NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
616012 | 5vnt | 30289 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 LEU 20 H LEU 20 19.128 -8.777 20.025 2 HA LEU 20 HA LEU 20 16.339 -7.857 20.178 3 HB2 LEU 20 2HB LEU 20 16.808 -7.407 17.659 4 HB3 LEU 20 3HB LEU 20 17.408 -6.294 18.887 5 HG LEU 20 HG LEU 20 19.631 -7.379 18.719 6 HD11 LEU 20 1HD1 LEU 20 19.871 -8.699 16.476 7 HD12 LEU 20 2HD1 LEU 20 18.160 -9.044 16.730 8 HD13 LEU 20 3HD1 LEU 20 19.346 -9.522 17.945 9 HD21 LEU 20 1HD2 LEU 20 18.538 -5.471 17.130 10 HD22 LEU 20 2HD2 LEU 20 19.102 -6.633 15.929 11 HD23 LEU 20 3HD2 LEU 20 20.235 -5.949 17.095 12 HA PRO 21 HA PRO 21 14.763 -11.586 18.486 13 HB2 PRO 21 2HB PRO 21 12.798 -10.681 16.846 14 HB3 PRO 21 3HB PRO 21 12.673 -10.640 18.608 15 HG2 PRO 21 2HG PRO 21 13.412 -8.446 16.709 16 HG3 PRO 21 3HG PRO 21 12.346 -8.388 18.125 17 HD2 PRO 21 2HD PRO 21 14.904 -7.501 18.190 18 HD3 PRO 21 3HD PRO 21 14.108 -8.225 19.602 19 H ALA 22 H ALA 22 14.995 -12.966 16.768 20 HA ALA 22 HA ALA 22 16.025 -11.821 14.256 21 HB1 ALA 22 1HB ALA 22 17.235 -13.814 16.036 22 HB2 ALA 22 2HB ALA 22 17.226 -14.256 14.328 23 HB3 ALA 22 3HB ALA 22 17.982 -12.749 14.845 24 H HIS 23 H HIS 23 15.876 -13.395 12.409 25 HA HIS 23 HA HIS 23 13.400 -14.978 12.630 26 HB2 HIS 23 2HB HIS 23 14.383 -13.733 10.071 27 HB3 HIS 23 3HB HIS 23 12.771 -14.335 10.447 28 HD1 HIS 23 HD1 HIS 23 11.786 -12.867 12.727 29 HD2 HIS 23 HD2 HIS 23 14.350 -11.044 10.014 30 HE1 HIS 23 HE1 HIS 23 11.425 -10.395 13.018 31 HA PRO 24 HA PRO 24 15.723 -18.506 11.402 32 HB2 PRO 24 2HB PRO 24 13.722 -20.010 10.351 33 HB3 PRO 24 3HB PRO 24 13.917 -19.750 12.089 34 HG2 PRO 24 2HG PRO 24 12.077 -18.382 10.164 35 HG3 PRO 24 3HG PRO 24 11.745 -18.970 11.804 36 HD2 PRO 24 2HD PRO 24 12.232 -16.362 11.262 37 HD3 PRO 24 3HD PRO 24 12.703 -17.122 12.795 38 H TYR 25 H TYR 25 16.513 -19.614 9.565 39 HA TYR 25 HA TYR 25 16.689 -18.043 7.215 40 HB2 TYR 25 2HB TYR 25 18.514 -19.507 7.932 41 HB3 TYR 25 3HB TYR 25 17.495 -20.921 7.690 42 HD1 TYR 25 HD1 TYR 25 16.788 -21.538 5.369 43 HD2 TYR 25 HD2 TYR 25 19.679 -18.509 6.123 44 HE1 TYR 25 HE1 TYR 25 17.550 -21.693 3.036 45 HE2 TYR 25 HE2 TYR 25 20.449 -18.655 3.792 46 HH TYR 25 HH TYR 25 19.176 -21.096 1.586 47 H ASP 26 H ASP 26 14.733 -20.796 8.140 48 HA ASP 26 HA ASP 26 13.815 -21.583 5.618 49 HB2 ASP 26 2HB ASP 26 13.473 -22.649 7.985 50 HB3 ASP 26 3HB ASP 26 12.014 -21.662 8.013 51 H ARG 27 H ARG 27 12.963 -18.877 7.621 52 HA ARG 27 HA ARG 27 10.682 -18.230 5.898 53 HB2 ARG 27 2HB ARG 27 10.879 -18.104 8.592 54 HB3 ARG 27 3HB ARG 27 11.356 -16.464 8.173 55 HG2 ARG 27 2HG ARG 27 9.179 -16.008 8.177 56 HG3 ARG 27 3HG ARG 27 9.128 -16.849 6.626 57 HD2 ARG 27 2HD ARG 27 7.618 -18.184 7.593 58 HD3 ARG 27 3HD ARG 27 8.992 -18.910 8.426 59 HE ARG 27 HE ARG 27 8.304 -17.913 10.377 60 HH11 ARG 27 1HH1 ARG 27 6.575 -16.532 7.689 61 HH12 ARG 27 2HH1 ARG 27 5.460 -15.658 8.686 62 HH21 ARG 27 1HH2 ARG 27 6.842 -16.767 11.701 63 HH22 ARG 27 2HH2 ARG 27 5.613 -15.792 10.968 64 H LEU 28 H LEU 28 13.937 -17.343 6.549 65 HA LEU 28 HA LEU 28 13.686 -14.751 5.245 66 HB2 LEU 28 2HB LEU 28 15.300 -15.669 7.250 67 HB3 LEU 28 3HB LEU 28 16.375 -15.737 5.855 68 HG LEU 28 HG LEU 28 15.550 -13.266 5.501 69 HD11 LEU 28 1HD1 LEU 28 14.687 -12.152 7.276 70 HD12 LEU 28 2HD1 LEU 28 15.479 -13.192 8.460 71 HD13 LEU 28 3HD1 LEU 28 14.024 -13.748 7.631 72 HD21 LEU 28 1HD2 LEU 28 17.379 -13.093 7.687 73 HD22 LEU 28 2HD2 LEU 28 17.688 -12.901 5.961 74 HD23 LEU 28 3HD2 LEU 28 17.784 -14.499 6.702 75 H LYS 29 H LYS 29 14.284 -14.319 3.202 76 HA LYS 29 HA LYS 29 15.700 -16.411 1.694 77 HB2 LYS 29 2HB LYS 29 13.048 -15.905 1.350 78 HB3 LYS 29 3HB LYS 29 13.751 -14.799 0.176 79 HG2 LYS 29 2HG LYS 29 13.820 -16.513 -1.228 80 HG3 LYS 29 3HG LYS 29 15.122 -17.169 -0.233 81 HD2 LYS 29 2HD LYS 29 13.491 -18.886 -0.475 82 HD3 LYS 29 3HD LYS 29 13.354 -18.270 1.174 83 HE2 LYS 29 2HE LYS 29 11.653 -16.750 -0.547 84 HE3 LYS 29 3HE LYS 29 11.338 -18.467 -0.793 85 HZ1 LYS 29 1HZ LYS 29 10.344 -16.928 1.223 86 HZ2 LYS 29 2HZ LYS 29 11.592 -17.787 1.974 87 HZ3 LYS 29 3HZ LYS 29 10.353 -18.620 1.179 88 H THR 30 H THR 30 16.636 -15.564 -0.372 89 HA THR 30 HA THR 30 18.304 -13.361 0.143 90 HB THR 30 HB THR 30 17.960 -13.929 -2.702 91 HG1 THR 30 HG1 THR 30 17.474 -15.993 -2.257 92 HG21 THR 30 1HG2 THR 30 20.432 -14.639 -2.260 93 HG22 THR 30 2HG2 THR 30 20.166 -13.900 -0.681 94 HG23 THR 30 3HG2 THR 30 19.978 -12.939 -2.148 95 H THR 31 H THR 31 15.353 -13.677 -1.781 96 HA THR 31 HA THR 31 15.209 -10.737 -1.892 97 HB THR 31 HB THR 31 13.972 -11.048 -4.095 98 HG1 THR 31 HG1 THR 31 15.376 -13.477 -4.337 99 HG21 THR 31 1HG2 THR 31 16.869 -11.295 -3.593 100 HG22 THR 31 2HG2 THR 31 15.982 -10.120 -4.563 101 HG23 THR 31 3HG2 THR 31 16.335 -11.718 -5.220 102 H SER 32 H SER 32 14.046 -12.199 0.143 103 HA SER 32 HA SER 32 11.247 -12.604 -0.536 104 HB2 SER 32 2HB SER 32 11.727 -14.226 0.994 105 HB3 SER 32 3HB SER 32 13.005 -13.278 1.753 106 HG SER 32 HG SER 32 11.497 -12.181 2.927 107 H THR 33 H THR 33 9.528 -11.477 0.446 108 HA THR 33 HA THR 33 10.257 -8.766 1.330 109 HB THR 33 HB THR 33 7.453 -9.108 0.650 110 HG1 THR 33 HG1 THR 33 9.362 -9.573 -1.418 111 HG21 THR 33 1HG2 THR 33 9.136 -7.397 -1.031 112 HG22 THR 33 2HG2 THR 33 9.294 -7.083 0.698 113 HG23 THR 33 3HG2 THR 33 7.711 -6.995 -0.074 114 H ASP 34 H ASP 34 9.656 -11.515 2.763 115 HA ASP 34 HA ASP 34 7.418 -11.296 4.363 116 HB2 ASP 34 2HB ASP 34 10.060 -12.623 4.636 117 HB3 ASP 34 3HB ASP 34 9.108 -12.443 6.107 118 HA PRO 35 HA PRO 35 8.016 -8.005 7.198 119 HB2 PRO 35 2HB PRO 35 7.046 -9.040 9.512 120 HB3 PRO 35 3HB PRO 35 6.010 -8.588 8.153 121 HG2 PRO 35 2HG PRO 35 7.023 -11.291 8.945 122 HG3 PRO 35 3HG PRO 35 5.403 -10.819 8.401 123 HD2 PRO 35 2HD PRO 35 7.205 -11.998 6.760 124 HD3 PRO 35 3HD PRO 35 6.012 -10.819 6.178 125 H VAL 36 H VAL 36 9.283 -7.228 8.931 126 HA VAL 36 HA VAL 36 11.169 -9.119 10.143 127 HB VAL 36 HB VAL 36 12.943 -7.258 9.813 128 HG11 VAL 36 1HG1 VAL 36 12.915 -9.546 8.790 129 HG12 VAL 36 2HG1 VAL 36 12.118 -8.838 7.384 130 HG13 VAL 36 3HG1 VAL 36 13.742 -8.317 7.834 131 HG21 VAL 36 1HG2 VAL 36 12.694 -5.902 7.839 132 HG22 VAL 36 2HG2 VAL 36 11.131 -6.636 7.483 133 HG23 VAL 36 3HG2 VAL 36 11.321 -5.612 8.907 134 H SER 37 H SER 37 12.541 -7.906 11.846 135 HA SER 37 HA SER 37 10.665 -6.501 13.566 136 HB2 SER 37 2HB SER 37 12.409 -8.428 14.171 137 HB3 SER 37 3HB SER 37 13.465 -7.040 14.434 138 HG SER 37 HG SER 37 10.881 -7.224 15.571 139 H ASP 38 H ASP 38 12.327 -5.415 11.144 140 HA ASP 38 HA ASP 38 13.128 -3.375 10.528 141 HB2 ASP 38 2HB ASP 38 11.234 -2.667 12.155 142 HB3 ASP 38 3HB ASP 38 12.545 -2.307 13.275 143 H ILE 39 H ILE 39 15.196 -4.569 10.600 144 HA ILE 39 HA ILE 39 17.009 -3.356 12.578 145 HB ILE 39 HB ILE 39 18.199 -5.758 11.735 146 HG12 ILE 39 2HG1 ILE 39 15.323 -6.152 12.589 147 HG13 ILE 39 3HG1 ILE 39 16.012 -6.572 11.025 148 HG21 ILE 39 1HG2 ILE 39 16.818 -5.415 14.371 149 HG22 ILE 39 2HG2 ILE 39 18.352 -6.207 14.013 150 HG23 ILE 39 3HG2 ILE 39 18.232 -4.448 13.950 151 HD11 ILE 39 1HD1 ILE 39 16.121 -7.996 13.583 152 HD12 ILE 39 2HD1 ILE 39 16.175 -8.611 11.931 153 HD13 ILE 39 3HD1 ILE 39 17.634 -7.961 12.678 154 H ASP 40 H ASP 40 19.406 -4.181 11.631 155 HA ASP 40 HA ASP 40 20.080 -2.402 9.673 156 HB2 ASP 40 2HB ASP 40 21.375 -5.099 10.130 157 HB3 ASP 40 3HB ASP 40 22.116 -3.726 9.313 158 H VAL 41 H VAL 41 18.818 -2.248 7.882 159 HA VAL 41 HA VAL 41 17.774 -4.377 6.394 160 HB VAL 41 HB VAL 41 18.442 -1.578 5.475 161 HG11 VAL 41 1HG1 VAL 41 16.524 -2.187 3.819 162 HG12 VAL 41 2HG1 VAL 41 18.176 -2.706 3.478 163 HG13 VAL 41 3HG1 VAL 41 17.014 -3.847 4.156 164 HG21 VAL 41 1HG2 VAL 41 16.111 -1.086 5.902 165 HG22 VAL 41 2HG2 VAL 41 15.822 -2.752 6.404 166 HG23 VAL 41 3HG2 VAL 41 16.865 -1.709 7.370 167 H THR 42 H THR 42 20.780 -2.546 6.014 168 HA THR 42 HA THR 42 21.604 -3.777 3.607 169 HB THR 42 HB THR 42 22.608 -1.686 4.292 170 HG1 THR 42 HG1 THR 42 23.990 -2.898 3.043 171 HG21 THR 42 1HG2 THR 42 24.458 -2.369 6.270 172 HG22 THR 42 2HG2 THR 42 22.931 -3.070 6.807 173 HG23 THR 42 3HG2 THR 42 23.035 -1.345 6.456 174 H ARG 43 H ARG 43 21.524 -4.891 6.832 175 HA ARG 43 HA ARG 43 23.283 -7.146 6.117 176 HB2 ARG 43 2HB ARG 43 22.765 -6.165 8.923 177 HB3 ARG 43 3HB ARG 43 23.974 -7.329 8.396 178 HG2 ARG 43 2HG ARG 43 24.904 -5.357 6.998 179 HG3 ARG 43 3HG ARG 43 23.958 -4.358 8.103 180 HD2 ARG 43 2HD ARG 43 25.963 -6.420 9.000 181 HD3 ARG 43 3HD ARG 43 26.347 -4.714 8.774 182 HE ARG 43 HE ARG 43 24.111 -5.145 10.514 183 HH11 ARG 43 1HH1 ARG 43 27.584 -5.009 10.327 184 HH12 ARG 43 2HH1 ARG 43 27.789 -4.610 12.001 185 HH21 ARG 43 1HH2 ARG 43 24.367 -4.620 12.719 186 HH22 ARG 43 2HH2 ARG 43 25.959 -4.390 13.361 187 H ARG 44 H ARG 44 20.658 -7.258 5.380 188 HA ARG 44 HA ARG 44 18.786 -8.230 7.152 189 HB2 ARG 44 2HB ARG 44 18.266 -7.733 4.820 190 HB3 ARG 44 3HB ARG 44 19.254 -9.089 4.292 191 HG2 ARG 44 2HG ARG 44 17.400 -10.303 4.310 192 HG3 ARG 44 3HG ARG 44 17.460 -10.219 6.072 193 HD2 ARG 44 2HD ARG 44 15.546 -9.095 6.058 194 HD3 ARG 44 3HD ARG 44 16.338 -7.794 5.169 195 HE ARG 44 HE ARG 44 14.559 -9.804 4.104 196 HH11 ARG 44 1HH1 ARG 44 17.007 -7.431 3.400 197 HH12 ARG 44 2HH1 ARG 44 16.536 -7.246 1.743 198 HH21 ARG 44 1HH2 ARG 44 13.929 -9.569 1.925 199 HH22 ARG 44 2HH2 ARG 44 14.784 -8.461 0.905 200 H GLU 45 H GLU 45 21.426 -9.956 5.571 201 HA GLU 45 HA GLU 45 20.740 -12.566 6.246 202 HB2 GLU 45 2HB GLU 45 23.009 -13.149 5.826 203 HB3 GLU 45 3HB GLU 45 22.612 -11.835 4.728 204 HG2 GLU 45 2HG GLU 45 24.066 -11.487 7.338 205 HG3 GLU 45 3HG GLU 45 24.851 -11.644 5.768 206 H ALA 46 H ALA 46 22.128 -10.021 8.182 207 HA ALA 46 HA ALA 46 23.043 -11.648 10.323 208 HB1 ALA 46 1HB ALA 46 22.238 -8.747 10.450 209 HB2 ALA 46 2HB ALA 46 23.316 -9.608 11.549 210 HB3 ALA 46 3HB ALA 46 23.806 -9.320 9.880 211 H TYR 47 H TYR 47 19.941 -10.740 9.302 212 HA TYR 47 HA TYR 47 18.565 -10.509 11.735 213 HB2 TYR 47 2HB TYR 47 17.614 -11.507 9.045 214 HB3 TYR 47 3HB TYR 47 16.550 -11.145 10.400 215 HD1 TYR 47 HD1 TYR 47 15.840 -9.766 8.093 216 HD2 TYR 47 HD2 TYR 47 18.996 -8.809 10.782 217 HE1 TYR 47 HE1 TYR 47 15.730 -7.416 7.376 218 HE2 TYR 47 HE2 TYR 47 18.894 -6.456 10.073 219 HH TYR 47 HH TYR 47 16.536 -5.034 8.749 220 H LEU 48 H LEU 48 20.103 -13.178 10.349 221 HA LEU 48 HA LEU 48 18.391 -15.181 11.552 222 HB2 LEU 48 2HB LEU 48 20.504 -15.115 9.591 223 HB3 LEU 48 3HB LEU 48 20.798 -16.375 10.788 224 HG LEU 48 HG LEU 48 18.240 -16.116 9.213 225 HD11 LEU 48 1HD1 LEU 48 19.959 -18.364 8.572 226 HD12 LEU 48 2HD1 LEU 48 20.706 -16.813 8.189 227 HD13 LEU 48 3HD1 LEU 48 19.134 -17.227 7.505 228 HD21 LEU 48 1HD2 LEU 48 19.171 -17.820 11.390 229 HD22 LEU 48 2HD2 LEU 48 18.561 -18.723 10.003 230 HD23 LEU 48 3HD2 LEU 48 17.536 -17.526 10.797 231 H SER 49 H SER 49 19.331 -16.841 13.003 232 HA SER 49 HA SER 