.347 -9.584 -1.091 331 HB2 CYS 50 2HB CYS 50 17.238 -9.755 -3.707 332 HB3 CYS 50 3HB CYS 50 18.285 -11.150 -3.466 333 H GLN 51 H GLN 51 17.711 -11.171 0.351 334 HA GLN 51 HA GLN 51 20.157 -12.759 0.154 335 HB2 GLN 51 2HB GLN 51 19.453 -11.593 2.817 336 HB3 GLN 51 3HB GLN 51 21.003 -12.184 2.235 337 HG2 GLN 51 2HG GLN 51 21.524 -10.027 2.040 338 HG3 GLN 51 3HG GLN 51 20.565 -10.090 0.562 339 HE21 GLN 51 1HE2 GLN 51 18.053 -10.403 1.966 340 HE22 GLN 51 2HE2 GLN 51 17.676 -8.860 2.647 341 H ARG 52 H ARG 52 20.171 -14.494 1.912 342 HA ARG 52 HA ARG 52 17.537 -15.736 1.920 343 HB2 ARG 52 2HB ARG 52 20.335 -16.676 2.183 344 HB3 ARG 52 3HB ARG 52 19.119 -17.588 3.068 345 HG2 ARG 52 2HG ARG 52 18.652 -16.960 0.194 346 HG3 ARG 52 3HG ARG 52 19.775 -18.250 0.630 347 HD2 ARG 52 2HD ARG 52 18.130 -19.608 1.375 348 HD3 ARG 52 3HD ARG 52 17.186 -18.274 2.037 349 HE ARG 52 HE ARG 52 15.936 -18.368 0.143 350 HH11 ARG 52 1HH1 ARG 52 19.137 -19.510 -0.612 351 HH12 ARG 52 2HH1 ARG 52 18.766 -19.850 -2.270 352 HH21 ARG 52 1HH2 ARG 52 15.436 -18.812 -2.038 353 HH22 ARG 52 2HH2 ARG 52 16.661 -19.451 -3.080 354 H MET 53 H MET 53 16.885 -16.958 3.915 355 HA MET 53 HA MET 53 17.289 -15.232 6.254 356 HB2 MET 53 2HB MET 53 15.129 -17.297 5.813 357 HB3 MET 53 3HB MET 53 15.195 -16.093 7.093 358 HG2 MET 53 2HG MET 53 15.260 -14.436 5.036 359 HG3 MET 53 3HG MET 53 14.469 -15.792 4.235 360 HE1 MET 53 1HE MET 53 14.726 -14.089 7.480 361 HE2 MET 53 2HE MET 53 13.329 -13.013 7.432 362 HE3 MET 53 3HE MET 53 13.227 -14.556 8.282 Start of MODEL 14 1 H1 GLY 1 H GLY 1 2.926 -1.156 3.658 2 HA2 GLY 1 2HA GLY 1 1.432 -2.086 1.836 3 HA3 GLY 1 3HA GLY 1 1.488 -0.458 1.175 4 H SER 2 H SER 2 3.447 -3.291 1.944 5 HA SER 2 HA SER 2 5.363 -2.417 -0.120 6 HB2 SER 2 2HB SER 2 5.885 -3.992 2.411 7 HB3 SER 2 3HB SER 2 7.074 -3.756 1.130 8 HG SER 2 HG SER 2 6.525 -1.402 1.512 9 H LYS 3 H LYS 3 3.213 -4.838 0.969 10 HA LYS 3 HA LYS 3 4.357 -7.033 -0.475 11 HB2 LYS 3 2HB LYS 3 2.132 -8.116 -0.012 12 HB3 LYS 3 3HB LYS 3 3.004 -7.569 1.414 13 HG2 LYS 3 2HG LYS 3 1.190 -5.559 0.342 14 HG3 LYS 3 3HG LYS 3 0.378 -7.046 0.836 15 HD2 LYS 3 2HD LYS 3 2.304 -5.493 2.562 16 HD3 LYS 3 3HD LYS 3 0.547 -5.352 2.647 17 HE2 LYS 3 2HE LYS 3 0.792 -8.013 2.864 18 HE3 LYS 3 3HE LYS 3 2.334 -7.524 3.565 19 HZ1 LYS 3 1HZ LYS 3 -0.369 -6.682 4.458 20 HZ2 LYS 3 2HZ LYS 3 1.075 -6.050 5.071 21 HZ3 LYS 3 3HZ LYS 3 0.708 -7.687 5.291 22 H LYS 4 H LYS 4 1.925 -4.585 -1.117 23 HA LYS 4 HA LYS 4 0.910 -5.755 -3.500 24 HB2 LYS 4 2HB LYS 4 0.889 -2.807 -2.888 25 HB3 LYS 4 3HB LYS 4 -0.283 -3.737 -3.812 26 HG2 LYS 4 2HG LYS 4 0.172 -3.904 -0.840 27 HG3 LYS 4 3HG LYS 4 -1.184 -3.116 -1.650 28 HD2 LYS 4 2HD LYS 4 -0.522 -6.053 -1.853 29 HD3 LYS 4 3HD LYS 4 -1.745 -5.366 -0.782 30 HE2 LYS 4 2HE LYS 4 -2.632 -4.299 -3.013 31 HE3 LYS 4 3HE LYS 4 -1.745 -5.631 -3.752 32 HZ1 LYS 4 1HZ LYS 4 -3.242 -7.116 -3.049 33 HZ2 LYS 4 2HZ LYS 4 -4.271 -5.789 -2.853 34 HZ3 LYS 4 3HZ LYS 4 -3.415 -6.399 -1.527 35 HA PRO 5 HA PRO 5 3.942 -2.633 -5.648 36 HB2 PRO 5 2HB PRO 5 5.982 -1.702 -4.118 37 HB3 PRO 5 3HB PRO 5 4.427 -0.873 -4.253 38 HG2 PRO 5 2HG PRO 5 5.424 -2.690 -2.092 39 HG3 PRO 5 3HG PRO 5 4.533 -1.164 -1.948 40 HD2 PRO 5 2HD PRO 5 3.334 -3.579 -1.707 41 HD3 PRO 5 3HD PRO 5 2.502 -2.163 -2.381 42 H VAL 6 H VAL 6 5.674 -4.313 -3.013 43 HA VAL 6 HA VAL 6 7.216 -5.752 -5.073 44 HB VAL 6 HB VAL 6 8.703 -4.225 -3.947 45 HG11 VAL 6 1HG1 VAL 6 7.363 -3.894 -1.916 46 HG12 VAL 6 2HG1 VAL 6 7.816 -5.507 -1.364 47 HG13 VAL 6 3HG1 VAL 6 9.047 -4.257 -1.542 48 HG21 VAL 6 1HG2 VAL 6 9.621 -6.398 -4.506 49 HG22 VAL 6 2HG2 VAL 6 10.330 -5.815 -3.000 50 HG23 VAL 6 3HG2 VAL 6 9.075 -7.053 -2.962 51 HA PRO 7 HA PRO 7 5.111 -9.170 -3.046 52 HB2 PRO 7 2HB PRO 7 5.840 -11.015 -4.900 53 HB3 PRO 7 3HB PRO 7 4.508 -9.880 -5.147 54 HG2 PRO 7 2HG PRO 7 7.326 -9.740 -6.146 55 HG3 PRO 7 3HG PRO 7 5.816 -9.380 -7.003 56 HD2 PRO 7 2HD PRO 7 7.403 -7.443 -5.973 57 HD3 PRO 7 3HD PRO 7 5.637 -7.282 -6.068 58 H ILE 8 H ILE 8 7.036 -8.659 -1.482 59 HA ILE 8 HA ILE 8 9.065 -10.779 -1.683 60 HB ILE 8 HB ILE 8 10.006 -9.343 0.349 61 HG12 ILE 8 2HG1 ILE 8 8.308 -7.422 -1.246 62 HG13 ILE 8 3HG1 ILE 8 8.246 -7.727 0.486 63 HG21 ILE 8 1HG2 ILE 8 10.625 -9.680 -2.330 64 HG22 ILE 8 2HG2 ILE 8 10.640 -7.932 -2.099 65 HG23 ILE 8 3HG2 ILE 8 11.659 -8.963 -1.095 66 HD11 ILE 8 1HD1 ILE 8 10.112 -6.060 -1.085 67 HD12 ILE 8 2HD1 ILE 8 9.412 -5.792 0.512 68 HD13 ILE 8 3HD1 ILE 8 10.765 -6.905 0.318 69 H ILE 9 H ILE 9 7.938 -12.512 -0.847 70 HA ILE 9 HA ILE 9 6.928 -12.234 1.903 71 HB ILE 9 HB ILE 9 5.889 -14.547 1.347 72 HG12 ILE 9 2HG1 ILE 9 5.299 -14.694 -1.107 73 HG13 ILE 9 3HG1 ILE 9 6.516 -13.457 -1.401 74 HG21 ILE 9 1HG2 ILE 9 4.156 -13.043 -0.160 75 HG22 ILE 9 2HG2 ILE 9 4.180 -13.132 1.600 76 HG23 ILE 9 3HG2 ILE 9 5.026 -11.825 0.772 77 HD11 ILE 9 1HD1 ILE 9 7.519 -15.692 0.164 78 HD12 ILE 9 2HD1 ILE 9 6.932 -16.159 -1.432 79 HD13 ILE 9 3HD1 ILE 9 8.181 -14.924 -1.278 80 H TYR 10 H TYR 10 7.021 -14.551 3.019 81 HA TYR 10 HA TYR 10 9.410 -16.053 2.482 82 HB2 TYR 10 2HB TYR 10 10.068 -15.483 5.039 83 HB3 TYR 10 3HB TYR 10 10.743 -14.635 3.652 84 HD1 TYR 10 HD1 TYR 10 11.218 -12.604 4.851 85 HD2 TYR 10 HD2 TYR 10 7.265 -14.175 4.753 86 HE1 TYR 10 HE1 TYR 10 10.356 -10.475 5.731 87 HE2 TYR 10 HE2 TYR 10 6.392 -12.050 5.631 88 HH TYR 10 HH TYR 10 7.229 -10.122 6.950 89 H CYS 11 H CYS 11 8.417 -17.975 2.605 90 HA CYS 11 HA CYS 11 6.535 -18.530 4.754 91 HB2 CYS 11 2HB CYS 11 6.390 -19.253 2.218 92 HB3 CYS 11 3HB CYS 11 7.386 -20.597 2.768 93 H ASN 12 H ASN 12 7.428 -19.016 6.657 94 HA ASN 12 HA ASN 12 9.966 -20.377 6.837 95 HB2 ASN 12 2HB ASN 12 8.069 -19.694 9.089 96 HB3 ASN 12 3HB ASN 12 9.792 -20.036 9.210 97 HD21 ASN 12 1HD2 ASN 12 10.404 -18.499 6.798 98 HD22 ASN 12 2HD2 ASN 12 10.299 -16.837 7.259 99 H ARG 13 H ARG 13 9.806 -22.462 6.160 100 HA ARG 13 HA ARG 13 7.749 -24.235 6.359 101 HB2 ARG 13 2HB ARG 13 10.694 -24.828 6.699 102 HB3 ARG 13 3HB ARG 13 9.460 -26.038 6.372 103 HG2 ARG 13 2HG ARG 13 10.206 -23.743 4.570 104 HG3 ARG 13 3HG ARG 13 10.662 -25.434 4.350 105 HD2 ARG 13 2HD ARG 13 7.890 -24.256 4.261 106 HD3 ARG 13 3HD ARG 13 8.797 -24.958 2.922 107 HE ARG 13 HE ARG 13 7.243 -26.359 4.859 108 HH11 ARG 13 1HH1 ARG 13 10.053 -26.594 2.817 109 HH12 ARG 13 2HH1 ARG 13 10.001 -28.323 2.722 110 HH21 ARG 13 1HH2 ARG 13 7.164 -28.636 4.742 111 HH22 ARG 13 2HH2 ARG 13 8.357 -29.483 3.817 112 H ARG 14 H ARG 14 10.048 -23.363 8.879 113 HA ARG 14 HA ARG 14 9.595 -25.299 10.768 114 HB2 ARG 14 2HB ARG 14 9.936 -23.367 12.454 115 HB3 ARG 14 3HB ARG 14 11.233 -23.739 11.326 116 HG2 ARG 14 2HG ARG 14 9.405 -21.788 10.229 117 HG3 ARG 14 3HG ARG 14 10.074 -21.264 11.776 118 HD2 ARG 14 2HD ARG 14 11.637 -20.481 10.256 119 HD3 ARG 14 3HD ARG 14 12.339 -22.012 10.777 120 HE ARG 14 HE ARG 14 10.721 -21.965 8.339 121 HH11 ARG 14 1HH1 ARG 14 13.829 -22.260 9.879 122 HH12 ARG 14 2HH1 ARG 14 14.608 -22.913 8.476 123 HH21 ARG 14 1HH2 ARG 14 11.735 -22.824 6.485 124 HH22 ARG 14 2HH2 ARG 14 13.416 -23.232 6.546 125 H THR 15 H THR 15 7.611 -22.462 10.060 126 HA THR 15 HA THR 15 5.524 -23.570 11.823 127 HB THR 15 HB THR 15 6.339 -21.420 12.659 128 HG1 THR 15 HG1 THR 15 4.219 -21.609 13.107 129 HG21 THR 15 1HG2 THR 15 7.121 -20.037 11.053 130 HG22 THR 15 2HG2 THR 15 5.454 -19.463 11.003 131 HG23 THR 15 3HG2 THR 15 6.011 -20.659 9.833 132 H GLY 16 H GLY 16 6.305 -23.554 8.739 133 HA2 GLY 16 2HA GLY 16 5.179 -23.520 6.728 134 HA3 GLY 16 3HA GLY 16 3.882 -24.232 7.677 135 H LYS 17 H LYS 17 5.144 -20.983 8.126 136 HA LYS 17 HA LYS 17 2.536 -19.935 7.241 137 HB2 LYS 17 2HB LYS 17 4.445 -18.918 9.348 138 HB3 LYS 17 3HB LYS 17 3.071 -17.991 8.760 139 HG2 LYS 17 2HG LYS 17 3.160 -20.303 10.578 140 HG3 LYS 17 3HG LYS 17 2.057 -18.926 10.536 141 HD2 LYS 17 2HD LYS 17 1.065 -19.982 8.445 142 HD3 LYS 17 3HD LYS 17 1.981 -21.430 8.869 143 HE2 LYS 17 2HE LYS 17 0.039 -21.924 9.940 144 HE3 LYS 17 3HE LYS 17 0.820 -20.998 11.221 145 HZ1 LYS 17 1HZ LYS 17 -1.341 -20.159 9.396 146 HZ2 LYS 17 2HZ LYS 17 -0.366 -19.010 10.164 147 HZ3 LYS 17 3HZ LYS 17 -1.291 -20.087 11.085 148 H CYS 18 H CYS 18 2.465 -18.334 5.752 149 HA CYS 18 HA CYS 18 5.045 -17.303 4.766 150 HB2 CYS 18 2HB CYS 18 2.608 -17.571 3.025 151 HB3 CYS 18 3HB CYS 18 4.297 -17.437 2.546 152 H GLN 19 H GLN 19 5.279 -15.156 4.667 153 HA GLN 19 HA GLN 19 2.911 -13.442 4.645 154 HB2 GLN 19 2HB GLN 19 5.131 -12.773 6.541 155 HB3 GLN 19 3HB GLN 19 3.456 -12.237 6.558 156 HG2 GLN 19 2HG GLN 19 3.199 -13.721 8.197 157 HG3 GLN 19 3HG GLN 19 3.178 -14.922 6.906 158 HE21 GLN 19 1HE2 GLN 19 5.981 -14.576 6.267 159 HE22 GLN 19 2HE2 GLN 19 6.871 -15.339 7.536 160 H ARG 20 H ARG 20 3.650 -11.058 4.465 161 HA ARG 20 HA ARG 20 5.896 -10.953 2.560 162 HB2 ARG 20 2HB ARG 20 3.413 -10.478 1.835 163 HB3 ARG 20 3HB ARG 20 3.712 -8.908 2.569 164 HG2 ARG 20 2HG ARG 20 4.906 -8.217 0.827 165 HG3 ARG 20 3HG ARG 20 5.855 -9.704 0.789 166 HD2 ARG 20 2HD ARG 20 3.203 -10.273 -0.095 167 HD3 ARG 20 3HD ARG 20 3.812 -8.877 -0.984 168 HE ARG 20 HE ARG 20 5.863 -10.621 -1.134 169 HH11 ARG 20 1HH1 ARG 20 2.458 -10.904 -1.803 170 HH12 ARG 20 2HH1 ARG 20 2.668 -12.102 -3.038 171 HH21 ARG 20 1HH2 ARG 20 6.152 -12.197 -2.757 172 HH22 ARG 20 2HH2 ARG 20 4.769 -12.837 -3.579 173 H MET 21 H MET 21 7.033 -8.868 2.443 174 HA MET 21 HA MET 21 7.761 -7.972 5.054 175 HB2 MET 21 2HB MET 21 8.542 -6.817 2.372 176 HB3 MET 21 3HB MET 21 9.351 -6.529 3.907 177 HG2 MET 21 2HG MET 21 9.554 -9.167 3.872 178 HG3 MET 21 3HG MET 21 9.424 -8.901 2.135 179 HE1 MET 21 1HE MET 21 11.628 -6.606 4.933 180 HE2 MET 21 2HE MET 21 11.086 -8.230 5.357 181 HE3 MET 21 3HE MET 21 12.785 -7.937 4.982 182 H1 GLY 33 H GLY 33 19.808 -22.976 11.178 183 HA2 GLY 33 2HA GLY 33 17.615 -22.964 10.268 184 HA3 GLY 33 3HA GLY 33 17.846 -21.285 9.804 185 H SER 34 H SER 34 17.385 -24.202 8.537 186 HA SER 34 HA SER 34 19.403 -24.295 6.511 187 HB2 SER 34 2HB SER 34 17.974 -26.063 5.510 188 HB3 SER 34 3HB SER 34 18.296 -26.345 7.221 189 HG SER 34 HG SER 34 16.064 -26.626 6.567 190 H LYS 35 H LYS 35 19.488 -23.199 4.669 191 HA LYS 35 HA LYS 35 17.010 -21.975 3.645 192 HB2 LYS 35 2HB LYS 35 19.557 -20.650 2.964 193 HB3 LYS 35 3HB LYS 35 18.000 -19.951 3.386 194 HG2 LYS 35 2HG LYS 35 19.201 -19.311 5.202 195 HG3 LYS 35 3HG LYS 35 18.633 -20.879 5.778 196 HD2 LYS 35 2HD LYS 35 20.950 -20.782 6.268 197 HD3 LYS 35 3HD LYS 35 20.781 -21.853 4.875 198 HE2 LYS 35 2HE LYS 35 22.098 -20.548 3.649 199 HE3 LYS 35 3HE LYS 35 21.097 -19.139 3.997 200 HZ1 LYS 35 1HZ LYS 35 22.471 -19.497 6.299 201 HZ2 LYS 35 2HZ LYS 35 22.880 -18.396 5.082 202 HZ3 LYS 35 3HZ LYS 35 23.620 -19.916 5.131 203 H LYS 36 H LYS 36 19.839 -23.820 3.004 204 HA LYS 36 HA LYS 36 20.026 -23.506 0.214 205 HB2 LYS 36 2HB LYS 36 20.667 -26.089 1.606 206 HB3 LYS 36 3HB LYS 36 21.480 -25.345 0.235 207 HG2 LYS 36 2HG LYS 36 21.606 -24.517 3.121 208 HG3 LYS 36 3HG LYS 36 22.914 -25.131 2.107 209 HD2 LYS 36 2HD LYS 36 22.203 -23.004 0.648 210 HD3 LYS 36 3HD LYS 36 21.716 -22.425 2.243 211 HE2 LYS 36 2HE LYS 36 24.428 -23.617 1.755 212 HE3 LYS 36 3HE LYS 36 24.101 -21.912 1.450 213 HZ1 LYS 36 1HZ LYS 36 23.191 -22.823 4.023 214 HZ2 LYS 36 2HZ LYS 36 24.100 -21.455 3.620 215 HZ3 LYS 36 3HZ LYS 36 24.866 -22.949 3.822 216 HA PRO 37 HA PRO 37 17.179 -27.423 -0.031 217 HB2 PRO 37 2HB PRO 37 15.748 -28.015 2.198 218 HB3 PRO 37 3HB PRO 37 17.354 -28.683 1.883 219 HG2 PRO 37 2HG PRO 37 16.569 -26.379 3.626 220 HG3 PRO 37 3HG PRO 37 17.730 -27.681 3.947 221 HD2 PRO 37 2HD PRO 37 18.496 -25.208 3.155 222 HD3 PRO 37 3HD PRO 37 19.392 -26.673 2.709 223 H VAL 38 H VAL 38 16.024 -24.901 2.191 224 HA VAL 38 HA VAL 38 13.519 -24.755 0.655 225 HB VAL 38 HB VAL 38 13.077 -25.094 2.978 226 HG11 VAL 38 1HG1 VAL 38 15.219 -24.427 3.895 227 HG12 VAL 38 2HG1 VAL 38 14.889 -22.739 3.499 228 HG13 VAL 38 3HG1 VAL 38 13.917 -23.567 4.716 229 HG21 VAL 38 1HG2 VAL 38 12.667 -22.204 2.221 230 HG22 VAL 38 2HG2 VAL 38 11.571 -23.548 1.903 231 HG23 VAL 38 3HG2 VAL 38 11.855 -23.016 3.560 232 HA PRO 39 HA PRO 39 15.294 -21.037 -1.095 233 HB2 PRO 39 2HB PRO 39 13.226 -20.548 -2.785 234 HB3 PRO 39 3HB PRO 39 14.467 -21.763 -3.112 235 HG2 PRO 39 2HG PRO 39 11.711 -22.123 -2.001 236 HG3 PRO 39 3HG PRO 39 12.562 -23.091 -3.219 237 HD2 PRO 39 2HD PRO 39 12.358 -23.858 -0.630 238 HD3 PRO 39 3HD PRO 39 13.767 -24.253 -1.635 239 H ILE 40 H ILE 40 14.668 -20.360 1.293 240 HA ILE 40 HA ILE 40 12.393 -18.501 1.209 241 HB ILE 40 HB ILE 40 13.064 -18.392 3.779 242 HG12 ILE 40 2HG1 ILE 40 14.100 -21.057 2.810 243 HG13 ILE 40 3HG1 ILE 40 14.971 -19.830 3.723 244 HG21 ILE 40 1HG2 ILE 40 11.332 -20.006 4.226 245 HG22 ILE 40 2HG2 ILE 40 10.893 -19.065 2.801 246 HG23 ILE 40 3HG2 ILE 40 11.517 -20.704 2.617 247 HD11 ILE 40 1HD1 ILE 40 13.172 -20.277 5.535 248 HD12 ILE 40 2HD1 ILE 40 12.926 -21.786 4.655 249 HD13 ILE 40 3HD1 ILE 40 14.511 -21.406 5.329 250 H ILE 41 H ILE 41 13.011 -16.550 0.529 251 HA ILE 41 HA ILE 41 15.376 -15.340 1.797 252 HB ILE 41 HB ILE 41 15.568 -14.016 -0.420 253 HG12 ILE 41 2HG1 ILE 41 14.921 -15.414 -2.401 254 HG13 ILE 41 3HG1 ILE 41 14.025 -16.462 -1.306 255 HG21 ILE 41 1HG2 ILE 41 16.528 -16.715 0.279 256 HG22 ILE 41 2HG2 ILE 41 16.760 -16.217 -1.396 257 HG23 ILE 41 3HG2 ILE 41 17.432 -15.246 -0.086 258 HD11 ILE 41 1HD1 ILE 41 12.314 -15.030 -1.144 259 HD12 ILE 41 2HD1 ILE 41 13.365 -13.614 -1.103 260 HD13 ILE 41 3HD1 ILE 41 12.966 -14.372 -2.644 261 H TYR 42 H TYR 42 15.316 -12.839 1.203 262 HA TYR 42 HA TYR 42 12.678 -11.696 1.111 263 HB2 TYR 42 2HB TYR 42 13.357 -10.461 3.397 264 HB3 TYR 42 3HB TYR 42 12.384 -11.927 3.358 265 HD1 TYR 42 HD1 TYR 42 15.957 -12.034 2.575 266 HD2 TYR 42 HD2 TYR 42 13.029 -12.544 5.620 267 HE1 TYR 42 HE1 TYR 42 17.624 -13.174 3.979 268 HE2 TYR 42 HE2 TYR 42 14.688 -13.684 7.033 269 HH TYR 42 HH TYR 42 16.938 -14.049 7.302 270 H CYS 43 H CYS 43 13.206 -10.297 -0.469 271 HA CYS 43 HA CYS 43 15.660 -8.737 -0.278 272 HB2 CYS 43 2HB CYS 43 13.686 -8.342 -2.482 273 HB3 CYS 43 3HB CYS 43 15.446 -8.309 -2.534 274 H ASN 44 H ASN 44 15.526 -7.041 1.053 275 HA ASN 44 HA ASN 44 13.059 -5.568 1.374 276 HB2 ASN 44 2HB ASN 44 14.732 -4.109 2.820 277 HB3 ASN 44 3HB ASN 44 14.130 -5.656 3.409 278 HD21 ASN 44 1HD2 ASN 44 16.517 -5.209 0.880 279 HD22 ASN 44 2HD2 ASN 44 17.838 -5.911 1.744 280 H ARG 45 H ARG 45 12.576 -4.410 -0.425 281 HA ARG 45 HA ARG 45 14.206 -3.207 -2.246 282 HB2 ARG 45 2HB ARG 45 11.606 -2.100 -1.168 283 HB3 ARG 45 3HB ARG 45 12.371 -1.608 -2.673 284 HG2 ARG 45 2HG ARG 45 11.413 -4.397 -2.066 285 HG3 ARG 45 3HG ARG 45 10.515 -3.195 -2.995 286 HD2 ARG 45 2HD ARG 45 13.144 -4.487 -3.691 287 HD3 ARG 45 3HD ARG 45 11.611 -4.622 -4.553 288 HE ARG 45 HE ARG 45 12.165 -1.963 -4.622 289 HH11 ARG 45 1HH1 ARG 45 13.917 -4.832 -5.525 