49 20.525 -15.597 15.270 233 HB2 SER 49 2HB SER 49 19.526 -18.315 14.593 234 HB3 SER 49 3HB SER 49 20.682 -18.193 15.918 235 HG SER 49 HG SER 49 18.061 -17.481 15.837 236 H SER 50 H SER 50 22.526 -16.115 16.269 237 HA SER 50 HA SER 50 24.752 -16.029 14.643 238 HB2 SER 50 2HB SER 50 26.071 -16.539 16.627 239 HB3 SER 50 3HB SER 50 24.742 -15.463 17.061 240 HG SER 50 HG SER 50 23.737 -17.086 18.086 241 H GLU 51 H GLU 51 22.936 -18.791 15.732 242 HA GLU 51 HA GLU 51 24.929 -20.732 15.030 243 HB2 GLU 51 2HB GLU 51 21.972 -21.190 15.428 244 HB3 GLU 51 3HB GLU 51 23.257 -22.385 15.533 245 HG2 GLU 51 2HG GLU 51 23.988 -20.459 17.376 246 HG3 GLU 51 3HG GLU 51 22.237 -20.574 17.545 247 H GLU 52 H GLU 52 21.729 -19.957 13.651 248 HA GLU 52 HA GLU 52 22.039 -21.511 11.334 249 HB2 GLU 52 2HB GLU 52 20.219 -19.317 12.189 250 HB3 GLU 52 3HB GLU 52 20.288 -19.690 10.472 251 HG2 GLU 52 2HG GLU 52 19.753 -21.748 12.596 252 HG3 GLU 52 3HG GLU 52 18.486 -20.856 11.755 253 H PHE 53 H PHE 53 22.417 -17.996 11.784 254 HA PHE 53 HA PHE 53 23.156 -17.280 9.235 255 HB2 PHE 53 2HB PHE 53 22.846 -15.515 10.751 256 HB3 PHE 53 3HB PHE 53 23.957 -16.209 11.927 257 HD1 PHE 53 HD1 PHE 53 26.380 -16.037 11.597 258 HD2 PHE 53 HD2 PHE 53 23.624 -14.149 8.960 259 HE1 PHE 53 HE1 PHE 53 28.193 -14.624 10.719 260 HE2 PHE 53 HE2 PHE 53 25.433 -12.734 8.077 261 HZ PHE 53 HZ PHE 53 27.721 -12.971 8.956 262 H LYS 54 H LYS 54 25.388 -18.162 11.873 263 HA LYS 54 HA LYS 54 27.697 -18.176 10.237 264 HB2 LYS 54 2HB LYS 54 28.852 -18.808 12.124 265 HB3 LYS 54 3HB LYS 54 27.414 -18.105 12.853 266 HG2 LYS 54 2HG LYS 54 26.450 -20.352 13.080 267 HG3 LYS 54 3HG LYS 54 27.926 -21.038 12.396 268 HD2 LYS 54 2HD LYS 54 29.140 -19.798 14.289 269 HD3 LYS 54 3HD LYS 54 27.543 -19.635 15.024 270 HE2 LYS 54 2HE LYS 54 27.626 -22.291 14.334 271 HE3 LYS 54 3HE LYS 54 29.290 -21.967 14.817 272 HZ1 LYS 54 1HZ LYS 54 27.873 -22.693 16.670 273 HZ2 LYS 54 2HZ LYS 54 26.902 -21.325 16.461 274 HZ3 LYS 54 3HZ LYS 54 28.519 -21.150 16.925 275 H GLU 55 H GLU 55 25.204 -20.495 10.818 276 HA GLU 55 HA GLU 55 26.697 -22.796 9.992 277 HB2 GLU 55 2HB GLU 55 23.873 -22.204 10.694 278 HB3 GLU 55 3HB GLU 55 24.158 -23.597 9.660 279 HG2 GLU 55 2HG GLU 55 25.701 -23.250 12.195 280 HG3 GLU 55 3HG GLU 55 24.069 -23.914 12.217 281 H LYS 56 H LYS 56 24.871 -20.318 8.402 282 HA LYS 56 HA LYS 56 24.747 -21.807 5.899 283 HB2 LYS 56 2HB LYS 56 23.439 -19.419 7.013 284 HB3 LYS 56 3HB LYS 56 23.844 -19.295 5.306 285 HG2 LYS 56 2HG LYS 56 21.577 -20.122 5.635 286 HG3 LYS 56 3HG LYS 56 22.594 -21.327 4.842 287 HD2 LYS 56 2HD LYS 56 22.586 -21.513 7.763 288 HD3 LYS 56 3HD LYS 56 21.006 -21.783 7.024 289 HE2 LYS 56 2HE LYS 56 23.038 -23.160 5.537 290 HE3 LYS 56 3HE LYS 56 23.143 -23.595 7.242 291 HZ1 LYS 56 1HZ LYS 56 21.628 -25.102 6.412 292 HZ2 LYS 56 2HZ LYS 56 20.903 -23.985 5.369 293 HZ3 LYS 56 3HZ LYS 56 20.611 -23.901 7.033 294 H PHE 57 H PHE 57 26.504 -19.180 7.390 295 HA PHE 57 HA PHE 57 27.946 -18.669 4.890 296 HB2 PHE 57 2HB PHE 57 27.910 -17.143 7.501 297 HB3 PHE 57 3HB PHE 57 28.870 -16.696 6.095 298 HD1 PHE 57 HD1 PHE 57 27.469 -16.479 3.858 299 HD2 PHE 57 HD2 PHE 57 25.874 -16.131 7.789 300 HE1 PHE 57 HE1 PHE 57 25.568 -15.193 2.970 301 HE2 PHE 57 HE2 PHE 57 23.971 -14.845 6.908 302 HZ PHE 57 HZ PHE 57 23.816 -14.375 4.495 303 H GLY 58 H GLY 58 28.209 -20.449 7.727 304 HA2 GLY 58 2HA GLY 58 29.910 -21.779 8.524 305 HA3 GLY 58 3HA GLY 58 30.833 -21.348 7.092 306 H MET 59 H MET 59 29.812 -18.583 8.678 307 HA MET 59 HA MET 59 32.224 -18.451 10.345 308 HB2 MET 59 2HB MET 59 31.412 -16.060 8.737 309 HB3 MET 59 3HB MET 59 32.980 -16.454 9.429 310 HG2 MET 59 2HG MET 59 32.811 -18.459 7.702 311 HG3 MET 59 3HG MET 59 31.758 -17.314 6.874 312 HE1 MET 59 1HE MET 59 34.936 -18.562 7.822 313 HE2 MET 59 2HE MET 59 36.093 -17.711 6.798 314 HE3 MET 59 3HE MET 59 35.767 -17.130 8.432 315 H THR 60 H THR 60 32.002 -17.340 12.233 316 HA THR 60 HA THR 60 29.382 -16.875 13.211 317 HB THR 60 HB THR 60 31.457 -15.544 14.758 318 HG1 THR 60 HG1 THR 60 32.399 -17.754 15.239 319 HG21 THR 60 1HG2 THR 60 29.696 -16.121 16.076 320 HG22 THR 60 2HG2 THR 60 30.642 -17.596 16.276 321 HG23 THR 60 3HG2 THR 60 29.311 -17.553 15.121 322 H LYS 61 H LYS 61 29.373 -14.614 14.662 323 HA LYS 61 HA LYS 61 28.723 -12.627 12.761 324 HB2 LYS 61 2HB LYS 61 28.579 -12.959 15.645 325 HB3 LYS 61 3HB LYS 61 29.018 -11.315 15.201 326 HG2 LYS 61 2HG LYS 61 27.018 -11.488 13.563 327 HG3 LYS 61 3HG LYS 61 26.520 -12.834 14.592 328 HD2 LYS 61 2HD LYS 61 27.310 -10.504 16.135 329 HD3 LYS 61 3HD LYS 61 25.990 -10.148 15.018 330 HE2 LYS 61 2HE LYS 61 25.662 -12.681 16.428 331 HE3 LYS 61 3HE LYS 61 25.737 -11.290 17.508 332 HZ1 LYS 61 1HZ LYS 61 24.081 -10.468 15.518 333 HZ2 LYS 61 2HZ LYS 61 23.591 -11.038 17.033 334 HZ3 LYS 61 3HZ LYS 61 23.652 -12.093 15.711 335 H GLU 62 H GLU 62 31.335 -12.742 15.188 336 HA GLU 62 HA GLU 62 32.625 -10.406 14.219 337 HB2 GLU 62 2HB GLU 62 32.899 -12.123 16.426 338 HB3 GLU 62 3HB GLU 62 34.437 -12.195 15.578 339 HG2 GLU 62 2HG GLU 62 34.627 -9.772 15.685 340 HG3 GLU 62 3HG GLU 62 33.069 -9.679 16.504 341 H ALA 63 H ALA 63 32.828 -13.791 13.424 342 HA ALA 63 HA ALA 63 35.304 -13.636 12.005 343 HB1 ALA 63 1HB ALA 63 34.883 -15.877 11.327 344 HB2 ALA 63 2HB ALA 63 34.334 -15.725 12.997 345 HB3 ALA 63 3HB ALA 63 33.162 -15.726 11.679 346 H PHE 64 H PHE 64 31.891 -13.734 11.011 347 HA PHE 64 HA PHE 64 32.451 -13.504 8.233 348 HB2 PHE 64 2HB PHE 64 30.332 -14.432 9.233 349 HB3 PHE 64 3HB PHE 64 29.874 -12.780 9.633 350 HD1 PHE 64 HD1 PHE 64 29.437 -11.149 7.825 351 HD2 PHE 64 HD2 PHE 64 30.116 -15.276 7.032 352 HE1 PHE 64 HE1 PHE 64 28.461 -10.875 5.583 353 HE2 PHE 64 HE2 PHE 64 29.142 -15.008 4.788 354 HZ PHE 64 HZ PHE 64 28.314 -12.806 4.061 355 H TYR 65 H TYR 65 31.134 -11.167 10.582 356 HA TYR 65 HA TYR 65 30.997 -8.948 8.957 357 HB2 TYR 65 2HB TYR 65 31.585 -9.215 11.899 358 HB3 TYR 65 3HB TYR 65 31.442 -7.642 11.122 359 HD1 TYR 65 HD1 TYR 65 29.223 -8.094 9.245 360 HD2 TYR 65 HD2 TYR 65 29.711 -9.386 13.270 361 HE1 TYR 65 HE1 TYR 65 26.779 -8.183 9.507 362 HE2 TYR 65 HE2 TYR 65 27.268 -9.479 13.542 363 HH TYR 65 HH TYR 65 25.295 -9.150 12.589 364 H LYS 66 H LYS 66 33.798 -10.443 10.386 365 HA LYS 66 HA LYS 66 35.641 -8.356 10.212 366 HB2 LYS 66 2HB LYS 66 35.701 -11.176 10.685 367 HB3 LYS 66 3HB LYS 66 36.972 -10.773 9.538 368 HG2 LYS 66 2HG LYS 66 36.623 -9.234 12.085 369 HG3 LYS 66 3HG LYS 66 37.539 -10.742 12.030 370 HD2 LYS 66 2HD LYS 66 39.294 -9.751 11.059 371 HD3 LYS 66 3HD LYS 66 38.273 -8.906 9.894 372 HE2 LYS 66 2HE LYS 66 39.154 -7.139 11.069 373 HE3 LYS 66 3HE LYS 66 37.661 -7.423 11.962 374 HZ1 LYS 66 1HZ LYS 66 40.424 -7.886 12.767 375 HZ2 LYS 66 2HZ LYS 66 39.282 -9.016 13.297 376 HZ3 LYS 66 3HZ LYS 66 39.098 -7.380 13.688 377 H LEU 67 H LEU 67 34.642 -10.733 7.787 378 HA LEU 67 HA LEU 67 36.464 -10.198 5.785 379 HB2 LEU 67 2HB LEU 67 33.612 -11.075 5.782 380 HB3 LEU 67 3HB LEU 67 34.405 -10.708 4.252 381 HG LEU 67 HG LEU 67 35.377 -12.763 6.236 382 HD11 LEU 67 1HD1 LEU 67 33.329 -12.875 4.165 383 HD12 LEU 67 2HD1 LEU 67 33.683 -14.000 5.476 384 HD13 LEU 67 3HD1 LEU 67 34.593 -14.089 3.968 385 HD21 LEU 67 1HD2 LEU 67 37.141 -11.816 4.842 386 HD22 LEU 67 2HD2 LEU 67 36.198 -12.169 3.394 387 HD23 LEU 67 3HD2 LEU 67 36.808 -13.489 4.393 388 HA PRO 68 HA PRO 68 35.678 -6.190 4.183 389 HB2 PRO 68 2HB PRO 68 35.919 -6.567 1.505 390 HB3 PRO 68 3HB PRO 68 37.300 -6.602 2.608 391 HG2 PRO 68 2HG PRO 68 35.760 -8.882 1.428 392 HG3 PRO 68 3HG PRO 68 37.513 -8.699 1.625 393 HD2 PRO 68 2HD PRO 68 36.004 -10.183 3.314 394 HD3 PRO 68 3HD PRO 68 37.453 -9.306 3.847 395 H LYS 69 H LYS 69 34.319 -4.933 2.610 396 HA LYS 69 HA LYS 69 31.597 -5.642 2.899 397 HB2 LYS 69 2HB LYS 69 33.103 -3.451 1.557 398 HB3 LYS 69 3HB LYS 69 31.431 -3.705 1.073 399 HG2 LYS 69 2HG LYS 69 31.098 -2.213 2.745 400 HG3 LYS 69 3HG LYS 69 31.059 -3.700 3.695 401 HD2 LYS 69 2HD LYS 69 33.625 -3.309 3.909 402 HD3 LYS 69 3HD LYS 69 33.225 -1.648 3.469 403 HE2 LYS 69 2HE LYS 69 31.471 -1.796 5.342 404 HE3 LYS 69 3HE LYS 69 32.362 -3.221 5.874 405 HZ1 LYS 69 1HZ LYS 69 34.330 -1.895 6.133 406 HZ2 LYS 69 2HZ LYS 69 33.069 -1.172 6.998 407 HZ3 LYS 69 3HZ LYS 69 33.554 -0.526 5.512 408 H TRP 70 H TRP 70 33.755 -5.599 0.076 409 HA TRP 70 HA TRP 70 31.907 -6.394 -1.850 410 HB2 TRP 70 2HB TRP 70 33.747 -6.873 -3.246 411 HB3 TRP 70 3HB TRP 70 34.323 -5.603 -2.169 412 HD1 TRP 70 HD1 TRP 70 36.210 -6.250 -0.402 413 HE1 TRP 70 HE1 TRP 70 37.815 -8.256 -0.242 414 HE3 TRP 70 HE3 TRP 70 33.906 -9.399 -3.705 415 HZ2 TRP 70 HZ2 TRP 70 38.071 -10.832 -1.368 416 HZ3 TRP 70 HZ3 TRP 70 34.896 -11.616 -4.108 417 HH2 TRP 70 HH2 TRP 70 36.936 -12.315 -2.963 418 H LYS 71 H LYS 71 33.913 -8.342 0.319 419 HA LYS 71 HA LYS 71 33.009 -10.839 -0.765 420 HB2 LYS 71 2HB LYS 71 35.226 -10.517 0.346 421 HB3 LYS 71 3HB LYS 71 34.384 -10.319 1.877 422 HG2 LYS 71 2HG LYS 71 34.382 -12.509 2.171 423 HG3 LYS 71 3HG LYS 71 33.473 -12.724 0.674 424 HD2 LYS 71 2HD LYS 71 35.385 -13.088 -0.585 425 HD3 LYS 71 3HD LYS 71 36.429 -12.271 0.580 426 HE2 LYS 71 2HE LYS 71 36.814 -14.164 1.694 427 HE3 LYS 71 3HE LYS 71 35.099 -14.568 1.742 428 HZ1 LYS 71 1HZ LYS 71 36.938 -15.078 -0.533 429 HZ2 LYS 71 2HZ LYS 71 35.288 -15.449 -0.506 430 HZ3 LYS 71 3HZ LYS 71 36.350 -16.241 0.545 431 H GLN 72 H GLN 72 32.114 -8.776 1.930 432 HA GLN 72 HA GLN 72 30.466 -10.595 3.302 433 HB2 GLN 72 2HB GLN 72 30.902 -7.682 3.299 434 HB3 GLN 72 3HB GLN 72 29.304 -8.188 3.832 435 HG2 GLN 72 2HG GLN 72 30.838 -9.892 5.242 436 HG3 GLN 72 3HG GLN 72 31.924 -8.508 5.125 437 HE21 GLN 72 1HE2 GLN 72 31.390 -6.597 6.145 438 HE22 GLN 72 2HE2 GLN 72 30.124 -6.487 7.315 439 H ASN 73 H ASN 73 29.825 -8.373 0.639 440 HA ASN 73 HA ASN 73 27.003 -8.860 0.609 441 HB2 ASN 73 2HB ASN 73 28.899 -7.188 -0.832 442 HB3 ASN 73 3HB ASN 73 27.699 -7.897 -1.910 443 HD21 ASN 73 1HD2 ASN 73 26.733 -5.917 -2.302 444 HD22 ASN 73 2HD2 ASN 73 25.759 -5.115 -1.121 445 H LYS 74 H LYS 74 29.798 -10.327 -0.836 446 HA LYS 74 HA LYS 74 28.425 -11.734 -2.901 447 HB2 LYS 74 2HB LYS 74 31.127 -12.124 -1.614 448 HB3 LYS 74 3HB LYS 74 30.543 -13.127 -2.936 449 HG2 LYS 74 2HG LYS 74 30.521 -10.174 -3.282 450 HG3 LYS 74 3HG LYS 74 32.062 -11.030 -3.373 451 HD2 LYS 74 2HD LYS 74 30.789 -12.608 -5.000 452 HD3 LYS 74 3HD LYS 74 29.655 -11.262 -5.138 453 HE2 LYS 74 2HE LYS 74 31.010 -10.406 -6.682 454 HE3 LYS 74 3HE LYS 74 32.168 -10.097 -5.389 455 HZ1 LYS 74 1HZ LYS 74 32.727 -11.571 -7.517 456 HZ2 LYS 74 2HZ LYS 74 32.158 -12.788 -6.490 457 HZ3 LYS 74 3HZ LYS 74 33.459 -11.817 -6.012 458 H PHE 75 H PHE 75 29.758 -12.764 0.241 459 HA PHE 75 HA PHE 75 28.809 -15.397 0.144 460 HB2 PHE 75 2HB PHE 75 30.167 -13.736 2.017 461 HB3 PHE 75 3HB PHE 75 28.821 -14.502 2.854 462 HD1 PHE 75 HD1 PHE 75 28.665 -17.108 1.556 463 HD2 PHE 75 HD2 PHE 75 32.069 -14.836 2.727 464 HE1 PHE 75 HE1 PHE 75 29.974 -19.181 1.765 465 HE2 PHE 75 HE2 PHE 75 33.383 -16.905 2.937 466 HZ PHE 75 HZ PHE 75 32.336 -19.082 2.454 467 H LYS 76 H LYS 76 27.330 -12.435 1.369 468 HA LYS 76 HA LYS 76 25.148 -13.378 2.715 469 HB2 LYS 76 2HB LYS 76 25.764 -10.948 1.185 470 HB3 LYS 76 3HB LYS 76 24.045 -11.295 1.313 471 HG2 LYS 76 2HG LYS 76 24.003 -10.969 3.572 472 HG3 LYS 76 3HG LYS 76 25.695 -11.425 3.781 473 HD2 LYS 76 2HD LYS 76 25.847 -9.173 2.206 474 HD3 LYS 76 3HD LYS 76 24.505 -8.807 3.293 475 HE2 LYS 76 2HE LYS 76 26.390 -9.913 4.968 476 HE3 LYS 76 3HE LYS 76 27.365 -8.980 3.834 477 HZ1 LYS 76 1HZ LYS 76 26.788 -7.143 4.894 478 HZ2 LYS 76 2HZ LYS 76 25.874 -8.041 5.998 479 HZ3 LYS 76 3HZ LYS 76 25.150 -7.438 4.593 480 H MET 77 H MET 77 25.103 -12.559 -0.761 481 HA MET 77 HA MET 77 22.606 -13.810 -1.229 482 HB2 MET 77 2HB MET 77 23.172 -13.534 -3.628 483 HB3 MET 77 3HB MET 77 23.382 -12.056 -2.699 484 HG2 MET 77 2HG MET 77 25.815 -12.575 -2.561 485 HG3 MET 77 3HG MET 77 25.533 -13.921 -3.663 486 HE1 MET 77 1HE MET 77 26.458 -12.297 -6.821 487 HE2 MET 77 2HE MET 77 27.078 -13.286 -5.499 488 HE3 MET 77 3HE MET 77 25.528 -13.680 -6.244 489 H ALA 78 H ALA 78 25.881 -14.956 -1.192 490 HA ALA 78 HA ALA 78 25.731 -17.222 -2.777 491 HB1 ALA 78 1HB ALA 78 27.220 -17.196 -0.171 492 HB2 ALA 78 2HB ALA 78 27.653 -17.990 -1.685 493 HB3 ALA 78 3HB ALA 78 27.747 -16.234 -1.553 494 H VAL 79 H VAL 79 24.754 -16.789 0.597 495 HA VAL 79 HA VAL 79 23.762 -19.540 0.687 496 HB VAL 79 HB VAL 79 23.735 -19.408 2.991 497 HG11 VAL 79 1HG1 VAL 79 26.029 -19.141 2.117 498 HG12 VAL 79 2HG1 VAL 79 25.860 -17.391 2.274 499 HG13 VAL 79 3HG1 VAL 79 25.817 -18.416 3.710 500 HG21 VAL 79 1HG2 VAL 79 23.409 -16.439 2.645 501 HG22 VAL 79 2HG2 VAL 79 22.281 -17.588 3.364 502 HG23 VAL 79 3HG2 VAL 79 23.776 -17.177 4.204 503 H GLN 80 H GLN 80 22.563 -17.034 -0.701 504 HA GLN 80 HA GLN 80 20.459 -16.378 -1.277 505 HB2 GLN 80 2HB GLN 80 19.358 -18.454 0.606 506 HB3 GLN 80 3HB GLN 80 18.606 -17.784 -0.836 507 HG2 GLN 80 2HG GLN 80 20.172 -18.939 -2.249 508 HG3 GLN 80 3HG GLN 80 21.066 -19.516 -0.844 509 HE21 GLN 80 1HE2 GLN 80 20.593 -21.468 -0.138 510 HE22 GLN 80 2HE2 GLN 80 19.144 -22.347 -0.474 511 H LEU 81 H LEU 81 21.901 -15.289 1.021 512 HA LEU 81 HA LEU 81 19.598 -14.208 2.505 513 HB2 LEU 81 2HB LEU 81 22.298 -15.055 3.481 514 HB3 LEU 81 3HB LEU 81 21.382 -13.820 4.344 515 HG LEU 81 HG LEU 81 20.603 -16.699 3.905 516 HD11 LEU 81 1HD1 LEU 81 21.040 -17.045 6.125 517 HD12 LEU 81 2HD1 LEU 81 20.807 -15.350 6.551 518 HD13 LEU 81 3HD1 LEU 81 22.285 -15.858 5.735 519 HD21 LEU 81 1HD2 LEU 81 18.586 -15.490 3.705 520 HD22 LEU 81 2HD2 LEU 81 19.033 -14.380 5.002 521 HD23 LEU 81 3HD2 LEU 81 18.644 -16.061 5.373 522 H PHE 82 H PHE 82 19.351 -12.350 1.333 523 HA PHE 82 HA PHE 82 21.391 -10.319 1.734 524 HB2 PHE 82 2HB PHE 82 21.872 -11.413 -0.482 525 HB3 PHE 82 3HB PHE 82 20.300 -10.845 -1.034 526 HD1 PHE 82 HD1 PHE 82 19.968 -8.599 -1.701 527 HD2 PHE 82 HD2 PHE 82 23.644 -9.781 0.089 528 HE1 PHE 82 HE1 PHE 82 20.973 -6.451 -2.355 529 HE2 PHE 82 HE2 PHE 82 24.655 -7.634 -0.561 530 HZ PHE 82 HZ PHE 82 23.319 -5.965 -1.784 Start of MODEL 2 1 H1 LEU 20 H LEU 20 15.223 -6.824 19.513 2 HA LEU 20 HA LEU 20 12.735 -8.267 20.117 3 HB2 LEU 20 2HB LEU 20 13.728 -6.779 17.727 4 HB3 LEU 20 3HB LEU 20 12.534 -8.058 17.516 5 HG LEU 20 HG LEU 20 11.507 -5.836 17.609 6 HD11 LEU 20 1HD1 LEU 20 9.815 -6.337 19.291 7 HD12 LEU 20 2HD1 LEU 20 10.874 -7.553 20.004 8 HD13 LEU 20 3HD1 LEU 20 10.246 -7.780 18.372 9 HD21 LEU 20 1HD2 LEU 20 11.678 -4.387 19.410 10 HD22 LEU 20 2HD2 LEU 20 13.323 -5.005 19.254 11 HD23 LEU 20 3HD2 LEU 20 12.253 -5.648 20.501 12 HA PRO 21 HA PRO 21 14.390 -12.151 18.924 13 HB2 PRO 21 2HB PRO 21 12.308 -13.278 17.594 14 HB3 PRO 21 3HB PRO 21 12.319 -13.052 19.347 15 HG2 PRO 21 2HG PRO 21 11.015 -11.385 17.230 16 HG3 PRO 21 3HG PRO 21 10.375 -11.899 18.802 17 HD2 PRO 21 2HD PRO 21 11.381 -9.421 18.379 18 HD3 PRO 21 3HD PRO 21 11.506 -10.248 19.945 19 H ALA 22 H ALA 22 15.033 -13.497 17.122 20 HA ALA 22 HA ALA 22 15.474 -11.916 14.700 21 HB1 ALA 22 1HB ALA 22 16.794 -14.465 14.663 22 HB2 ALA 22 2HB ALA 22 17.491 -12.844 14.672 23 HB3 ALA 22 3HB ALA 22 17.099 -13.643 16.194 24 H HIS 23 H HIS 23 15.673 -13.444 12.662 25 HA HIS 23 HA HIS 23 13.201 -15.042 12.544 26 HB2 HIS 23 2HB HIS 23 14.392 -13.728 10.126 27 HB3 HIS 23 3HB HIS 23 12.726 -14.224 10.411 28 HD1 HIS 23 HD1 HIS 23 11.912 -12.754 12.850 29 HD2 HIS 23 HD2 HIS 23 14.371 -11.037 9.975 30 HE1 HIS 23 HE1 HIS 23 11.664 -10.270 13.151 31 HA PRO 24 HA PRO 24 15.771 -18.457 11.449 32 HB2 PRO 24 2HB PRO 24 13.843 -20.072 10.427 33 HB3 PRO 24 3HB PRO 24 14.036 -19.785 12.161 34 HG2 PRO 24 2HG PRO 24 12.116 -18.533 10.235 35 HG3 PRO 24 3HG PRO 24 11.826 -19.120 11.884 36 HD2 PRO 24 2HD PRO 24 12.175 -16.496 11.312 37 HD3 PRO 24 3HD PRO 24 12.694 -17.216 12.849 38 H TYR 25 H TYR 25 16.569 -19.580 9.609 39 HA TYR 25 HA TYR 25 16.695 -18.018 7.252 40 HB2 TYR 25 2HB TYR 25 18.553 -19.442 7.954 41 HB3 TYR 25 3HB TYR 25 17.559 -20.878 7.735 42 HD1 TYR 25 HD1 TYR 25 16.832 -21.522 5.426 43 HD2 TYR 25 HD2 TYR 25 19.686 -18.444 6.126 44 HE1 TYR 25 HE1 TYR 25 17.571 -21.683 3.086 45 HE2 TYR 25 HE2 TYR 25 20.432 -18.596 3.787 46 HH TYR 25 HH TYR 25 20.349 -20.602 1.957 47 H ASP 26 H ASP 26 14.787 -20.792 8.205 48 HA ASP 26 HA ASP 26 13.869 -21.620 5.698 49 HB2 ASP 26 2HB ASP 26 13.554 -22.790 7.931 50 HB3 ASP 26 3HB ASP 26 12.226 -21.674 8.230 51 H ARG 27 H ARG 27 13.011 -18.884 7.650 52 HA ARG 27 HA ARG 27 10.711 -18.290 5.930 53 HB2 ARG 27 2HB ARG 27 11.620 -17.079 8.546 54 HB3 ARG 27 3HB ARG 27 10.246 -16.495 7.615 55 HG2 ARG 27 2HG ARG 27 10.359 -19.363 8.417 56 HG3 ARG 27 3HG ARG 27 9.891 -18.140 9.600 57 HD2 ARG 27 2HD ARG 27 8.580 -17.994 6.954 58 HD3 ARG 27 3HD ARG 27 8.144 -19.366 7.974 59 HE ARG 27 HE ARG 27 7.343 -16.663 8.326 60 HH11 ARG 27 1HH1 ARG 27 8.201 -19.552 10.071 61 HH12 ARG 27 2HH1 ARG 27 7.260 -19.144 11.467 62 HH21 ARG 27 1HH2 ARG 27 6.100 -16.115 10.160 63 HH22 ARG 27 2HH2 ARG 27 6.065 -17.190 11.517 64 H LEU 28 H LEU 28 13.940 -17.280 6.667 65 HA LEU 28 HA LEU 28 13.661 -14.743 5.280 66 HB2 LEU 28 2HB LEU 28 15.242 -15.540 7.330 67 HB3 LEU 28 3HB LEU 28 16.349 -15.721 5.970 68 HG LEU 28 HG LEU 28 15.501 -13.248 5.462 69 HD11 LEU 28 1HD1 LEU 28 14.185 -13.683 7.806 70 HD12 LEU 28 2HD1 LEU 28 14.624 -12.098 7.169 71 HD13 LEU 28 3HD1 LEU 28 15.657 -12.886 8.362 72 HD21 LEU 28 1HD2 LEU 28 17.456 -12.953 7.501 73 HD22 LEU 28 2HD2 LEU 28 17.677 -12.934 5.751 74 HD23 LEU 28 3HD2 LEU 28 17.782 -14.456 6.637 75 H LYS 29 H LYS 29 14.285 -14.328 3.239 76 HA LYS 29 HA LYS 29 15.734 -16.430 1.777 77 HB2 LYS 29 2HB LYS 29 13.090 -15.956 1.389 78 HB3 LYS 29 3HB LYS 29 13.789 -14.835 0.228 79 HG2 LYS 29 2HG LYS 29 14.860 -16.572 -0.955 80 HG3 LYS 29 3HG LYS 29 14.560 -17.736 0.338 81 HD2 LYS 29 2HD LYS 29 12.921 -18.308 -1.178 82 HD3 LYS 29 3HD LYS 29 12.050 -17.177 -0.139 83 HE2 LYS 29 2HE LYS 29 12.091 -15.492 -1.724 84 HE3 LYS 29 3HE LYS 29 13.483 -16.174 -2.563 85 HZ1 LYS 29 1HZ LYS 29 12.055 -17.070 -3.979 86 HZ2 LYS 29 2HZ LYS 29 10.723 -16.595 -3.052 87 HZ3 LYS 29 3HZ LYS 29 11.488 -18.071 -2.739 88 H THR 30 H THR 30 16.579 -15.554 -0.372 89 HA THR 30 HA THR 30 18.272 -13.349 0.166 90 HB THR 30 HB THR 30 17.964 -13.965 -2.673 91 HG1 THR 30 HG1 THR 30 17.725 -16.051 -2.430 92 HG21 THR 30 1HG2 THR 30 20.442 -14.660 -2.163 93 HG22 THR 30 2HG2 THR 30 20.139 -13.842 -0.630 94 HG23 THR 30 3HG2 THR 30 19.972 -12.961 -2.149 95 H THR 31 H THR 31 15.347 -13.722 -1.786 96 HA THR 31 HA THR 31 15.197 -10.785 -1.974 97 HB THR 31 HB THR 31 13.937 -11.156 -4.146 98 HG1 THR 31 HG1 THR 31 14.661 -13.231 -5.158 99 HG21 THR 31 1HG2 THR 31 16.514 -12.152 -4.924 100 HG22 THR 31 2HG2 THR 31 16.695 -10.982 -3.617 101 HG23 THR 31 3HG2 THR 31 15.852 -10.528 -5.097 102 H SER 32 H SER 32 14.061 -12.167 0.131 103 HA SER 32 HA SER 32 11.231 -12.495 -0.513 104 HB2 SER 32 2HB SER 32 13.025 -13.465 1.585 105 HB3 SER 32 3HB SER 32 11.481 -12.890 2.212 106 HG SER 32 HG SER 32 10.513 -14.536 1.321 107 H THR 33 H THR 33 9.594 -11.283 0.437 108 HA THR 33 HA THR 33 10.465 -8.679 1.490 109 HB THR 33 HB THR 33 8.098 -7.963 0.886 110 HG1 THR 33 HG1 THR 33 7.222 -9.382 -0.840 111 HG21 THR 33 1HG2 THR 33 8.713 -7.396 -1.297 112 HG22 THR 33 2HG2 THR 33 9.625 -8.889 -1.528 113 HG23 THR 33 3HG2 THR 33 10.259 -7.622 -0.479 114 H ASP 34 H ASP 34 9.827 -11.400 2.852 115 HA ASP 34 HA ASP 34 7.562 -11.237 4.420 116 HB2 ASP 34 2HB ASP 34 10.152 -12.610 4.596 117 HB3 ASP 34 3HB ASP 34 9.383 -12.333 6.156 118 HA PRO 35 HA PRO 35 8.074 -7.993 7.327 119 HB2 PRO 35 2HB PRO 35 7.105 -9.088 9.614 120 HB3 PRO 35 3HB PRO 35 6.072 -8.631 8.254 121 HG2 PRO 35 2HG PRO 35 7.130 -11.329 9.006 122 HG3 PRO 35 3HG PRO 35 5.505 -10.878 8.457 123 HD2 PRO 35 2HD PRO 35 7.343 -11.992 6.810 124 HD3 PRO 35 3HD PRO 35 6.133 -10.825 6.240 125 H VAL 36 H VAL 36 9.324 -7.218 9.067 126 HA VAL 36 HA VAL 36 11.227 -9.096 10.273 127 HB VAL 36 HB VAL 36 12.983 -7.220 9.978 128 HG11 VAL 36 1HG1 VAL 36 12.895 -9.503 8.872 129 HG12 VAL 36 2HG1 VAL 36 12.211 -8.683 7.467 130 HG13 VAL 36 3HG1 VAL 36 13.825 -8.259 8.038 131 HG21 VAL 36 1HG2 VAL 36 11.165 -6.550 7.666 132 HG22 VAL 36 2HG2 VAL 36 11.353 -5.560 9.114 133 HG23 VAL 36 3HG2 VAL 36 12.725 -5.815 8.036 134 H SER 37 H SER 37 12.569 -7.881 12.000 135 HA SER 37 HA SER 37 10.660 -6.536 13.728 136 HB2 SER 37 2HB SER 37 13.438 -7.631 14.190 137 HB3 SER 37 3HB SER 37 12.540 -6.746 15.423 138 HG SER 37 HG SER 37 10.940 -8.338 15.332 139 H ASP 38 H ASP 38 12.286 -5.376 11.321 140 HA ASP 38 HA ASP 38 13.007 -3.297 10.733 141 HB2 ASP 38 2HB ASP 38 11.157 -2.685 12.470 142 HB3 ASP 38 3HB ASP 38 12.517 -2.284 13.514 143 H ILE 39 H ILE 39 15.098 -4.445 10.704 144 HA ILE 39 HA ILE 39 16.952 -3.238 12.646 145 HB ILE 39 HB ILE 39 18.150 -5.614 11.741 146 HG12 ILE 39 2HG1 ILE 39 15.309 -6.058 12.680 147 HG13 ILE 39 3HG1 ILE 39 15.956 -6.457 11.093 148 HG21 ILE 39 1HG2 ILE 39 18.379 -4.413 13.928 149 HG22 ILE 39 2HG2 ILE 39 16.850 -5.142 14.414 150 HG23 ILE 39 3HG2 ILE 39 18.239 -6.166 14.055 151 HD11 ILE 39 1HD1 ILE 39 17.639 -7.798 12.791 152 HD12 ILE 39 2HD1 ILE 39 16.069 -7.942 13.584 153 HD13 ILE 39 3HD1 ILE 39 16.272 -8.492 11.920 154 H ASP 40 H ASP 40 19.331 -3.999 11.622 155 HA ASP 40 HA ASP 40 19.909 -2.197 9.655 156 HB2 ASP 40 2HB ASP 40 21.299 -4.867 9.948 157 HB3 ASP 40 3HB ASP 40 21.982 -3.382 9.291 158 H VAL 41 H VAL 41 18.569 -2.072 7.914 159 HA VAL 41 HA VAL 41 17.557 -4.230 6.441 160 HB VAL 41 HB VAL 41 16.714 -1.865 6.355 161 HG11 VAL 41 1HG1 VAL 41 18.727 -1.323 4.220 162 HG12 VAL 41 2HG1 VAL 41 17.791 -0.192 5.200 163 HG13 VAL 41 3HG1 VAL 41 19.161 -1.048 5.907 164 HG21 VAL 41 1HG2 VAL 41 16.073 -1.974 3.991 165 HG22 VAL 41 2HG2 VAL 41 17.312 -3.198 3.714 166 HG23 VAL 41 3HG2 VAL 41 15.947 -3.550 4.773 167 H THR 42 H THR 42 20.578 -2.477 6.218 168 HA THR 42 HA THR 42 21.341 -3.548 3.677 169 HB THR 42 HB THR 42 23.566 -2.623 4.163 170 HG1 THR 42 HG1 THR 42 24.063 -1.834 6.143 171 HG21 THR 42 1HG2 THR 42 21.726 -0.493 5.124 172 HG22 THR 42 2HG2 THR 42 21.396 -1.223 3.554 173 HG23 THR 42 3HG2 THR 42 22.948 -0.442 3.855 174 H ARG 43 H ARG 43 21.361 -4.734 6.876 175 HA ARG 43 HA ARG 43 23.155 -6.929 6.071 176 HB2 ARG 43 2HB ARG 43 22.708 -6.001 8.907 177 HB3 ARG 43 3HB ARG 43 23.920 -7.136 8.327 178 HG2 ARG 43 2HG ARG 43 24.479 -4.884 6.874 179 HG3 ARG 43 3HG ARG 43 23.973 -4.226 8.431 180 HD2 ARG 43 2HD ARG 43 25.592 -6.275 9.201 181 HD3 ARG 43 3HD ARG 43 26.374 -5.751 7.710 182 HE ARG 43 HE ARG 43 25.723 -3.598 9.501 183 HH11 ARG 43 1HH1 ARG 43 28.085 -6.012 8.658 184 HH12 ARG 43 2HH1 ARG 43 29.411 -5.149 9.365 185 HH21 ARG 43 1HH2 ARG 43 27.460 -2.452 10.435 186 HH22 ARG 43 2HH2 ARG 43 29.053 -3.124 10.376 187 H ARG 44 H ARG 44 20.504 -7.081 5.422 188 HA ARG 44 HA ARG 44 18.718 -8.130 7.236 189 HB2 ARG 44 2HB ARG 44 18.134 -7.597 4.915 190 HB3 ARG 44 3HB ARG 44 19.100 -8.955 4.353 191 HG2 ARG 44 2HG ARG 44 17.290 -10.220 4.476 192 HG3 ARG 44 3HG ARG 44 17.315 -10.018 6.229 193 HD2 ARG 44 2HD ARG 44 15.275 -9.126 5.922 194 HD3 ARG 44 3HD ARG 44 16.176 -7.683 5.455 195 HE ARG 44 HE ARG 44 15.645 -9.507 3.287 196 HH11 ARG 44 1HH1 ARG 44 14.477 -6.791 5.124 197 HH12 ARG 44 2HH1 ARG 44 13.435 -6.219 3.862 198 HH21 ARG 44 1HH2 ARG 44 14.278 -8.765 1.620 199 HH22 ARG 44 2HH2 ARG 44 13.322 -7.343 1.870 200 H GLU 45 H GLU 45 21.391 -9.730 5.604 201 HA GLU 45 HA GLU 45 20.785 -12.383 6.198 202 HB2 GLU 45 2HB GLU 45 23.295 -12.723 6.092 203 HB3 GLU 45 3HB GLU 45 22.559 -11.968 4.685 204 HG2 GLU 45 2HG GLU 45 23.679 -10.053 4.967 205 HG3 GLU 45 3HG GLU 45 23.500 -10.086 6.720 206 H ALA 46 H ALA 46 22.076 -9.848 8.209 207 HA ALA 46 HA ALA 46 23.024 -11.529 10.306 208 HB1 ALA 46 1HB ALA 46 23.772 -9.179 9.898 209 HB2 ALA 46 2HB ALA 46 22.215 -8.635 10.524 210 HB3 ALA 46 3HB ALA 46 23.323 -9.527 11.568 211 H TYR 47 H TYR 47 19.923 -10.608 9.302 212 HA TYR 47 HA TYR 47 18.537 -10.410 11.727 213 HB2 TYR 47 2HB TYR 47 17.615 -11.399 9.022 214 HB3 TYR 47 3HB TYR 47 16.535 -11.079 10.374 215 HD1 TYR 47 HD1 TYR 47 15.776 -9.671 8.124 216 HD2 TYR 47 HD2 TYR 47 18.965 -8.707 10.771 217 HE1 TYR 47 HE1 TYR 47 15.622 -7.313 7.442 218 HE2 TYR 47 HE2 TYR 47 18.819 -6.347 10.097 219 HH TYR 47 HH TYR 47 16.211 -5.084 8.373 220 H LEU 48 H LEU 48 20.094 -13.065 10.327 221 HA LEU 48 HA LEU 48 18.401 -15.083 11.533 222 HB2 LEU 48 2HB LEU 48 20.506 -14.997 9.562 223 HB3 LEU 48 3HB LEU 48 20.810 -16.262 10.752 224 HG LEU 48 HG LEU 48 18.258 -16.001 9.166 225 HD11 LEU 48 1HD1 LEU 48 19.155 -17.155 7.486 226 HD12 LEU 48 2HD1 LEU 48 19.981 -18.266 8.577 227 HD13 LEU 48 3HD1 LEU 48 20.722 -16.719 8.169 228 HD21 LEU 48 1HD2 LEU 48 17.530 -17.378 10.772 229 HD22 LEU 48 2HD2 LEU 48 19.159 -17.700 11.365 230 HD23 LEU 48 3HD2 LEU 48 18.531 -18.598 9.983 231 H SER 49 H SER 49 19.334 -16.725 12.991 232 HA SER 49 HA SER 49 20.553 -15.479 15.243 233 HB2 SER 49 2HB SER 49 20.295 -18.458 14.875 234 HB3 SER 49 3HB SER 49 20.230 -17.525 16.370 235 HG SER 49 HG SER 49 18.163 -17.411 16.088 236 H SER 50 H SER 50 22.554 -16.026 16.238 237 HA SER 50 HA SER 50 24.772 -15.954 14.595 238 HB2 SER 50 2HB SER 50 25.969 -15.872 16.523 239 HB3 SER 50 3HB SER 50 24.381 -15.758 17.281 240 HG SER 50 HG SER 50 26.126 -17.545 17.805 241 H GLU 51 H GLU 51 22.944 -18.700 15.709 242 HA GLU 51 HA GLU 51 24.918 -20.657 15.001 243 HB2 GLU 51 2HB GLU 51 21.963 -21.134 15.375 244 HB3 GLU 51 3HB GLU 51 23.272 -22.293 15.559 245 HG2 GLU 51 2HG GLU 51 24.102 -20.842 17.461 246 HG3 GLU 51 3HG GLU 51 22.555 -20.004 17.359 247 H GLU 52 H GLU 52 21.725 -19.845 13.628 248 HA GLU 52 HA GLU 52 22.001 -21.416 11.319 249 HB2 GLU 52 2HB GLU 52 20.221 -19.191 12.172 250 HB3 GLU 52 3HB GLU 52 20.282 -19.563 10.454 251 HG2 GLU 52 2HG GLU 52 19.974 -21.915 12.153 252 HG3 GLU 52 3HG GLU 52 18.650 -20.759 12.286 253 H PHE 53 H PHE 53 22.443 -17.906 11.749 254 HA PHE 53 HA PHE 53 23.189 -17.220 9.194 255 HB2 PHE 53 2HB PHE 53 22.901 -15.447 10.712 256 HB3 PHE 53 3HB PHE 53 24.026 -16.142 11.874 257 HD1 PHE 53 HD1 PHE 53 26.449 -16.006 11.489 258 HD2 PHE 53 HD2 PHE 53 23.656 -14.081 8.915 259 HE1 PHE 53 HE1 PHE 53 28.258 -14.613 10.572 260 HE2 PHE 53 HE2 PHE 53 25.462 -12.686 7.995 261 HZ PHE 53 HZ PHE 53 27.766 -12.950 8.823 262 H LYS 54 H LYS 54 25.416 -18.099 11.837 263 HA LYS 54 HA LYS 54 27.717 -18.173 10.194 264 HB2 LYS 54 2HB LYS 54 28.869 -18.776 12.087 265 HB3 LYS 54 3HB LYS 54 27.433 -18.068 12.816 266 HG2 LYS 54 2HG LYS 54 27.498 -19.980 14.013 267 HG3 LYS 54 3HG LYS 54 26.589 -20.586 12.627 268 HD2 LYS 54 2HD LYS 54 28.178 -22.187 12.615 269 HD3 LYS 54 3HD LYS 54 29.121 -20.964 11.759 270 HE2 LYS 54 2HE LYS 54 29.396 -20.469 14.532 271 HE3 LYS 54 3HE LYS 54 29.641 -22.197 14.280 272 HZ1 LYS 54 1HZ LYS 54 30.985 -20.540 12.348 273 HZ2 LYS 54 2HZ LYS 54 31.574 -21.842 13.252 274 HZ3 LYS 54 3HZ LYS 54 31.523 -20.294 13.933 275 H GLU 55 H GLU 55 25.188 -20.439 10.801 276 HA GLU 55 HA GLU 55 26.646 -22.777 10.013 277 HB2 GLU 55 2HB GLU 55 24.762 -23.070 11.466 278 HB3 GLU 55 3HB GLU 55 23.698 -22.226 10.351 279 HG2 GLU 55 2HG GLU 55 23.385 -24.667 10.339 280 HG3 GLU 55 3HG GLU 55 23.839 -24.018 8.765 281 H LYS 56 H LYS 56 24.862 -20.293 8.388 282 HA LYS 56 HA LYS 56 24.726 -21.818 5.904 283 HB2 LYS 56 2HB LYS 56 23.410 -19.425 6.992 284 HB3 LYS 56 3HB LYS 56 23.830 -19.303 5.289 285 HG2 LYS 56 2HG LYS 56 21.550 -20.139 5.645 286 HG3 LYS 56 3HG LYS 56 22.569 -21.300 4.792 287 HD2 LYS 56 2HD LYS 56 22.820 -22.641 6.732 288 HD3 LYS 56 3HD LYS 56 22.138 -21.387 7.771 289 HE2 LYS 56 2HE LYS 56 19.998 -21.887 7.198 290 HE3 LYS 56 3HE LYS 56 20.433 -22.367 5.560 291 HZ1 LYS 56 1HZ LYS 56 20.680 -24.488 6.166 292 HZ2 LYS 56 2HZ LYS 56 19.778 -24.071 7.535 293 HZ3 LYS 56 3HZ LYS 56 21.468 -24.105 7.614 294 H PHE 57 H PHE 57 26.480 -19.171 7.364 295 HA PHE 57 HA PHE 57 27.915 -18.674 4.860 296 HB2 PHE 57 2HB PHE 57 27.897 -17.159 7.478 297 HB3 PHE 57 3HB PHE 57 28.872 -16.717 6.080 298 HD1 PHE 57 HD1 PHE 57 27.498 -16.458 3.838 299 HD2 PHE 57 HD2 PHE 57 25.862 -16.138 7.754 300 HE1 PHE 57 HE1 PHE 57 25.620 -15.144 2.942 301 HE2 PHE 57 HE2 PHE 57 23.982 -14.826 6.865 302 HZ PHE 57 HZ PHE 57 23.858 -14.328 4.456 303 H GLY 58 H GLY 58 28.211 -20.363 7.789 304 HA2 GLY 58 2HA GLY 58 29.902 -21.769 8.497 305 HA3 GLY 58 3HA GLY 58 30.841 -21.279 7.095 306 H MET 59 H MET 59 29.887 -18.497 8.555 307 HA MET 59 HA MET 59 32.193 -18.431 10.378 308 HB2 MET 59 2HB MET 59 31.488 -16.086 8.631 309 HB3 MET 59 3HB MET 59 32.974 -16.380 9.524 310 HG2 MET 59 2HG MET 59 32.064 -18.004 7.162 311 HG3 MET 59 3HG MET 59 33.188 -16.651 7.072 312 HE1 MET 59 1HE MET 59 34.179 -18.824 5.716 313 HE2 MET 59 2HE MET 59 35.273 -19.965 6.496 314 HE3 MET 59 3HE MET 59 33.532 -20.247 6.533 315 H THR 60 H THR 60 31.923 -17.270 12.237 316 HA THR 60 HA THR 60 29.272 -16.755 13.101 317 HB THR 60 HB THR 60 31.236 -15.420 14.748 318 HG1 THR 60 HG1 THR 60 32.782 -16.877 14.830 319 HG21 THR 60 1HG2 THR 60 29.306 -16.133 15.825 320 HG22 THR 60 2HG2 THR 60 30.472 -17.371 16.291 321 HG23 THR 60 3HG2 THR 60 29.305 -17.695 15.009 322 H LYS 61 H LYS 61 29.259 -14.469 14.527 323 HA LYS 61 HA LYS 61 28.714 -12.499 12.573 324 HB2 LYS 61 2HB LYS 61 28.419 -12.805 15.437 325 HB3 LYS 61 3HB LYS 61 28.960 -11.182 15.032 326 HG2 LYS 61 2HG LYS 61 26.832 -10.691 14.653 327 HG3 LYS 61 3HG LYS 61 26.950 -11.687 13.201 328 HD2 LYS 61 2HD LYS 61 25.059 -12.452 14.433 329 HD3 LYS 61 3HD LYS 61 26.331 -13.661 14.623 330 HE2 LYS 61 2HE LYS 61 26.321 -13.410 16.832 331 HE3 LYS 61 3HE LYS 61 26.530 -11.666 16.684 332 HZ1 LYS 61 1HZ LYS 61 24.120 -13.206 17.145 333 HZ2 LYS 61 2HZ LYS 61 23.954 -11.936 16.042 334 HZ3 LYS 61 3HZ LYS 61 24.502 -11.626 17.613 335 H GLU 62 H GLU 62 31.235 -12.638 15.093 336 HA GLU 62 HA GLU 62 32.600 -10.331 14.163 337 HB2 GLU 62 2HB GLU 62 32.891 -12.261 16.289 338 HB3 GLU 62 3HB GLU 62 34.449 -11.935 15.542 339 HG2 GLU 62 2HG GLU 62 34.189 -9.569 15.947 340 HG3 GLU 62 3HG GLU 62 32.575 -9.832 16.602 341 H ALA 63 H ALA 63 32.769 -13.721 13.373 342 HA ALA 63 HA ALA 63 35.284 -13.593 12.016 343 HB1 ALA 63 1HB ALA 63 33.131 -15.672 11.671 344 HB2 ALA 63 2HB ALA 63 34.855 -15.838 11.336 345 HB3 ALA 63 3HB ALA 63 34.293 -15.670 12.999 346 H PHE 64 H PHE 64 31.894 -13.701 10.940 347 HA PHE 64 HA PHE 64 32.504 -13.503 8.176 348 HB2 PHE 64 2HB PHE 64 30.348 -14.368 9.157 349 HB3 PHE 64 3HB PHE 64 29.921 -12.699 9.519 350 HD1 PHE 64 HD1 PHE 64 29.638 -11.076 7.642 351 HD2 PHE 64 HD2 PHE 64 30.065 -15.262 7.001 352 HE1 PHE 64 HE1 PHE 64 28.708 -10.821 5.377 353 HE2 PHE 64 HE2 PHE 64 29.137 -15.014 4.736 354 HZ PHE 64 HZ PHE 64 28.457 -12.792 3.921 355 H TYR 65 H TYR 65 31.198 -11.101 10.465 356 HA TYR 65 HA TYR 65 31.144 -8.906 8.799 357 HB2 TYR 65 2HB TYR 65 31.654 -9.137 11.759 358 HB3 TYR 65 3HB TYR 65 31.565 -7.574 10.954 359 HD1 TYR 65 HD1 TYR 65 29.383 -7.999 9.032 360 HD2 TYR 65 HD2 TYR 65 29.743 -9.255 13.081 361 HE1 TYR 65 HE1 TYR 65 26.932 -8.030 9.233 362 HE2 TYR 65 HE2 TYR 65 27.292 -9.291 13.294 363 HH TYR 65 HH TYR 65 25.330 -8.152 12.148 364 H LYS 66 H LYS 66 33.875 -10.447 10.302 365 HA LYS 66 HA LYS 66 35.772 -8.408 10.161 366 HB2 LYS 66 2HB LYS 66 35.757 -11.248 10.598 367 HB3 LYS 66 3HB LYS 66 37.089 -10.827 9.529 368 HG2 LYS 66 2HG LYS 66 38.019 -9.343 11.132 369 HG3 LYS 66 3HG LYS 66 36.581 -9.448 12.152 370 HD2 LYS 66 2HD LYS 66 37.204 -11.430 13.048 371 HD3 LYS 66 3HD LYS 66 37.912 -12.009 11.538 372 HE2 LYS 66 2HE LYS 66 39.469 -9.821 12.461 373 HE3 LYS 66 3HE LYS 66 39.219 -10.921 13.817 374 HZ1 LYS 66 1HZ LYS 66 41.025 -11.887 12.883 375 HZ2 LYS 66 2HZ LYS 66 40.670 -11.347 11.320 376 HZ3 LYS 66 3HZ LYS 66 39.843 -12.675 11.965 377 H LEU 67 H LEU 67 34.823 -10.806 7.727 378 HA LEU 67 HA LEU 67 36.687 -10.272 5.765 379 HB2 LEU 67 2HB LEU 67 33.990 -11.399 5.866 380 HB3 LEU 67 3HB LEU 67 34.408 -10.689 4.308 381 HG LEU 67 HG LEU 67 36.323 -12.172 4.120 382 HD11 LEU 67 1HD1 LEU 67 35.759 -12.621 6.944 383 HD12 LEU 67 2HD1 LEU 67 37.254 -12.839 6.035 384 HD13 LEU 67 3HD1 LEU 67 36.030 -14.108 6.035 385 HD21 LEU 67 1HD2 LEU 67 34.149 -14.034 4.916 386 HD22 LEU 67 2HD2 LEU 67 35.133 -13.999 3.451 387 HD23 LEU 67 3HD2 LEU 67 33.809 -12.850 3.652 388 HA PRO 68 HA PRO 68 35.897 -6.306 4.068 389 HB2 PRO 68 2HB PRO 68 36.104 -6.729 1.394 390 HB3 PRO 68 3HB PRO 68 37.497 -6.753 2.482 391 HG2 PRO 68 2HG PRO 68 35.931 -9.044 1.359 392 HG3 PRO 68 3HG PRO 68 37.687 -8.868 1.532 393 HD2 PRO 68 2HD PRO 68 36.189 -10.313 3.264 394 HD3 PRO 68 3HD PRO 68 37.649 -9.437 3.766 395 H LYS 69 H LYS 69 34.517 -5.057 2.523 396 HA LYS 69 HA LYS 69 31.798 -5.771 2.835 397 HB2 LYS 69 2HB LYS 69 33.281 -3.573 1.472 398 HB3 