290 HH12 ARG 45 2HH1 ARG 45 14.800 -4.051 -6.795 291 HH21 ARG 45 1HH2 ARG 45 13.320 -0.923 -6.292 292 HH22 ARG 45 2HH2 ARG 45 14.460 -1.828 -7.230 293 H ARG 46 H ARG 46 13.512 -2.137 0.997 294 HA ARG 46 HA ARG 46 14.159 0.514 0.981 295 HB2 ARG 46 2HB ARG 46 15.075 -1.498 3.044 296 HB3 ARG 46 3HB ARG 46 14.938 0.239 3.284 297 HG2 ARG 46 2HG ARG 46 12.912 -0.192 4.093 298 HG3 ARG 46 3HG ARG 46 12.428 -0.455 2.416 299 HD2 ARG 46 2HD ARG 46 13.690 -2.742 3.796 300 HD3 ARG 46 3HD ARG 46 12.088 -2.274 4.365 301 HE ARG 46 HE ARG 46 12.761 -3.440 1.803 302 HH11 ARG 46 1HH1 ARG 46 10.391 -1.746 3.708 303 HH12 ARG 46 2HH1 ARG 46 9.056 -2.228 2.714 304 HH21 ARG 46 1HH2 ARG 46 11.013 -4.082 0.486 305 HH22 ARG 46 2HH2 ARG 46 9.411 -3.558 0.882 306 H THR 47 H THR 47 16.324 -2.213 0.637 307 HA THR 47 HA THR 47 18.508 -0.332 0.051 308 HB THR 47 HB THR 47 19.048 -1.158 2.230 309 HG1 THR 47 HG1 THR 47 21.032 -1.992 1.754 310 HG21 THR 47 1HG2 THR 47 19.010 -3.421 2.892 311 HG22 THR 47 2HG2 THR 47 18.862 -3.989 1.229 312 HG23 THR 47 3HG2 THR 47 17.504 -3.177 2.008 313 H GLY 48 H GLY 48 16.523 -2.538 -1.205 314 HA2 GLY 48 2HA GLY 48 16.573 -3.896 -3.055 315 HA3 GLY 48 3HA GLY 48 17.960 -2.941 -3.558 316 H LYS 49 H LYS 49 17.782 -4.940 -0.663 317 HA LYS 49 HA LYS 49 19.831 -6.697 -1.849 318 HB2 LYS 49 2HB LYS 49 19.505 -5.834 1.031 319 HB3 LYS 49 3HB LYS 49 20.672 -7.025 0.469 320 HG2 LYS 49 2HG LYS 49 20.670 -4.077 0.165 321 HG3 LYS 49 3HG LYS 49 21.999 -5.181 0.524 322 HD2 LYS 49 2HD LYS 49 21.579 -6.018 -1.915 323 HD3 LYS 49 3HD LYS 49 20.793 -4.449 -2.112 324 HE2 LYS 49 2HE LYS 49 22.813 -3.604 -2.512 325 HE3 LYS 49 3HE LYS 49 23.177 -3.873 -0.808 326 HZ1 LYS 49 1HZ LYS 49 24.852 -5.066 -1.705 327 HZ2 LYS 49 2HZ LYS 49 24.030 -5.379 -3.150 328 HZ3 LYS 49 3HZ LYS 49 23.678 -6.283 -1.764 329 H CYS 50 H CYS 50 19.685 -8.900 -1.498 330 HA CYS 50 HA CYS 50 17.276 -9.859 -0.107 331 HB2 CYS 50 2HB CYS 50 17.267 -9.810 -2.745 332 HB3 CYS 50 3HB CYS 50 18.234 -11.271 -2.563 333 H GLN 51 H GLN 51 17.566 -11.578 1.196 334 HA GLN 51 HA GLN 51 20.059 -13.109 0.973 335 HB2 GLN 51 2HB GLN 51 19.033 -12.347 3.681 336 HB3 GLN 51 3HB GLN 51 20.653 -12.836 3.205 337 HG2 GLN 51 2HG GLN 51 21.163 -10.677 3.313 338 HG3 GLN 51 3HG GLN 51 20.293 -10.522 1.787 339 HE21 GLN 51 1HE2 GLN 51 17.707 -11.053 2.962 340 HE22 GLN 51 2HE2 GLN 51 17.267 -9.637 3.848 341 H ARG 52 H ARG 52 19.979 -15.091 2.431 342 HA ARG 52 HA ARG 52 17.388 -16.370 2.030 343 HB2 ARG 52 2HB ARG 52 20.186 -17.270 2.218 344 HB3 ARG 52 3HB ARG 52 19.019 -18.333 2.994 345 HG2 ARG 52 2HG ARG 52 18.572 -17.367 0.199 346 HG3 ARG 52 3HG ARG 52 19.639 -18.735 0.526 347 HD2 ARG 52 2HD ARG 52 17.929 -20.093 1.167 348 HD3 ARG 52 3HD ARG 52 16.970 -18.761 1.810 349 HE ARG 52 HE ARG 52 15.870 -18.736 -0.177 350 HH11 ARG 52 1HH1 ARG 52 19.077 -19.974 -0.727 351 HH12 ARG 52 2HH1 ARG 52 18.822 -20.248 -2.418 352 HH21 ARG 52 1HH2 ARG 52 15.522 -19.092 -2.403 353 HH22 ARG 52 2HH2 ARG 52 16.800 -19.746 -3.371 354 H MET 53 H MET 53 16.525 -17.802 3.716 355 HA MET 53 HA MET 53 16.746 -16.519 6.331 356 HB2 MET 53 2HB MET 53 14.756 -18.586 5.379 357 HB3 MET 53 3HB MET 53 14.671 -17.667 6.876 358 HG2 MET 53 2HG MET 53 14.782 -15.643 5.136 359 HG3 MET 53 3HG MET 53 14.026 -16.862 4.113 360 HE1 MET 53 1HE MET 53 14.207 -15.830 7.638 361 HE2 MET 53 2HE MET 53 12.887 -14.662 7.694 362 HE3 MET 53 3HE MET 53 12.640 -16.302 8.295 Start of MODEL 15 1 H1 GLY 1 H GLY 1 3.524 1.866 -1.702 2 HA2 GLY 1 2HA GLY 1 2.526 -0.114 -0.307 3 HA3 GLY 1 3HA GLY 1 2.525 -0.883 -1.887 4 H SER 2 H SER 2 3.977 -1.652 0.518 5 HA SER 2 HA SER 2 6.751 -1.253 -0.383 6 HB2 SER 2 2HB SER 2 5.827 -2.201 2.337 7 HB3 SER 2 3HB SER 2 7.463 -1.734 1.872 8 HG SER 2 HG SER 2 6.503 -0.014 2.928 9 H LYS 3 H LYS 3 4.269 -3.589 0.239 10 HA LYS 3 HA LYS 3 6.127 -5.738 -0.550 11 HB2 LYS 3 2HB LYS 3 4.981 -7.277 0.844 12 HB3 LYS 3 3HB LYS 3 5.258 -5.845 1.827 13 HG2 LYS 3 2HG LYS 3 2.741 -5.582 0.520 14 HG3 LYS 3 3HG LYS 3 2.822 -7.164 1.300 15 HD2 LYS 3 2HD LYS 3 3.296 -6.180 3.418 16 HD3 LYS 3 3HD LYS 3 3.537 -4.589 2.693 17 HE2 LYS 3 2HE LYS 3 1.340 -4.144 2.666 18 HE3 LYS 3 3HE LYS 3 0.925 -5.767 2.114 19 HZ1 LYS 3 1HZ LYS 3 0.589 -4.721 4.652 20 HZ2 LYS 3 2HZ LYS 3 1.842 -5.849 4.788 21 HZ3 LYS 3 3HZ LYS 3 0.343 -6.322 4.163 22 H LYS 4 H LYS 4 3.201 -4.073 -1.171 23 HA LYS 4 HA LYS 4 1.810 -6.054 -2.628 24 HB2 LYS 4 2HB LYS 4 1.635 -3.101 -3.186 25 HB3 LYS 4 3HB LYS 4 0.377 -4.319 -3.352 26 HG2 LYS 4 2HG LYS 4 1.530 -3.252 -0.785 27 HG3 LYS 4 3HG LYS 4 -0.084 -2.953 -1.435 28 HD2 LYS 4 2HD LYS 4 0.243 -5.751 -1.327 29 HD3 LYS 4 3HD LYS 4 0.833 -5.113 0.209 30 HE2 LYS 4 2HE LYS 4 -1.223 -4.179 0.752 31 HE3 LYS 4 3HE LYS 4 -1.772 -4.169 -0.923 32 HZ1 LYS 4 1HZ LYS 4 -2.929 -5.945 -0.165 33 HZ2 LYS 4 2HZ LYS 4 -1.798 -6.340 1.029 34 HZ3 LYS 4 3HZ LYS 4 -1.507 -6.760 -0.584 35 HA PRO 5 HA PRO 5 3.903 -4.010 -6.500 36 HB2 PRO 5 2HB PRO 5 6.137 -2.543 -6.020 37 HB3 PRO 5 3HB PRO 5 4.515 -1.842 -6.049 38 HG2 PRO 5 2HG PRO 5 6.182 -2.661 -3.701 39 HG3 PRO 5 3HG PRO 5 5.193 -1.205 -3.918 40 HD2 PRO 5 2HD PRO 5 4.348 -3.339 -2.481 41 HD3 PRO 5 3HD PRO 5 3.235 -2.305 -3.399 42 H VAL 6 H VAL 6 6.116 -4.806 -3.836 43 HA VAL 6 HA VAL 6 7.652 -6.507 -5.683 44 HB VAL 6 HB VAL 6 9.103 -4.935 -4.649 45 HG11 VAL 6 1HG1 VAL 6 7.699 -4.199 -2.830 46 HG12 VAL 6 2HG1 VAL 6 7.865 -5.761 -2.026 47 HG13 VAL 6 3HG1 VAL 6 9.265 -4.700 -2.192 48 HG21 VAL 6 1HG2 VAL 6 9.254 -7.675 -3.432 49 HG22 VAL 6 2HG2 VAL 6 10.186 -7.011 -4.774 50 HG23 VAL 6 3HG2 VAL 6 10.490 -6.454 -3.129 51 HA PRO 7 HA PRO 7 5.630 -9.902 -3.596 52 HB2 PRO 7 2HB PRO 7 6.813 -11.850 -5.071 53 HB3 PRO 7 3HB PRO 7 5.461 -10.880 -5.668 54 HG2 PRO 7 2HG PRO 7 8.392 -10.574 -6.196 55 HG3 PRO 7 3HG PRO 7 7.033 -10.453 -7.328 56 HD2 PRO 7 2HD PRO 7 8.260 -8.276 -6.286 57 HD3 PRO 7 3HD PRO 7 6.532 -8.295 -6.691 58 H ILE 8 H ILE 8 7.369 -8.921 -1.913 59 HA ILE 8 HA ILE 8 9.503 -10.887 -1.488 60 HB ILE 8 HB ILE 8 9.927 -9.130 0.490 61 HG12 ILE 8 2HG1 ILE 8 8.523 -7.578 -1.692 62 HG13 ILE 8 3HG1 ILE 8 8.044 -7.702 -0.002 63 HG21 ILE 8 1HG2 ILE 8 11.814 -8.845 -0.650 64 HG22 ILE 8 2HG2 ILE 8 11.076 -9.753 -1.968 65 HG23 ILE 8 3HG2 ILE 8 10.974 -7.993 -1.945 66 HD11 ILE 8 1HD1 ILE 8 9.030 -5.636 -0.059 67 HD12 ILE 8 2HD1 ILE 8 10.386 -6.649 0.438 68 HD13 ILE 8 3HD1 ILE 8 10.244 -6.126 -1.240 69 H ILE 9 H ILE 9 8.767 -12.620 -0.420 70 HA ILE 9 HA ILE 9 7.265 -12.150 2.070 71 HB ILE 9 HB ILE 9 6.317 -14.515 1.620 72 HG12 ILE 9 2HG1 ILE 9 5.995 -14.942 -0.833 73 HG13 ILE 9 3HG1 ILE 9 7.164 -13.667 -1.156 74 HG21 ILE 9 1HG2 ILE 9 4.600 -13.073 1.595 75 HG22 ILE 9 2HG2 ILE 9 5.486 -11.884 0.642 76 HG23 ILE 9 3HG2 ILE 9 4.695 -13.242 -0.157 77 HD11 ILE 9 1HD1 ILE 9 8.916 -14.963 -0.620 78 HD12 ILE 9 2HD1 ILE 9 8.058 -15.770 0.692 79 HD13 ILE 9 3HD1 ILE 9 7.788 -16.270 -0.978 80 H TYR 10 H TYR 10 7.300 -14.379 3.364 81 HA TYR 10 HA TYR 10 9.771 -15.835 3.171 82 HB2 TYR 10 2HB TYR 10 10.152 -15.073 5.732 83 HB3 TYR 10 3HB TYR 10 10.936 -14.292 4.363 84 HD1 TYR 10 HD1 TYR 10 11.227 -12.186 5.511 85 HD2 TYR 10 HD2 TYR 10 7.352 -13.878 5.036 86 HE1 TYR 10 HE1 TYR 10 10.216 -10.038 6.156 87 HE2 TYR 10 HE2 TYR 10 6.331 -11.734 5.678 88 HH TYR 10 HH TYR 10 8.261 -9.060 6.859 89 H CYS 11 H CYS 11 8.904 -17.798 3.386 90 HA CYS 11 HA CYS 11 6.774 -18.274 5.310 91 HB2 CYS 11 2HB CYS 11 8.079 -20.250 3.431 92 HB3 CYS 11 3HB CYS 11 6.547 -20.442 4.277 93 H ASN 12 H ASN 12 7.411 -18.534 7.353 94 HA ASN 12 HA ASN 12 9.966 -19.718 8.000 95 HB2 ASN 12 2HB ASN 12 7.742 -18.856 9.861 96 HB3 ASN 12 3HB ASN 12 9.410 -19.198 10.308 97 HD21 ASN 12 1HD2 ASN 12 10.313 -17.907 7.763 98 HD22 ASN 12 2HD2 ASN 12 10.231 -16.211 8.084 99 H ARG 13 H ARG 13 9.950 -21.865 7.487 100 HA ARG 13 HA ARG 13 7.922 -23.695 7.686 101 HB2 ARG 13 2HB ARG 13 10.840 -24.205 8.294 102 HB3 ARG 13 3HB ARG 13 9.650 -25.425 7.858 103 HG2 ARG 13 2HG ARG 13 10.515 -23.143 6.094 104 HG3 ARG 13 3HG ARG 13 11.108 -24.802 5.983 105 HD2 ARG 13 2HD ARG 13 8.317 -23.792 5.487 106 HD3 ARG 13 3HD ARG 13 9.413 -24.556 4.336 107 HE ARG 13 HE ARG 13 9.072 -26.448 6.251 108 HH11 ARG 13 1HH1 ARG 13 6.893 -24.565 4.295 109 HH12 ARG 13 2HH1 ARG 13 5.663 -25.784 4.259 110 HH21 ARG 13 1HH2 ARG 13 7.460 -28.061 6.212 111 HH22 ARG 13 2HH2 ARG 13 5.986 -27.773 5.351 112 H ARG 14 H ARG 14 10.015 -22.500 10.247 113 HA ARG 14 HA ARG 14 9.609 -24.273 12.275 114 HB2 ARG 14 2HB ARG 14 9.565 -22.141 13.776 115 HB3 ARG 14 3HB ARG 14 11.005 -22.514 12.838 116 HG2 ARG 14 2HG ARG 14 9.155 -20.884 11.332 117 HG3 ARG 14 3HG ARG 14 9.603 -20.125 12.861 118 HD2 ARG 14 2HD ARG 14 11.261 -19.374 11.435 119 HD3 ARG 14 3HD ARG 14 12.020 -20.778 12.186 120 HE ARG 14 HE ARG 14 10.667 -21.129 9.617 121 HH11 ARG 14 1HH1 ARG 14 13.617 -20.952 11.456 122 HH12 ARG 14 2HH1 ARG 14 14.590 -21.662 10.210 123 HH21 ARG 14 1HH2 ARG 14 11.936 -22.065 7.969 124 HH22 ARG 14 2HH2 ARG 14 13.633 -22.293 8.226 125 H THR 15 H THR 15 7.361 -21.809 11.130 126 HA THR 15 HA THR 15 5.291 -22.989 12.868 127 HB THR 15 HB THR 15 5.320 -20.873 13.729 128 HG1 THR 15 HG1 THR 15 3.347 -20.416 13.142 129 HG21 THR 15 1HG2 THR 15 7.036 -19.753 12.692 130 HG22 THR 15 2HG2 THR 15 5.656 -18.856 12.058 131 HG23 THR 15 3HG2 THR 15 6.428 -20.099 11.073 132 H GLY 16 H GLY 16 6.320 -23.003 9.812 133 HA2 GLY 16 2HA GLY 16 5.351 -23.351 7.757 134 HA3 GLY 16 3HA GLY 16 4.050 -24.092 8.678 135 H LYS 17 H LYS 17 5.203 -20.745 8.244 136 HA LYS 17 HA LYS 17 2.568 -20.035 7.178 137 HB2 LYS 17 2HB LYS 17 2.628 -17.952 8.611 138 HB3 LYS 17 3HB LYS 17 2.313 -19.456 9.467 139 HG2 LYS 17 2HG LYS 17 3.826 -18.356 10.835 140 HG3 LYS 17 3HG LYS 17 4.839 -19.484 9.931 141 HD2 LYS 17 2HD LYS 17 5.727 -17.798 8.589 142 HD3 LYS 17 3HD LYS 17 4.407 -16.683 8.952 143 HE2 LYS 17 2HE LYS 17 6.574 -17.578 10.851 144 HE3 LYS 17 3HE LYS 17 6.445 -15.996 10.085 145 HZ1 LYS 17 1HZ LYS 17 4.030 -16.431 11.346 146 HZ2 LYS 17 2HZ LYS 17 5.252 -15.364 11.824 147 HZ3 LYS 17 3HZ LYS 17 5.207 -16.933 12.453 148 H CYS 18 H CYS 18 2.540 -17.995 6.030 149 HA CYS 18 HA CYS 18 5.193 -17.014 5.233 150 HB2 CYS 18 2HB CYS 18 2.961 -17.457 3.252 151 HB3 CYS 18 3HB CYS 18 4.645 -17.069 2.916 152 H GLN 19 H GLN 19 5.341 -14.846 4.882 153 HA GLN 19 HA GLN 19 2.886 -13.255 4.834 154 HB2 GLN 19 2HB GLN 19 5.148 -12.464 6.650 155 HB3 GLN 19 3HB GLN 19 3.494 -11.867 6.633 156 HG2 GLN 19 2HG GLN 19 3.056 -13.275 8.279 157 HG3 GLN 19 3HG GLN 19 3.254 -14.591 7.123 158 HE21 GLN 19 1HE2 GLN 19 6.035 -14.269 6.703 159 HE22 GLN 19 2HE2 GLN 19 6.847 -14.771 8.143 160 H ARG 20 H ARG 20 3.409 -10.896 4.400 161 HA ARG 20 HA ARG 20 5.462 -10.802 2.312 162 HB2 ARG 20 2HB ARG 20 2.851 -9.509 2.734 163 HB3 ARG 20 3HB ARG 20 4.097 -8.449 2.089 164 HG2 ARG 20 2HG ARG 20 3.585 -11.124 0.855 165 HG3 ARG 20 3HG ARG 20 2.578 -9.731 0.456 166 HD2 ARG 20 2HD ARG 20 4.267 -8.648 -0.634 167 HD3 ARG 20 3HD ARG 20 5.524 -9.386 0.358 168 HE ARG 20 HE ARG 20 5.756 -10.939 -1.283 169 HH11 ARG 20 1HH1 ARG 20 2.487 -9.744 -1.374 170 HH12 ARG 20 2HH1 ARG 20 2.033 -10.711 -2.738 171 HH21 ARG 20 1HH2 ARG 20 5.169 -12.218 -3.079 172 HH22 ARG 20 2HH2 ARG 20 3.559 -12.119 -3.706 173 H MET 21 H MET 21 6.725 -8.806 2.073 174 HA MET 21 HA MET 21 7.749 -7.959 4.652 175 HB2 MET 21 2HB MET 21 8.682 -7.399 1.833 176 HB3 MET 21 3HB MET 21 9.501 -6.825 3.279 177 HG2 MET 21 2HG MET 21 9.468 -9.382 3.901 178 HG3 MET 21 3HG MET 21 9.329 -9.566 2.154 179 HE1 MET 21 1HE MET 21 11.885 -6.869 4.274 180 HE2 MET 21 2HE MET 21 11.068 -8.205 5.085 181 HE3 MET 21 3HE MET 21 12.788 -8.319 4.713 182 H1 GLY 33 H GLY 33 23.639 -21.283 4.790 183 HA2 GLY 33 2HA GLY 33 23.335 -22.527 2.886 184 HA3 GLY 33 3HA GLY 33 23.886 -23.899 3.837 185 H SER 34 H SER 34 21.106 -22.241 4.983 186 HA SER 34 HA SER 34 19.488 -24.585 4.615 187 HB2 SER 34 2HB SER 34 19.494 -22.499 6.424 188 HB3 SER 34 3HB SER 34 18.072 -22.159 5.439 189 HG SER 34 HG SER 34 18.655 -24.562 6.831 190 H LYS 35 H LYS 35 20.221 -21.939 2.694 191 HA LYS 35 HA LYS 35 17.860 -21.227 1.454 192 HB2 LYS 35 2HB LYS 35 19.288 -20.772 -0.568 193 HB3 LYS 35 3HB LYS 35 19.858 -20.037 0.925 194 HG2 LYS 35 2HG LYS 35 20.994 -22.671 0.495 195 HG3 LYS 35 3HG LYS 35 21.346 -21.556 -0.828 196 HD2 LYS 35 2HD LYS 35 21.814 -20.961 2.093 197 HD3 LYS 35 3HD LYS 35 23.055 -21.524 0.971 198 HE2 LYS 35 2HE LYS 35 21.790 -19.330 -0.259 199 HE3 LYS 35 3HE LYS 35 22.080 -18.865 1.416 200 HZ1 LYS 35 1HZ LYS 35 24.122 -19.909 -0.472 201 HZ2 LYS 35 2HZ LYS 35 24.405 -19.481 1.140 202 HZ3 LYS 35 3HZ LYS 35 23.957 -18.298 0.016 203 H LYS 36 H LYS 36 19.741 -24.144 1.107 204 HA LYS 36 HA LYS 36 18.503 -25.065 -1.285 205 HB2 LYS 36 2HB LYS 36 20.329 -26.183 0.763 206 HB3 LYS 36 3HB LYS 36 19.370 -27.349 -0.139 207 HG2 LYS 36 2HG LYS 36 20.591 -27.091 -1.987 208 HG3 LYS 36 3HG LYS 36 20.622 -25.333 -1.832 209 HD2 LYS 36 2HD LYS 36 22.331 -25.663 0.009 210 HD3 LYS 36 3HD LYS 36 22.425 -27.349 -0.508 211 HE2 LYS 36 2HE LYS 36 22.887 -24.992 -2.329 212 HE3 LYS 36 3HE LYS 36 24.174 -25.856 -1.490 213 HZ1 LYS 36 1HZ LYS 36 22.761 -26.572 -3.867 214 HZ2 LYS 36 2HZ LYS 36 22.734 -27.818 -2.724 215 HZ3 LYS 36 3HZ LYS 36 24.212 -27.187 -3.251 216 HA PRO 37 HA PRO 37 15.838 -27.832 1.630 217 HB2 PRO 37 2HB PRO 37 16.010 -27.383 4.302 218 HB3 PRO 37 3HB PRO 37 17.066 -28.514 3.447 219 HG2 PRO 37 2HG PRO 37 17.607 -25.697 4.305 220 HG3 PRO 37 3HG PRO 37 18.660 -27.120 4.410 221 HD2 PRO 37 2HD PRO 37 18.918 -25.259 2.461 222 HD3 PRO 37 3HD PRO 37 19.289 -26.974 2.198 223 H VAL 38 H VAL 38 16.338 -24.708 3.288 224 HA VAL 38 HA VAL 38 13.470 -24.147 2.891 225 HB VAL 38 HB VAL 38 14.062 -24.563 5.278 226 HG11 VAL 38 1HG1 VAL 38 15.616 -23.366 6.432 227 HG12 VAL 38 2HG1 VAL 38 16.355 -23.300 4.830 228 HG13 VAL 38 3HG1 VAL 38 15.418 -21.929 5.428 229 HG21 VAL 38 1HG2 VAL 38 12.887 -22.624 6.152 230 HG22 VAL 38 2HG2 VAL 38 13.204 -21.736 4.661 231 HG23 VAL 38 3HG2 VAL 38 12.154 -23.152 4.637 232 HA PRO 39 HA PRO 39 15.703 -20.877 0.602 233 HB2 PRO 39 2HB PRO 39 13.712 -20.501 -1.205 234 HB3 PRO 39 3HB PRO 39 14.927 -21.775 -1.366 235 HG2 PRO 39 2HG PRO 39 12.123 -21.952 -0.332 236 HG3 PRO 39 3HG PRO 39 12.988 -23.056 -1.417 237 HD2 PRO 39 2HD PRO 39 12.668 -23.561 1.224 238 HD3 PRO 39 3HD PRO 39 14.100 -24.090 0.317 239 H ILE 40 H ILE 40 14.977 -19.985 2.909 240 HA ILE 40 HA ILE 40 12.761 -18.090 2.567 241 HB ILE 40 HB ILE 40 13.282 -17.702 5.100 242 HG12 ILE 40 2HG1 ILE 40 14.611 -20.347 4.517 243 HG13 ILE 40 3HG1 ILE 40 15.295 -18.948 5.338 244 HG21 ILE 40 1HG2 ILE 40 11.230 -18.694 4.125 245 HG22 ILE 40 2HG2 ILE 40 12.001 -20.277 4.201 246 HG23 ILE 40 3HG2 ILE 40 11.668 -19.387 5.686 247 HD11 ILE 40 1HD1 ILE 40 13.857 -19.319 7.238 248 HD12 ILE 40 2HD1 ILE 40 13.065 -20.660 6.408 249 HD13 ILE 40 3HD1 ILE 40 14.763 -20.786 6.869 