LYS 69 3HB LYS 69 31.594 -3.821 1.042 399 HG2 LYS 69 2HG LYS 69 31.494 -2.239 2.729 400 HG3 LYS 69 3HG LYS 69 31.155 -3.752 3.574 401 HD2 LYS 69 2HD LYS 69 34.000 -3.013 3.415 402 HD3 LYS 69 3HD LYS 69 32.994 -1.927 4.376 403 HE2 LYS 69 2HE LYS 69 32.094 -4.198 5.368 404 HE3 LYS 69 3HE LYS 69 33.656 -4.798 4.811 405 HZ1 LYS 69 1HZ LYS 69 33.268 -3.675 7.193 406 HZ2 LYS 69 2HZ LYS 69 33.725 -2.311 6.304 407 HZ3 LYS 69 3HZ LYS 69 34.754 -3.652 6.383 408 H TRP 70 H TRP 70 33.943 -5.723 0.004 409 HA TRP 70 HA TRP 70 32.086 -6.496 -1.921 410 HB2 TRP 70 2HB TRP 70 33.917 -6.975 -3.325 411 HB3 TRP 70 3HB TRP 70 34.512 -5.725 -2.236 412 HD1 TRP 70 HD1 TRP 70 36.410 -6.403 -0.502 413 HE1 TRP 70 HE1 TRP 70 37.984 -8.434 -0.359 414 HE3 TRP 70 HE3 TRP 70 34.021 -9.514 -3.781 415 HZ2 TRP 70 HZ2 TRP 70 38.187 -11.014 -1.488 416 HZ3 TRP 70 HZ3 TRP 70 34.971 -11.746 -4.193 417 HH2 TRP 70 HH2 TRP 70 37.011 -12.479 -3.071 418 H LYS 71 H LYS 71 34.081 -8.470 0.233 419 HA LYS 71 HA LYS 71 33.147 -10.953 -0.859 420 HB2 LYS 71 2HB LYS 71 35.378 -10.628 0.252 421 HB3 LYS 71 3HB LYS 71 34.531 -10.489 1.786 422 HG2 LYS 71 2HG LYS 71 35.250 -12.703 1.714 423 HG3 LYS 71 3HG LYS 71 33.547 -12.783 1.254 424 HD2 LYS 71 2HD LYS 71 34.419 -12.628 -1.166 425 HD3 LYS 71 3HD LYS 71 35.984 -13.059 -0.475 426 HE2 LYS 71 2HE LYS 71 34.899 -15.061 0.544 427 HE3 LYS 71 3HE LYS 71 33.428 -14.654 -0.337 428 HZ1 LYS 71 1HZ LYS 71 35.989 -14.989 -1.762 429 HZ2 LYS 71 2HZ LYS 71 34.414 -15.128 -2.361 430 HZ3 LYS 71 3HZ LYS 71 35.047 -16.337 -1.360 431 H GLN 72 H GLN 72 32.297 -8.897 1.857 432 HA GLN 72 HA GLN 72 30.648 -10.703 3.240 433 HB2 GLN 72 2HB GLN 72 31.103 -7.794 3.230 434 HB3 GLN 72 3HB GLN 72 29.502 -8.284 3.767 435 HG2 GLN 72 2HG GLN 72 30.747 -9.916 5.311 436 HG3 GLN 72 3HG GLN 72 32.164 -8.926 4.967 437 HE21 GLN 72 1HE2 GLN 72 28.755 -8.508 5.866 438 HE22 GLN 72 2HE2 GLN 72 29.039 -7.270 7.036 439 H ASN 73 H ASN 73 29.994 -8.485 0.577 440 HA ASN 73 HA ASN 73 27.170 -8.964 0.572 441 HB2 ASN 73 2HB ASN 73 29.043 -7.270 -0.848 442 HB3 ASN 73 3HB ASN 73 27.893 -8.008 -1.959 443 HD21 ASN 73 1HD2 ASN 73 27.052 -5.907 -2.328 444 HD22 ASN 73 2HD2 ASN 73 25.963 -5.184 -1.197 445 H LYS 74 H LYS 74 29.950 -10.435 -0.899 446 HA LYS 74 HA LYS 74 28.575 -11.829 -2.964 447 HB2 LYS 74 2HB LYS 74 31.258 -12.256 -1.649 448 HB3 LYS 74 3HB LYS 74 30.674 -13.259 -2.969 449 HG2 LYS 74 2HG LYS 74 30.690 -10.309 -3.337 450 HG3 LYS 74 3HG LYS 74 32.224 -11.180 -3.400 451 HD2 LYS 74 2HD LYS 74 30.304 -12.618 -4.937 452 HD3 LYS 74 3HD LYS 74 30.256 -10.923 -5.426 453 HE2 LYS 74 2HE LYS 74 32.756 -11.015 -5.632 454 HE3 LYS 74 3HE LYS 74 32.647 -12.756 -5.376 455 HZ1 LYS 74 1HZ LYS 74 32.292 -11.320 -7.759 456 HZ2 LYS 74 2HZ LYS 74 30.824 -12.067 -7.375 457 HZ3 LYS 74 3HZ LYS 74 32.232 -12.995 -7.522 458 H PHE 75 H PHE 75 29.861 -12.887 0.189 459 HA PHE 75 HA PHE 75 28.868 -15.503 0.078 460 HB2 PHE 75 2HB PHE 75 30.229 -13.864 1.973 461 HB3 PHE 75 3HB PHE 75 28.869 -14.625 2.789 462 HD1 PHE 75 HD1 PHE 75 28.677 -17.226 1.570 463 HD2 PHE 75 HD2 PHE 75 32.143 -14.978 2.593 464 HE1 PHE 75 HE1 PHE 75 29.966 -19.312 1.775 465 HE2 PHE 75 HE2 PHE 75 33.437 -17.060 2.800 466 HZ PHE 75 HZ PHE 75 32.349 -19.231 2.390 467 H LYS 76 H LYS 76 27.401 -12.502 1.169 468 HA LYS 76 HA LYS 76 25.206 -13.373 2.553 469 HB2 LYS 76 2HB LYS 76 25.881 -11.009 0.972 470 HB3 LYS 76 3HB LYS 76 24.154 -11.343 1.001 471 HG2 LYS 76 2HG LYS 76 24.030 -11.114 3.323 472 HG3 LYS 76 3HG LYS 76 25.778 -11.262 3.519 473 HD2 LYS 76 2HD LYS 76 25.490 -9.083 1.843 474 HD3 LYS 76 3HD LYS 76 24.153 -8.909 2.983 475 HE2 LYS 76 2HE LYS 76 25.538 -8.601 4.769 476 HE3 LYS 76 3HE LYS 76 26.819 -9.601 4.086 477 HZ1 LYS 76 1HZ LYS 76 27.469 -7.286 4.140 478 HZ2 LYS 76 2HZ LYS 76 26.117 -6.847 3.223 479 HZ3 LYS 76 3HZ LYS 76 27.329 -7.807 2.536 480 H MET 77 H MET 77 25.176 -12.691 -0.953 481 HA MET 77 HA MET 77 22.681 -13.952 -1.384 482 HB2 MET 77 2HB MET 77 23.272 -13.790 -3.791 483 HB3 MET 77 3HB MET 77 23.468 -12.271 -2.925 484 HG2 MET 77 2HG MET 77 25.897 -12.759 -2.744 485 HG3 MET 77 3HG MET 77 25.641 -14.175 -3.760 486 HE1 MET 77 1HE MET 77 27.233 -13.116 -6.257 487 HE2 MET 77 2HE MET 77 26.042 -14.324 -5.778 488 HE3 MET 77 3HE MET 77 25.694 -13.226 -7.113 489 H ALA 78 H ALA 78 25.948 -15.115 -1.276 490 HA ALA 78 HA ALA 78 25.796 -17.446 -2.762 491 HB1 ALA 78 1HB ALA 78 27.695 -18.194 -1.603 492 HB2 ALA 78 2HB ALA 78 27.814 -16.433 -1.584 493 HB3 ALA 78 3HB ALA 78 27.264 -17.295 -0.148 494 H VAL 79 H VAL 79 24.783 -16.860 0.576 495 HA VAL 79 HA VAL 79 23.766 -19.598 0.768 496 HB VAL 79 HB VAL 79 23.733 -19.382 3.066 497 HG11 VAL 79 1HG1 VAL 79 25.829 -18.415 3.754 498 HG12 VAL 79 2HG1 VAL 79 26.034 -19.166 2.171 499 HG13 VAL 79 3HG1 VAL 79 25.885 -17.414 2.303 500 HG21 VAL 79 1HG2 VAL 79 23.785 -17.129 4.209 501 HG22 VAL 79 2HG2 VAL 79 23.475 -16.416 2.625 502 HG23 VAL 79 3HG2 VAL 79 22.299 -17.518 3.342 503 H GLN 80 H GLN 80 22.609 -17.102 -0.696 504 HA GLN 80 HA GLN 80 20.514 -16.449 -1.308 505 HB2 GLN 80 2HB GLN 80 19.341 -18.408 0.646 506 HB3 GLN 80 3HB GLN 80 18.658 -17.825 -0.865 507 HG2 GLN 80 2HG GLN 80 20.893 -19.789 -0.474 508 HG3 GLN 80 3HG GLN 80 19.329 -20.049 -1.246 509 HE21 GLN 80 1HE2 GLN 80 22.567 -19.246 -1.704 510 HE22 GLN 80 2HE2 GLN 80 22.481 -18.791 -3.368 511 H LEU 81 H LEU 81 21.974 -15.341 0.996 512 HA LEU 81 HA LEU 81 19.681 -14.147 2.408 513 HB2 LEU 81 2HB LEU 81 22.346 -15.027 3.452 514 HB3 LEU 81 3HB LEU 81 21.433 -13.759 4.267 515 HG LEU 81 HG LEU 81 20.611 -16.633 3.874 516 HD11 LEU 81 1HD1 LEU 81 20.786 -15.260 6.504 517 HD12 LEU 81 2HD1 LEU 81 22.281 -15.765 5.718 518 HD13 LEU 81 3HD1 LEU 81 21.036 -16.956 6.092 519 HD21 LEU 81 1HD2 LEU 81 18.612 -15.421 3.633 520 HD22 LEU 81 2HD2 LEU 81 19.071 -14.253 4.873 521 HD23 LEU 81 3HD2 LEU 81 18.654 -15.906 5.329 522 H PHE 82 H PHE 82 19.509 -12.323 1.165 523 HA PHE 82 HA PHE 82 21.649 -10.367 1.498 524 HB2 PHE 82 2HB PHE 82 21.987 -11.485 -0.719 525 HB3 PHE 82 3HB PHE 82 20.399 -10.901 -1.202 526 HD1 PHE 82 HD1 PHE 82 20.062 -8.649 -1.871 527 HD2 PHE 82 HD2 PHE 82 23.821 -9.887 -0.306 528 HE1 PHE 82 HE1 PHE 82 21.068 -6.534 -2.624 529 HE2 PHE 82 HE2 PHE 82 24.833 -7.773 -1.054 530 HZ PHE 82 HZ PHE 82 23.457 -6.093 -2.214 Start of MODEL 3 1 H1 LEU 20 H LEU 20 19.362 -9.034 19.966 2 HA LEU 20 HA LEU 20 16.608 -8.049 20.212 3 HB2 LEU 20 2HB LEU 20 18.806 -7.619 18.298 4 HB3 LEU 20 3HB LEU 20 17.196 -7.746 17.593 5 HG LEU 20 HG LEU 20 16.528 -5.928 19.277 6 HD11 LEU 20 1HD1 LEU 20 19.260 -4.895 19.238 7 HD12 LEU 20 2HD1 LEU 20 19.054 -6.332 20.239 8 HD13 LEU 20 3HD1 LEU 20 18.064 -4.902 20.535 9 HD21 LEU 20 1HD2 LEU 20 18.466 -5.218 17.078 10 HD22 LEU 20 2HD2 LEU 20 17.218 -4.177 17.764 11 HD23 LEU 20 3HD2 LEU 20 16.763 -5.610 16.840 12 HA PRO 21 HA PRO 21 14.815 -11.657 18.475 13 HB2 PRO 21 2HB PRO 21 12.901 -10.635 16.844 14 HB3 PRO 21 3HB PRO 21 12.781 -10.598 18.608 15 HG2 PRO 21 2HG PRO 21 13.636 -8.436 16.722 16 HG3 PRO 21 3HG PRO 21 12.578 -8.329 18.140 17 HD2 PRO 21 2HD PRO 21 15.180 -7.584 18.205 18 HD3 PRO 21 3HD PRO 21 14.349 -8.273 19.614 19 H ALA 22 H ALA 22 15.165 -13.051 16.830 20 HA ALA 22 HA ALA 22 16.150 -11.945 14.281 21 HB1 ALA 22 1HB ALA 22 18.093 -12.919 14.789 22 HB2 ALA 22 2HB ALA 22 17.378 -13.866 16.094 23 HB3 ALA 22 3HB ALA 22 17.280 -14.443 14.431 24 H HIS 23 H HIS 23 15.933 -13.485 12.436 25 HA HIS 23 HA HIS 23 13.458 -15.064 12.697 26 HB2 HIS 23 2HB HIS 23 14.363 -13.889 10.089 27 HB3 HIS 23 3HB HIS 23 12.742 -14.357 10.591 28 HD1 HIS 23 HD1 HIS 23 12.113 -12.757 12.952 29 HD2 HIS 23 HD2 HIS 23 14.437 -11.207 9.876 30 HE1 HIS 23 HE1 HIS 23 11.934 -10.257 13.168 31 HA PRO 24 HA PRO 24 15.729 -18.598 11.397 32 HB2 PRO 24 2HB PRO 24 13.708 -20.069 10.339 33 HB3 PRO 24 3HB PRO 24 13.916 -19.834 12.078 34 HG2 PRO 24 2HG PRO 24 12.077 -18.423 10.182 35 HG3 PRO 24 3HG PRO 24 11.749 -19.028 11.816 36 HD2 PRO 24 2HD PRO 24 12.260 -16.418 11.305 37 HD3 PRO 24 3HD PRO 24 12.732 -17.203 12.826 38 H TYR 25 H TYR 25 16.560 -19.628 9.556 39 HA TYR 25 HA TYR 25 16.676 -18.044 7.213 40 HB2 TYR 25 2HB TYR 25 18.550 -19.450 7.908 41 HB3 TYR 25 3HB TYR 25 17.574 -20.896 7.678 42 HD1 TYR 25 HD1 TYR 25 16.846 -21.519 5.357 43 HD2 TYR 25 HD2 TYR 25 19.689 -18.441 6.096 44 HE1 TYR 25 HE1 TYR 25 17.592 -21.655 3.018 45 HE2 TYR 25 HE2 TYR 25 20.442 -18.567 3.758 46 HH TYR 25 HH TYR 25 18.992 -20.881 1.483 47 H ASP 26 H ASP 26 14.789 -20.837 8.142 48 HA ASP 26 HA ASP 26 13.893 -21.667 5.628 49 HB2 ASP 26 2HB ASP 26 13.493 -22.529 8.172 50 HB3 ASP 26 3HB ASP 26 11.925 -21.805 7.826 51 H ARG 27 H ARG 27 13.004 -18.939 7.576 52 HA ARG 27 HA ARG 27 10.710 -18.360 5.846 53 HB2 ARG 27 2HB ARG 27 11.593 -17.275 8.513 54 HB3 ARG 27 3HB ARG 27 10.351 -16.483 7.553 55 HG2 ARG 27 2HG ARG 27 9.498 -19.087 7.599 56 HG3 ARG 27 3HG ARG 27 10.202 -18.876 9.202 57 HD2 ARG 27 2HD ARG 27 8.497 -16.667 8.261 58 HD3 ARG 27 3HD ARG 27 7.667 -18.196 8.551 59 HE ARG 27 HE ARG 27 8.804 -16.439 10.521 60 HH11 ARG 27 1HH1 ARG 27 7.839 -19.708 9.812 61 HH12 ARG 27 2HH1 ARG 27 7.618 -20.142 11.475 62 HH21 ARG 27 1HH2 ARG 27 8.515 -16.998 12.714 63 HH22 ARG 27 2HH2 ARG 27 8.001 -18.600 13.125 64 H LEU 28 H LEU 28 13.906 -17.261 6.675 65 HA LEU 28 HA LEU 28 13.619 -14.759 5.239 66 HB2 LEU 28 2HB LEU 28 15.146 -15.452 7.332 67 HB3 LEU 28 3HB LEU 28 16.293 -15.749 6.027 68 HG LEU 28 HG LEU 28 15.641 -13.315 5.306 69 HD11 LEU 28 1HD1 LEU 28 14.135 -13.586 7.666 70 HD12 LEU 28 2HD1 LEU 28 14.377 -12.136 6.691 71 HD13 LEU 28 3HD1 LEU 28 15.464 -12.486 8.034 72 HD21 LEU 28 1HD2 LEU 28 17.762 -14.450 6.606 73 HD22 LEU 28 2HD2 LEU 28 17.301 -13.150 7.705 74 HD23 LEU 28 3HD2 LEU 28 17.693 -12.788 6.023 75 H LYS 29 H LYS 29 14.266 -14.350 3.205 76 HA LYS 29 HA LYS 29 15.769 -16.442 1.780 77 HB2 LYS 29 2HB LYS 29 13.140 -16.054 1.342 78 HB3 LYS 29 3HB LYS 29 13.796 -14.859 0.232 79 HG2 LYS 29 2HG LYS 29 15.299 -17.175 -0.197 80 HG3 LYS 29 3HG LYS 29 13.623 -17.711 -0.046 81 HD2 LYS 29 2HD LYS 29 14.103 -15.313 -1.711 82 HD3 LYS 29 3HD LYS 29 14.690 -16.849 -2.352 83 HE2 LYS 29 2HE LYS 29 12.597 -17.040 -3.152 84 HE3 LYS 29 3HE LYS 29 12.216 -17.559 -1.511 85 HZ1 LYS 29 1HZ LYS 29 11.283 -15.539 -0.993 86 HZ2 LYS 29 2HZ LYS 29 10.835 -15.692 -2.616 87 HZ3 LYS 29 3HZ LYS 29 12.134 -14.698 -2.188 88 H THR 30 H THR 30 16.545 -15.523 -0.423 89 HA THR 30 HA THR 30 18.263 -13.337 0.141 90 HB THR 30 HB THR 30 17.917 -13.911 -2.703 91 HG1 THR 30 HG1 THR 30 17.888 -16.017 -2.595 92 HG21 THR 30 1HG2 THR 30 20.119 -13.807 -0.690 93 HG22 THR 30 2HG2 THR 30 19.931 -12.910 -2.197 94 HG23 THR 30 3HG2 THR 30 20.405 -14.608 -2.234 95 H THR 31 H THR 31 15.314 -13.674 -1.782 96 HA THR 31 HA THR 31 15.146 -10.736 -1.889 97 HB THR 31 HB THR 31 13.917 -11.045 -4.091 98 HG1 THR 31 HG1 THR 31 15.140 -13.614 -3.880 99 HG21 THR 31 1HG2 THR 31 16.536 -11.971 -4.846 100 HG22 THR 31 