250 H ILE 41 H ILE 41 13.377 -16.196 1.758 251 HA ILE 41 HA ILE 41 15.736 -14.889 2.928 252 HB ILE 41 HB ILE 41 16.001 -13.828 0.568 253 HG12 ILE 41 2HG1 ILE 41 15.452 -15.479 -1.240 254 HG13 ILE 41 3HG1 ILE 41 14.525 -16.393 -0.055 255 HG21 ILE 41 1HG2 ILE 41 17.222 -16.173 -0.047 256 HG22 ILE 41 2HG2 ILE 41 17.875 -14.963 1.057 257 HG23 ILE 41 3HG2 ILE 41 16.991 -16.350 1.692 258 HD11 ILE 41 1HD1 ILE 41 12.786 -14.997 -0.170 259 HD12 ILE 41 2HD1 ILE 41 13.811 -13.562 -0.219 260 HD13 ILE 41 3HD1 ILE 41 13.513 -14.484 -1.692 261 H TYR 42 H TYR 42 15.728 -12.473 2.039 262 HA TYR 42 HA TYR 42 13.090 -11.341 1.757 263 HB2 TYR 42 2HB TYR 42 13.785 -9.808 3.854 264 HB3 TYR 42 3HB TYR 42 12.790 -11.252 4.011 265 HD1 TYR 42 HD1 TYR 42 16.380 -11.454 3.280 266 HD2 TYR 42 HD2 TYR 42 13.407 -11.628 6.318 267 HE1 TYR 42 HE1 TYR 42 18.029 -12.417 4.830 268 HE2 TYR 42 HE2 TYR 42 15.048 -12.591 7.877 269 HH TYR 42 HH TYR 42 18.403 -13.194 6.871 270 H CYS 43 H CYS 43 13.685 -10.241 -0.039 271 HA CYS 43 HA CYS 43 16.119 -8.640 -0.027 272 HB2 CYS 43 2HB CYS 43 14.206 -8.592 -2.314 273 HB3 CYS 43 3HB CYS 43 15.966 -8.579 -2.323 274 H ASN 44 H ASN 44 15.987 -6.725 0.945 275 HA ASN 44 HA ASN 44 13.508 -5.267 1.114 276 HB2 ASN 44 2HB ASN 44 16.265 -4.318 1.910 277 HB3 ASN 44 3HB ASN 44 14.717 -3.700 2.477 278 HD21 ASN 44 1HD2 ASN 44 13.564 -6.374 2.696 279 HD22 ASN 44 2HD2 ASN 44 14.258 -7.074 4.115 280 H ARG 45 H ARG 45 12.874 -4.556 -0.874 281 HA ARG 45 HA ARG 45 14.334 -3.668 -2.991 282 HB2 ARG 45 2HB ARG 45 11.708 -2.572 -1.973 283 HB3 ARG 45 3HB ARG 45 12.378 -2.208 -3.558 284 HG2 ARG 45 2HG ARG 45 11.592 -4.934 -2.549 285 HG3 ARG 45 3HG ARG 45 10.695 -3.946 -3.704 286 HD2 ARG 45 2HD ARG 45 13.381 -5.252 -4.061 287 HD3 ARG 45 3HD ARG 45 11.901 -5.537 -4.977 288 HE ARG 45 HE ARG 45 13.811 -3.417 -5.372 289 HH11 ARG 45 1HH1 ARG 45 10.534 -4.475 -5.885 290 HH12 ARG 45 2HH1 ARG 45 10.271 -3.431 -7.242 291 HH21 ARG 45 1HH2 ARG 45 13.477 -2.038 -7.158 292 HH22 ARG 45 2HH2 ARG 45 11.946 -2.045 -7.966 293 H ARG 46 H ARG 46 13.509 -1.855 -0.084 294 HA ARG 46 HA ARG 46 14.181 0.706 -0.775 295 HB2 ARG 46 2HB ARG 46 15.054 0.864 1.655 296 HB3 ARG 46 3HB ARG 46 13.365 0.448 1.393 297 HG2 ARG 46 2HG ARG 46 14.991 -1.924 1.469 298 HG3 ARG 46 3HG ARG 46 15.237 -0.943 2.915 299 HD2 ARG 46 2HD ARG 46 13.420 -2.096 3.623 300 HD3 ARG 46 3HD ARG 46 12.575 -0.809 2.764 301 HE ARG 46 HE ARG 46 13.167 -3.030 1.071 302 HH11 ARG 46 1HH1 ARG 46 10.961 -1.850 3.492 303 HH12 ARG 46 2HH1 ARG 46 9.641 -2.835 2.956 304 HH21 ARG 46 1HH2 ARG 46 11.436 -4.333 0.356 305 HH22 ARG 46 2HH2 ARG 46 9.912 -4.248 1.173 306 H THR 47 H THR 47 16.372 -1.926 0.105 307 HA THR 47 HA THR 47 18.618 -0.265 -0.838 308 HB THR 47 HB THR 47 18.801 -0.640 1.573 309 HG1 THR 47 HG1 THR 47 20.725 -0.642 0.281 310 HG21 THR 47 1HG2 THR 47 19.464 -3.336 1.810 311 HG22 THR 47 2HG2 THR 47 17.996 -3.319 0.832 312 HG23 THR 47 3HG2 THR 47 18.009 -2.549 2.418 313 H GLY 48 H GLY 48 16.722 -2.584 -1.876 314 HA2 GLY 48 2HA GLY 48 16.922 -4.419 -3.254 315 HA3 GLY 48 3HA GLY 48 18.296 -3.538 -3.904 316 H LYS 49 H LYS 49 18.009 -4.854 -0.645 317 HA LYS 49 HA LYS 49 20.269 -6.640 -1.264 318 HB2 LYS 49 2HB LYS 49 19.494 -5.266 1.311 319 HB3 LYS 49 3HB LYS 49 20.714 -6.530 1.222 320 HG2 LYS 49 2HG LYS 49 20.845 -3.710 0.399 321 HG3 LYS 49 3HG LYS 49 22.106 -4.778 1.019 322 HD2 LYS 49 2HD LYS 49 22.037 -5.934 -1.238 323 HD3 LYS 49 3HD LYS 49 21.050 -4.580 -1.793 324 HE2 LYS 49 2HE LYS 49 23.127 -3.828 -2.381 325 HE3 LYS 49 3HE LYS 49 23.011 -3.163 -0.753 326 HZ1 LYS 49 1HZ LYS 49 24.629 -4.498 -0.008 327 HZ2 LYS 49 2HZ LYS 49 25.052 -4.656 -1.638 328 HZ3 LYS 49 3HZ LYS 49 24.098 -5.838 -0.894 329 H CYS 50 H CYS 50 20.012 -8.770 -1.011 330 HA CYS 50 HA CYS 50 17.647 -9.717 0.471 331 HB2 CYS 50 2HB CYS 50 17.705 -9.890 -2.154 332 HB3 CYS 50 3HB CYS 50 18.750 -11.271 -1.838 333 H GLN 51 H GLN 51 17.951 -11.341 1.898 334 HA GLN 51 HA GLN 51 20.468 -12.827 1.859 335 HB2 GLN 51 2HB GLN 51 19.505 -11.714 4.468 336 HB3 GLN 51 3HB GLN 51 21.110 -12.283 4.030 337 HG2 GLN 51 2HG GLN 51 21.622 -10.121 3.885 338 HG3 GLN 51 3HG GLN 51 20.793 -10.184 2.331 339 HE21 GLN 51 1HE2 GLN 51 18.176 -10.541 3.532 340 HE22 GLN 51 2HE2 GLN 51 17.725 -9.005 4.181 341 H ARG 52 H ARG 52 20.423 -14.605 3.563 342 HA ARG 52 HA ARG 52 17.888 -15.990 3.306 343 HB2 ARG 52 2HB ARG 52 20.683 -16.733 3.902 344 HB3 ARG 52 3HB ARG 52 19.460 -17.691 4.724 345 HG2 ARG 52 2HG ARG 52 19.471 -17.231 1.754 346 HG3 ARG 52 3HG ARG 52 20.260 -18.604 2.532 347 HD2 ARG 52 2HD ARG 52 17.396 -18.051 2.100 348 HD3 ARG 52 3HD ARG 52 18.260 -19.587 2.149 349 HE ARG 52 HE ARG 52 16.824 -18.413 4.269 350 HH11 ARG 52 1HH1 ARG 52 19.788 -20.123 3.625 351 HH12 ARG 52 2HH1 ARG 52 19.885 -20.815 5.210 352 HH21 ARG 52 1HH2 ARG 52 16.941 -19.319 6.359 353 HH22 ARG 52 2HH2 ARG 52 18.265 -20.358 6.764 354 H MET 53 H MET 53 16.749 -16.919 5.073 355 HA MET 53 HA MET 53 16.769 -15.226 7.426 356 HB2 MET 53 2HB MET 53 14.946 -17.528 6.708 357 HB3 MET 53 3HB MET 53 14.702 -16.392 8.028 358 HG2 MET 53 2HG MET 53 14.914 -14.686 5.952 359 HG3 MET 53 3HG MET 53 14.210 -16.087 5.148 360 HE1 MET 53 1HE MET 53 12.896 -13.274 8.207 361 HE2 MET 53 2HE MET 53 12.651 -14.779 9.091 362 HE3 MET 53 3HE MET 53 14.236 -14.402 8.415 Start of MODEL 16 1 H1 GLY 1 H GLY 1 3.186 1.548 -1.761 2 HA2 GLY 1 2HA GLY 1 2.089 -0.627 -0.339 3 HA3 GLY 1 3HA GLY 1 2.214 -1.060 -2.038 4 H SER 2 H SER 2 3.645 -1.918 0.510 5 HA SER 2 HA SER 2 6.400 -1.390 -0.386 6 HB2 SER 2 2HB SER 2 5.214 -1.926 2.316 7 HB3 SER 2 3HB SER 2 6.905 -2.322 2.010 8 HG SER 2 HG SER 2 7.273 -0.292 2.356 9 H LYS 3 H LYS 3 4.018 -3.827 0.213 10 HA LYS 3 HA LYS 3 5.968 -5.895 -0.569 11 HB2 LYS 3 2HB LYS 3 4.860 -7.490 0.806 12 HB3 LYS 3 3HB LYS 3 5.114 -6.061 1.799 13 HG2 LYS 3 2HG LYS 3 2.581 -5.841 0.518 14 HG3 LYS 3 3HG LYS 3 2.703 -7.429 1.278 15 HD2 LYS 3 2HD LYS 3 3.206 -6.444 3.403 16 HD3 LYS 3 3HD LYS 3 3.342 -4.838 2.682 17 HE2 LYS 3 2HE LYS 3 1.033 -4.692 2.305 18 HE3 LYS 3 3HE LYS 3 0.801 -6.426 2.517 19 HZ1 LYS 3 1HZ LYS 3 1.585 -4.539 4.672 20 HZ2 LYS 3 2HZ LYS 3 1.277 -6.192 4.855 21 HZ3 LYS 3 3HZ LYS 3 0.023 -5.141 4.429 22 H LYS 4 H LYS 4 2.973 -4.356 -1.194 23 HA LYS 4 HA LYS 4 1.667 -6.384 -2.658 24 HB2 LYS 4 2HB LYS 4 1.387 -3.442 -3.227 25 HB3 LYS 4 3HB LYS 4 0.175 -4.705 -3.391 26 HG2 LYS 4 2HG LYS 4 1.280 -3.583 -0.826 27 HG3 LYS 4 3HG LYS 4 -0.343 -3.351 -1.481 28 HD2 LYS 4 2HD LYS 4 0.088 -6.132 -1.359 29 HD3 LYS 4 3HD LYS 4 0.656 -5.467 0.174 30 HE2 LYS 4 2HE LYS 4 -1.534 -5.708 0.715 31 HE3 LYS 4 3HE LYS 4 -1.634 -4.117 -0.038 32 HZ1 LYS 4 1HZ LYS 4 -2.811 -6.577 -0.859 33 HZ2 LYS 4 2HZ LYS 4 -1.896 -5.894 -2.107 34 HZ3 LYS 4 3HZ LYS 4 -3.140 -5.003 -1.384 35 HA PRO 5 HA PRO 5 3.696 -4.278 -6.529 36 HB2 PRO 5 2HB PRO 5 5.862 -2.713 -6.048 37 HB3 PRO 5 3HB PRO 5 4.211 -2.083 -6.089 38 HG2 PRO 5 2HG PRO 5 5.901 -2.815 -3.729 39 HG3 PRO 5 3HG PRO 5 4.851 -1.404 -3.959 40 HD2 PRO 5 2HD PRO 5 4.092 -3.564 -2.512 41 HD3 PRO 5 3HD PRO 5 2.940 -2.584 -3.442 42 H VAL 6 H VAL 6 5.929 -4.960 -3.851 43 HA VAL 6 HA VAL 6 7.561 -6.586 -5.680 44 HB VAL 6 HB VAL 6 8.917 -4.960 -4.596 45 HG11 VAL 6 1HG1 VAL 6 9.024 -4.748 -2.140 46 HG12 VAL 6 2HG1 VAL 6 7.435 -4.334 -2.788 47 HG13 VAL 6 3HG1 VAL 6 7.690 -5.893 -2.003 48 HG21 VAL 6 1HG2 VAL 6 9.205 -7.656 -3.279 49 HG22 VAL 6 2HG2 VAL 6 9.991 -7.095 -4.754 50 HG23 VAL 6 3HG2 VAL 6 10.423 -6.383 -3.200 51 HA PRO 7 HA PRO 7 5.636 -10.083 -3.667 52 HB2 PRO 7 2HB PRO 7 6.903 -11.964 -5.159 53 HB3 PRO 7 3HB PRO 7 5.521 -11.035 -5.754 54 HG2 PRO 7 2HG PRO 7 8.443 -10.613 -6.251 55 HG3 PRO 7 3HG PRO 7 7.090 -10.524 -7.393 56 HD2 PRO 7 2HD PRO 7 8.227 -8.320 -6.308 57 HD3 PRO 7 3HD PRO 7 6.504 -8.397 -6.729 58 H ILE 8 H ILE 8 7.284 -9.095 -1.926 59 HA ILE 8 HA ILE 8 9.493 -10.984 -1.517 60 HB ILE 8 HB ILE 8 9.880 -9.252 0.471 61 HG12 ILE 8 2HG1 ILE 8 8.323 -7.727 -1.620 62 HG13 ILE 8 3HG1 ILE 8 7.964 -7.865 0.098 63 HG21 ILE 8 1HG2 ILE 8 11.728 -8.831 -0.695 64 HG22 ILE 8 2HG2 ILE 8 11.016 -9.768 -2.008 65 HG23 ILE 8 3HG2 ILE 8 10.819 -8.016 -1.969 66 HD11 ILE 8 1HD1 ILE 8 10.040 -6.227 -1.275 67 HD12 ILE 8 2HD1 ILE 8 8.862 -5.757 -0.049 68 HD13 ILE 8 3HD1 ILE 8 10.269 -6.718 0.403 69 H ILE 9 H ILE 9 8.778 -12.752 -0.486 70 HA ILE 9 HA ILE 9 7.251 -12.350 2.001 71 HB ILE 9 HB ILE 9 6.383 -14.745 1.509 72 HG12 ILE 9 2HG1 ILE 9 6.074 -15.130 -0.950 73 HG13 ILE 9 3HG1 ILE 9 7.191 -13.804 -1.249 74 HG21 ILE 9 1HG2 ILE 9 4.691 -13.525 -0.205 75 HG22 ILE 9 2HG2 ILE 9 4.644 -13.317 1.545 76 HG23 ILE 9 3HG2 ILE 9 5.466 -12.125 0.537 77 HD11 ILE 9 1HD1 ILE 9 8.985 -15.058 -0.800 78 HD12 ILE 9 2HD1 ILE 9 8.207 -15.869 0.559 79 HD13 ILE 9 3HD1 ILE 9 7.891 -16.411 -1.089 80 H TYR 10 H TYR 10 7.337 -14.586 3.276 81 HA TYR 10 HA TYR 10 9.819 -16.007 3.084 82 HB2 TYR 10 2HB TYR 10 10.280 -15.220 5.605 83 HB3 TYR 10 3HB TYR 10 10.979 -14.402 4.212 84 HD1 TYR 10 HD1 TYR 10 11.254 -12.331 5.474 85 HD2 TYR 10 HD2 TYR 10 7.412 -14.076 4.932 86 HE1 TYR 10 HE1 TYR 10 10.204 -10.223 6.182 87 HE2 TYR 10 HE2 TYR 10 6.351 -11.973 5.637 88 HH TYR 10 HH TYR 10 6.800 -9.986 6.806 89 H CYS 11 H CYS 11 9.016 -17.981 3.381 90 HA CYS 11 HA CYS 11 6.873 -18.444 5.288 91 HB2 CYS 11 2HB CYS 11 8.286 -20.487 3.569 92 HB3 CYS 11 3HB CYS 11 6.711 -20.640 4.340 93 H ASN 12 H ASN 12 7.441 -18.623 7.357 94 HA ASN 12 HA ASN 12 10.031 -19.582 8.159 95 HB2 ASN 12 2HB ASN 12 7.636 -19.040 9.922 96 HB3 ASN 12 3HB ASN 12 9.328 -19.095 10.407 97 HD21 ASN 12 1HD2 ASN 12 10.204 -17.669 8.010 98 HD22 ASN 12 2HD2 ASN 12 9.774 -16.015 8.261 99 H ARG 13 H ARG 13 10.297 -21.712 7.666 100 HA ARG 13 HA ARG 13 8.532 -23.774 7.658 101 HB2 ARG 13 2HB ARG 13 11.413 -23.767 8.553 102 HB3 ARG 13 3HB ARG 13 10.483 -25.244 8.336 103 HG2 ARG 13 2HG ARG 13 11.151 -23.209 6.221 104 HG3 ARG 13 3HG ARG 13 11.820 -24.834 6.382 105 HD2 ARG 13 2HD ARG 13 8.976 -24.079 5.735 106 HD3 ARG 13 3HD ARG 13 10.140 -24.867 4.671 107 HE ARG 13 HE ARG 13 8.521 -26.110 6.684 108 HH11 ARG 13 1HH1 ARG 13 11.495 -26.332 4.888 109 HH12 ARG 13 2HH1 ARG 13 11.627 -28.050 5.067 110 HH21 ARG 13 1HH2 ARG 13 8.684 -28.372 6.927 111 HH22 ARG 13 2HH2 ARG 13 10.027 -29.209 6.226 112 H ARG 14 H ARG 14 10.137 -22.401 10.486 113 HA ARG 14 HA ARG 14 9.562 -24.210 12.444 114 HB2 ARG 14 2HB ARG 14 9.216 -22.125 13.938 115 HB3 ARG 14 3HB ARG 14 10.772 -22.350 13.149 116 HG2 ARG 14 2HG ARG 14 8.985 -20.847 11.466 117 HG3 ARG 14 3HG ARG 14 9.138 -20.098 13.057 118 HD2 ARG 14 2HD ARG 14 10.943 -19.142 12.070 119 HD3 ARG 14 3HD ARG 14 11.709 -20.635 12.609 120 HE ARG 14 HE ARG 14 10.580 -20.843 9.985 121 HH11 ARG 14 1HH1 ARG 14 13.357 -19.793 11.803 122 HH12 ARG 14 2HH1 ARG 14 14.453 -19.955 10.472 123 HH21 ARG 14 1HH2 ARG 14 12.013 -21.061 8.224 124 HH22 ARG 14 2HH2 ARG 14 13.688 -20.675 8.436 125 H THR 15 H THR 15 7.356 -21.849 11.019 126 HA THR 15 HA THR 15 5.132 -23.212 12.394 127 HB THR 15 HB THR 15 5.419 -20.939 13.274 128 HG1 THR 15 HG1 THR 15 3.309 -20.818 13.343 129 HG21 THR 15 1HG2 THR 15 6.246 -19.438 11.816 130 HG22 THR 15 2HG2 THR 15 4.563 -19.215 11.334 131 HG23 THR 15 3HG2 THR 15 5.607 -20.302 10.418 132 H GLY 16 H GLY 16 6.560 -23.116 9.554 133 HA2 GLY 16 2HA GLY 16 5.914 -23.293 7.349 134 HA3 GLY 16 3HA GLY 16 4.560 -24.183 8.030 135 H LYS 17 H LYS 17 5.217 -20.764 8.544 136 HA LYS 17 HA LYS 17 2.733 -20.152 7.080 137 HB2 LYS 17 2HB LYS 17 3.965 -18.786 9.477 138 HB3 LYS 17 3HB LYS 17 2.604 -18.134 8.572 139 HG2 LYS 17 2HG LYS 17 2.712 -20.374 10.488 140 HG3 LYS 17 3HG LYS 17 1.436 -19.192 10.185 141 HD2 LYS 17 2HD LYS 17 1.085 -20.424 7.965 142 HD3 LYS 17 3HD LYS 17 2.059 -21.714 8.675 143 HE2 LYS 17 2HE LYS 17 0.380 -22.400 9.983 144 HE3 LYS 17 3HE LYS 17 -0.037 -20.754 10.457 145 HZ1 LYS 17 1HZ LYS 17 -0.786 -21.930 7.840 146 HZ2 LYS 17 2HZ LYS 17 -1.350 -20.489 8.522 147 HZ3 LYS 17 3HZ LYS 17 -1.794 -21.974 9.199 148 H CYS 18 H CYS 18 2.733 -18.553 5.571 149 HA CYS 18 HA CYS 18 5.330 -17.278 5.013 150 HB2 CYS 18 2HB CYS 18 3.147 -17.736 2.985 151 HB3 CYS 18 3HB CYS 18 4.836 -17.337 2.691 152 H GLN 19 H GLN 19 5.435 -15.108 4.834 153 HA GLN 19 HA GLN 19 2.933 -13.581 4.726 154 HB2 GLN 19 2HB GLN 19 5.145 -12.699 6.549 155 HB3 GLN 19 3HB GLN 19 3.446 -12.244 6.569 156 HG2 GLN 19 2HG GLN 19 3.264 -13.675 8.260 157 HG3 GLN 19 3HG GLN 19 3.321 -14.932 7.025 158 HE21 GLN 19 1HE2 GLN 19 6.115 -14.383 6.388 159 HE22 GLN 19 2HE2 GLN 19 7.041 -15.053 7.683 160 H ARG 20 H ARG 20 3.359 -11.225 4.284 161 HA ARG 20 HA ARG 20 5.422 -11.038 2.219 162 HB2 ARG 20 2HB ARG 20 2.787 -9.809 2.672 163 HB3 ARG 20 3HB ARG 20 4.008 -8.706 2.051 164 HG2 ARG 20 2HG ARG 20 3.538 -11.365 0.759 165 HG3 ARG 20 3HG ARG 20 2.521 -9.972 0.384 166 HD2 ARG 20 2HD ARG 20 4.207 -8.852 -0.675 167 HD3 ARG 20 3HD ARG 20 5.466 -9.602 0.305 168 HE ARG 20 HE ARG 20 5.714 -11.118 -1.368 169 HH11 ARG 20 1HH1 ARG 20 2.437 -9.945 -1.444 170 HH12 ARG 20 2HH1 ARG 20 1.994 -10.887 -2.829 171 HH21 ARG 20 1HH2 ARG 20 5.143 -12.363 -3.192 172 HH22 ARG 20 2HH2 ARG 20 3.534 -12.263 -3.822 173 H MET 21 H MET 21 6.598 -8.962 2.001 174 HA MET 21 HA MET 21 7.510 -8.074 4.635 175 HB2 MET 21 2HB MET 21 8.750 -7.624 1.915 176 HB3 MET 21 3HB MET 21 9.474 -7.211 3.463 177 HG2 MET 21 2HG MET 21 8.924 -9.872 3.765 178 HG3 MET 21 3HG MET 21 9.362 -9.762 2.062 179 HE1 MET 21 1HE MET 21 12.985 -8.504 2.090 180 HE2 MET 21 2HE MET 21 11.805 -9.459 1.193 181 HE3 MET 21 3HE MET 21 11.448 -7.783 1.611 182 H1 GLY 33 H GLY 33 21.266 -22.898 8.445 183 HA2 GLY 33 2HA GLY 33 19.739 -24.707 7.690 184 HA3 GLY 33 3HA GLY 33 18.605 -23.431 7.273 185 H SER 34 H SER 34 18.785 -24.751 5.201 186 HA SER 34 HA SER 34 20.963 -23.639 3.556 187 HB2 SER 34 2HB SER 34 19.706 -26.373 3.524 188 HB3 SER 34 3HB SER 34 20.512 -25.729 2.095 189 HG SER 34 HG SER 34 21.578 -26.554 4.524 190 H LYS 35 H LYS 35 20.355 -22.404 1.906 191 HA LYS 35 HA LYS 35 17.674 -21.699 1.458 192 HB2 LYS 35 2HB LYS 35 18.543 -20.517 -0.548 193 HB3 LYS 35 3HB LYS 35 19.451 -20.161 0.915 194 HG2 LYS 35 2HG LYS 35 20.591 -22.408 -0.486 195 HG3 LYS 35 3HG LYS 35 20.464 -20.994 -1.536 196 HD2 LYS 35 2HD LYS 35 21.725 -21.011 1.206 197 HD3 LYS 35 3HD LYS 35 22.612 -21.096 -0.318 198 HE2 LYS 35 2HE LYS 35 20.911 -18.828 0.701 199 HE3 LYS 35 3HE LYS 35 22.653 -18.828 0.433 200 HZ1 LYS 35 1HZ LYS 35 21.827 -17.754 -1.421 201 HZ2 LYS 35 2HZ LYS 35 20.479 -18.766 -1.556 202 HZ3 LYS 35 3HZ LYS 35 22.012 -19.338 -1.986 203 H LYS 36 H LYS 36 19.744 -24.095 -0.027 204 HA LYS 36 HA LYS 36 18.407 -24.638 -2.377 205 HB2 LYS 36 2HB LYS 36 20.164 -26.138 -0.557 206 HB3 LYS 36 3HB LYS 36 19.119 -27.146 -1.550 207 HG2 LYS 36 2HG LYS 36 20.283 -26.725 -3.408 208 HG3 LYS 36 3HG LYS 36 20.439 -25.006 -3.035 209 HD2 LYS 36 2HD LYS 36 22.636 -25.827 -2.984 210 HD3 LYS 36 3HD LYS 36 22.161 -25.723 -1.287 211 HE2 LYS 36 2HE LYS 36 23.052 -27.820 -1.293 212 HE3 LYS 36 3HE LYS 36 21.392 -28.217 -1.732 213 HZ1 LYS 36 1HZ LYS 36 22.476 -29.326 -3.362 214 HZ2 LYS 36 2HZ LYS 36 23.811 -28.287 -3.362 215 HZ3 LYS 36 3HZ LYS 36 22.379 -27.823 -4.134 216 HA PRO 37 HA PRO 37 15.507 -27.757 -0.125 217 HB2 PRO 37 2HB PRO 37 15.631 -27.876 2.584 218 HB3 PRO 37 3HB PRO 37 16.646 -28.869 1.531 219 HG2 PRO 37 2HG PRO 37 17.318 -26.325 2.959 220 HG3 PRO 37 3HG PRO 37 18.287 -27.800 2.785 221 HD2 PRO 37 2HD PRO 37 18.701 -25.597 1.266 222 HD3 PRO 37 3HD PRO 37 18.984 -27.241 0.660 223 H VAL 38 H VAL 38 16.157 -25.013 2.063 224 HA VAL 38 HA VAL 38 13.317 -24.259 1.807 225 HB VAL 38 HB VAL 38 14.072 -25.129 4.098 226 HG11 VAL 38 1HG1 VAL 38 16.191 -23.583 3.860 227 HG12 VAL 38 2HG1 VAL 38 15.120 -22.388 4.595 228 HG13 VAL 38 3HG1 VAL 38 15.465 -23.900 5.435 229 HG21 VAL 38 1HG2 VAL 38 12.599 -22.612 3.517 230 HG22 VAL 38 2HG2 VAL 38 12.013 -24.137 4.182 231 HG23 VAL 38 3HG2 VAL 38 12.922 -23.022 5.202 232 HA PRO 39 HA PRO 39 15.837 -20.782 0.144 233 HB2 PRO 39 2HB PRO 39 14.048 -20.137 -1.794 234 HB3 PRO 39 3HB PRO 39 15.277 -21.390 -2.000 235 HG2 PRO 39 2HG PRO 39 12.380 -21.675 -1.303 236 HG3 PRO 39 3HG PRO 39 13.358 -22.629 -2.433 237 HD2 PRO 39 2HD PRO 39 12.762 -23.491 0.063 238 HD3 PRO 39 3HD PRO 39 14.283 -23.906 -0.752 239 H ILE 40 H ILE 40 14.981 -20.107 2.421 240 HA ILE 40 HA ILE 40 12.711 -18.265 2.182 241 HB ILE 40 HB ILE 40 13.692 -18.257 4.830 242 HG12 ILE 40 2HG1 ILE 40 13.368 -21.059 3.733 243 HG13 ILE 40 3HG1 ILE 40 14.888 -20.341 4.257 244 HG21 ILE 40 1HG2 ILE 40 11.329 -18.097 3.796 245 HG22 ILE 40 2HG2 ILE 40 11.326 -19.854 3.933 246 HG23 ILE 40 3HG2 ILE 40 11.518 -18.858 5.375 247 HD11 ILE 40 1HD1 ILE 40 13.827 -20.062 6.525 248 HD12 ILE 40 2HD1 ILE 40 12.515 -21.083 5.934 249 HD13 ILE 40 3HD1 ILE 40 14.158 -21.718 6.016 250 H ILE 41 H ILE 41 13.618 -16.508 1.156 251 HA ILE 41 HA ILE 41 15.804 -15.151 2.595 252 HB ILE 41 HB ILE 41 16.001 -13.882 0.327 253 HG12 ILE 41 2HG1 ILE 41 15.481 -15.413 -1.600 254 HG13 ILE 41 3HG1 ILE 41 14.585 -16.430 -0.477 255 HG21 ILE 41 1HG2 ILE 41 17.909 -15.003 0.754 256 HG22 ILE 41 2HG2 ILE 41 17.065 -16.486 1.195 257 HG23 ILE 41 3HG2 ILE 41 17.312 -16.084 -0.504 258 HD11 ILE 41 1HD1 ILE 41 13.792 -13.628 -0.392 259 HD12 ILE 41 2HD1 ILE 41 13.541 -14.396 -1.960 260 HD13 ILE 41 3HD1 ILE 41 12.810 -15.087 -0.513 261 H TYR 42 H TYR 42 15.735 -12.668 1.929 262 HA TYR 42 HA TYR 42 13.077 -11.566 1.764 263 HB2 TYR 42 2HB TYR 42 13.892 -10.243 4.027 264 HB3 TYR 42 3HB TYR 42 12.725 -11.560 3.988 265 HD1 TYR 42 HD1 TYR 42 16.368 -11.894 3.427 266 HD2 TYR 42 HD2 TYR 42 13.131 -12.508 6.119 267 HE1 TYR 42 HE1 TYR 42 17.836 -13.232 4.878 268 HE2 TYR 42 HE2 TYR 42 14.590 -13.846 7.577 269 HH TYR 42 HH TYR 42 17.883 -14.667 6.628 270 H CYS 43 H CYS 43 13.649 -10.287 0.082 271 HA CYS 43 HA CYS 43 16.037 -8.621 0.284 272 HB2 CYS 43 2HB CYS 43 15.296 -9.940 -1.821 273 HB3 CYS 43 3HB CYS 43 14.134 -8.637 -2.043 274 H ASN 44 H ASN 44 15.746 -6.837 1.467 275 HA ASN 44 HA ASN 44 13.211 -5.471 1.569 276 HB2 ASN 44 2HB ASN 44 15.858 -4.539 2.692 277 HB3 ASN 44 3HB ASN 44 14.248 -4.020 3.181 278 HD21 ASN 44 1HD2 ASN 44 13.184 -6.743 3.019 279 HD22 ASN 44 2HD2 ASN 44 13.773 -7.562 4.422 280 H ARG 45 H ARG 45 12.733 -4.597 -0.403 281 HA ARG 45 HA ARG 45 14.377 -3.428 -2.249 282 HB2 ARG 45 2HB ARG 45 11.583 -2.552 -1.493 283 HB3 ARG 45 3HB ARG 45 12.412 -2.110 -2.980 284 HG2 ARG 45 2HG ARG 45 11.702 -4.916 -2.148 285 HG3 ARG 45 3HG ARG 45 10.813 -3.932 -3.312 286 HD2 ARG 45 2HD ARG 45 13.634 -4.960 -3.551 287 HD3 ARG 45 3HD ARG 45 12.239 -5.421 -4.526 288 HE ARG 45 HE ARG 45 12.528 -2.703 -4.862 289 HH11 ARG 45 1HH1 ARG 45 14.462 -5.543 -5.418 290 HH12 ARG 45 2HH1 ARG 45 15.319 -4.856 -6.759 291 HH21 ARG 45 1HH2 ARG 45 13.648 -1.788 -6.626 292 HH22 ARG 45 2HH2 ARG 45 14.855 -2.720 -7.444 293 H ARG 46 H ARG 46 13.134 -2.022 0.720 294 HA ARG 46 HA ARG 46 13.637 0.652 0.358 295 HB2 ARG 46 2HB ARG 46 14.224 0.620 2.871 296 HB3 ARG 46 3HB ARG 46 12.620 0.090 2.381 297 HG2 ARG 46 2HG ARG 46 14.444 -2.131 2.409 298 HG3 ARG 46 3HG ARG 46 14.459 -1.289 3.960 299 HD2 ARG 46 2HD ARG 46 12.723 -2.739 4.304 300 HD3 ARG 46 3HD ARG 46 11.849 -1.356 3.648 301 HE ARG 46 HE ARG 46 12.703 -3.311 1.696 302 HH11 ARG 46 1HH1 ARG 46 10.171 -2.244 3.834 303 HH12 ARG 46 2HH1 ARG 46 8.914 -3.060 2.964 304 HH21 ARG 46 1HH2 ARG 46 11.058 -4.390 0.543 305 HH22 ARG 46 2HH2 ARG 46 9.420 -4.281 1.093 306 H THR 47 H THR 47 15.938 -1.887 1.232 307 HA THR 47 HA THR 47 18.122 0.028 0.726 308 HB THR 47 HB THR 47 18.119 -0.594 3.075 309 HG1 THR 47 HG1 THR 47 20.147 -0.564 1.690 310 HG21 THR 47 1HG2 THR 47 17.580 -3.243 1.983 311 HG22 THR 47 2HG2 THR 47 17.268 -2.601 3.595 312 HG23 THR 47 3HG2 THR 47 18.859 -3.248 3.196 313 H GLY 48 H GLY 48 16.549 -2.276 -0.779 314 HA2 GLY 48 2HA GLY 48 17.044 -3.892 -2.340 315 HA3 GLY 48 3HA GLY 48 18.427 -2.867 -2.694 316 H LYS 49 H LYS 49 17.795 -4.632 0.299 317 HA LYS 49 HA LYS 49 20.253 -6.177 -0.204 318 HB2 LYS 49 2HB LYS 49 19.014 -5.230 2.381 319 HB3 LYS 49 3HB LYS 49 20.322 -6.404 2.315 320 HG2 LYS 49 2HG LYS 49 20.367 -3.493 1.914 321 HG3 LYS 49 3HG LYS 49 21.604 -4.576 2.556 322 HD2 LYS 49 2HD LYS 49 21.935 -5.384 0.177 323 HD3 LYS 49 3HD LYS 49 20.930 -4.022 -0.326 324 HE2 LYS 49 2HE LYS 49 22.890 -3.048 1.480 325 HE3 LYS 49 3HE LYS 49 23.708 -4.058 0.289 326 HZ1 LYS 49 1HZ LYS 49 22.712 -1.450 -0.019 327 HZ2 LYS 49 2HZ LYS 49 21.870 -2.469 -1.074 328 HZ3 LYS 49 3HZ LYS 49 23.558 -2.394 -1.140 329 H CYS 50 H CYS 50 20.123 -8.328 -0.303 330 HA CYS 50 HA CYS 50 17.649 -9.615 0.651 331 HB2 CYS 50 2HB CYS 50 19.242 -10.730 -1.633 332 HB3 CYS 50 3HB CYS 50 17.544 -10.978 -1.238 333 H GLN 51 H GLN 51 17.860 -11.367 1.924 334 HA GLN 51 HA GLN 51 20.472 -12.677 2.122 335 HB2 GLN 51 2HB GLN 51 18.941 -11.924 4.601 336 HB3 GLN 51 3HB GLN 51 20.602 -12.488 4.473 337 HG2 GLN 51 2HG GLN 51 21.135 -10.335 4.687 338 HG3 GLN 51 3HG GLN 51 20.689 -10.217 2.985 339 HE21 GLN 51 1HE2 GLN 51 17.850 -10.679 3.612 340 HE22 GLN 51 2HE2 GLN 51 17.269 -9.185 4.256 341 H ARG 52 H ARG 52 20.346 -14.725 3.394 342 HA ARG 52 HA ARG 52 17.735 -16.014 2.952 343 HB2 ARG 52 2HB ARG 52 19.206 -17.129 1.537 344 HB3 ARG 52 3HB ARG 52 20.549 -16.996 2.663 345 HG2 ARG 52 2HG ARG 52 19.918 -19.269 2.624 346 HG3 ARG 52 3HG ARG 52 19.324 -18.610 4.150 347 HD2 ARG 52 2HD ARG 52 17.265 -18.199 2.305 348 HD3 ARG 52 3HD ARG 52 17.866 -19.824 1.980 349 HE ARG 52 HE ARG 52 16.255 -19.071 4.141 350 HH11 ARG 52 1HH1 ARG 52 19.115 -20.945 3.486 351 HH12 ARG 52 2HH1 ARG 52 18.867 -22.029 4.814 352 HH21 ARG 52 1HH2 ARG 52 15.918 -20.492 5.893 353 HH22 ARG 52 2HH2 ARG 52 17.048 -21.771 6.182 354 H MET 53 H MET 53 16.899 -17.395 4.518 355 HA MET 53 HA MET 53 17.588 -16.746 7.212 356 HB2 MET 53 2HB MET 53 15.654 -18.749 6.043 357 HB3 MET 53 3HB MET 53 15.827 -18.460 7.769 358 HG2 MET 53 2HG MET 53 15.445 -15.942 6.905 359 HG3 MET 53 3HG MET 53 14.526 -16.833 5.694 360 HE1 MET 53 1HE MET 53 14.648 -17.471 9.930 361 HE2 MET 53 2HE MET 53 15.241 -15.989 9.180 362 HE3 MET 53 3HE MET 53 13.680 -15.998 10.001 Start of MODEL 17 1 H1 GLY 1 H GLY 1 3.139 1.748 1.910 2 HA2 GLY 1 2HA GLY 1 2.525 -1.136 1.990 3 HA3 GLY 1 3HA GLY 1 1.711 -0.078 0.847 4 H SER 2 H SER 2 4.587 -1.830 1.575 5 HA SER 2 HA SER 2 5.767 -0.941 -0.976 6 HB2 SER 2 2HB SER 2 7.011 -1.663 1.651 7 HB3 SER 2 3HB SER 2 7.918 -1.945 0.166 8 HG SER 2 HG SER 2 8.438 0.091 0.679 9 H LYS 3 H LYS 3 4.879 -3.652 1.035 10 HA LYS 3 HA LYS 3 6.041 -5.632 -0.701 11 HB2 LYS 3 2HB LYS 3 5.100 -7.253 0.778 12 HB3 LYS 3 3HB LYS 3 5.708 -5.936 1.772 13 HG2 LYS 3 2HG LYS 3 2.836 -6.033 0.933 14 HG3 LYS 3 3HG LYS 3 3.415 -6.943 2.330 15 HD2 LYS 3 2HD LYS 3 4.503 -4.460 2.745 16 HD3 LYS 3 3HD LYS 3 2.942 -4.075 2.017 17 HE2 LYS 3 2HE LYS 3 3.448 -5.753 4.470 18 HE3 LYS 3 3HE LYS 3 2.689 -4.163 4.406 19 HZ1 LYS 3 1HZ LYS 3 1.178 -5.642 2.713 20 HZ2 LYS 3 2HZ LYS 3 0.787 -5.295 4.322 21 HZ3 LYS 3 3HZ LYS 3 1.547 -6.755 3.933 22 H LYS 4 H LYS 4 3.360 -3.687 -0.926 23 HA LYS 4 HA LYS 4 1.438 -5.491 -1.981 24 HB2 LYS 4 2HB LYS 4 1.765 -2.540 -1.848 25 HB3 LYS 4 3HB LYS 4 0.671 -3.168 -3.074 26 HG2 LYS 4 2HG LYS 4 -0.896 -3.696 -1.573 27 HG3 LYS 4 3HG LYS 4 0.281 -4.352 -0.433 28 HD2 LYS 4 2HD LYS 4 -0.634 -2.496 0.668 29 HD3 LYS 4 3HD LYS 4 0.911 -1.917 0.038 30 HE2 LYS 4 2HE LYS 4 -0.098 -0.366 -1.198 31 HE3 LYS 4 3HE LYS 4 -1.193 -1.555 -1.900 32 HZ1 LYS 4 1HZ LYS 4 -2.740 -0.393 -0.799 33 HZ2 LYS 4 2HZ LYS 4 -1.632 0.301 0.274 34 HZ3 LYS 4 3HZ LYS 4 -2.218 -1.261 0.556 35 HA PRO 5 HA PRO 5 3.001 -3.925 -6.284 36 HB2 PRO 5 2HB PRO 5 5.361 -2.584 -6.322 37 HB3 PRO 5 3HB PRO 5 3.801 -1.776 -6.130 38 HG2 PRO 5 2HG PRO 5 5.811 -2.535 -4.045 39 HG3 PRO 5 3HG PRO 5 4.881 -1.034 -4.209 40 HD2 PRO 5 2HD PRO 5 4.190 -2.994 -2.474 41 HD3 PRO 5 3HD PRO 5 2.989 -1.955 -3.269 42 H VAL 6 H VAL 6 5.587 -4.692 -3.975 43 HA VAL 6 HA VAL 6 6.709 -6.591 -5.921 44 HB VAL 6 HB VAL 6 8.394 -5.080 -5.201 45 HG11 VAL 6 1HG1 VAL 6 7.384 -5.631 -2.421 46 HG12 VAL 6 2HG1 VAL 6 8.936 -4.855 -2.743 47 HG13 VAL 6 3HG1 VAL 6 7.438 -4.090 -3.275 48 HG21 VAL 6 1HG2 VAL 6 9.965 -6.565 -3.984 49 HG22 VAL 6 2HG2 VAL 6 8.630 -7.681 -3.693 50 HG23 VAL 6 3HG2 VAL 6 9.164 -7.357 -5.342 51 HA PRO 7 HA PRO 7 4.756 -9.683 -3.324 52 HB2 PRO 7 2HB PRO 7 5.373 -11.774 -4.941 53 HB3 PRO 7 3HB PRO 7 4.035 -10.667 -5.271 54 HG2 PRO 7 2HG PRO 7 6.795 -10.701 -6.430 55 HG3 PRO 7 3HG PRO 7 5.242 -10.444 -7.246 56 HD2 PRO 7 2HD PRO 7 6.892 -8.404 -6.579 57 HD3 PRO 7 3HD PRO 7 5.125 -8.234 -6.601 58 H ILE 8 H ILE 8 6.912 -8.882 -2.090 59 HA ILE 8 HA ILE 8 8.905 -11.023 -2.088 60 HB ILE 8 HB ILE 8 9.880 -9.381 -0.240 61 HG12 ILE 8 2HG1 ILE 8 8.022 -7.680 -1.902 62 HG13 ILE 8 3HG1 ILE 8 8.103 -7.798 -0.147 63 HG21 ILE 8 1HG2 ILE 8 11.127 -8.234 -2.062 64 HG22 ILE 8 2HG2 ILE 8 11.068 -9.988 -2.230 65 HG23 ILE 8 3HG2 ILE 8 10.022 -8.972 -3.222 66 HD11 ILE 8 1HD1 ILE 8 9.104 -5.764 -0.607 67 HD12 ILE 8 2HD1 ILE 8 10.478 -6.853 -0.414 68 HD13 ILE 8 3HD1 ILE 8 9.944 -6.384 -2.028 69 H ILE 9 H ILE 9 8.496 -12.705 -0.821 70 HA ILE 9 HA ILE 9 7.417 -12.199 1.870 71 HB ILE 9 HB ILE 9 6.371 -14.551 1.620 72 HG12 ILE 9 2HG1 ILE 9 5.622 -14.996 -0.737 73 HG13 ILE 9 3HG1 ILE 9 6.740 -13.746 -1.272 74 HG21 ILE 9 1HG2 ILE 9 4.728 -13.035 1.894 75 HG22 ILE 9 2HG2 ILE 9 5.411 -11.925 0.706 76 HG23 ILE 9 3HG2 ILE 9 4.459 -13.310 0.173 77 HD11 ILE 9 1HD1 ILE 9 7.328 -16.375 -1.138 78 HD12 ILE 9 2HD1 ILE 9 8.524 -15.081 -1.056 79 HD13 ILE 9 3HD1 ILE 9 7.923 -15.823 0.427 80 H TYR 10 H TYR 10 7.653 -14.408 3.169 81 HA TYR 10 HA TYR 10 10.032 -15.904 2.559 82 HB2 TYR 10 2HB TYR 10 10.885 -15.141 4.990 83 HB3 TYR 10 3HB TYR 10 11.392 -14.343 3.506 84 HD1 TYR 10 HD1 TYR 10 7.990 -13.941 4.806 85 HD2 TYR 10 HD2 TYR 10 11.895 -12.260 4.642 86 HE1 TYR 10 HE1 TYR 10 7.102 -11.810 5.654 87 HE2 TYR 10 HE2 TYR 10 11.018 -10.124 5.491 88 HH TYR 10 HH TYR 10 9.241 -9.088 6.384 89 H CYS 11 H CYS 11 9.072 -17.825 2.884 90 HA CYS 11 HA CYS 11 7.409 -18.254 5.237 91 HB2 CYS 11 2HB CYS 11 8.057 -20.444 3.313 92 HB3 CYS 11 3HB CYS 11 6.555 -20.113 4.169 93 H ASN 12 H ASN 12 8.492 -18.637 7.062 94 HA ASN 12 HA ASN 12 11.054 -19.956 7.066 95 HB2 ASN 12 2HB ASN 12 9.353 -19.230 9.456 96 HB3 ASN 12 3HB ASN 12 11.090 -19.519 9.426 97 HD21 ASN 12 1HD2 ASN 12 11.442 -18.062 6.922 98 HD22 ASN 12 2HD2 ASN 12 11.321 -16.387 7.326 99 H ARG 13 H ARG 13 10.876 -22.067 6.478 100 HA ARG 13 HA ARG 13 8.897 -23.876 6.914 101 HB2 ARG 13 2HB ARG 13 11.841 -24.512 7.173 102 HB3 ARG 13 3HB ARG 13 10.559 -25.633 6.736 103 HG2 ARG 13 2HG ARG 13 11.406 -23.244 5.110 104 HG3 ARG 13 3HG ARG 13 11.879 -24.916 4.801 105 HD2 ARG 13 2HD ARG 13 9.892 -25.437 3.885 106 HD3 ARG 13 3HD ARG 13 8.989 -24.491 5.067 107 HE ARG 13 HE ARG 13 10.103 -22.584 3.536 108 HH11 ARG 13 1HH1 ARG 13 8.308 -25.464 2.757 109 HH12 ARG 13 2HH1 ARG 13 7.631 -24.806 1.304 110 HH21 ARG 13 1HH2 ARG 13 9.218 -21.707 1.625 111 HH22 ARG 13 2HH2 ARG 13 8.150 -22.669 0.661 112 H ARG 14 H ARG 14 11.390 -22.896 9.211 113 HA ARG 14 HA ARG 14 11.109 -24.742 11.207 114 HB2 ARG 14 2HB ARG 14 11.524 -22.732 12.784 115 HB3 ARG 14 3HB ARG 14 12.745 -23.128 11.583 116 HG2 ARG 14 2HG ARG 14 10.793 -21.258 10.552 117 HG3 ARG 14 3HG ARG 14 11.583 -20.657 12.011 118 HD2 ARG 14 2HD ARG 14 12.987 -19.920 10.316 119 HD3 ARG 14 3HD ARG 14 13.768 -21.403 10.863 120 HE ARG 14 HE ARG 14 11.964 -21.502 8.556 121 HH11 ARG 14 1HH1 ARG 14 15.168 -21.755 9.895 122 HH12 ARG 14 2HH1 ARG 14 15.841 -22.499 8.482 123 HH21 ARG 14 1HH2 ARG 14 12.838 -22.481 6.690 124 HH22 ARG 14 2HH2 ARG 14 14.515 -22.911 6.660 125 H THR 15 H THR 15 9.006 -21.984 10.531 126 HA THR 15 HA THR 15 7.075 -23.075 12.475 127 HB THR 15 HB THR 15 7.905 -20.900 13.217 128 HG1 THR 15 HG1 THR 15 5.638 -21.471 13.483 129 HG21 THR 15 1HG2 THR 15 7.348 -20.180 10.405 130 HG22 THR 15 2HG2 THR 15 8.582 -19.572 11.509 131 HG23 THR 15 3HG2 THR 15 6.928 -18.968 11.614 132 H GLY 16 H GLY 16 7.638 -23.105 9.343 133 HA2 GLY 16 2HA GLY 16 6.372 -23.134 7.417 134 HA3 GLY 16 3HA GLY 16 5.154 -23.839 8.470 135 H LYS 17 H LYS 17 6.402 -20.566 8.757 136 HA LYS 17 HA LYS 17 3.725 -19.569 8.036 137 HB2 LYS 17 2HB LYS 17 5.761 -18.484 9.984 138 HB3 LYS 17 3HB LYS 17 4.337 -17.587 9.474 139 HG2 LYS 17 2HG LYS 17 4.583 -19.857 11.329 140 HG3 LYS 17 3HG LYS 17 3.459 -18.496 11.334 141 HD2 LYS 17 2HD LYS 17 2.346 -19.612 9.335 142 HD3 LYS 17 3HD LYS 17 3.306 -21.039 9.735 143 HE2 LYS 17 2HE LYS 17 1.365 -21.477 10.885 144 HE3 LYS 17 3HE LYS 17 2.317 -20.665 12.127 145 HZ1 LYS 17 1HZ LYS 17 -0.169 -19.972 11.494 146 HZ2 LYS 17 2HZ LYS 17 0.682 -18.942 10.456 147 HZ3 LYS 17 3HZ LYS 17 0.964 -18.884 12.123 148 H CYS 18 H CYS 18 3.532 -18.046 6.488 149 HA CYS 18 HA CYS 18 6.013 -16.908 5.378 150 HB2 CYS 18 2HB CYS 18 4.687 -18.748 4.036 151 HB3 CYS 18 3HB CYS 18 3.633 -17.396 3.634 152 H GLN 19 H GLN 19 6.045 -14.759 5.041 153 HA GLN 19 HA GLN 19 3.526 -13.270 5.066 154 HB2 GLN 19 2HB GLN 19 5.810 -12.215 6.683 155 HB3 GLN 19 3HB GLN 19 4.092 -11.868 6.824 156 HG2 GLN 19 2HG GLN 19 4.157 -13.218 8.591 157 HG3 GLN 19 3HG GLN 19 4.170 -14.526 7.409 158 HE21 GLN 19 1HE2 GLN 19 6.839 -13.946 6.471 159 HE22 GLN 19 2HE2 GLN 19 7.924 -14.476 7.707 160 H ARG 20 H ARG 20 3.966 -10.885 4.566 161 HA ARG 20 HA ARG 20 5.779 -10.808 2.279 162 HB2 ARG 20 2HB ARG 20 3.331 -9.355 3.092 163 HB3 ARG 20 3HB ARG 20 4.522 -8.420 2.196 164 HG2 ARG 20 2HG ARG 20 3.678 -11.088 1.167 165 HG3 ARG 20 3HG ARG 20 2.625 -9.689 0.944 166 HD2 ARG 20 2HD ARG 20 4.014 -8.714 -0.550 167 HD3 ARG 20 3HD ARG 20 5.466 -9.285 0.270 168 HE ARG 20 HE ARG 20 5.534 -10.966 -1.257 169 HH11 ARG 20 1HH1 ARG 20 2.217 -9.983 -0.873 170 HH12 