2HG2 THR 31 16.654 -10.817 -3.517 101 HG23 THR 31 3HG2 THR 31 15.830 -10.364 -5.009 102 H SER 32 H SER 32 13.997 -12.203 0.148 103 HA SER 32 HA SER 32 11.176 -12.519 -0.553 104 HB2 SER 32 2HB SER 32 12.943 -13.565 1.554 105 HB3 SER 32 3HB SER 32 11.340 -13.098 2.122 106 HG SER 32 HG SER 32 10.933 -15.071 1.422 107 H THR 33 H THR 33 9.542 -11.301 0.331 108 HA THR 33 HA THR 33 10.385 -8.767 1.538 109 HB THR 33 HB THR 33 8.006 -8.059 1.011 110 HG1 THR 33 HG1 THR 33 6.791 -9.734 0.509 111 HG21 THR 33 1HG2 THR 33 8.549 -7.438 -1.176 112 HG22 THR 33 2HG2 THR 33 9.458 -8.920 -1.470 113 HG23 THR 33 3HG2 THR 33 10.120 -7.674 -0.413 114 H ASP 34 H ASP 34 9.903 -11.501 2.865 115 HA ASP 34 HA ASP 34 7.654 -11.485 4.471 116 HB2 ASP 34 2HB ASP 34 10.328 -12.711 4.597 117 HB3 ASP 34 3HB ASP 34 9.532 -12.532 6.158 118 HA PRO 35 HA PRO 35 8.057 -8.263 7.418 119 HB2 PRO 35 2HB PRO 35 7.162 -9.437 9.696 120 HB3 PRO 35 3HB PRO 35 6.095 -9.004 8.355 121 HG2 PRO 35 2HG PRO 35 7.278 -11.664 9.051 122 HG3 PRO 35 3HG PRO 35 5.629 -11.276 8.527 123 HD2 PRO 35 2HD PRO 35 7.495 -12.282 6.842 124 HD3 PRO 35 3HD PRO 35 6.229 -11.159 6.304 125 H VAL 36 H VAL 36 9.307 -7.455 9.134 126 HA VAL 36 HA VAL 36 11.290 -9.269 10.310 127 HB VAL 36 HB VAL 36 12.971 -7.323 9.998 128 HG11 VAL 36 1HG1 VAL 36 12.993 -9.607 8.918 129 HG12 VAL 36 2HG1 VAL 36 12.225 -8.855 7.518 130 HG13 VAL 36 3HG1 VAL 36 13.827 -8.329 8.036 131 HG21 VAL 36 1HG2 VAL 36 12.643 -5.952 8.039 132 HG22 VAL 36 2HG2 VAL 36 11.101 -6.740 7.703 133 HG23 VAL 36 3HG2 VAL 36 11.282 -5.730 9.138 134 H SER 37 H SER 37 12.608 -8.018 12.026 135 HA SER 37 HA SER 37 10.674 -6.722 13.770 136 HB2 SER 37 2HB SER 37 12.848 -8.463 14.182 137 HB3 SER 37 3HB SER 37 13.318 -6.927 14.910 138 HG SER 37 HG SER 37 11.800 -7.142 16.376 139 H ASP 38 H ASP 38 12.280 -5.529 11.363 140 HA ASP 38 HA ASP 38 12.982 -3.444 10.777 141 HB2 ASP 38 2HB ASP 38 12.373 -2.477 13.561 142 HB3 ASP 38 3HB ASP 38 12.299 -1.582 12.046 143 H ILE 39 H ILE 39 15.070 -4.722 10.919 144 HA ILE 39 HA ILE 39 16.869 -3.426 12.861 145 HB ILE 39 HB ILE 39 18.118 -5.774 11.931 146 HG12 ILE 39 2HG1 ILE 39 15.283 -6.264 12.865 147 HG13 ILE 39 3HG1 ILE 39 15.928 -6.628 11.269 148 HG21 ILE 39 1HG2 ILE 39 18.074 -4.460 14.198 149 HG22 ILE 39 2HG2 ILE 39 16.824 -5.633 14.611 150 HG23 ILE 39 3HG2 ILE 39 18.439 -6.186 14.166 151 HD11 ILE 39 1HD1 ILE 39 16.242 -8.677 12.079 152 HD12 ILE 39 2HD1 ILE 39 17.637 -7.985 12.909 153 HD13 ILE 39 3HD1 ILE 39 16.095 -8.138 13.752 154 H ASP 40 H ASP 40 19.283 -4.175 11.863 155 HA ASP 40 HA ASP 40 19.897 -2.313 9.962 156 HB2 ASP 40 2HB ASP 40 21.198 -4.930 10.663 157 HB3 ASP 40 3HB ASP 40 21.863 -3.908 9.392 158 H VAL 41 H VAL 41 18.623 -2.118 8.186 159 HA VAL 41 HA VAL 41 17.574 -4.193 6.641 160 HB VAL 41 HB VAL 41 18.267 -1.384 5.772 161 HG11 VAL 41 1HG1 VAL 41 16.323 -1.921 4.136 162 HG12 VAL 41 2HG1 VAL 41 17.950 -2.494 3.767 163 HG13 VAL 41 3HG1 VAL 41 16.758 -3.600 4.449 164 HG21 VAL 41 1HG2 VAL 41 15.657 -2.536 6.750 165 HG22 VAL 41 2HG2 VAL 41 16.730 -1.499 7.689 166 HG23 VAL 41 3HG2 VAL 41 15.941 -0.871 6.242 167 H THR 42 H THR 42 20.564 -2.326 6.232 168 HA THR 42 HA THR 42 21.368 -3.557 3.819 169 HB THR 42 HB THR 42 23.737 -2.803 4.778 170 HG1 THR 42 HG1 THR 42 23.497 -1.925 6.687 171 HG21 THR 42 1HG2 THR 42 21.890 -1.745 3.050 172 HG22 THR 42 2HG2 THR 42 23.502 -1.093 3.341 173 HG23 THR 42 3HG2 THR 42 22.114 -0.435 4.208 174 H ARG 43 H ARG 43 21.332 -4.676 7.036 175 HA ARG 43 HA ARG 43 23.155 -6.879 6.323 176 HB2 ARG 43 2HB ARG 43 22.554 -5.971 9.135 177 HB3 ARG 43 3HB ARG 43 23.829 -7.058 8.599 178 HG2 ARG 43 2HG ARG 43 24.831 -5.126 7.361 179 HG3 ARG 43 3HG ARG 43 23.645 -4.090 8.158 180 HD2 ARG 43 2HD ARG 43 24.969 -5.791 10.069 181 HD3 ARG 43 3HD ARG 43 26.146 -4.874 9.130 182 HE ARG 43 HE ARG 43 24.361 -3.854 11.112 183 HH11 ARG 43 1HH1 ARG 43 26.052 -3.064 8.173 184 HH12 ARG 43 2HH1 ARG 43 26.093 -1.362 8.500 185 HH21 ARG 43 1HH2 ARG 43 24.408 -1.616 11.553 186 HH22 ARG 43 2HH2 ARG 43 25.158 -0.541 10.423 187 H ARG 44 H ARG 44 20.499 -6.994 5.573 188 HA ARG 44 HA ARG 44 18.668 -8.086 7.319 189 HB2 ARG 44 2HB ARG 44 18.164 -7.482 4.985 190 HB3 ARG 44 3HB ARG 44 19.104 -8.860 4.429 191 HG2 ARG 44 2HG ARG 44 17.268 -10.088 4.506 192 HG3 ARG 44 3HG ARG 44 17.238 -9.880 6.259 193 HD2 ARG 44 2HD ARG 44 15.174 -9.054 5.716 194 HD3 ARG 44 3HD ARG 44 16.134 -7.577 5.632 195 HE ARG 44 HE ARG 44 15.622 -7.462 3.419 196 HH11 ARG 44 1HH1 ARG 44 15.296 -10.771 4.448 197 HH12 ARG 44 2HH1 ARG 44 14.706 -11.326 2.916 198 HH21 ARG 44 1HH2 ARG 44 14.845 -8.180 1.398 199 HH22 ARG 44 2HH2 ARG 44 14.451 -9.851 1.182 200 H GLU 45 H GLU 45 21.334 -9.674 5.643 201 HA GLU 45 HA GLU 45 20.707 -12.329 6.201 202 HB2 GLU 45 2HB GLU 45 23.223 -12.682 6.075 203 HB3 GLU 45 3HB GLU 45 22.465 -11.933 4.677 204 HG2 GLU 45 2HG GLU 45 23.643 -10.058 4.903 205 HG3 GLU 45 3HG GLU 45 23.386 -9.998 6.645 206 H ALA 46 H ALA 46 22.046 -9.842 8.238 207 HA ALA 46 HA ALA 46 23.006 -11.563 10.295 208 HB1 ALA 46 1HB ALA 46 22.210 -8.671 10.571 209 HB2 ALA 46 2HB ALA 46 23.323 -9.583 11.592 210 HB3 ALA 46 3HB ALA 46 23.760 -9.211 9.925 211 H TYR 47 H TYR 47 19.899 -10.638 9.337 212 HA TYR 47 HA TYR 47 18.537 -10.467 11.780 213 HB2 TYR 47 2HB TYR 47 17.588 -11.420 9.072 214 HB3 TYR 47 3HB TYR 47 16.522 -11.119 10.440 215 HD1 TYR 47 HD1 TYR 47 15.758 -9.686 8.194 216 HD2 TYR 47 HD2 TYR 47 18.935 -8.747 10.864 217 HE1 TYR 47 HE1 TYR 47 15.597 -7.320 7.544 218 HE2 TYR 47 HE2 TYR 47 18.781 -6.378 10.223 219 HH TYR 47 HH TYR 47 16.180 -5.167 8.271 220 H LEU 48 H LEU 48 20.078 -13.104 10.325 221 HA LEU 48 HA LEU 48 18.399 -15.137 11.523 222 HB2 LEU 48 2HB LEU 48 20.502 -15.027 9.541 223 HB3 LEU 48 3HB LEU 48 20.783 -16.322 10.704 224 HG LEU 48 HG LEU 48 18.228 -15.988 9.136 225 HD11 LEU 48 1HD1 LEU 48 20.661 -16.668 8.071 226 HD12 LEU 48 2HD1 LEU 48 19.088 -17.121 7.416 227 HD13 LEU 48 3HD1 LEU 48 19.958 -18.238 8.468 228 HD21 LEU 48 1HD2 LEU 48 18.771 -18.642 9.998 229 HD22 LEU 48 2HD2 LEU 48 17.432 -17.588 10.449 230 HD23 LEU 48 3HD2 LEU 48 18.928 -17.564 11.385 231 H SER 49 H SER 49 19.224 -16.718 13.035 232 HA SER 49 HA SER 49 20.483 -15.536 15.265 233 HB2 SER 49 2HB SER 49 19.751 -18.373 14.567 234 HB3 SER 49 3HB SER 49 20.605 -17.990 16.061 235 HG SER 49 HG SER 49 18.593 -17.756 16.720 236 H SER 50 H SER 50 22.494 -16.078 16.258 237 HA SER 50 HA SER 50 24.710 -15.924 14.609 238 HB2 SER 50 2HB SER 50 25.705 -17.138 16.883 239 HB3 SER 50 3HB SER 50 25.469 -15.403 16.665 240 HG SER 50 HG SER 50 24.466 -16.349 18.577 241 H GLU 51 H GLU 51 22.953 -18.725 15.709 242 HA GLU 51 HA GLU 51 24.967 -20.625 14.962 243 HB2 GLU 51 2HB GLU 51 22.033 -21.189 15.362 244 HB3 GLU 51 3HB GLU 51 23.378 -22.306 15.535 245 HG2 GLU 51 2HG GLU 51 24.138 -20.625 17.391 246 HG3 GLU 51 3HG GLU 51 22.433 -20.176 17.383 247 H GLU 52 H GLU 52 21.743 -19.867 13.634 248 HA GLU 52 HA GLU 52 22.009 -21.420 11.314 249 HB2 GLU 52 2HB GLU 52 20.342 -18.925 11.683 250 HB3 GLU 52 3HB GLU 52 20.110 -20.154 10.449 251 HG2 GLU 52 2HG GLU 52 19.792 -20.524 13.418 252 HG3 GLU 52 3HG GLU 52 18.498 -20.420 12.227 253 H PHE 53 H PHE 53 22.410 -17.903 11.740 254 HA PHE 53 HA PHE 53 23.136 -17.216 9.178 255 HB2 PHE 53 2HB PHE 53 22.826 -15.437 10.681 256 HB3 PHE 53 3HB PHE 53 23.952 -16.112 11.854 257 HD1 PHE 53 HD1 PHE 53 26.370 -15.931 11.499 258 HD2 PHE 53 HD2 PHE 53 23.581 -14.089 8.864 259 HE1 PHE 53 HE1 PHE 53 28.168 -14.521 10.588 260 HE2 PHE 53 HE2 PHE 53 25.375 -12.677 7.947 261 HZ PHE 53 HZ PHE 53 27.672 -12.891 8.809 262 H LYS 54 H LYS 54 25.379 -18.057 11.820 263 HA LYS 54 HA LYS 54 27.682 -18.091 10.178 264 HB2 LYS 54 2HB LYS 54 28.844 -18.711 12.068 265 HB3 LYS 54 3HB LYS 54 27.413 -17.987 12.792 266 HG2 LYS 54 2HG LYS 54 26.435 -20.211 13.075 267 HG3 LYS 54 3HG LYS 54 27.881 -20.931 12.364 268 HD2 LYS 54 2HD LYS 54 28.522 -19.110 14.529 269 HD3 LYS 54 3HD LYS 54 27.441 -20.403 15.053 270 HE2 LYS 54 2HE LYS 54 29.082 -21.962 13.806 271 HE3 LYS 54 3HE LYS 54 30.194 -20.597 13.885 272 HZ1 LYS 54 1HZ LYS 54 30.642 -21.068 15.988 273 HZ2 LYS 54 2HZ LYS 54 29.718 -22.476 15.849 274 HZ3 LYS 54 3HZ LYS 54 29.005 -21.051 16.414 275 H GLU 55 H GLU 55 25.190 -20.401 10.780 276 HA GLU 55 HA GLU 55 26.687 -22.709 9.971 277 HB2 GLU 55 2HB GLU 55 24.831 -23.063 11.434 278 HB3 GLU 55 3HB GLU 55 23.737 -22.209 10.355 279 HG2 GLU 55 2HG GLU 55 23.536 -23.975 8.927 280 HG3 GLU 55 3HG GLU 55 25.130 -24.617 9.320 281 H LYS 56 H LYS 56 24.860 -20.242 8.373 282 HA LYS 56 HA LYS 56 24.712 -21.759 5.885 283 HB2 LYS 56 2HB LYS 56 23.401 -19.364 6.987 284 HB3 LYS 56 3HB LYS 56 23.784 -19.264 5.273 285 HG2 LYS 56 2HG LYS 56 22.388 -21.672 6.355 286 HG3 LYS 56 3HG LYS 56 21.487 -20.190 6.028 287 HD2 LYS 56 2HD LYS 56 21.990 -20.262 3.735 288 HD3 LYS 56 3HD LYS 56 23.295 -21.426 3.971 289 HE2 LYS 56 2HE LYS 56 20.456 -22.114 4.651 290 HE3 LYS 56 3HE LYS 56 21.055 -22.255 2.999 291 HZ1 LYS 56 1HZ LYS 56 21.926 -24.202 3.531 292 HZ2 LYS 56 2HZ LYS 56 21.382 -24.051 5.125 293 HZ3 LYS 56 3HZ LYS 56 22.912 -23.470 4.694 294 H PHE 57 H PHE 57 26.462 -19.107 7.339 295 HA PHE 57 HA PHE 57 27.867 -18.585 4.823 296 HB2 PHE 57 2HB PHE 57 27.851 -17.090 7.450 297 HB3 PHE 57 3HB PHE 57 28.835 -16.637 6.062 298 HD1 PHE 57 HD1 PHE 57 27.482 -16.351 3.815 299 HD2 PHE 57 HD2 PHE 57 25.810 -16.081 7.720 300 HE1 PHE 57 HE1 PHE 57 25.609 -15.030 2.919 301 HE2 PHE 57 HE2 PHE 57 23.934 -14.761 6.830 302 HZ PHE 57 HZ PHE 57 23.832 -14.234 4.426 303 H GLY 58 H GLY 58 28.261 -20.082 7.905 304 HA2 GLY 58 2HA GLY 58 29.958 -21.603 8.453 305 HA3 GLY 58 3HA GLY 58 30.920 -20.977 7.122 306 H MET 59 H MET 59 29.981 -18.250 8.497 307 HA MET 59 HA MET 59 32.153 -18.247 10.488 308 HB2 MET 59 2HB MET 59 31.408 -15.903 8.739 309 HB3 MET 59 3HB MET 59 32.800 -16.043 9.804 310 HG2 MET 59 2HG MET 59 34.001 -16.828 8.129 311 HG3 MET 59 3HG MET 59 32.907 -18.202 7.987 312 HE1 MET 59 1HE MET 59 33.711 -17.845 4.898 313 HE2 MET 59 2HE MET 59 33.943 -16.122 4.603 314 HE3 MET 59 3HE MET 59 34.729 -16.895 5.981 315 H THR 60 H THR 60 31.799 -17.168 12.390 316 HA THR 60 HA THR 60 29.180 -16.906 13.322 317 HB THR 60 HB THR 60 31.053 -15.200 14.763 318 HG1 THR 60 HG1 THR 60 31.770 -17.934 14.382 319 HG21 THR 60 1HG2 THR 60 28.897 -16.852 15.318 320 HG22 THR 60 2HG2 THR 60 29.928 -16.046 16.500 321 HG23 THR 60 3HG2 THR 60 30.276 -17.704 16.011 322 H LYS 61 H LYS 61 28.397 -14.792 14.399 323 HA LYS 61 HA LYS 61 27.676 -12.977 12.430 324 HB2 LYS 61 2HB LYS 61 27.870 -12.300 15.365 325 HB3 LYS 61 3HB LYS 61 26.767 -11.619 14.176 326 HG2 LYS 61 2HG LYS 61 25.870 -14.017 13.945 327 HG3 LYS 61 3HG LYS 61 26.708 -14.316 15.470 328 HD2 LYS 61 2HD LYS 61 24.814 -12.009 15.147 329 HD3 LYS 61 3HD LYS 61 24.237 -13.624 15.565 330 HE2 LYS 61 2HE LYS 61 24.757 -13.256 17.691 331 HE3 LYS 61 3HE LYS 61 26.446 -13.034 17.240 332 HZ1 LYS 61 1HZ LYS 