ARG 20 2HH1 ARG 20 1.613 -11.101 -2.051 171 HH21 ARG 20 1HH2 ARG 20 4.751 -12.441 -2.810 172 HH22 ARG 20 2HH2 ARG 20 3.055 -12.499 -3.151 173 H MET 21 H MET 21 7.005 -8.771 1.892 174 HA MET 21 HA MET 21 8.396 -8.020 4.340 175 HB2 MET 21 2HB MET 21 9.066 -7.378 1.463 176 HB3 MET 21 3HB MET 21 10.098 -7.086 2.857 177 HG2 MET 21 2HG MET 21 9.854 -9.651 3.226 178 HG3 MET 21 3HG MET 21 9.400 -9.656 1.523 179 HE1 MET 21 1HE MET 21 13.439 -8.504 3.332 180 HE2 MET 21 2HE MET 21 12.297 -7.177 3.122 181 HE3 MET 21 3HE MET 21 11.872 -8.555 4.139 182 H1 GLY 33 H GLY 33 19.491 -22.142 9.880 183 HA2 GLY 33 2HA GLY 33 20.192 -24.660 10.584 184 HA3 GLY 33 3HA GLY 33 18.482 -24.828 10.216 185 H SER 34 H SER 34 17.944 -25.254 8.179 186 HA SER 34 HA SER 34 20.037 -25.094 6.142 187 HB2 SER 34 2HB SER 34 18.384 -26.488 4.800 188 HB3 SER 34 3HB SER 34 19.039 -27.253 6.248 189 HG SER 34 HG SER 34 16.616 -25.818 6.343 190 H LYS 35 H LYS 35 20.041 -23.574 4.629 191 HA LYS 35 HA LYS 35 17.518 -22.190 4.006 192 HB2 LYS 35 2HB LYS 35 19.977 -20.588 3.753 193 HB3 LYS 35 3HB LYS 35 18.391 -20.131 4.361 194 HG2 LYS 35 2HG LYS 35 19.613 -19.964 6.273 195 HG3 LYS 35 3HG LYS 35 19.100 -21.649 6.390 196 HD2 LYS 35 2HD LYS 35 21.424 -21.595 6.886 197 HD3 LYS 35 3HD LYS 35 21.261 -22.274 5.264 198 HE2 LYS 35 2HE LYS 35 22.526 -20.659 4.410 199 HE3 LYS 35 3HE LYS 35 21.483 -19.420 5.107 200 HZ1 LYS 35 1HZ LYS 35 22.756 -19.337 7.042 201 HZ2 LYS 35 2HZ LYS 35 23.909 -19.439 5.809 202 HZ3 LYS 35 3HZ LYS 35 23.530 -20.808 6.727 203 H LYS 36 H LYS 36 20.046 -24.014 2.879 204 HA LYS 36 HA LYS 36 20.371 -22.805 0.293 205 HB2 LYS 36 2HB LYS 36 21.357 -25.266 1.652 206 HB3 LYS 36 3HB LYS 36 21.375 -25.240 -0.107 207 HG2 LYS 36 2HG LYS 36 23.125 -23.860 -0.180 208 HG3 LYS 36 3HG LYS 36 22.479 -22.824 1.094 209 HD2 LYS 36 2HD LYS 36 23.178 -24.609 2.736 210 HD3 LYS 36 3HD LYS 36 24.037 -25.384 1.403 211 HE2 LYS 36 2HE LYS 36 25.768 -24.105 2.018 212 HE3 LYS 36 3HE LYS 36 24.899 -22.795 1.220 213 HZ1 LYS 36 1HZ LYS 36 23.848 -22.296 3.380 214 HZ2 LYS 36 2HZ LYS 36 25.528 -22.099 3.404 215 HZ3 LYS 36 3HZ LYS 36 24.827 -23.467 4.110 216 HA PRO 37 HA PRO 37 17.675 -26.574 -1.093 217 HB2 PRO 37 2HB PRO 37 16.412 -27.975 0.860 218 HB3 PRO 37 3HB PRO 37 18.032 -28.381 0.280 219 HG2 PRO 37 2HG PRO 37 17.222 -26.851 2.723 220 HG3 PRO 37 3HG PRO 37 18.471 -28.098 2.546 221 HD2 PRO 37 2HD PRO 37 19.050 -25.453 2.602 222 HD3 PRO 37 3HD PRO 37 20.000 -26.619 1.658 223 H VAL 38 H VAL 38 16.642 -24.763 1.748 224 HA VAL 38 HA VAL 38 13.895 -24.638 0.772 225 HB VAL 38 HB VAL 38 14.042 -24.990 3.120 226 HG11 VAL 38 1HG1 VAL 38 15.896 -22.615 3.172 227 HG12 VAL 38 2HG1 VAL 38 15.221 -23.382 4.611 228 HG13 VAL 38 3HG1 VAL 38 16.295 -24.291 3.547 229 HG21 VAL 38 1HG2 VAL 38 12.981 -22.912 4.028 230 HG22 VAL 38 2HG2 VAL 38 13.336 -22.129 2.488 231 HG23 VAL 38 3HG2 VAL 38 12.252 -23.519 2.541 232 HA PRO 39 HA PRO 39 14.847 -20.815 -1.320 233 HB2 PRO 39 2HB PRO 39 12.332 -20.386 -2.248 234 HB3 PRO 39 3HB PRO 39 13.440 -21.551 -2.981 235 HG2 PRO 39 2HG PRO 39 11.198 -22.022 -1.053 236 HG3 PRO 39 3HG PRO 39 11.643 -22.947 -2.499 237 HD2 PRO 39 2HD PRO 39 12.305 -23.746 0.002 238 HD3 PRO 39 3HD PRO 39 13.329 -24.080 -1.409 239 H ILE 40 H ILE 40 14.999 -20.185 1.157 240 HA ILE 40 HA ILE 40 12.771 -18.378 1.816 241 HB ILE 40 HB ILE 40 14.167 -18.333 4.080 242 HG12 ILE 40 2HG1 ILE 40 14.867 -20.968 2.781 243 HG13 ILE 40 3HG1 ILE 40 15.975 -19.752 3.407 244 HG21 ILE 40 1HG2 ILE 40 12.641 -20.812 3.950 245 HG22 ILE 40 2HG2 ILE 40 12.358 -19.354 4.901 246 HG23 ILE 40 3HG2 ILE 40 11.803 -19.438 3.229 247 HD11 ILE 40 1HD1 ILE 40 16.003 -21.415 5.018 248 HD12 ILE 40 2HD1 ILE 40 14.878 -20.227 5.677 249 HD13 ILE 40 3HD1 ILE 40 14.265 -21.690 4.906 250 H ILE 41 H ILE 41 13.462 -16.703 0.424 251 HA ILE 41 HA ILE 41 15.894 -15.308 1.337 252 HB ILE 41 HB ILE 41 15.671 -14.207 -1.037 253 HG12 ILE 41 2HG1 ILE 41 14.904 -15.880 -2.719 254 HG13 ILE 41 3HG1 ILE 41 14.306 -16.883 -1.402 255 HG21 ILE 41 1HG2 ILE 41 17.672 -15.219 -0.852 256 HG22 ILE 41 2HG2 ILE 41 16.989 -16.661 -0.102 257 HG23 ILE 41 3HG2 ILE 41 16.922 -16.463 -1.853 258 HD11 ILE 41 1HD1 ILE 41 13.320 -14.138 -1.335 259 HD12 ILE 41 2HD1 ILE 41 12.846 -15.044 -2.773 260 HD13 ILE 41 3HD1 ILE 41 12.455 -15.665 -1.170 261 H TYR 42 H TYR 42 15.722 -12.880 0.508 262 HA TYR 42 HA TYR 42 13.089 -11.739 0.656 263 HB2 TYR 42 2HB TYR 42 14.021 -10.302 2.716 264 HB3 TYR 42 3HB TYR 42 13.085 -11.776 2.937 265 HD1 TYR 42 HD1 TYR 42 16.533 -11.918 1.718 266 HD2 TYR 42 HD2 TYR 42 14.025 -12.166 5.146 267 HE1 TYR 42 HE1 TYR 42 18.390 -12.900 2.998 268 HE2 TYR 42 HE2 TYR 42 15.876 -13.147 6.436 269 HH TYR 42 HH TYR 42 19.038 -13.759 4.937 270 H CYS 43 H CYS 43 13.440 -10.535 -1.130 271 HA CYS 43 HA CYS 43 15.880 -8.977 -1.399 272 HB2 CYS 43 2HB CYS 43 14.567 -10.256 -3.278 273 HB3 CYS 43 3HB CYS 43 13.580 -8.798 -3.311 274 H ASN 44 H ASN 44 16.020 -7.064 -0.444 275 HA ASN 44 HA ASN 44 13.672 -5.598 0.354 276 HB2 ASN 44 2HB ASN 44 16.545 -4.679 0.513 277 HB3 ASN 44 3HB ASN 44 15.180 -4.104 1.465 278 HD21 ASN 44 1HD2 ASN 44 14.081 -6.741 1.890 279 HD22 ASN 44 2HD2 ASN 44 15.107 -7.521 3.041 280 H ARG 45 H ARG 45 12.603 -4.811 -1.406 281 HA ARG 45 HA ARG 45 13.596 -3.829 -3.762 282 HB2 ARG 45 2HB ARG 45 11.515 -2.318 -3.738 283 HB3 ARG 45 3HB ARG 45 11.270 -4.057 -3.647 284 HG2 ARG 45 2HG ARG 45 9.806 -3.201 -2.061 285 HG3 ARG 45 3HG ARG 45 11.198 -3.720 -1.109 286 HD2 ARG 45 2HD ARG 45 10.088 -1.350 -0.758 287 HD3 ARG 45 3HD ARG 45 11.830 -1.584 -0.613 288 HE ARG 45 HE ARG 45 12.137 -0.389 -2.568 289 HH11 ARG 45 1HH1 ARG 45 8.750 -0.993 -2.033 290 HH12 ARG 45 2HH1 ARG 45 8.226 0.119 -3.254 291 HH21 ARG 45 1HH2 ARG 45 11.459 1.078 -4.177 292 HH22 ARG 45 2HH2 ARG 45 9.768 1.296 -4.474 293 H ARG 46 H ARG 46 13.664 -2.340 -0.633 294 HA ARG 46 HA ARG 46 14.018 0.342 -1.367 295 HB2 ARG 46 2HB ARG 46 15.301 0.431 0.878 296 HB3 ARG 46 3HB ARG 46 13.594 0.009 0.899 297 HG2 ARG 46 2HG ARG 46 15.187 -2.359 0.609 298 HG3 ARG 46 3HG ARG 46 15.727 -1.422 2.004 299 HD2 ARG 46 2HD ARG 46 14.066 -2.504 3.067 300 HD3 ARG 46 3HD ARG 46 13.045 -1.281 2.312 301 HE ARG 46 HE ARG 46 13.322 -3.431 0.539 302 HH11 ARG 46 1HH1 ARG 46 11.868 -2.685 3.614 303 HH12 ARG 46 2HH1 ARG 46 10.593 -3.845 3.439 304 HH21 ARG 46 1HH2 ARG 46 11.647 -4.961 0.298 305 HH22 ARG 46 2HH2 ARG 46 10.468 -5.139 1.553 306 H THR 47 H THR 47 16.366 -2.269 -0.902 307 HA THR 47 HA THR 47 18.402 -0.554 -2.171 308 HB THR 47 HB THR 47 19.025 -1.025 0.132 309 HG1 THR 47 HG1 THR 47 21.026 -2.231 -0.383 310 HG21 THR 47 1HG2 THR 47 18.258 -2.935 1.020 311 HG22 THR 47 2HG2 THR 47 19.648 -3.707 0.256 312 HG23 THR 47 3HG2 THR 47 18.085 -3.697 -0.561 313 H GLY 48 H GLY 48 16.360 -2.842 -2.984 314 HA2 GLY 48 2HA GLY 48 16.319 -4.584 -4.486 315 HA3 GLY 48 3HA GLY 48 17.592 -3.680 -5.292 316 H LYS 49 H LYS 49 17.758 -5.193 -2.106 317 HA LYS 49 HA LYS 49 19.893 -6.936 -3.148 318 HB2 LYS 49 2HB LYS 49 19.493 -5.733 -0.408 319 HB3 LYS 49 3HB LYS 49 20.673 -6.993 -0.743 320 HG2 LYS 49 2HG LYS 49 20.731 -4.126 -1.384 321 HG3 LYS 49 3HG LYS 49 22.051 -5.244 -1.030 322 HD2 LYS 49 2HD LYS 49 21.640 -6.232 -3.330 323 HD3 LYS 49 3HD LYS 49 20.605 -4.836 -3.639 324 HE2 LYS 49 2HE LYS 49 23.236 -4.166 -2.540 325 HE3 LYS 49 3HE LYS 49 23.292 -4.946 -4.120 326 HZ1 LYS 49 1HZ LYS 49 23.136 -2.671 -4.559 327 HZ2 LYS 49 2HZ LYS 49 21.954 -2.416 -3.376 328 HZ3 LYS 49 3HZ LYS 49 21.563 -3.245 -4.798 329 H CYS 50 H CYS 50 19.629 -9.073 -3.032 330 HA CYS 50 HA CYS 50 17.448 -10.109 -1.340 331 HB2 CYS 50 2HB CYS 50 18.350 -11.578 -3.783 332 HB3 CYS 50 3HB CYS 50 16.773 -11.573 -3.000 333 H GLN 51 H GLN 51 17.911 -11.732 0.029 334 HA GLN 51 HA GLN 51 20.384 -13.248 -0.314 335 HB2 GLN 51 2HB GLN 51 19.766 -12.171 2.409 336 HB3 GLN 51 3HB GLN 51 21.302 -12.722 1.752 337 HG2 GLN 51 2HG GLN 51 21.778 -10.549 1.604 338 HG3 GLN 51 3HG GLN 51 20.777 -10.595 0.154 339 HE21 GLN 51 1HE2 GLN 51 18.321 -11.002 1.658 340 HE22 GLN 51 2HE2 GLN 51 17.934 -9.478 2.372 341 H ARG 52 H ARG 52 20.510 -15.068 1.313 342 HA ARG 52 HA ARG 52 17.897 -16.343 1.436 343 HB2 ARG 52 2HB ARG 52 19.873 -17.550 0.520 344 HB3 ARG 52 3HB ARG 52 20.615 -17.478 2.112 345 HG2 ARG 52 2HG ARG 52 19.615 -19.649 1.728 346 HG3 ARG 52 3HG ARG 52 18.774 -18.802 3.028 347 HD2 ARG 52 2HD ARG 52 17.015 -19.631 1.788 348 HD3 ARG 52 3HD ARG 52 17.192 -18.008 1.123 349 HE ARG 52 HE ARG 52 18.665 -20.070 -0.268 350 HH11 ARG 52 1HH1 ARG 52 15.695 -18.268 -0.040 351 HH12 ARG 52 2HH1 ARG 52 15.237 -18.564 -1.685 352 HH21 ARG 52 1HH2 ARG 52 18.073 -20.467 -2.434 353 HH22 ARG 52 2HH2 ARG 52 16.590 -19.816 -3.045 354 H MET 53 H MET 53 17.224 -17.511 3.375 355 HA MET 53 HA MET 53 17.671 -15.890 5.743 356 HB2 MET 53 2HB MET 53 15.763 -18.170 5.202 357 HB3 MET 53 3HB MET 53 15.831 -17.269 6.710 358 HG2 MET 53 2HG MET 53 15.589 -15.301 4.797 359 HG3 MET 53 3HG MET 53 14.562 -16.598 4.191 360 HE1 MET 53 1HE MET 53 14.414 -14.136 7.898 361 HE2 MET 53 2HE MET 53 14.610 -15.798 8.456 362 HE3 MET 53 3HE MET 53 15.774 -15.104 7.326 Start of MODEL 18 1 H1 GLY 1 H GLY 1 -0.399 -0.671 0.566 2 HA2 GLY 1 2HA GLY 1 -1.036 -3.469 1.247 3 HA3 GLY 1 3HA GLY 1 -0.819 -2.986 -0.429 4 H SER 2 H SER 2 0.723 -4.988 0.519 5 HA SER 2 HA SER 2 3.355 -3.713 0.887 6 HB2 SER 2 2HB SER 2 3.306 -6.513 1.644 7 HB3 SER 2 3HB SER 2 3.813 -5.109 2.584 8 HG SER 2 HG SER 2 2.077 -5.558 3.692 9 H LYS 3 H LYS 3 1.475 -6.136 -0.786 10 HA LYS 3 HA LYS 3 3.530 -7.474 -2.137 11 HB2 LYS 3 2HB LYS 3 0.732 -6.920 -3.141 12 HB3 LYS 3 3HB LYS 3 1.811 -8.186 -3.712 13 HG2 LYS 3 2HG LYS 3 0.810 -9.524 -2.253 14 HG3 LYS 3 3HG LYS 3 1.665 -8.634 -0.991 15 HD2 LYS 3 2HD LYS 3 -0.665 -8.689 -0.429 16 HD3 LYS 3 3HD LYS 3 -0.253 -7.042 -0.912 17 HE2 LYS 3 2HE LYS 3 -1.809 -7.094 -2.494 18 HE3 LYS 3 3HE LYS 3 -1.044 -8.504 -3.227 19 HZ1 LYS 3 1HZ LYS 3 -3.419 -8.342 -1.629 20 HZ2 LYS 3 2HZ LYS 3 -2.348 -9.529 -1.076 21 HZ3 LYS 3 3HZ LYS 3 -2.903 -9.569 -2.674 22 H LYS 4 H LYS 4 2.507 -4.273 -2.407 23 HA LYS 4 HA LYS 4 3.431 -3.999 -5.170 24 HB2 LYS 4 2HB LYS 4 2.689 -1.506 -3.932 25 HB3 LYS 4 3HB LYS 4 1.969 -2.316 -5.317 26 HG2 LYS 4 2HG LYS 4 1.325 -2.985 -2.455 27 HG3 LYS 4 3HG LYS 4 0.391 -1.865 -3.451 28 HD2 LYS 4 2HD LYS 4 0.552 -4.061 -5.068 29 HD3 LYS 4 3HD LYS 4 0.462 -4.795 -3.465 30 HE2 LYS 4 2HE LYS 4 -1.758 -4.568 -3.759 31 HE3 LYS 4 3HE LYS 4 -1.459 -2.905 -3.256 32 HZ1 LYS 4 1HZ LYS 4 -1.920 -2.133 -5.284 33 HZ2 LYS 4 2HZ LYS 4 -2.655 -3.632 -5.558 34 HZ3 LYS 4 3HZ LYS 4 -1.066 -3.363 -6.072 35 HA PRO 5 HA PRO 5 6.359 -0.917 -2.904 36 HB2 PRO 5 2HB PRO 5 6.202 -0.772 -0.198 37 HB3 PRO 5 3HB PRO 5 5.220 0.230 -1.272 38 HG2 PRO 5 2HG PRO 5 4.483 -2.289 0.168 39 HG3 PRO 5 3HG PRO 5 3.543 -0.798 -0.031 40 HD2 PRO 5 2HD PRO 5 3.109 -3.006 -1.537 41 HD3 PRO 5 3HD PRO 5 2.864 -1.362 -2.160 42 H VAL 6 H VAL 6 5.658 -3.559 -0.605 43 HA VAL 6 HA VAL 6 8.486 -4.370 -0.820 44 HB VAL 6 HB VAL 6 7.866 -3.543 1.432 45 HG11 VAL 6 1HG1 VAL 6 5.900 -4.066 2.317 46 HG12 VAL 6 2HG1 VAL 6 5.569 -5.171 0.982 47 HG13 VAL 6 3HG1 VAL 6 6.408 -5.752 2.421 48 HG21 VAL 6 1HG2 VAL 6 8.334 -6.499 1.612 49 HG22 VAL 6 2HG2 VAL 6 9.553 -5.422 0.931 50 HG23 VAL 6 3HG2 VAL 6 9.016 -5.205 2.597 51 HA PRO 7 HA PRO 7 5.732 -7.780 -2.453 52 HB2 PRO 7 2HB PRO 7 7.077 -8.103 -4.789 53 HB3 PRO 7 3HB PRO 7 5.753 -6.948 -4.594 54 HG2 PRO 7 2HG PRO 7 8.708 -6.473 -4.521 55 HG3 PRO 7 3HG PRO 7 7.440 -5.516 -5.308 56 HD2 PRO 7 2HD PRO 7 8.525 -4.819 -2.928 57 HD3 PRO 7 3HD PRO 7 6.835 -4.470 -3.345 58 H ILE 8 H ILE 8 7.700 -8.056 -0.487 59 HA ILE 8 HA ILE 8 9.072 -10.473 -1.440 60 HB ILE 8 HB ILE 8 10.884 -9.737 0.335 61 HG12 ILE 8 2HG1 ILE 8 9.375 -7.578 0.634 62 HG13 ILE 8 3HG1 ILE 8 11.130 -7.485 0.731 63 HG21 ILE 8 1HG2 ILE 8 10.602 -9.022 -2.545 64 HG22 ILE 8 2HG2 ILE 8 12.009 -8.454 -1.648 65 HG23 ILE 8 3HG2 ILE 8 11.682 -10.183 -1.774 66 HD11 ILE 8 1HD1 ILE 8 10.161 -7.164 -1.980 67 HD12 ILE 8 2HD1 ILE 8 9.498 -5.962 -0.873 68 HD13 ILE 8 3HD1 ILE 8 11.245 -6.145 -1.033 69 H ILE 9 H ILE 9 8.164 -12.092 -0.360 70 HA ILE 9 HA ILE 9 7.484 -11.690 2.477 71 HB ILE 9 HB ILE 9 6.116 -13.864 2.054 72 HG12 ILE 9 2HG1 ILE 9 5.245 -13.982 -0.276 73 HG13 ILE 9 3HG1 ILE 9 6.439 -12.779 -0.752 74 HG21 ILE 9 1HG2 ILE 9 4.446 -12.086 0.743 75 HG22 ILE 9 2HG2 ILE 9 4.593 -12.299 2.486 76 HG23 ILE 9 3HG2 ILE 9 5.535 -11.053 1.668 77 HD11 ILE 9 1HD1 ILE 9 7.512 -15.141 0.624 78 HD12 ILE 9 2HD1 ILE 9 6.800 -15.434 -0.963 79 HD13 ILE 9 3HD1 ILE 9 8.113 -14.270 -0.786 80 H TYR 10 H TYR 10 7.401 -14.020 3.586 81 HA TYR 10 HA TYR 10 9.536 -15.782 2.803 82 HB2 TYR 10 2HB TYR 10 10.506 -15.363 5.274 83 HB3 TYR 10 3HB TYR 10 11.113 -14.520 3.853 84 HD1 TYR 10 HD1 TYR 10 7.816 -13.756 5.261 85 HD2 TYR 10 HD2 TYR 10 11.917 -12.630 5.137 86 HE1 TYR 10 HE1 TYR 10 7.249 -11.601 6.302 87 HE2 TYR 10 HE2 TYR 10 11.361 -10.472 6.180 88 HH TYR 10 HH TYR 10 9.472 -9.589 7.689 89 H CYS 11 H CYS 11 8.314 -17.569 2.982 90 HA CYS 11 HA CYS 11 6.632 -17.961 5.329 91 HB2 CYS 11 2HB CYS 11 5.952 -18.495 2.894 92 HB3 CYS 11 3HB CYS 11 6.964 -19.924 3.074 93 H ASN 12 H ASN 12 7.662 -18.676 7.082 94 HA ASN 12 HA ASN 12 9.956 -20.438 6.848 95 HB2 ASN 12 2HB ASN 12 8.613 -19.381 9.345 96 HB3 ASN 12 3HB ASN 12 10.201 -20.138 9.245 97 HD21 ASN 12 1HD2 ASN 12 10.700 -18.740 6.663 98 HD22 ASN 12 2HD2 ASN 12 11.120 -17.124 7.108 99 H ARG 13 H ARG 13 9.287 -22.442 6.234 100 HA ARG 13 HA ARG 13 6.969 -23.765 6.973 101 HB2 ARG 13 2HB ARG 13 9.676 -24.967 6.362 102 HB3 ARG 13 3HB ARG 13 8.152 -25.845 6.366 103 HG2 ARG 13 2HG ARG 13 8.876 -23.572 4.528 104 HG3 ARG 13 3HG ARG 13 8.846 -25.285 4.105 105 HD2 ARG 13 2HD ARG 13 6.481 -23.648 5.012 106 HD3 ARG 13 3HD ARG 13 6.824 -24.128 3.351 107 HE ARG 13 HE ARG 13 6.730 -26.424 4.961 108 HH11 ARG 13 1HH1 ARG 13 4.629 -23.950 3.701 109 HH12 ARG 13 2HH1 ARG 13 3.227 -24.968 3.680 110 HH21 ARG 13 1HH2 ARG 13 4.891 -27.774 4.938 111 HH22 ARG 13 2HH2 ARG 13 3.377 -27.142 4.385 112 H ARG 14 H ARG 14 9.859 -23.210 8.786 113 HA ARG 14 HA ARG 14 9.810 -25.283 10.627 114 HB2 ARG 14 2HB ARG 14 10.680 -22.411 10.842 115 HB3 ARG 14 3HB ARG 14 10.807 -23.509 12.211 116 HG2 ARG 14 2HG ARG 14 12.911 -23.357 11.010 117 HG3 ARG 14 3HG ARG 14 12.241 -24.986 10.903 118 HD2 ARG 14 2HD ARG 14 13.150 -24.198 8.755 119 HD3 ARG 14 3HD ARG 14 11.422 -24.541 8.672 120 HE ARG 14 HE ARG 14 11.082 -22.357 8.126 121 HH11 ARG 14 1HH1 ARG 14 14.156 -22.625 9.738 122 HH12 ARG 14 2HH1 ARG 14 14.574 -20.960 9.498 123 HH21 ARG 14 1HH2 ARG 14 11.620 -20.164 7.804 124 HH22 ARG 14 2HH2 ARG 14 13.130 -19.561 8.399 125 H THR 15 H THR 15 7.781 -22.458 10.380 126 HA THR 15 HA THR 15 6.233 -23.431 12.688 127 HB THR 15 HB THR 15 7.054 -21.533 13.677 128 HG1 THR 15 HG1 THR 15 4.770 -21.282 13.501 129 HG21 THR 15 1HG2 THR 15 7.176 -19.350 12.137 130 HG22 THR 15 2HG2 THR 15 7.391 -20.579 10.890 131 HG23 THR 15 3HG2 THR 15 8.504 -20.504 12.256 132 H GLY 16 H GLY 16 6.205 -23.132 9.483 133 HA2 GLY 16 2HA GLY 16 4.569 -23.016 7.877 134 HA3 GLY 16 3HA GLY 16 3.466 -23.502 9.156 135 H LYS 17 H LYS 17 5.331 -20.548 8.434 136 HA LYS 17 HA LYS 17 2.816 -19.047 8.366 137 HB2 LYS 17 2HB LYS 17 3.905 -17.245 9.740 138 HB3 LYS 17 3HB LYS 17 3.534 -18.722 10.620 139 HG2 LYS 17 2HG LYS 17 5.662 -18.136 11.353 140 HG3 LYS 17 3HG LYS 17 5.956 -19.393 10.150 141 HD2 LYS 17 2HD LYS 17 7.178 -18.001 8.917 142 HD3 LYS 17 3HD LYS 17 5.877 -16.809 8.892 143 HE2 LYS 17 2HE LYS 17 7.881 -15.846 9.861 144 HE3 LYS 17 3HE LYS 17 6.617 -15.979 11.083 145 HZ1 LYS 17 1HZ LYS 17 9.126 -16.818 11.432 146 HZ2 LYS 17 2HZ LYS 17 8.405 -18.251 10.897 147 HZ3 LYS 17 3HZ LYS 17 7.798 -17.458 12.263 148 H CYS 18 H CYS 18 2.900 -17.097 7.186 149 HA CYS 18 HA CYS 18 5.377 -16.528 5.735 150 HB2 CYS 18 2HB CYS 18 2.806 -16.585 4.199 151 HB3 CYS 18 3HB CYS 18 4.459 -16.723 3.608 152 H GLN 19 H GLN 19 5.758 -14.407 5.512 153 HA GLN 19 HA GLN 19 3.541 -12.513 5.651 154 HB2 GLN 19 2HB GLN 19 5.937 -11.910 7.324 155 HB3 GLN 19 3HB GLN 19 4.280 -11.350 7.501 156 HG2 GLN 19 2HG GLN 19 4.102 -12.822 9.149 157 HG3 GLN 19 3HG GLN 19 4.072 -14.064 7.899 158 HE21 GLN 19 1HE2 GLN 19 6.709 -13.947 7.054 159 HE22 GLN 19 2HE2 GLN 19 7.732 -14.507 8.329 160 H ARG 20 H ARG 20 4.542 -10.178 5.436 161 HA ARG 20 HA ARG 20 6.421 -10.315 3.178 162 HB2 ARG 20 2HB ARG 20 3.996 -9.256 3.092 163 HB3 ARG 20 3HB ARG 20 4.826 -7.864 3.775 164 HG2 ARG 20 2HG ARG 20 5.312 -7.284 1.690 165 HG3 ARG 20 3HG ARG 20 6.451 -8.632 1.677 166 HD2 ARG 20 2HD ARG 20 3.981 -9.800 1.171 167 HD3 ARG 20 3HD ARG 20 3.955 -8.299 0.247 168 HE ARG 20 HE ARG 20 6.402 -9.521 -0.237 169 HH11 ARG 20 1HH1 ARG 20 3.023 -10.166 -0.772 170 HH12 ARG 20 2HH1 ARG 20 3.294 -11.104 -2.203 171 HH21 ARG 20 1HH2 ARG 20 6.772 -10.755 -2.120 172 HH22 ARG 20 2HH2 ARG 20 5.427 -11.439 -2.968 173 H MET 21 H MET 21 7.910 -8.456 2.936 174 HA MET 21 HA MET 21 9.265 -7.968 5.434 175 HB2 MET 21 2HB MET 21 9.880 -7.234 2.575 176 HB3 MET 21 3HB MET 21 10.887 -6.722 3.922 177 HG2 MET 21 2HG MET 21 10.345 -9.570 3.970 178 HG3 MET 21 3HG MET 21 11.134 -9.055 2.481 179 HE1 MET 21 1HE MET 21 11.908 -6.910 5.761 180 HE2 MET 21 2HE MET 21 11.133 -8.410 6.270 181 HE3 MET 21 3HE MET 21 12.829 -8.118 6.656 182 H1 GLY 33 H GLY 33 22.775 -23.413 9.772 183 HA2 GLY 33 2HA GLY 33 22.568 -22.921 6.864 184 HA3 GLY 33 3HA GLY 33 23.133 -24.447 7.528 185 H SER 34 H SER 34 20.333 -22.265 7.889 186 HA SER 34 HA SER 34 18.613 -24.657 7.900 187 HB2 SER 34 2HB SER 34 18.167 -21.954 9.188 188 HB3 SER 34 3HB SER 34 16.966 -23.245 9.137 189 HG SER 34 HG SER 34 18.716 -22.923 10.981 190 H LYS 35 H LYS 35 19.312 -21.640 6.387 191 HA LYS 35 HA LYS 35 16.805 -21.523 4.939 192 HB2 LYS 35 2HB LYS 35 17.694 -19.512 3.923 193 HB3 LYS 35 3HB LYS 35 17.962 -19.457 5.660 194 HG2 LYS 35 2HG LYS 35 20.104 -20.468 3.839 195 HG3 LYS 35 3HG LYS 35 19.853 -18.734 4.054 196 HD2 LYS 35 2HD LYS 35 19.840 -19.576 6.630 197 HD3 LYS 35 3HD LYS 35 20.959 -20.734 5.909 198 HE2 LYS 35 2HE LYS 35 21.159 -17.731 5.929 199 HE3 LYS 35 3HE LYS 35 22.252 -18.893 6.679 200 HZ1 LYS 35 1HZ LYS 35 21.964 -18.188 3.837 201 HZ2 LYS 35 2HZ LYS 35 22.558 -19.713 4.263 202 HZ3 LYS 35 3HZ LYS 35 23.370 -18.318 4.769 203 H LYS 36 H LYS 36 19.484 -23.383 4.672 204 HA LYS 36 HA LYS 36 19.992 -23.265 1.868 205 HB2 LYS 36 2HB LYS 36 20.545 -25.713 3.500 206 HB3 LYS 36 3HB LYS 36 21.501 -24.997 2.209 207 HG2 LYS 36 2HG LYS 36 21.224 -24.016 5.038 208 HG3 LYS 36 3HG LYS 36 22.664 -24.678 4.262 209 HD2 LYS 36 2HD LYS 36 21.916 -22.579 2.614 210 HD3 LYS 36 3HD LYS 36 21.620 -21.968 4.244 211 HE2 LYS 36 2HE LYS 36 23.881 -21.438 3.553 212 HE3 LYS 36 3HE LYS 36 23.911 -22.602 4.876 213 HZ1 LYS 36 1HZ LYS 36 25.154 -22.841 2.431 214 HZ2 LYS 36 2HZ LYS 36 23.855 -23.923 2.364 215 HZ3 LYS 36 3HZ LYS 36 24.993 -24.044 3.610 216 HA PRO 37 HA PRO 37 17.229 -27.247 1.794 217 HB2 PRO 37 2HB PRO 37 15.653 -27.670 3.964 218 HB3 PRO 37 3HB PRO 37 17.290 -28.323 3.823 219 HG2 PRO 37 2HG PRO 37 16.340 -25.891 5.289 220 HG3 PRO 37 3HG PRO 37 17.499 -27.129 5.808 221 HD2 PRO 37 2HD PRO 37 18.274 -24.719 4.846 222 HD3 PRO 37 3HD PRO 37 19.227 -26.197 4.600 223 H VAL 38 H VAL 38 15.909 -24.521 3.644 224 HA VAL 38 HA VAL 38 13.440 -24.648 2.068 225 HB VAL 38 HB VAL 38 12.955 -24.476 4.377 226 HG11 VAL 38 1HG1 VAL 38 14.939 -22.207 4.471 227 HG12 VAL 38 2HG1 VAL 38 13.887 -22.681 5.807 228 HG13 VAL 38 3HG1 VAL 38 15.114 -23.799 5.210 229 HG21 VAL 38 1HG2 VAL 38 11.915 -22.204 4.566 230 HG22 VAL 38 2HG2 VAL 38 12.710 -21.781 3.050 231 HG23 VAL 38 3HG2 VAL 38 11.515 -23.077 3.087 232 HA PRO 39 HA PRO 39 15.088 -21.377 -0.472 233 HB2 PRO 39 2HB PRO 39 12.881 -21.102 -2.028 234 HB3 PRO 39 3HB PRO 39 14.038 -22.422 -2.228 235 HG2 PRO 39 2HG PRO 39 11.395 -22.417 -0.823 236 HG3 PRO 39 3HG PRO 39 12.085 -23.641 -1.904 237 HD2 PRO 39 2HD PRO 39 12.112 -23.896 0.792 238 HD3 PRO 39 3HD PRO 39 13.399 -24.549 -0.242 239 H ILE 40 H ILE 40 14.663 -20.283 1.842 240 HA ILE 40 HA ILE 40 12.516 -18.296 1.541 241 HB ILE 40 HB ILE 40 13.272 -17.824 4.030 242 HG12 ILE 40 2HG1 ILE 40 14.133 -20.678 3.529 243 HG13 ILE 40 3HG1 ILE 40 15.131 -19.351 4.114 244 HG21 ILE 40 1HG2 ILE 40 11.040 -18.501 3.340 245 HG22 ILE 40 2HG2 ILE 40 11.571 -20.178 3.219 246 HG23 ILE 40 3HG2 ILE 40 11.533 -19.377 4.789 247 HD11 ILE 40 1HD1 ILE 40 13.459 -19.303 6.090 248 HD12 ILE 40 2HD1 ILE 40 13.057 -20.935 5.554 249 HD13 ILE 40 3HD1 ILE 40 14.709 -20.545 6.032 250 H ILE 41 H ILE 41 13.088 -16.351 0.857 251 HA ILE 41 HA ILE 41 15.749 -15.320 1.582 252 HB ILE 41 HB ILE 41 15.600 -14.066 -0.673 253 HG12 ILE 41 2HG1 ILE 41 14.435 -15.436 -2.431 254 HG13 ILE 41 3HG1 ILE 41 13.682 -16.358 -1.134 255 HG21 ILE 41 1HG2 ILE 41 16.457 -16.812 -0.065 256 HG22 ILE 41 2HG2 ILE 41 16.334 -16.422 -1.780 257 HG23 ILE 41 3HG2 ILE 41 17.369 -15.456 -0.728 258 HD11 ILE 41 1HD1 ILE 41 12.190 -14.749 -0.696 259 HD12 ILE 41 2HD1 ILE 41 13.364 -13.452 -0.927 260 HD13 ILE 41 3HD1 ILE 41 12.586 -14.197 -2.323 261 H TYR 42 H TYR 42 15.768 -12.836 0.916 262 HA TYR 42 HA TYR 42 13.252 -11.494 1.373 263 HB2 TYR 42 2HB TYR 42 14.568 -10.211 3.331 264 HB3 TYR 42 3HB TYR 42 13.529 -11.600 3.632 265 HD1 TYR 42 HD1 TYR 42 16.799 -11.949 2.003 266 HD2 TYR 42 HD2 TYR 42 14.664 -12.223 5.673 267 HE1 TYR 42 HE1 TYR 42 18.697 -13.144 3.011 268 HE2 TYR 42 HE2 TYR 42 16.556 -13.418 6.691 269 HH TYR 42 HH TYR 42 19.561 -13.972 4.895 270 H CYS 43 H CYS 43 13.443 -10.209 -0.370 271 HA CYS 43 HA CYS 43 15.958 -8.816 -0.878 272 HB2 CYS 43 2HB CYS 43 13.586 -8.381 -2.617 273 HB3 CYS 43 3HB CYS 43 15.280 -8.579 -3.053 274 H ASN 44 H ASN 44 16.247 -6.976 0.195 275 HA ASN 44 HA ASN 44 14.011 -5.377 1.080 276 HB2 ASN 44 2HB ASN 44 16.957 -4.730 1.287 277 HB3 ASN 44 3HB ASN 44 15.645 -4.037 2.236 278 HD21 ASN 44 1HD2 ASN 44 14.298 -6.612 2.523 279 HD22 ASN 44 2HD2 ASN 44 15.212 -7.497 3.693 280 H ARG 45 H ARG 45 13.018 -4.434 -0.649 281 HA ARG 45 HA ARG 45 14.090 -3.435 -2.958 282 HB2 ARG 45 2HB ARG 45 11.757 -2.418 -1.337 283 HB3 ARG 45 3HB ARG 45 12.146 -1.809 -2.940 284 HG2 ARG 45 2HG ARG 45 11.376 -4.626 -2.213 285 HG3 ARG 45 3HG ARG 45 10.415 -3.456 -3.120 286 HD2 ARG 45 2HD ARG 45 12.984 -4.781 -3.967 287 HD3 ARG 45 3HD ARG 45 11.385 -4.981 -4.682 288 HE ARG 45 HE ARG 45 11.905 -2.318 -4.934 289 HH11 ARG 45 1HH1 ARG 45 13.552 -5.238 -5.875 290 HH12 ARG 45 2HH1 ARG 45 14.292 -4.526 -7.270 291 HH21 ARG 45 1HH2 ARG 45 12.874 -1.369 -6.768 292 HH22 ARG 45 2HH2 ARG 45 13.907 -2.325 -7.777 293 H ARG 46 H ARG 46 14.269 -2.082 0.231 294 HA ARG 46 HA ARG 46 14.815 0.587 -0.329 295 HB2 ARG 46 2HB ARG 46 16.186 -0.966 1.859 296 HB3 ARG 46 3HB ARG 46 15.741 0.735 1.851 297 HG2 ARG 46 2HG ARG 46 13.898 0.178 2.943 298 HG3 ARG 46 3HG ARG 46 13.347 -0.642 1.480 299 HD2 ARG 46 2HD ARG 46 15.245 -2.219 3.028 300 HD3 ARG 46 3HD ARG 46 13.787 -1.816 3.933 301 HE ARG 46 HE ARG 46 13.789 -3.220 1.340 302 HH11 ARG 46 1HH1 ARG 46 12.445 -2.600 4.491 303 HH12 ARG 46 2HH1 ARG 46 11.196 -3.790 4.336 304 HH21 ARG 46 1HH2 ARG 46 12.149 -4.791 1.124 305 HH22 ARG 46 2HH2 ARG 46 11.029 -5.037 2.421 306 H THR 47 H THR 47 16.864 -2.241 -0.545 307 HA THR 47 HA THR 47 18.964 -0.556 -1.733 308 HB THR 47 HB THR 47 19.795 -1.126 0.449 309 HG1 THR 47 HG1 THR 47 21.349 -1.297 -1.184 310 HG21 THR 47 1HG2 THR 47 20.032 -3.957 0.327 311 HG22 THR 47 2HG2 THR 47 18.343 -3.536 0.041 312 HG23 THR 47 3HG2 THR 47 19.155 -2.979 1.503 313 H GLY 48 H GLY 48 16.739 -2.719 -2.445 314 HA2 GLY 48 2HA GLY 48 16.470 -4.347 -4.044 315 HA3 GLY 48 3HA GLY 48 17.776 -3.520 -4.880 316 H LYS 49 H LYS 49 18.025 -5.130 -1.757 317 HA LYS 49 HA LYS 49 19.895 -7.044 -2.991 318 HB2 LYS 49 2HB LYS 49 19.837 -5.857 -0.215 319 HB3 LYS 49 3HB LYS 49 20.858 -7.218 -0.658 320 HG2 LYS 49 2HG LYS 49 21.141 -4.360 -1.276 321 HG3 LYS 49 3HG LYS 49 22.371 -5.604 -1.041 322 HD2 LYS 49 2HD LYS 49 21.688 -6.510 -3.308 323 HD3 LYS 49 3HD LYS 49 20.762 -5.022 -3.519 324 HE2 LYS 49 2HE LYS 49 23.639 -4.872 -2.731 325 HE3 LYS 49 3HE LYS 49 23.215 -5.198 -4.411 326 HZ1 LYS 49 1HZ LYS 49 22.421 -2.831 -2.807 327 HZ2 LYS 49 2HZ LYS 49 21.841 -3.163 -4.361 328 HZ3 LYS 49 3HZ LYS 49 23.487 -2.856 -4.121 329 H CYS 50 H CYS 50 19.469 -9.157 -2.846 330 HA CYS 50 HA CYS 50 17.416 -10.038 -0.927 331 HB2 CYS 50 2HB CYS 50 16.751 -9.887 -3.443 332 HB3 CYS 50 3HB CYS 50 17.725 -11.344 -3.612 333 H GLN 51 H GLN 51 17.894 -11.804 0.248 334 HA GLN 51 HA GLN 51 20.047 -13.576 -0.611 335 HB2 GLN 51 2HB GLN 51 20.106 -12.620 2.221 336 HB3 GLN 51 3HB GLN 51 21.406 -13.285 1.242 337 HG2 GLN 51 2HG GLN 51 22.100 -11.167 1.125 338 HG3 GLN 51 3HG GLN 51 20.857 -11.009 -0.115 339 HE21 GLN 51 1HE2 GLN 51 18.666 -11.231 1.761 340 HE22 GLN 51 2HE2 GLN 51 18.600 -9.733 2.619 341 H ARG 52 H ARG 52 20.273 -15.425 1.065 342 HA ARG 52 HA ARG 52 17.588 -16.454 1.510 343 HB2 ARG 52 2HB ARG 52 20.295 -17.615 1.216 344 HB3 ARG 52 3HB ARG 52 19.201 -18.474 2.293 345 HG2 ARG 52 2HG ARG 52 18.277 -17.689 -0.432 346 HG3 ARG 52 3HG ARG 52 19.314 -19.101 -0.224 347 HD2 ARG 52 2HD ARG 52 17.689 -20.311 0.772 348 HD3 ARG 52 3HD ARG 52 17.031 -18.915 1.626 349 HE ARG 52 HE ARG 52 15.459 -18.796 -0.008 350 HH11 ARG 52 1HH1 ARG 52 18.321 -20.243 -1.362 351 HH12 ARG 52 2HH1 ARG 52 17.621 -20.476 -2.929 352 HH21 ARG 52 1HH2 ARG 52 14.525 -19.098 -2.068 353 HH22 ARG 52 2HH2 ARG 52 15.462 -19.823 -3.330 354 H MET 53 H MET 53 16.847 -17.255 3.499 355 HA MET 53 HA MET 53 17.280 -15.725 5.738 356 HB2 MET 53 2HB MET 53 16.193 -18.487 5.346 357 HB3 MET 53 3HB MET 53 16.412 -17.867 6.977 358 HG2 MET 53 2HG MET 53 14.142 -17.586 5.670 359 HG3 MET 53 3HG MET 53 14.736 -16.357 6.784 360 HE1 MET 53 1HE MET 53 13.614 -14.100 5.800 361 HE2 MET 53 2HE MET 53 13.135 -14.096 4.103 362 HE3 MET 53 3HE MET 53 12.615 -15.407 5.163 Start of MODEL 19 1 H1 GLY 1 H GLY 1 -3.059 -2.147 0.050 2 HA2 GLY 1 2HA GLY 1 -1.997 -4.652 0.702 3 HA3 GLY 1 3HA GLY 1 -1.882 -3.885 -0.875 4 H SER 2 H SER 2 0.069 -5.520 0.627 5 HA SER 2 HA SER 2 2.243 -3.543 0.850 6 HB2 SER 2 2HB SER 2 2.032 -6.270 2.150 7 HB3 SER 2 3HB SER 2 3.387 -5.154 2.321 8 HG SER 2 HG SER 2 1.877 -5.028 4.063 9 H LYS 3 H LYS 3 1.241 -6.618 -0.499 10 HA LYS 3 HA LYS 3 3.648 -7.512 -1.567 11 HB2 LYS 3 2HB LYS 3 2.251 -8.726 -3.222 12 HB3 LYS 3 3HB LYS 3 1.683 -8.918 -1.568 13 HG2 LYS 3 2HG LYS 3 0.429 -6.666 -2.892 14 HG3 LYS 3 3HG LYS 3 0.171 -8.182 -3.758 15 HD2 LYS 3 2HD LYS 3 -0.345 -7.780 -0.813 16 HD3 LYS 3 3HD LYS 3 -1.583 -7.691 -2.068 17 HE2 LYS 3 2HE LYS 3 -0.616 -10.063 -2.700 18 HE3 LYS 3 3HE LYS 3 -0.101 -10.049 -1.014 19 HZ1 LYS 3 1HZ LYS 3 -2.152 -10.543 -0.393 20 HZ2 LYS 3 2HZ LYS 3 -2.620 -10.653 -2.015 21 HZ3 LYS 3 3HZ LYS 3 -2.777 -9.186 -1.187 22 H LYS 4 H LYS 4 1.740 -4.810 -2.444 23 HA LYS 4 HA LYS 4 2.610 -4.597 -5.162 24 HB2 LYS 4 2HB LYS 4 1.030 -2.956 -3.270 25 HB3 LYS 4 3HB LYS 4 1.850 -2.077 -4.553 26 HG2 LYS 4 2HG LYS 4 0.410 -2.779 -6.101 27 HG3 LYS 4 3HG LYS 4 0.448 -4.442 -5.511 28 HD2 LYS 4 2HD LYS 4 -1.028 -3.647 -3.606 29 HD3 LYS 4 3HD LYS 4 -1.239 -2.154 -4.522 30 HE2 LYS 4 2HE LYS 4 -1.929 -3.692 -6.464 31 HE3 LYS 4 3HE LYS 4 -2.104 -4.938 -5.230 32 HZ1 LYS 4 1HZ LYS 4 -3.484 -2.311 -5.161 33 HZ2 LYS 4 2HZ LYS 4 -3.724 -3.608 -4.102 34 HZ3 LYS 4 3HZ LYS 4 -4.187 -3.743 -5.724 35 HA PRO 5 HA PRO 5 5.564 -1.178 -3.509 36 HB2 PRO 5 2HB PRO 5 5.668 -0.766 -0.827 37 HB3 PRO 5 3HB PRO 5 4.524 0.070 -1.884 38 HG2 PRO 5 2HG PRO 5 4.089 -2.323 -0.139 39 HG3 PRO 5 3HG PRO 5 3.045 -0.911 -0.381 40 HD2 PRO 5 2HD PRO 5 2.600 -3.280 -1.614 41 HD3 PRO 5 3HD PRO 5 2.193 -1.723 -2.363 42 H VAL 6 H VAL 6 5.240 -3.647 -0.950 43 HA VAL 6 HA VAL 6 8.103 -4.257 -1.300 44 HB VAL 6 HB VAL 6 7.463 -3.391 0.952 45 HG11 VAL 6 1HG1 VAL 6 5.350 -5.245 0.657 46 HG12 VAL 6 2HG1 VAL 6 6.338 -5.785 2.016 47 HG13 VAL 6 3HG1 VAL 6 5.666 -4.154 2.006 48 HG21 VAL 6 1HG2 VAL 6 9.324 -5.133 0.381 49 HG22 VAL 6 2HG2 VAL 6 8.929 -4.780 2.064 50 HG23 VAL 6 3HG2 VAL 6 8.298 -6.237 1.297 51 HA PRO 7 HA PRO 7 5.626 -7.949 -2.715 52 HB2 PRO 7 2HB PRO 7 6.991 -8.289 -5.037 53 HB3 PRO 7 3HB PRO 7 5.587 -7.225 -4.895 54 HG2 PRO 7 2HG PRO 7 8.499 -6.534 -4.856 55 HG3 PRO 7 3HG PRO 7 7.165 -5.711 -5.685 56 HD2 PRO 7 2HD PRO 7 8.197 -4.820 -3.345 57 HD3 PRO 7 3HD PRO 7 6.486 -4.616 -3.773 58 H ILE 8 H ILE 8 7.653 -7.945 -0.759 59 HA ILE 8 HA ILE 8 9.159 -10.331 -1.577 60 HB ILE 8 HB ILE 8 10.939 -9.326 0.124 61 HG12 ILE 8 2HG1 ILE 8 9.375 -7.251 0.292 62 HG13 ILE 8 3HG1 ILE 8 11.112 -7.002 0.156 63 HG21 ILE 8 1HG2 ILE 8 12.170 -8.445 -1.849 64 HG22 ILE 8 2HG2 ILE 8 11.486 -10.051 -2.094 65 HG23 ILE 8 3HG2 ILE 8 10.698 -8.640 -2.800 66 HD11 ILE 8 1HD1 ILE 8 9.244 -5.760 -1.358 67 HD12 ILE 8 2HD1 ILE 8 10.929 -5.988 -1.828 68 HD13 ILE 8 3HD1 ILE 8 9.694 -7.108 -2.402 69 H ILE 9 H ILE 9 8.444 -11.935 -0.348 70 HA ILE 9 HA ILE 9 7.753 -11.368 2.458 71 HB ILE 9 HB ILE 9 6.592 -13.690 2.227 72 HG12 ILE 9 2HG1 ILE 9 5.709 -14.065 -0.070 73 HG13 ILE 9 3HG1 ILE 9 6.773 -12.791 -0.657 74 HG21 ILE 9 1HG2 ILE 9 4.732 -12.200 0.839 75 HG22 ILE 9 2HG2 ILE 9 4.952 -12.224 2.588 76 HG23 ILE 9 3HG2 ILE 9 5.741 -10.981 1.617 77 HD11 ILE 9 1HD1 ILE 9 8.579 -14.117 -0.627 78 HD12 ILE 9 2HD1 ILE 9 8.095 -14.924 0.865 79 HD13 ILE 9 3HD1 ILE 9 7.384 -15.412 -0.674 80 H TYR 10 H TYR 10 7.891 -13.603 3.748 81 HA TYR 10 HA TYR 10 10.146 -15.245 3.080 82 HB2 TYR 10 2HB TYR 10 11.205 -14.522 5.415 83 HB3 TYR 10 3HB TYR 10 11.625 -13.708 3.912 84 HD1 TYR 10 HD1 TYR 10 8.321 -13.157 5.333 85 HD2 TYR 10 HD2 TYR 10 12.327 -11.729 5.199 86 HE1 TYR 10 HE1 TYR 10 7.583 -11.015 6.292 87 HE2 TYR 10 HE2 TYR 10 11.600 -9.584 6.159 