61 24.938 -10.717 16.622 333 HZ2 LYS 61 2HZ LYS 61 26.283 -10.874 17.634 334 HZ3 LYS 61 3HZ LYS 61 24.728 -11.126 18.250 335 H GLU 62 H GLU 62 30.104 -12.524 15.005 336 HA GLU 62 HA GLU 62 31.043 -10.061 13.881 337 HB2 GLU 62 2HB GLU 62 32.802 -10.213 15.615 338 HB3 GLU 62 3HB GLU 62 31.183 -10.405 16.273 339 HG2 GLU 62 2HG GLU 62 31.789 -12.976 15.845 340 HG3 GLU 62 3HG GLU 62 33.408 -12.331 16.114 341 H ALA 63 H ALA 63 32.243 -13.392 13.997 342 HA ALA 63 HA ALA 63 34.724 -13.030 12.812 343 HB1 ALA 63 1HB ALA 63 33.814 -15.143 13.831 344 HB2 ALA 63 2HB ALA 63 32.950 -15.410 12.316 345 HB3 ALA 63 3HB ALA 63 34.712 -15.354 12.328 346 H PHE 64 H PHE 64 31.555 -13.451 11.296 347 HA PHE 64 HA PHE 64 32.447 -13.633 8.637 348 HB2 PHE 64 2HB PHE 64 30.155 -14.221 9.401 349 HB3 PHE 64 3HB PHE 64 29.820 -12.508 9.629 350 HD1 PHE 64 HD1 PHE 64 30.033 -15.224 7.271 351 HD2 PHE 64 HD2 PHE 64 29.780 -10.993 7.656 352 HE1 PHE 64 HE1 PHE 64 29.322 -15.056 4.921 353 HE2 PHE 64 HE2 PHE 64 29.068 -10.818 5.308 354 HZ PHE 64 HZ PHE 64 28.838 -12.852 3.937 355 H TYR 65 H TYR 65 31.430 -10.844 10.578 356 HA TYR 65 HA TYR 65 31.574 -8.887 8.603 357 HB2 TYR 65 2HB TYR 65 32.160 -8.648 11.561 358 HB3 TYR 65 3HB TYR 65 31.899 -7.287 10.476 359 HD1 TYR 65 HD1 TYR 65 29.645 -8.439 8.845 360 HD2 TYR 65 HD2 TYR 65 30.345 -8.399 13.041 361 HE1 TYR 65 HE1 TYR 65 27.222 -8.582 9.245 362 HE2 TYR 65 HE2 TYR 65 27.924 -8.543 13.452 363 HH TYR 65 HH TYR 65 25.915 -9.050 12.459 364 H LYS 66 H LYS 66 34.082 -10.622 10.185 365 HA LYS 66 HA LYS 66 36.217 -8.839 10.035 366 HB2 LYS 66 2HB LYS 66 36.014 -11.287 11.000 367 HB3 LYS 66 3HB LYS 66 36.650 -11.732 9.422 368 HG2 LYS 66 2HG LYS 66 38.706 -11.212 10.052 369 HG3 LYS 66 3HG LYS 66 38.199 -9.586 10.514 370 HD2 LYS 66 2HD LYS 66 37.456 -11.761 12.369 371 HD3 LYS 66 3HD LYS 66 39.178 -11.390 12.254 372 HE2 LYS 66 2HE LYS 66 38.652 -9.014 12.697 373 HE3 LYS 66 3HE LYS 66 36.957 -9.454 12.904 374 HZ1 LYS 66 1HZ LYS 66 38.132 -9.268 15.022 375 HZ2 LYS 66 2HZ LYS 66 39.201 -10.491 14.550 376 HZ3 LYS 66 3HZ LYS 66 37.561 -10.840 14.769 377 H LEU 67 H LEU 67 34.698 -10.784 7.558 378 HA LEU 67 HA LEU 67 36.732 -10.519 5.599 379 HB2 LEU 67 2HB LEU 67 33.944 -11.456 5.698 380 HB3 LEU 67 3HB LEU 67 34.480 -10.853 4.131 381 HG LEU 67 HG LEU 67 36.224 -12.506 4.032 382 HD11 LEU 67 1HD1 LEU 67 35.685 -12.713 6.893 383 HD12 LEU 67 2HD1 LEU 67 37.150 -13.079 5.983 384 HD13 LEU 67 3HD1 LEU 67 35.856 -14.273 6.085 385 HD21 LEU 67 1HD2 LEU 67 34.903 -14.301 3.537 386 HD22 LEU 67 2HD2 LEU 67 33.669 -13.044 3.646 387 HD23 LEU 67 3HD2 LEU 67 33.937 -14.139 5.004 388 HA PRO 68 HA PRO 68 36.115 -6.514 3.917 389 HB2 PRO 68 2HB PRO 68 36.290 -6.943 1.243 390 HB3 PRO 68 3HB PRO 68 37.686 -7.031 2.324 391 HG2 PRO 68 2HG PRO 68 36.013 -9.247 1.205 392 HG3 PRO 68 3HG PRO 68 37.776 -9.151 1.371 393 HD2 PRO 68 2HD PRO 68 36.222 -10.530 3.108 394 HD3 PRO 68 3HD PRO 68 37.723 -9.721 3.603 395 H LYS 69 H LYS 69 34.799 -5.217 2.334 396 HA LYS 69 HA LYS 69 32.046 -5.792 2.677 397 HB2 LYS 69 2HB LYS 69 33.625 -3.581 1.853 398 HB3 LYS 69 3HB LYS 69 32.437 -3.873 0.589 399 HG2 LYS 69 2HG LYS 69 30.710 -3.218 1.874 400 HG3 LYS 69 3HG LYS 69 31.399 -3.914 3.343 401 HD2 LYS 69 2HD LYS 69 32.932 -1.657 2.310 402 HD3 LYS 69 3HD LYS 69 31.270 -1.234 2.734 403 HE2 LYS 69 2HE LYS 69 32.118 -0.992 4.804 404 HE3 LYS 69 3HE LYS 69 31.970 -2.747 4.868 405 HZ1 LYS 69 1HZ LYS 69 34.178 -3.016 4.812 406 HZ2 LYS 69 2HZ LYS 69 34.240 -1.406 5.326 407 HZ3 LYS 69 3HZ LYS 69 34.424 -1.777 3.686 408 H TRP 70 H TRP 70 34.181 -5.888 -0.159 409 HA TRP 70 HA TRP 70 32.270 -6.593 -2.066 410 HB2 TRP 70 2HB TRP 70 34.069 -7.169 -3.479 411 HB3 TRP 70 3HB TRP 70 34.714 -5.919 -2.419 412 HD1 TRP 70 HD1 TRP 70 36.584 -6.641 -0.659 413 HE1 TRP 70 HE1 TRP 70 38.100 -8.714 -0.502 414 HE3 TRP 70 HE3 TRP 70 34.117 -9.699 -3.930 415 HZ2 TRP 70 HZ2 TRP 70 38.234 -11.303 -1.618 416 HZ3 TRP 70 HZ3 TRP 70 35.005 -11.958 -4.330 417 HH2 TRP 70 HH2 TRP 70 37.021 -12.742 -3.197 418 H LYS 71 H LYS 71 34.227 -8.632 0.069 419 HA LYS 71 HA LYS 71 33.164 -11.081 -0.982 420 HB2 LYS 71 2HB LYS 71 35.436 -10.812 0.092 421 HB3 LYS 71 3HB LYS 71 34.608 -10.685 1.639 422 HG2 LYS 71 2HG LYS 71 34.002 -12.896 1.656 423 HG3 LYS 71 3HG LYS 71 34.060 -13.037 -0.103 424 HD2 LYS 71 2HD LYS 71 36.654 -12.358 0.965 425 HD3 LYS 71 3HD LYS 71 36.023 -13.823 1.723 426 HE2 LYS 71 2HE LYS 71 35.715 -13.632 -1.207 427 HE3 LYS 71 3HE LYS 71 37.366 -13.802 -0.611 428 HZ1 LYS 71 1HZ LYS 71 35.314 -15.758 -0.786 429 HZ2 LYS 71 2HZ LYS 71 35.878 -15.633 0.804 430 HZ3 LYS 71 3HZ LYS 71 36.960 -15.962 -0.453 431 H GLN 72 H GLN 72 32.426 -8.941 1.689 432 HA GLN 72 HA GLN 72 30.756 -10.670 3.151 433 HB2 GLN 72 2HB GLN 72 31.517 -8.695 4.226 434 HB3 GLN 72 3HB GLN 72 30.891 -7.668 2.943 435 HG2 GLN 72 2HG GLN 72 28.784 -9.233 4.128 436 HG3 GLN 72 3HG GLN 72 29.654 -8.307 5.350 437 HE21 GLN 72 1HE2 GLN 72 27.957 -6.917 5.732 438 HE22 GLN 72 2HE2 GLN 72 27.457 -5.716 4.595 439 H ASN 73 H ASN 73 30.112 -8.461 0.475 440 HA ASN 73 HA ASN 73 27.277 -8.864 0.531 441 HB2 ASN 73 2HB ASN 73 29.139 -7.190 -0.881 442 HB3 ASN 73 3HB ASN 73 28.048 -7.958 -2.033 443 HD21 ASN 73 1HD2 ASN 73 27.500 -6.899 1.296 444 HD22 ASN 73 2HD2 ASN 73 26.233 -5.788 0.919 445 H LYS 74 H LYS 74 29.986 -10.422 -0.982 446 HA LYS 74 HA LYS 74 28.532 -11.795 -3.008 447 HB2 LYS 74 2HB LYS 74 31.231 -12.278 -1.748 448 HB3 LYS 74 3HB LYS 74 30.593 -13.278 -3.046 449 HG2 LYS 74 2HG LYS 74 30.687 -10.330 -3.432 450 HG3 LYS 74 3HG LYS 74 32.186 -11.257 -3.543 451 HD2 LYS 74 2HD LYS 74 31.078 -12.733 -5.212 452 HD3 LYS 74 3HD LYS 74 29.675 -11.665 -5.165 453 HE2 LYS 74 2HE LYS 74 30.942 -9.841 -6.030 454 HE3 LYS 74 3HE LYS 74 32.455 -10.725 -5.840 455 HZ1 LYS 74 1HZ LYS 74 32.160 -11.250 -7.975 456 HZ2 LYS 74 2HZ LYS 74 30.520 -10.835 -7.970 457 HZ3 LYS 74 3HZ LYS 74 31.009 -12.361 -7.424 458 H PHE 75 H PHE 75 29.862 -12.864 0.122 459 HA PHE 75 HA PHE 75 28.830 -15.458 0.067 460 HB2 PHE 75 2HB PHE 75 30.186 -13.784 1.945 461 HB3 PHE 75 3HB PHE 75 28.830 -14.555 2.763 462 HD1 PHE 75 HD1 PHE 75 28.670 -17.164 1.555 463 HD2 PHE 75 HD2 PHE 75 32.109 -14.874 2.581 464 HE1 PHE 75 HE1 PHE 75 29.980 -19.236 1.775 465 HE2 PHE 75 HE2 PHE 75 33.424 -16.942 2.800 466 HZ PHE 75 HZ PHE 75 32.360 -19.126 2.397 467 H LYS 76 H LYS 76 27.392 -12.429 1.137 468 HA LYS 76 HA LYS 76 25.184 -13.265 2.518 469 HB2 LYS 76 2HB LYS 76 25.751 -10.952 0.741 470 HB3 LYS 76 3HB LYS 76 24.067 -11.247 1.154 471 HG2 LYS 76 2HG LYS 76 24.727 -11.221 3.557 472 HG3 LYS 76 3HG LYS 76 26.344 -10.728 3.051 473 HD2 LYS 76 2HD LYS 76 25.024 -8.863 1.758 474 HD3 LYS 76 3HD LYS 76 23.771 -9.217 2.949 475 HE2 LYS 76 2HE LYS 76 25.204 -8.650 4.751 476 HE3 LYS 76 3HE LYS 76 26.621 -8.613 3.703 477 HZ1 LYS 76 1HZ LYS 76 25.886 -6.639 2.688 478 HZ2 LYS 76 2HZ LYS 76 25.670 -6.396 4.348 479 HZ3 LYS 76 3HZ LYS 76 24.340 -6.755 3.366 480 H MET 77 H MET 77 25.177 -12.622 -0.995 481 HA MET 77 HA MET 77 22.667 -13.872 -1.413 482 HB2 MET 77 2HB MET 77 23.242 -13.703 -3.821 483 HB3 MET 77 3HB MET 77 23.455 -12.187 -2.956 484 HG2 MET 77 2HG MET 77 25.886 -12.715 -2.786 485 HG3 MET 77 3HG MET 77 25.599 -14.101 -3.836 486 HE1 MET 77 1HE MET 77 25.505 -9.672 -4.852 487 HE2 MET 77 2HE MET 77 25.441 -10.440 -3.266 488 HE3 MET 77 3HE MET 77 26.952 -10.422 -4.177 489 H ALA 78 H ALA 78 25.935 -15.033 -1.315 490 HA ALA 78 HA ALA 78 25.779 -17.363 -2.803 491 HB1 ALA 78 1HB ALA 78 27.256 -17.205 -0.192 492 HB2 ALA 78 2HB ALA 78 27.681 -18.112 -1.645 493 HB3 ALA 78 3HB ALA 78 27.802 -16.353 -1.636 494 H VAL 79 H VAL 79 24.782 -16.780 0.542 495 HA VAL 79 HA VAL 79 23.771 -19.520 0.740 496 HB VAL 79 HB VAL 79 23.738 -19.297 3.037 497 HG11 VAL 79 1HG1 VAL 79 25.830 -18.328 3.721 498 HG12 VAL 79 2HG1 VAL 79 26.038 -19.061 2.128 499 HG13 VAL 79 3HG1 VAL 79 25.877 -17.312 2.281 500 HG21 VAL 79 1HG2 VAL 79 23.463 -16.334 2.586 501 HG22 VAL 79 2HG2 VAL 79 22.293 -17.440 3.305 502 HG23 VAL 79 3HG2 VAL 79 23.775 -17.039 4.172 503 H GLN 80 H GLN 80 22.602 -17.040 -0.737 504 HA GLN 80 HA GLN 80 20.506 -16.386 -1.346 505 HB2 GLN 80 2HB GLN 80 19.352 -18.378 0.592 506 HB3 GLN 80 3HB GLN 80 18.652 -17.775 -0.905 507 HG2 GLN 80 2HG GLN 80 20.880 -19.748 -0.551 508 HG3 GLN 80 3HG GLN 80 19.329 -19.971 -1.358 509 HE21 GLN 80 1HE2 GLN 80 22.286 -20.127 -2.145 510 HE22 GLN 80 2HE2 GLN 80 22.350 -19.259 -3.637 511 H LEU 81 H LEU 81 21.948 -15.269 0.955 512 HA LEU 81 HA LEU 81 19.642 -14.103 2.370 513 HB2 LEU 81 2HB LEU 81 22.315 -14.957 3.425 514 HB3 LEU 81 3HB LEU 81 21.364 -13.722 4.249 515 HG LEU 81 HG LEU 81 20.587 -16.601 3.791 516 HD11 LEU 81 1HD1 LEU 81 20.764 -15.311 6.461 517 HD12 LEU 81 2HD1 LEU 81 22.264 -15.758 5.647 518 HD13 LEU 81 3HD1 LEU 81 21.047 -16.986 5.990 519 HD21 LEU 81 1HD2 LEU 81 19.039 -14.281 4.924 520 HD22 LEU 81 2HD2 LEU 81 18.624 -15.966 5.245 521 HD23 LEU 81 3HD2 LEU 81 18.588 -15.346 3.593 522 H PHE 82 H PHE 82 19.468 -12.273 1.135 523 HA PHE 82 HA PHE 82 21.580 -10.299 1.509 524 HB2 PHE 82 2HB PHE 82 21.976 -11.428 -0.703 525 HB3 PHE 82 3HB PHE 82 20.406 -10.825 -1.227 526 HD1 PHE 82 HD1 PHE 82 20.111 -8.571 -1.899 527 HD2 PHE 82 HD2 PHE 82 23.810 -9.846 -0.220 528 HE1 PHE 82 HE1 PHE 82 21.158 -6.461 -2.610 529 HE2 PHE 82 HE2 PHE 82 24.861 -7.738 -0.927 530 HZ PHE 82 HZ PHE 82 23.535 -6.041 -2.123 Start of MODEL 4 1 H1 LEU 20 H LEU 20 17.441 -6.346 19.050 2 HA LEU 20 HA LEU 20 14.575 -6.918 19.227 3 HB2 LEU 20 2HB LEU 20 16.051 -6.791 16.643 4 HB3 LEU 20 3HB LEU 20 14.389 -6.336 17.010 5 HG LEU 20 HG LEU 20 15.652 -4.451 18.419 6 HD11 LEU 20 1HD1 LEU 20 17.448 -3.960 16.324 7 HD12 LEU 20 2HD1 LEU 20 17.713 -5.633 16.813 8 HD13 LEU 20 3HD1 LEU 20 17.827 -4.339 18.004 9 HD21 LEU 20 1HD2 LEU 20 14.113 -3.635 16.953 10 HD22 LEU 20 2HD2 LEU 20 14.713 -4.605 15.607 11 HD23 LEU 20 3HD2 LEU 20 15.584 -3.156 16.107 12 HA PRO 21 HA PRO 21 15.007 -11.241 18.603 13 HB2 PRO 21 2HB PRO 21 12.811 -11.783 17.103 14 HB3 PRO 21 3HB PRO 21 12.724 -11.382 18.821 15 HG2 PRO 21 2HG PRO 21 12.257 -9.627 16.442 16 HG3 PRO 21 3HG PRO 21 11.332 -9.735 17.950 17 HD2 PRO 21 2HD PRO 21 13.137 -7.770 17.484 18 HD3 PRO 21 3HD PRO 21 12.828 -8.419 19.108 19 H ALA 22 H ALA 22 14.912 -12.954 16.814 20 HA ALA 22 HA ALA 22 16.009 -11.840 14.313 21 HB1 ALA 22 1HB ALA 22 17.927 -12.786 15.010 22 HB2 ALA 22 2HB ALA 22 17.107 -13.863 16.142 23 HB3 ALA 22 3HB ALA 22 17.180 -14.276 14.429 24 H HIS 23 H HIS 23 15.887 -13.396 12.463 25 HA HIS 23 HA HIS 23 13.392 -14.960 12.607 26 HB2 HIS 23 2HB HIS 23 14.507 -13.577 10.160 27 HB3 HIS 23 3HB HIS 23 12.946 -14.379 10.306 28 HD1 HIS 23 HD1 HIS 23 11.390 -13.198 12.320 29 HD2 HIS 23 HD2 HIS 23 14.310 -10.905 10.457 30 HE1 HIS 23 HE1 HIS 23 10.744 -10.807 12.753 31 HA PRO 24 HA PRO 24 15.711 -18.507 11.432 32 HB2 PRO 24 2HB PRO 24 13.734 -19.979 10.294 33 HB3 PRO 24 3HB PRO 24 13.866 -19.734 