88 HH TYR 10 HH TYR 10 8.461 -9.130 7.481 89 H CYS 11 H CYS 11 9.173 -17.120 3.532 90 HA CYS 11 HA CYS 11 7.501 -17.388 5.897 91 HB2 CYS 11 2HB CYS 11 7.142 -18.398 3.468 92 HB3 CYS 11 3HB CYS 11 8.130 -19.702 4.120 93 H ASN 12 H ASN 12 8.538 -17.703 7.758 94 HA ASN 12 HA ASN 12 11.087 -19.041 7.875 95 HB2 ASN 12 2HB ASN 12 9.349 -18.188 10.195 96 HB3 ASN 12 3HB ASN 12 11.084 -18.490 10.212 97 HD21 ASN 12 1HD2 ASN 12 11.506 -17.159 7.656 98 HD22 ASN 12 2HD2 ASN 12 11.387 -15.465 7.974 99 H ARG 13 H ARG 13 10.916 -21.177 7.398 100 HA ARG 13 HA ARG 13 8.908 -22.948 7.880 101 HB2 ARG 13 2HB ARG 13 11.885 -23.434 8.052 102 HB3 ARG 13 3HB ARG 13 10.684 -24.717 8.010 103 HG2 ARG 13 2HG ARG 13 11.173 -22.670 5.857 104 HG3 ARG 13 3HG ARG 13 11.649 -24.369 5.817 105 HD2 ARG 13 2HD ARG 13 8.849 -23.254 5.859 106 HD3 ARG 13 3HD ARG 13 9.640 -24.098 4.529 107 HE ARG 13 HE ARG 13 9.664 -25.824 6.695 108 HH11 ARG 13 1HH1 ARG 13 7.300 -24.232 4.697 109 HH12 ARG 13 2HH1 ARG 13 6.111 -25.479 4.882 110 HH21 ARG 13 1HH2 ARG 13 8.108 -27.473 6.947 111 HH22 ARG 13 2HH2 ARG 13 6.572 -27.322 6.163 112 H ARG 14 H ARG 14 11.334 -21.829 10.175 113 HA ARG 14 HA ARG 14 11.019 -23.590 12.253 114 HB2 ARG 14 2HB ARG 14 11.423 -21.511 13.737 115 HB3 ARG 14 3HB ARG 14 12.660 -21.965 12.572 116 HG2 ARG 14 2HG ARG 14 10.752 -20.151 11.397 117 HG3 ARG 14 3HG ARG 14 11.457 -19.477 12.867 118 HD2 ARG 14 2HD ARG 14 12.970 -18.795 11.267 119 HD3 ARG 14 3HD ARG 14 13.704 -20.292 11.839 120 HE ARG 14 HE ARG 14 11.969 -20.456 9.502 121 HH11 ARG 14 1HH1 ARG 14 15.192 -20.385 10.815 122 HH12 ARG 14 2HH1 ARG 14 15.927 -21.045 9.391 123 HH21 ARG 14 1HH2 ARG 14 12.924 -21.326 7.622 124 HH22 ARG 14 2HH2 ARG 14 14.636 -21.580 7.576 125 H THR 15 H THR 15 8.956 -20.843 11.417 126 HA THR 15 HA THR 15 6.983 -21.824 13.377 127 HB THR 15 HB THR 15 7.817 -19.610 14.001 128 HG1 THR 15 HG1 THR 15 5.635 -20.012 14.444 129 HG21 THR 15 1HG2 THR 15 8.494 -18.342 12.261 130 HG22 THR 15 2HG2 THR 15 6.816 -17.796 12.245 131 HG23 THR 15 3HG2 THR 15 7.339 -19.074 11.148 132 H GLY 16 H GLY 16 7.596 -22.037 10.262 133 HA2 GLY 16 2HA GLY 16 6.361 -22.164 8.319 134 HA3 GLY 16 3HA GLY 16 5.128 -22.814 9.389 135 H LYS 17 H LYS 17 6.367 -19.529 9.527 136 HA LYS 17 HA LYS 17 3.703 -18.575 8.706 137 HB2 LYS 17 2HB LYS 17 5.701 -17.386 10.632 138 HB3 LYS 17 3HB LYS 17 4.284 -16.522 10.052 139 HG2 LYS 17 2HG LYS 17 4.503 -18.697 12.023 140 HG3 LYS 17 3HG LYS 17 3.380 -17.337 11.944 141 HD2 LYS 17 2HD LYS 17 2.303 -18.554 9.981 142 HD3 LYS 17 3HD LYS 17 3.250 -19.959 10.475 143 HE2 LYS 17 2HE LYS 17 1.321 -20.352 11.637 144 HE3 LYS 17 3HE LYS 17 2.206 -19.404 12.831 145 HZ1 LYS 17 1HZ LYS 17 0.649 -17.849 12.778 146 HZ2 LYS 17 2HZ LYS 17 -0.287 -18.856 11.793 147 HZ3 LYS 17 3HZ LYS 17 0.742 -17.709 11.094 148 H CYS 18 H CYS 18 3.534 -17.097 7.105 149 HA CYS 18 HA CYS 18 6.047 -16.142 5.896 150 HB2 CYS 18 2HB CYS 18 3.493 -16.457 4.346 151 HB3 CYS 18 3HB CYS 18 5.149 -16.409 3.750 152 H GLN 19 H GLN 19 6.300 -14.009 5.641 153 HA GLN 19 HA GLN 19 3.954 -12.262 5.721 154 HB2 GLN 19 2HB GLN 19 6.349 -11.452 7.311 155 HB3 GLN 19 3HB GLN 19 4.667 -10.973 7.501 156 HG2 GLN 19 2HG GLN 19 4.672 -12.359 9.244 157 HG3 GLN 19 3HG GLN 19 4.542 -13.637 8.036 158 HE21 GLN 19 1HE2 GLN 19 7.226 -13.255 7.034 159 HE22 GLN 19 2HE2 GLN 19 8.295 -13.904 8.226 160 H ARG 20 H ARG 20 4.668 -9.918 5.277 161 HA ARG 20 HA ARG 20 6.534 -10.004 3.015 162 HB2 ARG 20 2HB ARG 20 4.028 -9.099 3.007 163 HB3 ARG 20 3HB ARG 20 4.824 -7.625 3.542 164 HG2 ARG 20 2HG ARG 20 5.064 -7.200 1.366 165 HG3 ARG 20 3HG ARG 20 6.387 -8.366 1.437 166 HD2 ARG 20 2HD ARG 20 4.098 -9.916 1.144 167 HD3 ARG 20 3HD ARG 20 3.837 -8.537 0.078 168 HE ARG 20 HE ARG 20 6.431 -9.487 -0.343 169 HH11 ARG 20 1HH1 ARG 20 3.135 -10.510 -0.799 170 HH12 ARG 20 2HH1 ARG 20 3.497 -11.511 -2.165 171 HH21 ARG 20 1HH2 ARG 20 6.921 -10.802 -2.141 172 HH22 ARG 20 2HH2 ARG 20 5.651 -11.677 -2.928 173 H MET 21 H MET 21 7.886 -8.063 2.649 174 HA MET 21 HA MET 21 9.228 -7.338 5.109 175 HB2 MET 21 2HB MET 21 9.838 -6.853 2.197 176 HB3 MET 21 3HB MET 21 10.803 -6.154 3.491 177 HG2 MET 21 2HG MET 21 10.405 -9.010 3.820 178 HG3 MET 21 3HG MET 21 11.190 -8.602 2.296 179 HE1 MET 21 1HE MET 21 11.125 -7.544 6.015 180 HE2 MET 21 2HE MET 21 12.794 -7.069 6.331 181 HE3 MET 21 3HE MET 21 11.776 -6.076 5.286 182 H1 GLY 33 H GLY 33 18.718 -28.775 8.223 183 HA2 GLY 33 2HA GLY 33 18.410 -27.341 6.434 184 HA3 GLY 33 3HA GLY 33 16.674 -27.533 6.628 185 H SER 34 H SER 34 18.741 -25.205 6.394 186 HA SER 34 HA SER 34 17.582 -23.604 8.582 187 HB2 SER 34 2HB SER 34 19.793 -22.184 7.917 188 HB3 SER 34 3HB SER 34 19.765 -23.404 9.189 189 HG SER 34 HG SER 34 21.273 -24.310 8.042 190 H LYS 35 H LYS 35 19.425 -22.716 5.683 191 HA LYS 35 HA LYS 35 17.082 -21.208 4.732 192 HB2 LYS 35 2HB LYS 35 18.362 -19.306 4.254 193 HB3 LYS 35 3HB LYS 35 18.946 -19.818 5.832 194 HG2 LYS 35 2HG LYS 35 20.340 -20.770 3.374 195 HG3 LYS 35 3HG LYS 35 20.623 -19.130 3.963 196 HD2 LYS 35 2HD LYS 35 20.814 -21.471 5.823 197 HD3 LYS 35 3HD LYS 35 22.167 -21.050 4.770 198 HE2 LYS 35 2HE LYS 35 21.592 -18.626 5.792 199 HE3 LYS 35 3HE LYS 35 21.087 -19.651 7.135 200 HZ1 LYS 35 1HZ LYS 35 23.738 -19.908 5.840 201 HZ2 LYS 35 2HZ LYS 35 23.236 -20.559 7.318 202 HZ3 LYS 35 3HZ LYS 35 23.466 -18.890 7.163 203 H LYS 36 H LYS 36 19.816 -23.197 4.028 204 HA LYS 36 HA LYS 36 20.077 -22.845 1.277 205 HB2 LYS 36 2HB LYS 36 20.681 -25.038 3.191 206 HB3 LYS 36 3HB LYS 36 20.657 -25.451 1.482 207 HG2 LYS 36 2HG LYS 36 22.627 -24.487 1.126 208 HG3 LYS 36 3HG LYS 36 22.156 -23.024 1.994 209 HD2 LYS 36 2HD LYS 36 23.176 -23.680 3.886 210 HD3 LYS 36 3HD LYS 36 22.623 -25.348 3.717 211 HE2 LYS 36 2HE LYS 36 24.930 -25.529 3.503 212 HE3 LYS 36 3HE LYS 36 24.372 -25.503 1.831 213 HZ1 LYS 36 1HZ LYS 36 24.811 -22.864 2.659 214 HZ2 LYS 36 2HZ LYS 36 25.638 -23.741 1.472 215 HZ3 LYS 36 3HZ LYS 36 26.178 -23.770 3.075 216 HA PRO 37 HA PRO 37 16.807 -26.357 0.673 217 HB2 PRO 37 2HB PRO 37 15.333 -27.059 2.843 218 HB3 PRO 37 3HB PRO 37 16.865 -27.838 2.429 219 HG2 PRO 37 2HG PRO 37 16.316 -25.684 4.434 220 HG3 PRO 37 3HG PRO 37 17.345 -27.119 4.588 221 HD2 PRO 37 2HD PRO 37 18.347 -24.658 4.070 222 HD3 PRO 37 3HD PRO 37 19.094 -26.143 3.447 223 H VAL 38 H VAL 38 15.896 -24.025 3.199 224 HA VAL 38 HA VAL 38 13.320 -23.572 1.914 225 HB VAL 38 HB VAL 38 13.257 -23.715 4.314 226 HG11 VAL 38 1HG1 VAL 38 15.549 -23.133 4.825 227 HG12 VAL 38 2HG1 VAL 38 15.272 -21.469 4.304 228 HG13 VAL 38 3HG1 VAL 38 14.454 -22.094 5.737 229 HG21 VAL 38 1HG2 VAL 38 12.418 -21.355 4.852 230 HG22 VAL 38 2HG2 VAL 38 12.813 -20.972 3.176 231 HG23 VAL 38 3HG2 VAL 38 11.626 -22.225 3.538 232 HA PRO 39 HA PRO 39 15.217 -20.214 -0.376 233 HB2 PRO 39 2HB PRO 39 13.020 -19.683 -1.879 234 HB3 PRO 39 3HB PRO 39 14.115 -21.028 -2.221 235 HG2 PRO 39 2HG PRO 39 11.480 -21.044 -0.801 236 HG3 PRO 39 3HG PRO 39 12.108 -22.183 -2.006 237 HD2 PRO 39 2HD PRO 39 12.134 -22.711 0.650 238 HD3 PRO 39 3HD PRO 39 13.385 -23.314 -0.455 239 H ILE 40 H ILE 40 14.883 -19.318 2.018 240 HA ILE 40 HA ILE 40 12.732 -17.333 2.069 241 HB ILE 40 HB ILE 40 14.054 -16.982 4.423 242 HG12 ILE 40 2HG1 ILE 40 14.305 -19.893 3.647 243 HG13 ILE 40 3HG1 ILE 40 15.613 -18.789 4.057 244 HG21 ILE 40 1HG2 ILE 40 11.575 -17.633 3.680 245 HG22 ILE 40 2HG2 ILE 40 12.070 -19.175 4.378 246 HG23 ILE 40 3HG2 ILE 40 12.119 -17.708 5.356 247 HD11 ILE 40 1HD1 ILE 40 15.444 -19.853 6.037 248 HD12 ILE 40 2HD1 ILE 40 14.205 -18.628 6.314 249 HD13 ILE 40 3HD1 ILE 40 13.742 -20.252 5.805 250 H ILE 41 H ILE 41 13.399 -15.703 0.733 251 HA ILE 41 HA ILE 41 15.937 -14.381 1.440 252 HB ILE 41 HB ILE 41 15.693 -13.352 -0.913 253 HG12 ILE 41 2HG1 ILE 41 14.552 -14.907 -2.519 254 HG13 ILE 41 3HG1 ILE 41 13.875 -15.759 -1.136 255 HG21 ILE 41 1HG2 ILE 41 16.552 -15.695 -1.862 256 HG22 ILE 41 2HG2 ILE 41 17.524 -14.682 -0.795 257 HG23 ILE 41 3HG2 ILE 41 16.627 -16.049 -0.136 258 HD11 ILE 41 1HD1 ILE 41 12.334 -14.173 -0.752 259 HD12 ILE 41 2HD1 ILE 41 13.422 -12.855 -1.188 260 HD13 ILE 41 3HD1 ILE 41 12.617 -13.788 -2.450 261 H TYR 42 H TYR 42 15.816 -11.971 0.565 262 HA TYR 42 HA TYR 42 13.243 -10.717 0.921 263 HB2 TYR 42 2HB TYR 42 14.629 -9.244 2.769 264 HB3 TYR 42 3HB TYR 42 13.452 -10.496 3.153 265 HD1 TYR 42 HD1 TYR 42 16.828 -11.083 1.756 266 HD2 TYR 42 HD2 TYR 42 14.353 -11.245 5.213 267 HE1 TYR 42 HE1 TYR 42 18.572 -12.352 2.938 268 HE2 TYR 42 HE2 TYR 42 16.091 -12.513 6.405 269 HH TYR 42 HH TYR 42 18.421 -12.960 6.331 270 H CYS 43 H CYS 43 13.427 -9.627 -0.965 271 HA CYS 43 HA CYS 43 15.860 -8.110 -1.520 272 HB2 CYS 43 2HB CYS 43 14.589 -9.570 -3.239 273 HB3 CYS 43 3HB CYS 43 13.446 -8.233 -3.310 274 H ASN 44 H ASN 44 15.916 -6.227 -0.449 275 HA ASN 44 HA ASN 44 13.521 -4.685 0.027 276 HB2 ASN 44 2HB ASN 44 16.391 -3.912 0.584 277 HB3 ASN 44 3HB ASN 44 14.944 -3.190 1.281 278 HD21 ASN 44 1HD2 ASN 44 13.692 -5.881 1.487 279 HD22 ASN 44 2HD2 ASN 44 14.420 -6.604 2.877 280 H ARG 45 H ARG 45 12.768 -3.994 -1.954 281 HA ARG 45 HA ARG 45 14.189 -3.006 -4.092 282 HB2 ARG 45 2HB ARG 45 11.489 -2.070 -3.102 283 HB3 ARG 45 3HB ARG 45 12.136 -1.781 -4.712 284 HG2 ARG 45 2HG ARG 45 11.533 -4.481 -3.522 285 HG3 ARG 45 3HG ARG 45 10.534 -3.619 -4.694 286 HD2 ARG 45 2HD ARG 45 13.341 -4.639 -5.107 287 HD3 ARG 45 3HD ARG 45 11.867 -5.279 -5.832 288 HE ARG 45 HE ARG 45 11.948 -2.654 -6.601 289 HH11 ARG 45 1HH1 ARG 45 14.073 -5.396 -6.895 290 HH12 ARG 45 2HH1 ARG 45 14.766 -4.864 -8.390 291 HH21 ARG 45 1HH2 ARG 45 12.853 -1.942 -8.570 292 HH22 ARG 45 2HH2 ARG 45 14.072 -2.898 -9.342 293 H ARG 46 H ARG 46 13.491 -1.472 -1.054 294 HA ARG 46 HA ARG 46 13.842 1.211 -1.710 295 HB2 ARG 46 2HB ARG 46 14.863 0.024 0.859 296 HB3 ARG 46 3HB ARG 46 14.159 1.613 0.590 297 HG2 ARG 46 2HG ARG 46 12.695 -1.017 0.492 298 HG3 ARG 46 3HG ARG 46 12.622 0.175 1.791 299 HD2 ARG 46 2HD ARG 46 10.683 0.497 0.470 300 HD3 ARG 46 3HD ARG 46 11.781 1.821 0.082 301 HE ARG 46 HE ARG 46 12.219 -0.254 -1.743 302 HH11 ARG 46 1HH1 ARG 46 9.754 2.050 -0.886 303 HH12 ARG 46 2HH1 ARG 46 9.091 2.132 -2.485 304 HH21 ARG 46 1HH2 ARG 46 11.355 -0.155 -3.852 305 HH22 ARG 46 2HH2 ARG 46 10.002 0.877 -4.171 306 H THR 47 H THR 47 16.151 -1.355 -1.453 307 HA THR 47 HA THR 47 18.306 0.571 -2.023 308 HB THR 47 HB THR 47 19.297 -0.047 -0.117 309 HG1 THR 47 HG1 THR 47 20.507 -1.383 -1.497 310 HG21 THR 47 1HG2 THR 47 17.405 -0.796 1.020 311 HG22 THR 47 2HG2 THR 47 18.503 -2.172 1.127 312 HG23 THR 47 3HG2 THR 47 17.191 -2.180 -0.051 313 H GLY 48 H GLY 48 16.488 -1.841 -3.258 314 HA2 GLY 48 2HA GLY 48 16.708 -3.256 -5.051 315 HA3 GLY 48 3HA GLY 48 18.043 -2.225 -5.543 316 H LYS 49 H LYS 49 17.551 -4.475 -2.823 317 HA LYS 49 HA LYS 49 19.787 -6.088 -3.807 318 HB2 LYS 49 2HB LYS 49 20.730 -6.178 -1.489 319 HB3 LYS 49 3HB LYS 49 20.870 -4.606 -2.266 320 HG2 LYS 49 2HG LYS 49 20.206 -4.097 -0.103 321 HG3 LYS 49 3HG LYS 49 18.703 -4.019 -1.026 322 HD2 LYS 49 2HD LYS 49 17.819 -5.820 0.016 323 HD3 LYS 49 3HD LYS 49 19.371 -6.656 0.113 324 HE2 LYS 49 2HE LYS 49 18.380 -4.431 1.890 325 HE3 LYS 49 3HE LYS 49 18.633 -6.117 2.337 326 HZ1 LYS 49 1HZ LYS 49 20.612 -4.001 1.880 327 HZ2 LYS 49 2HZ LYS 49 21.050 -5.601 1.555 328 HZ3 LYS 49 3HZ LYS 49 20.544 -5.162 3.108 329 H CYS 50 H CYS 50 19.827 -8.236 -3.010 330 HA CYS 50 HA CYS 50 17.515 -9.097 -1.434 331 HB2 CYS 50 2HB CYS 50 18.247 -10.694 -3.858 332 HB3 CYS 50 3HB CYS 50 16.716 -10.620 -2.991 333 H GLN 51 H GLN 51 17.904 -10.809 -0.111 334 HA GLN 51 HA GLN 51 20.385 -12.320 -0.441 335 HB2 GLN 51 2HB GLN 51 19.663 -11.191 2.252 336 HB3 GLN 51 3HB GLN 51 21.187 -11.902 1.736 337 HG2 GLN 51 2HG GLN 51 21.887 -9.803 1.516 338 HG3 GLN 51 3HG GLN 51 20.941 -9.788 0.029 339 HE21 GLN 51 1HE2 GLN 51 18.400 -9.903 1.426 340 HE22 GLN 51 2HE2 GLN 51 18.142 -8.332 2.097 341 H ARG 52 H ARG 52 20.483 -14.142 1.223 342 HA ARG 52 HA ARG 52 17.771 -15.241 1.573 343 HB2 ARG 52 2HB ARG 52 18.671 -16.742 0.096 344 HB3 ARG 52 3HB ARG 52 20.319 -16.449 0.637 345 HG2 ARG 52 2HG ARG 52 19.927 -18.608 1.347 346 HG3 ARG 52 3HG ARG 52 19.576 -17.661 2.794 347 HD2 ARG 52 2HD ARG 52 17.874 -19.368 2.429 348 HD3 ARG 52 3HD ARG 52 17.191 -17.750 2.279 349 HE ARG 52 HE ARG 52 16.596 -18.297 0.156 350 HH11 ARG 52 1HH1 ARG 52 19.317 -20.269 1.067 351 HH12 ARG 52 2HH1 ARG 52 19.334 -21.161 -0.418 352 HH21 ARG 52 1HH2 ARG 52 16.608 -19.466 -1.803 353 HH22 ARG 52 2HH2 ARG 52 17.793 -20.703 -2.050 354 H MET 53 H MET 53 17.298 -16.390 3.465 355 HA MET 53 HA MET 53 18.516 -15.407 5.819 356 HB2 MET 53 2HB MET 53 16.590 -17.695 5.389 357 HB3 MET 53 3HB MET 53 17.065 -17.094 6.973 358 HG2 MET 53 2HG MET 53 16.254 -14.802 6.005 359 HG3 MET 53 3HG MET 53 15.345 -15.831 4.902 360 HE1 MET 53 1HE MET 53 14.197 -14.632 9.040 361 HE2 MET 53 2HE MET 53 15.850 -14.503 8.436 362 HE3 MET 53 3HE MET 53 14.536 -13.683 7.591 Start of MODEL 20 1 H1 GLY 1 H GLY 1 4.376 3.574 0.645 2 HA2 GLY 1 2HA GLY 1 6.063 1.975 0.892 3 HA3 GLY 1 3HA GLY 1 4.643 1.013 1.280 4 H SER 2 H SER 2 7.327 0.543 -0.155 5 HA SER 2 HA SER 2 6.503 -0.277 -2.799 6 HB2 SER 2 2HB SER 2 8.921 0.436 -1.701 7 HB3 SER 2 3HB SER 2 9.065 -1.318 -1.813 8 HG SER 2 HG SER 2 8.892 0.588 -3.822 9 H LYS 3 H LYS 3 6.778 -1.689 0.341 10 HA LYS 3 HA LYS 3 7.143 -4.368 -0.173 11 HB2 LYS 3 2HB LYS 3 5.503 -4.663 1.833 12 HB3 LYS 3 3HB LYS 3 7.045 -3.855 2.084 13 HG2 LYS 3 2HG LYS 3 4.920 -2.022 1.320 14 HG3 LYS 3 3HG LYS 3 4.578 -2.899 2.813 15 HD2 LYS 3 2HD LYS 3 7.121 -1.375 2.248 16 HD3 LYS 3 3HD LYS 3 5.763 -0.759 3.193 17 HE2 LYS 3 2HE LYS 3 6.141 -3.039 4.501 18 HE3 LYS 3 3HE LYS 3 7.776 -2.836 3.872 19 HZ1 LYS 3 1HZ LYS 3 7.127 -1.811 6.146 20 HZ2 LYS 3 2HZ LYS 3 6.451 -0.577 5.208 21 HZ3 LYS 3 3HZ LYS 3 8.101 -0.929 5.081 22 H LYS 4 H LYS 4 4.093 -2.549 -0.255 23 HA LYS 4 HA LYS 4 2.302 -4.566 -0.749 24 HB2 LYS 4 2HB LYS 4 2.431 -1.690 -1.322 25 HB3 LYS 4 3HB LYS 4 1.378 -2.585 -2.410 26 HG2 LYS 4 2HG LYS 4 -0.179 -2.889 -0.841 27 HG3 LYS 4 3HG LYS 4 1.013 -3.281 0.401 28 HD2 LYS 4 2HD LYS 4 1.539 -0.793 0.462 29 HD3 LYS 4 3HD LYS 4 0.072 -0.566 -0.494 30 HE2 LYS 4 2HE LYS 4 -0.954 -2.086 1.423 31 HE3 LYS 4 3HE LYS 4 0.395 -1.413 2.336 32 HZ1 LYS 4 1HZ LYS 4 -1.569 0.239 0.849 33 HZ2 LYS 4 2HZ LYS 4 -0.389 0.780 1.933 34 HZ3 LYS 4 3HZ LYS 4 -1.704 -0.122 2.496 35 HA PRO 5 HA PRO 5 3.018 -4.334 -5.499 36 HB2 PRO 5 2HB PRO 5 4.963 -2.681 -6.422 37 HB3 PRO 5 3HB PRO 5 3.296 -2.153 -6.165 38 HG2 PRO 5 2HG PRO 5 5.692 -1.784 -4.409 39 HG3 PRO 5 3HG PRO 5 4.418 -0.622 -4.822 40 HD2 PRO 5 2HD PRO 5 4.454 -1.971 -2.474 41 HD3 PRO 5 3HD PRO 5 2.945 -1.498 -3.280 42 H VAL 6 H VAL 6 5.403 -4.603 -3.134 43 HA VAL 6 HA VAL 6 7.219 -6.083 -4.910 44 HB VAL 6 HB VAL 6 7.609 -4.790 -2.230 45 HG11 VAL 6 1HG1 VAL 6 9.487 -6.786 -3.489 46 HG12 VAL 6 2HG1 VAL 6 9.760 -5.877 -2.001 47 HG13 VAL 6 3HG1 VAL 6 8.482 -7.092 -2.073 48 HG21 VAL 6 1HG2 VAL 6 9.597 -3.852 -3.407 49 HG22 VAL 6 2HG2 VAL 6 9.043 -4.649 -4.879 50 HG23 VAL 6 3HG2 VAL 6 8.054 -3.396 -4.129 51 HA PRO 7 HA PRO 7 5.364 -9.761 -3.178 52 HB2 PRO 7 2HB PRO 7 6.841 -11.506 -4.642 53 HB3 PRO 7 3HB PRO 7 5.456 -10.630 -5.303 54 HG2 PRO 7 2HG PRO 7 8.377 -10.029 -5.564 55 HG3 PRO 7 3HG PRO 7 7.107 -9.966 -6.800 56 HD2 PRO 7 2HD PRO 7 8.034 -7.750 -5.549 57 HD3 PRO 7 3HD PRO 7 6.354 -7.903 -6.100 58 H ILE 8 H ILE 8 7.019 -8.606 -1.401 59 HA ILE 8 HA ILE 8 9.258 -10.397 -0.876 60 HB ILE 8 HB ILE 8 9.469 -8.828 1.192 61 HG12 ILE 8 2HG1 ILE 8 7.514 -7.364 -0.570 62 HG13 ILE 8 3HG1 ILE 8 7.411 -7.671 1.161 63 HG21 ILE 8 1HG2 ILE 8 10.382 -7.013 -0.554 64 HG22 ILE 8 2HG2 ILE 8 11.207 -8.535 -0.224 65 HG23 ILE 8 3HG2 ILE 8 10.170 -8.385 -1.642 66 HD11 ILE 8 1HD1 ILE 8 9.670 -6.208 1.059 67 HD12 ILE 8 2HD1 ILE 8 8.778 -5.530 -0.304 68 HD13 ILE 8 3HD1 ILE 8 8.060 -5.533 1.307 69 H ILE 9 H ILE 9 8.515 -12.313 -0.120 70 HA ILE 9 HA ILE 9 6.828 -12.228 2.295 71 HB ILE 9 HB ILE 9 6.190 -14.622 1.588 72 HG12 ILE 9 2HG1 ILE 9 6.151 -14.871 -0.927 73 HG13 ILE 9 3HG1 ILE 9 7.252 -13.499 -1.009 74 HG21 ILE 9 1HG2 ILE 9 4.408 -13.197 1.559 75 HG22 ILE 9 2HG2 ILE 9 5.201 -12.051 0.480 76 HG23 ILE 9 3HG2 ILE 9 4.528 -13.547 -0.165 77 HD11 ILE 9 1HD1 ILE 9 8.035 -16.071 -0.936 78 HD12 ILE 9 2HD1 ILE 9 9.020 -14.721 -0.370 79 HD13 ILE 9 3HD1 ILE 9 8.083 -15.673 0.781 80 H TYR 10 H TYR 10 7.027 -14.506 3.445 81 HA TYR 10 HA TYR 10 9.647 -15.686 3.352 82 HB2 TYR 10 2HB TYR 10 9.767 -15.071 5.976 83 HB3 TYR 10 3HB TYR 10 10.553 -14.117 4.722 84 HD1 TYR 10 HD1 TYR 10 6.908 -14.116 5.116 85 HD2 TYR 10 HD2 TYR 10 10.532 -12.091 6.050 86 HE1 TYR 10 HE1 TYR 10 5.618 -12.142 5.815 87 HE2 TYR 10 HE2 TYR 10 9.251 -10.112 6.753 88 HH TYR 10 HH TYR 10 6.560 -9.894 7.675 89 H CYS 11 H CYS 11 9.085 -17.754 3.463 90 HA CYS 11 HA CYS 11 6.832 -18.585 5.110 91 HB2 CYS 11 2HB CYS 11 8.571 -20.335 3.371 92 HB3 CYS 11 3HB CYS 11 6.952 -20.681 3.968 93 H ASN 12 H ASN 12 7.142 -19.126 7.158 94 HA ASN 12 HA ASN 12 9.775 -19.770 8.150 95 HB2 ASN 12 2HB ASN 12 7.159 -19.804 9.664 96 HB3 ASN 12 3HB ASN 12 8.781 -19.702 10.342 97 HD21 ASN 12 1HD2 ASN 12 9.717 -17.853 8.311 98 HD22 ASN 12 2HD2 ASN 12 9.012 -16.321 8.689 99 H ARG 13 H ARG 13 10.353 -21.754 7.322 100 HA ARG 13 HA ARG 13 8.925 -24.015 6.918 101 HB2 ARG 13 2HB ARG 13 11.710 -23.737 8.045 102 HB3 ARG 13 3HB ARG 13 11.023 -25.286 7.572 103 HG2 ARG 13 2HG ARG 13 11.521 -22.914 5.787 104 HG3 ARG 13 3HG ARG 13 12.404 -24.442 5.798 105 HD2 ARG 13 2HD ARG 13 9.542 -23.968 4.991 106 HD3 ARG 13 3HD ARG 13 10.875 -24.507 3.970 107 HE ARG 13 HE ARG 13 10.723 -26.440 5.855 108 HH11 ARG 13 1HH1 ARG 13 8.379 -24.976 3.737 109 HH12 ARG 13 2HH1 ARG 13 7.401 -26.401 3.621 110 HH21 ARG 13 1HH2 ARG 13 9.443 -28.322 5.710 111 HH22 ARG 13 2HH2 ARG 13 8.006 -28.304 4.745 112 H ARG 14 H ARG 14 10.023 -22.782 10.022 113 HA ARG 14 HA ARG 14 9.607 -24.942 11.671 114 HB2 ARG 14 2HB ARG 14 8.896 -23.148 13.393 115 HB3 ARG 14 3HB ARG 14 10.516 -23.067 12.713 116 HG2 ARG 14 2HG ARG 14 8.663 -21.568 11.100 117 HG3 ARG 14 3HG ARG 14 8.606 -21.042 12.784 118 HD2 ARG 14 2HD ARG 14 10.306 -19.725 11.995 119 HD3 ARG 14 3HD ARG 14 11.220 -21.122 12.562 120 HE ARG 14 HE ARG 14 10.419 -21.188 9.779 121 HH11 ARG 14 1HH1 ARG 14 12.893 -20.395 12.095 122 HH12 ARG 14 2HH1 ARG 14 14.178 -20.443 10.935 123 HH21 ARG 14 1HH2 ARG 14 12.102 -21.255 8.241 124 HH22 ARG 14 2HH2 ARG 14 13.727 -20.931 8.742 125 H THR 15 H THR 15 7.212 -22.639 10.453 126 HA THR 15 HA THR 15 5.098 -24.473 11.384 127 HB THR 15 HB THR 15 4.990 -22.419 12.679 128 HG1 THR 15 HG1 THR 15 2.887 -22.501 12.491 129 HG21 THR 15 1HG2 THR 15 5.646 -20.494 11.766 130 HG22 THR 15 2HG2 THR 15 4.162 -20.489 10.814 131 HG23 THR 15 3HG2 THR 15 5.631 -21.206 10.153 132 H GLY 16 H GLY 16 6.674 -23.713 8.733 133 HA2 GLY 16 2HA GLY 16 6.199 -23.602 6.483 134 HA3 GLY 16 3HA GLY 16 4.883 -24.689 6.899 135 H LYS 17 H LYS 17 5.258 -21.336 7.936 136 HA LYS 17 HA LYS 17 2.784 -20.701 6.468 137 HB2 LYS 17 2HB LYS 17 3.875 -19.592 9.056 138 HB3 LYS 17 3HB LYS 17 2.527 -18.868 8.189 139 HG2 LYS 17 2HG LYS 17 2.635 -21.307 9.828 140 HG3 LYS 17 3HG LYS 17 1.315 -20.165 9.568 141 HD2 LYS 17 2HD LYS 17 1.110 -21.157 7.240 142 HD3 LYS 17 3HD LYS 17 2.186 -22.439 7.800 143 HE2 LYS 17 2HE LYS 17 0.394 -23.492 8.591 144 HE3 LYS 17 3HE LYS 17 0.233 -22.201 9.780 145 HZ1 LYS 17 1HZ LYS 17 -0.855 -21.282 7.386 146 HZ2 LYS 17 2HZ LYS 17 -1.666 -21.636 8.827 147 HZ3 LYS 17 3HZ LYS 17 -1.479 -22.833 7.646 148 H CYS 18 H CYS 18 2.787 -19.066 5.038 149 HA CYS 18 HA CYS 18 5.262 -17.486 4.797 150 HB2 CYS 18 2HB CYS 18 3.289 -17.958 2.569 151 HB3 CYS 18 3HB CYS 18 4.959 -17.413 2.451 152 H GLN 19 H GLN 19 5.150 -15.291 4.640 153 HA GLN 19 HA GLN 19 2.519 -14.020 4.500 154 HB2 GLN 19 2HB GLN 19 4.503 -13.140 6.582 155 HB3 GLN 19 3HB GLN 19 2.794 -12.742 6.458 156 HG2 GLN 19 2HG GLN 19 2.515 -14.296 8.027 157 HG3 GLN 19 3HG GLN 19 2.712 -15.450 6.709 158 HE21 GLN 19 1HE2 GLN 19 5.544 -14.761 6.384 159 HE22 GLN 19 2HE2 GLN 19 6.368 -15.527 7.695 160 H ARG 20 H ARG 20 2.732 -11.606 4.267 161 HA ARG 20 HA ARG 20 5.005 -11.032 2.498 162 HB2 ARG 20 2HB ARG 20 3.098 -10.654 1.241 163 HB3 ARG 20 3HB ARG 20 2.180 -10.065 2.620 164 HG2 ARG 20 2HG ARG 20 2.563 -8.206 1.221 165 HG3 ARG 20 3HG ARG 20 3.658 -8.029 2.595 166 HD2 ARG 20 2HD ARG 20 5.031 -7.544 0.796 167 HD3 ARG 20 3HD ARG 20 5.362 -9.253 1.078 168 HE ARG 20 HE ARG 20 4.606 -9.647 -1.027 169 HH11 ARG 20 1HH1 ARG 20 3.101 -6.733 0.141 170 HH12 ARG 20 2HH1 ARG 20 2.249 -6.426 -1.335 171 HH21 ARG 20 1HH2 ARG 20 3.489 -9.253 -2.977 172 HH22 ARG 20 2HH2 ARG 20 2.469 -7.860 -3.108 173 H MET 21 H MET 21 6.121 -9.050 2.648 174 HA MET 21 HA MET 21 6.393 -8.084 5.348 175 HB2 MET 21 2HB MET 21 7.766 -7.050 2.865 176 HB3 MET 21 3HB MET 21 8.282 -6.839 4.532 177 HG2 MET 21 2HG MET 21 8.247 -9.511 4.422 178 HG3 MET 21 3HG MET 21 8.580 -9.152 2.729 179 HE1 MET 21 1HE MET 21 10.585 -6.890 5.895 180 HE2 MET 21 2HE MET 21 9.207 -7.961 6.148 181 HE3 MET 21 3HE MET 21 10.843 -8.535 6.476 182 H1 GLY 33 H GLY 33 25.182 -22.606 5.137 183 HA2 GLY 33 2HA GLY 33 23.598 -24.073 4.358 184 HA3 GLY 33 3HA GLY 33 23.701 -24.845 5.934 185 H SER 34 H SER 34 22.108 -22.290 4.101 186 HA SER 34 HA SER 34 19.877 -22.418 6.024 187 HB2 SER 34 2HB SER 34 19.913 -19.999 4.407 188 HB3 SER 34 3HB SER 34 19.816 -20.175 6.159 189 HG SER 34 HG SER 34 21.724 -19.092 5.513 190 H LYS 35 H LYS 35 20.884 -22.378 2.689 191 HA LYS 35 HA LYS 35 18.370 -22.087 1.464 192 HB2 LYS 35 2HB LYS 35 20.574 -23.770 0.304 193 HB3 LYS 35 3HB LYS 35 19.413 -22.750 -0.535 194 HG2 LYS 35 2HG LYS 35 21.049 -21.250 -0.656 195 HG3 LYS 35 3HG LYS 35 20.756 -20.962 1.061 196 HD2 LYS 35 2HD LYS 35 22.386 -23.212 1.002 197 HD3 LYS 35 3HD LYS 35 23.044 -22.159 -0.253 198 HE2 LYS 35 2HE LYS 35 22.338 -20.871 2.311 199 HE3 LYS 35 3HE LYS 35 23.713 -21.975 2.343 200 HZ1 LYS 35 1HZ LYS 35 23.921 -20.319 0.083 201 HZ2 LYS 35 2HZ LYS 35 24.958 -20.418 1.415 202 HZ3 LYS 35 3HZ LYS 35 23.654 -19.341 1.438 203 H LYS 36 H LYS 36 19.572 -24.583 3.366 204 HA LYS 36 HA LYS 36 17.872 -26.617 2.119 205 HB2 LYS 36 2HB LYS 36 19.251 -27.532 4.478 206 HB3 LYS 36 3HB LYS 36 19.393 -28.097 2.818 207 HG2 LYS 36 2HG LYS 36 20.834 -25.688 3.900 208 HG3 LYS 36 3HG LYS 36 21.524 -27.312 3.834 209 HD2 LYS 36 2HD LYS 36 20.666 -27.040 1.287 210 HD3 LYS 36 3HD LYS 36 21.047 -25.360 1.675 211 HE2 LYS 36 2HE LYS 36 23.219 -26.639 2.682 212 HE3 LYS 36 3HE LYS 36 22.824 -27.674 1.310 213 HZ1 LYS 36 1HZ LYS 36 24.078 -26.173 0.222 214 HZ2 LYS 36 2HZ LYS 36 23.807 -24.940 1.348 215 HZ3 LYS 36 3HZ LYS 36 22.638 -25.285 0.175 216 HA PRO 37 HA PRO 37 16.195 -26.592 6.636 217 HB2 PRO 37 2HB PRO 37 17.215 -24.758 8.358 218 HB3 PRO 37 3HB PRO 37 17.919 -26.364 8.138 219 HG2 PRO 37 2HG PRO 37 18.771 -23.747 6.963 220 HG3 PRO 37 3HG PRO 37 19.768 -25.042 7.650 221 HD2 PRO 37 2HD PRO 37 19.442 -24.715 4.982 222 HD3 PRO 37 3HD PRO 37 19.669 -26.310 5.728 223 H VAL 38 H VAL 38 17.270 -23.268 5.889 224 HA VAL 38 HA VAL 38 14.446 -22.427 6.020 225 HB VAL 38 HB VAL 38 15.868 -21.448 7.808 226 HG11 VAL 38 1HG1 VAL 38 17.214 -19.634 5.913 227 HG12 VAL 38 2HG1 VAL 38 17.789 -20.322 7.433 228 HG13 VAL 38 3HG1 VAL 38 17.818 -21.291 5.959 229 HG21 VAL 38 1HG2 VAL 38 14.918 -19.331 7.676 230 HG22 VAL 38 2HG2 VAL 38 15.095 -19.251 5.923 231 HG23 VAL 38 3HG2 VAL 38 13.871 -20.299 6.639 232 HA PRO 39 HA PRO 39 16.120 -21.770 1.696 233 HB2 PRO 39 2HB PRO 39 14.104 -23.076 0.431 234 HB3 PRO 39 3HB PRO 39 15.562 -23.890 1.008 235 HG2 PRO 39 2HG PRO 39 12.854 -23.731 2.275 236 HG3 PRO 39 3HG PRO 39 13.939 -25.126 2.125 237 HD2 PRO 39 2HD PRO 39 13.721 -23.688 4.409 238 HD3 PRO 39 3HD PRO 39 15.237 -24.468 3.913 239 H ILE 40 H ILE 40 14.883 -19.824 3.214 240 HA ILE 40 HA ILE 40 12.932 -18.758 1.294 241 HB ILE 40 HB ILE 40 11.966 -17.612 3.494 242 HG12 ILE 40 2HG1 ILE 40 13.735 -19.112 4.759 243 HG13 ILE 40 3HG1 ILE 40 12.139 -18.828 5.445 244 HG21 ILE 40 1HG2 ILE 40 10.451 -18.683 2.121 245 HG22 ILE 40 2HG2 ILE 40 11.302 -20.224 2.207 246 HG23 ILE 40 3HG2 ILE 40 10.362 -19.658 3.588 247 HD11 ILE 40 1HD1 ILE 40 11.591 -20.980 5.323 248 HD12 ILE 40 2HD1 ILE 40 12.244 -21.150 3.693 249 HD13 ILE 40 3HD1 ILE 40 13.315 -21.265 5.089 250 H ILE 41 H ILE 41 13.535 -16.843 0.546 251 HA ILE 41 HA ILE 41 15.363 -15.209 2.183 252 HB ILE 41 HB ILE 41 15.955 -14.192 -0.136 253 HG12 ILE 41 2HG1 ILE 41 15.857 -15.919 -1.948 254 HG13 ILE 41 3HG1 ILE 41 14.826 -16.891 -0.904 255 HG21 ILE 41 1HG2 ILE 41 16.939 -16.537 1.291 256 HG22 ILE 41 2HG2 ILE 41 17.405 -16.503 -0.409 257 HG23 ILE 41 3HG2 ILE 41 17.817 -15.151 0.645 258 HD11 ILE 41 1HD1 ILE 41 13.910 -14.139 -1.293 259 HD12 ILE 41 2HD1 ILE 41 13.937 -15.128 -2.753 260 HD13 ILE 41 3HD1 ILE 41 13.016 -15.658 -1.346 261 H TYR 42 H TYR 42 15.323 -12.826 1.212 262 HA TYR 42 HA TYR 42 12.724 -11.909 0.392 263 HB2 TYR 42 2HB TYR 42 12.777 -10.332 2.544 264 HB3 TYR 42 3HB TYR 42 11.962 -11.892 2.547 265 HD1 TYR 42 HD1 TYR 42 15.605 -11.789 2.516 266 HD2 TYR 42 HD2 TYR 42 12.151 -12.005 4.992 267 HE1 TYR 42 HE1 TYR 42 17.009 -12.515 4.401 268 HE2 TYR 42 HE2 TYR 42 13.546 -12.730 6.884 269 HH TYR 42 HH TYR 42 17.066 -13.080 6.544 270 H CYS 43 H CYS 43 13.514 -10.687 -1.220 271 HA CYS 43 HA CYS 43 15.819 -8.968 -0.773 272 HB2 CYS 43 2HB CYS 43 14.262 -8.966 -3.326 273 HB3 CYS 43 3HB CYS 43 15.995 -8.785 -3.074 274 H ASN 44 H ASN 44 15.430 -7.106 0.238 275 HA ASN 44 HA ASN 44 12.888 -5.764 0.026 276 HB2 ASN 44 2HB ASN 44 15.409 -4.751 1.351 277 HB3 ASN 44 3HB ASN 44 13.757 -4.219 1.651 278 HD21 ASN 44 1HD2 ASN 44 12.708 -6.944 1.542 279 HD22 ASN 44 2HD2 ASN 44 13.163 -7.686 3.034 280 H ARG 45 H ARG 45 12.566 -4.943 -1.986 281 HA ARG 45 HA ARG 45 14.318 -3.921 -3.793 282 HB2 ARG 45 2HB ARG 45 11.524 -2.992 -3.138 283 HB3 ARG 45 3HB ARG 45 12.425 -2.397 -4.525 284 HG2 ARG 45 2HG ARG 45 11.575 -5.236 -4.003 285 HG3 ARG 45 3HG ARG 45 10.944 -4.141 -5.235 286 HD2 ARG 45 2HD ARG 45 13.704 -5.335 -5.073 287 HD3 ARG 45 3HD ARG 45 12.470 -5.646 -6.293 288 HE ARG 45 HE ARG 45 14.297 -3.438 -6.205 289 HH11 ARG 45 1HH1 ARG 45 11.184 -4.514 -7.333 290 HH12 ARG 45 2HH1 ARG 45 11.116 -3.374 -8.636 291 HH21 ARG 45 1HH2 ARG 45 14.219 -1.932 -7.917 292 HH22 ARG 45 2HH2 ARG 45 12.844 -1.906 -8.968 293 H ARG 46 H ARG 46 12.997 -2.262 -0.976 294 HA ARG 46 HA ARG 46 13.740 0.334 -1.428 295 HB2 ARG 46 2HB ARG 46 14.183 0.383 1.121 296 HB3 ARG 46 3HB ARG 46 12.569 -0.024 0.552 297 HG2 ARG 46 2HG ARG 46 14.225 -2.378 0.823 298 HG3 ARG 46 3HG ARG 46 14.120 -1.469 2.332 299 HD2 ARG 46 2HD ARG 46 12.290 -2.882 2.467 300 HD3 ARG 46 3HD ARG 46 11.582 -1.398 1.829 301 HE ARG 46 HE ARG 46 12.400 -3.484 -0.053 302 HH11 ARG 46 1HH1 ARG 46 9.872 -1.704 1.547 303 HH12 ARG 46 2HH1 ARG 46 8.634 -2.221 0.450 304 HH21 ARG 46 1HH2 ARG 46 10.780 -4.171 -1.505 305 HH22 ARG 46 2HH2 ARG 46 9.152 -3.625 -1.285 306 H THR 47 H THR 47 15.782 -2.329 -0.323 307 HA THR 47 HA THR 47 18.134 -0.597 -0.733 308 HB THR 47 HB THR 47 17.907 -1.204 1.625 309 HG1 THR 47 HG1 THR 47 20.026 -1.169 0.508 310 HG21 THR 47 1HG2 THR 47 18.502 -3.841 1.890 311 HG22 THR 47 2HG2 THR 47 17.448 -3.873 0.476 312 HG23 THR 47 3HG2 THR 47 16.873 -3.175 1.990 313 H GLY 48 H GLY 48 16.471 -2.832 -2.275 314 HA2 GLY 48 2HA GLY 48 16.936 -4.547 -3.742 315 HA3 GLY 48 3HA GLY 48 18.348 -3.570 -4.117 316 H LYS 49 H LYS 49 17.743 -5.091 -1.009 317 HA LYS 49 HA LYS 49 20.073 -6.828 -1.495 318 HB2 LYS 49 2HB LYS 49 19.071 -5.569 1.060 319 HB3 LYS 49 3HB LYS 49 20.318 -6.809 1.015 320 HG2 LYS 49 2HG LYS 49 20.456 -3.954 0.309 321 HG3 LYS 49 3HG LYS 49 21.679 -5.017 1.010 322 HD2 LYS 49 2HD LYS 49 21.814 -6.107 -1.291 323 HD3 LYS 49 3HD LYS 49 20.892 -4.720 -1.878 324 HE2 LYS 49 2HE LYS 49 23.426 -4.399 -0.297 325 HE3 LYS 49 3HE LYS 49 23.439 -4.605 -2.048 326 HZ1 LYS 49 1HZ LYS 49 21.586 -2.600 -1.178 327 HZ2 LYS 49 2HZ LYS 49 22.798 -2.510 -2.354 328 HZ3 LYS 49 3HZ LYS 49 23.177 -2.245 -0.727 329 H CYS 50 H CYS 50 19.895 -8.979 -1.164 330 HA CYS 50 HA CYS 50 17.334 -9.978 -0.101 331 HB2 CYS 50 2HB CYS 50 17.952 -10.223 -2.668 332 HB3 CYS 50 3HB CYS 50 18.886 -11.592 -2.075 333 H GLN 51 H GLN 51 17.426 -11.489 1.457 334 HA GLN 51 HA GLN 51 19.947 -12.898 1.935 335 HB2 GLN 51 2HB GLN 51 18.484 -11.778 4.290 336 HB3 GLN 51 3HB GLN 51 20.177 -12.232 4.142 337 HG2 GLN 51 2HG GLN 51 20.561 -10.045 4.010 338 HG3 GLN 51 3HG GLN 51 19.987 -10.188 2.350 339 HE21 GLN 51 1HE2 GLN 51 17.250 -10.691 3.083 340 HE22 GLN 51 2HE2 GLN 51 16.599 -9.192 3.643 341 H ARG 52 H ARG 52 19.605 -14.570 3.760 342 HA ARG 52 HA ARG 52 17.150 -16.017 3.113 343 HB2 ARG 52 2HB ARG 52 19.876 -16.759 3.941 344 HB3 ARG 52 3HB ARG 52 18.600 -17.716 4.681 345 HG2 ARG 52 2HG ARG 52 18.715 -17.271 1.719 346 HG3 ARG 52 3HG ARG 52 19.618 -18.567 2.505 347 HD2 ARG 52 2HD ARG 52 17.774 -19.800 2.857 348 HD3 ARG 52 3HD ARG 52 16.807 -18.397 3.307 349 HE ARG 52 HE ARG 52 15.959 -18.419 1.199 350 HH11 ARG 52 1HH1 ARG 52 19.095 -19.931 1.129 351 HH12 ARG 52 2HH1 ARG 52 19.010 -20.328 -0.555 352 HH21 ARG 52 1HH2 ARG 52 15.836 -18.936 -1.019 353 HH22 ARG 52 2HH2 ARG 52 17.156 -19.761 -1.777 354 H MET 53 H MET 53 15.949 -17.106 4.811 355 HA MET 53 HA MET 53 15.583 -15.373 7.099 356 HB2 MET 53 2HB MET 53 14.088 -17.718 5.967 357 HB3 MET 53 3HB MET 53 13.731 -17.130 7.585 358 HG2 MET 53 2HG MET 53 13.818 -15.019 5.578 359 HG3 MET 53 3HG MET 53 12.587 -16.242 5.267 360 HE1 MET 53 1HE MET 53 13.680 -15.632 8.975 361 HE2 MET 53 2HE MET 53 14.149 -14.132 8.174 362 HE3 MET 53 3HE MET 53 12.838 -14.129 9.355
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