12.039 34 HG2 PRO 24 2HG PRO 24 12.118 -18.329 10.057 35 HG3 PRO 24 3HG PRO 24 11.716 -18.925 11.678 36 HD2 PRO 24 2HD PRO 24 12.256 -16.319 11.175 37 HD3 PRO 24 3HD PRO 24 12.658 -17.097 12.720 38 H TYR 25 H TYR 25 16.496 -19.669 9.600 39 HA TYR 25 HA TYR 25 16.847 -18.074 7.288 40 HB2 TYR 25 2HB TYR 25 18.567 -19.637 8.019 41 HB3 TYR 25 3HB TYR 25 17.478 -20.995 7.763 42 HD1 TYR 25 HD1 TYR 25 16.907 -21.717 5.485 43 HD2 TYR 25 HD2 TYR 25 19.698 -18.581 6.176 44 HE1 TYR 25 HE1 TYR 25 17.704 -21.926 3.169 45 HE2 TYR 25 HE2 TYR 25 20.503 -18.781 3.860 46 HH TYR 25 HH TYR 25 19.165 -21.223 1.654 47 H ASP 26 H ASP 26 14.720 -20.745 8.079 48 HA ASP 26 HA ASP 26 13.844 -21.387 5.492 49 HB2 ASP 26 2HB ASP 26 13.400 -22.797 7.462 50 HB3 ASP 26 3HB ASP 26 12.310 -21.566 8.093 51 H ARG 27 H ARG 27 13.066 -18.747 7.600 52 HA ARG 27 HA ARG 27 10.774 -17.965 5.967 53 HB2 ARG 27 2HB ARG 27 10.853 -17.873 8.547 54 HB3 ARG 27 3HB ARG 27 11.839 -16.434 8.325 55 HG2 ARG 27 2HG ARG 27 10.002 -15.439 6.993 56 HG3 ARG 27 3HG ARG 27 9.016 -16.853 7.372 57 HD2 ARG 27 2HD ARG 27 9.386 -16.332 9.802 58 HD3 ARG 27 3HD ARG 27 10.132 -14.817 9.293 59 HE ARG 27 HE ARG 27 8.045 -13.974 8.916 60 HH11 ARG 27 1HH1 ARG 27 7.846 -17.448 9.018 61 HH12 ARG 27 2HH1 ARG 27 6.116 -17.482 8.935 62 HH21 ARG 27 1HH2 ARG 27 5.767 -14.005 8.805 63 HH22 ARG 27 2HH2 ARG 27 4.935 -15.523 8.813 64 H LEU 28 H LEU 28 14.109 -17.273 6.371 65 HA LEU 28 HA LEU 28 13.920 -14.679 5.057 66 HB2 LEU 28 2HB LEU 28 16.056 -16.195 6.466 67 HB3 LEU 28 3HB LEU 28 16.534 -14.985 5.276 68 HG LEU 28 HG LEU 28 14.602 -14.142 7.362 69 HD11 LEU 28 1HD1 LEU 28 16.823 -13.593 8.700 70 HD12 LEU 28 2HD1 LEU 28 17.363 -15.077 7.916 71 HD13 LEU 28 3HD1 LEU 28 15.930 -15.095 8.944 72 HD21 LEU 28 1HD2 LEU 28 17.047 -12.636 6.637 73 HD22 LEU 28 2HD2 LEU 28 15.399 -12.067 6.908 74 HD23 LEU 28 3HD2 LEU 28 15.825 -12.841 5.381 75 H LYS 29 H LYS 29 14.395 -14.309 2.970 76 HA LYS 29 HA LYS 29 15.603 -16.489 1.408 77 HB2 LYS 29 2HB LYS 29 12.961 -15.881 1.236 78 HB3 LYS 29 3HB LYS 29 13.622 -14.811 0.006 79 HG2 LYS 29 2HG LYS 29 14.420 -16.580 -1.278 80 HG3 LYS 29 3HG LYS 29 14.334 -17.719 0.068 81 HD2 LYS 29 2HD LYS 29 11.850 -16.419 -0.986 82 HD3 LYS 29 3HD LYS 29 12.539 -17.824 -1.802 83 HE2 LYS 29 2HE LYS 29 12.325 -19.157 0.175 84 HE3 LYS 29 3HE LYS 29 11.864 -17.752 1.134 85 HZ1 LYS 29 1HZ LYS 29 10.290 -19.178 -0.915 86 HZ2 LYS 29 2HZ LYS 29 9.917 -17.585 -0.489 87 HZ3 LYS 29 3HZ LYS 29 9.864 -18.806 0.680 88 H THR 30 H THR 30 16.817 -15.853 -0.412 89 HA THR 30 HA THR 30 18.458 -13.668 -0.138 90 HB THR 30 HB THR 30 17.940 -14.355 -2.949 91 HG1 THR 30 HG1 THR 30 17.889 -16.447 -2.691 92 HG21 THR 30 1HG2 THR 30 19.958 -13.197 -2.270 93 HG22 THR 30 2HG2 THR 30 20.376 -14.795 -2.889 94 HG23 THR 30 3HG2 THR 30 20.361 -14.499 -1.150 95 H THR 31 H THR 31 15.423 -13.890 -1.936 96 HA THR 31 HA THR 31 15.428 -10.952 -2.146 97 HB THR 31 HB THR 31 14.196 -11.157 -4.288 98 HG1 THR 31 HG1 THR 31 15.008 -13.864 -4.384 99 HG21 THR 31 1HG2 THR 31 16.096 -11.571 -5.652 100 HG22 THR 31 2HG2 THR 31 16.817 -12.635 -4.444 101 HG23 THR 31 3HG2 THR 31 16.708 -10.902 -4.141 102 H SER 32 H SER 32 14.288 -12.306 -0.010 103 HA SER 32 HA SER 32 11.469 -12.679 -0.501 104 HB2 SER 32 2HB SER 32 11.915 -14.047 1.245 105 HB3 SER 32 3HB SER 32 13.333 -13.119 1.731 106 HG SER 32 HG SER 32 11.959 -12.714 3.336 107 H THR 33 H THR 33 9.809 -11.481 0.661 108 HA THR 33 HA THR 33 10.576 -8.676 1.150 109 HB THR 33 HB THR 33 8.197 -8.136 0.376 110 HG1 THR 33 HG1 THR 33 7.792 -10.588 0.334 111 HG21 THR 33 1HG2 THR 33 8.960 -7.666 -1.741 112 HG22 THR 33 2HG2 THR 33 9.771 -9.223 -1.912 113 HG23 THR 33 3HG2 THR 33 10.488 -7.958 -0.913 114 H ASP 34 H ASP 34 9.632 -11.368 2.660 115 HA ASP 34 HA ASP 34 7.388 -10.808 4.165 116 HB2 ASP 34 2HB ASP 34 9.702 -12.570 4.405 117 HB3 ASP 34 3HB ASP 34 9.072 -12.066 5.971 118 HA PRO 35 HA PRO 35 8.319 -7.542 6.939 119 HB2 PRO 35 2HB PRO 35 7.140 -8.372 9.239 120 HB3 PRO 35 3HB PRO 35 6.220 -7.827 7.830 121 HG2 PRO 35 2HG PRO 35 6.837 -10.616 8.728 122 HG3 PRO 35 3HG PRO 35 5.315 -9.951 8.110 123 HD2 PRO 35 2HD PRO 35 7.000 -11.405 6.569 124 HD3 PRO 35 3HD PRO 35 5.997 -10.097 5.913 125 H VAL 36 H VAL 36 9.461 -6.931 8.896 126 HA VAL 36 HA VAL 36 11.160 -9.023 10.056 127 HB VAL 36 HB VAL 36 13.049 -7.243 9.972 128 HG11 VAL 36 1HG1 VAL 36 13.049 -9.432 8.819 129 HG12 VAL 36 2HG1 VAL 36 12.253 -8.673 7.439 130 HG13 VAL 36 3HG1 VAL 36 13.878 -8.172 7.905 131 HG21 VAL 36 1HG2 VAL 36 12.995 -5.751 8.081 132 HG22 VAL 36 2HG2 VAL 36 11.417 -6.367 7.592 133 HG23 VAL 36 3HG2 VAL 36 11.580 -5.451 9.090 134 H SER 37 H SER 37 12.512 -8.008 11.911 135 HA SER 37 HA SER 37 10.616 -6.663 13.653 136 HB2 SER 37 2HB SER 37 12.299 -8.680 14.166 137 HB3 SER 37 3HB SER 37 13.358 -7.336 14.599 138 HG SER 37 HG SER 37 11.966 -6.731 16.170 139 H ASP 38 H ASP 38 12.385 -5.443 11.384 140 HA ASP 38 HA ASP 38 13.233 -3.372 10.958 141 HB2 ASP 38 2HB ASP 38 11.366 -2.786 12.700 142 HB3 ASP 38 3HB ASP 38 12.728 -2.498 13.779 143 H ILE 39 H ILE 39 15.304 -4.381 10.796 144 HA ILE 39 HA ILE 39 17.148 -3.453 12.872 145 HB ILE 39 HB ILE 39 18.251 -5.867 11.971 146 HG12 ILE 39 2HG1 ILE 39 15.353 -6.197 12.777 147 HG13 ILE 39 3HG1 ILE 39 16.046 -6.581 11.205 148 HG21 ILE 39 1HG2 ILE 39 18.389 -6.373 14.227 149 HG22 ILE 39 2HG2 ILE 39 18.259 -4.616 14.238 150 HG23 ILE 39 3HG2 ILE 39 16.846 -5.606 14.599 151 HD11 ILE 39 1HD1 ILE 39 16.123 -8.085 13.731 152 HD12 ILE 39 2HD1 ILE 39 16.090 -8.656 12.062 153 HD13 ILE 39 3HD1 ILE 39 17.604 -8.097 12.774 154 H ASP 40 H ASP 40 19.505 -4.344 11.886 155 HA ASP 40 HA ASP 40 20.236 -2.540 9.971 156 HB2 ASP 40 2HB ASP 40 21.415 -5.293 10.409 157 HB3 ASP 40 3HB ASP 40 22.201 -3.985 9.529 158 H VAL 41 H VAL 41 18.937 -2.299 8.209 159 HA VAL 41 HA VAL 41 17.833 -4.362 6.666 160 HB VAL 41 HB VAL 41 18.526 -1.541 5.834 161 HG11 VAL 41 1HG1 VAL 41 18.230 -2.681 3.821 162 HG12 VAL 41 2HG1 VAL 41 16.959 -3.712 4.482 163 HG13 VAL 41 3HG1 VAL 41 16.636 -2.008 4.158 164 HG21 VAL 41 1HG2 VAL 41 16.965 -1.799 7.771 165 HG22 VAL 41 2HG2 VAL 41 16.263 -0.985 6.373 166 HG23 VAL 41 3HG2 VAL 41 15.869 -2.673 6.699 167 H THR 42 H THR 42 20.849 -2.543 6.285 168 HA THR 42 HA THR 42 21.621 -3.698 3.830 169 HB THR 42 HB THR 42 23.929 -3.034 5.406 170 HG1 THR 42 HG1 THR 42 23.159 -1.467 6.589 171 HG21 THR 42 1HG2 THR 42 24.342 -1.485 3.659 172 HG22 THR 42 2HG2 THR 42 22.632 -1.396 3.235 173 HG23 THR 42 3HG2 THR 42 23.548 -2.867 2.905 174 H ARG 43 H ARG 43 21.560 -4.946 7.000 175 HA ARG 43 HA ARG 43 23.257 -7.204 6.164 176 HB2 ARG 43 2HB ARG 43 22.931 -6.038 8.934 177 HB3 ARG 43 3HB ARG 43 23.809 -7.517 8.568 178 HG2 ARG 43 2HG ARG 43 25.591 -6.167 8.494 179 HG3 ARG 43 3HG ARG 43 25.008 -5.779 6.874 180 HD2 ARG 43 2HD ARG 43 23.727 -3.889 7.843 181 HD3 ARG 43 3HD ARG 43 24.450 -4.249 9.411 182 HE ARG 43 HE ARG 43 25.665 -2.845 7.247 183 HH11 ARG 43 1HH1 ARG 43 26.319 -4.963 9.931 184 HH12 ARG 43 2HH1 ARG 43 27.955 -4.426 10.124 185 HH21 ARG 43 1HH2 ARG 43 27.817 -2.130 7.491 186 HH22 ARG 43 2HH2 ARG 43 28.806 -2.814 8.737 187 H ARG 44 H ARG 44 20.622 -7.260 5.511 188 HA ARG 44 HA ARG 44 18.778 -8.220 7.319 189 HB2 ARG 44 2HB ARG 44 18.201 -7.681 5.014 190 HB3 ARG 44 3HB ARG 44 19.156 -9.039 4.434 191 HG2 ARG 44 2HG ARG 44 17.282 -10.222 4.474 192 HG3 ARG 44 3HG ARG 44 17.399 -10.185 6.235 193 HD2 ARG 44 2HD ARG 44 15.499 -9.042 6.310 194 HD3 ARG 44 3HD ARG 44 16.284 -7.724 5.441 195 HE ARG 44 HE ARG 44 14.454 -9.683 4.359 196 HH11 ARG 44 1HH1 ARG 44 16.885 -7.286 3.677 197 HH12 ARG 44 2HH1 ARG 44 16.362 -7.031 2.044 198 HH21 ARG 44 1HH2 ARG 44 13.757 -9.357 2.212 199 HH22 ARG 44 2HH2 ARG 44 14.582 -8.209 1.212 200 H GLU 45 H GLU 45 21.341 -9.976 5.647 201 HA GLU 45 HA GLU 45 20.617 -12.580 6.308 202 HB2 GLU 45 2HB GLU 45 22.862 -13.205 5.817 203 HB3 GLU 45 3HB GLU 45 22.457 -11.875 4.742 204 HG2 GLU 45 2HG GLU 45 23.986 -11.562 7.312 205 HG3 GLU 45 3HG GLU 45 24.731 -11.747 5.726 206 H ALA 46 H ALA 46 22.111 -10.089 8.232 207 HA ALA 46 HA ALA 46 23.058 -11.762 10.325 208 HB1 ALA 46 1HB ALA 46 22.290 -8.872 10.632 209 HB2 ALA 46 2HB ALA 46 23.514 -9.783 11.516 210 HB3 ALA 46 3HB ALA 46 23.771 -9.380 9.819 211 H TYR 47 H TYR 47 19.946 -10.830 9.395 212 HA TYR 47 HA TYR 47 18.646 -10.587 11.875 213 HB2 TYR 47 2HB TYR 47 17.603 -11.531 9.198 214 HB3 TYR 47 3HB TYR 47 16.582 -11.178 10.588 215 HD1 TYR 47 HD1 TYR 47 15.830 -9.751 8.324 216 HD2 TYR 47 HD2 TYR 47 19.066 -8.879 10.945 217 HE1 TYR 47 HE1 TYR 47 15.731 -7.388 7.650 218 HE2 TYR 47 HE2 TYR 47 18.976 -6.514 10.278 219 HH TYR 47 HH TYR 47 16.417 -5.139 8.720 220 H LEU 48 H LEU 48 20.114 -13.258 10.435 221 HA LEU 48 HA LEU 48 18.395 -15.255 11.635 222 HB2 LEU 48 2HB LEU 48 20.466 -15.187 9.640 223 HB3 LEU 48 3HB LEU 48 20.804 -16.443 10.830 224 HG LEU 48 HG LEU 48 18.212 -16.210 9.307 225 HD11 LEU 48 1HD1 LEU 48 20.631 -16.874 8.215 226 HD12 LEU 48 2HD1 LEU 48 19.057 -17.395 7.614 227 HD13 LEU 48 3HD1 LEU 48 19.983 -18.445 8.688 228 HD21 LEU 48 1HD2 LEU 48 18.501 -18.797 10.105 229 HD22 LEU 48 2HD2 LEU 48 17.555 -17.577 10.960 230 HD23 LEU 48 3HD2 LEU 48 19.210 -17.924 11.464 231 H SER 49 H SER 49 19.290 -16.916 13.087 232 HA SER 49 HA SER 49 20.500 -15.729 15.359 233 HB2 SER 49 2HB SER 49 19.218 -18.217 14.710 234 HB3 SER 49 3HB SER 49 20.719 -18.543 15.577 235 HG SER 49 HG SER 49 19.197 -18.228 17.126 236 H SER 50 H SER 50 22.516 -16.195 16.330 237 HA SER 50 HA SER 50 24.733 -16.052 14.697 238 HB2 SER 50 2HB SER 50 26.065 -16.401 16.649 239 HB3 SER 50 3HB SER 50 24.609 -15.561 17.183 240 HG SER 50 HG SER 50 25.468 -18.144 17.704 241 H GLU 51 H GLU 51 22.984 -18.859 15.780 242 HA GLU 51 HA GLU 51 25.018 -20.749 15.057 243 HB2 GLU 51 2HB GLU 51 22.078 -21.301 15.455 244 HB3 GLU 51 3HB GLU 51 23.408 -22.442 15.587 245 HG2 GLU 51 2HG GLU 51 24.252 -21.096 17.521 246 HG3 GLU 51 3HG GLU 51 22.754 -20.171 17.443 247 H GLU 52 H GLU 52 21.791 -20.041 13.705 248 HA GLU 52 HA GLU 52 22.107 -21.582 11.383 249 HB2 GLU 52 2HB GLU 52 20.256 -19.447 12.286 250 HB3 GLU 52 3HB GLU 52 20.342 -19.728 10.552 251 HG2 GLU 52 2HG GLU 52 19.772 -21.856 12.602 252 HG3 GLU 52 3HG GLU 52 18.544 -20.991 11.680 253 H PHE 53 H PHE 53 22.449 -18.062 11.831 254 HA PHE 53 HA PHE 53 23.168 -17.341 9.277 255 HB2 PHE 53 2HB PHE 53 22.838 -15.581 10.798 256 HB3 PHE 53 3HB PHE 53 23.973 -16.256 11.963 257 HD1 PHE 53 HD1 PHE 53 26.389 -16.043 11.607 258 HD2 PHE 53 HD2 PHE 53 23.574 -14.206 8.995 259 HE1 PHE 53 HE1 PHE 53 28.169 -14.602 10.708 260 HE2 PHE 53 HE2 PHE 53 25.350 -12.763 8.091 261 HZ PHE 53 HZ PHE 53 27.651 -12.960 8.946 262 H LYS 54 H LYS 54 25.420 -18.189 11.909 263 HA LYS 54 HA LYS 54 27.723 -18.179 10.264 264 HB2 LYS 54 2HB LYS 54 28.891 -18.761 12.150 265 HB3 LYS 54 3HB LYS 54 27.429 -18.120 12.890 266 HG2 LYS 54 2HG LYS 54 27.569 -20.050 14.055 267 HG3 LYS 54 3HG LYS 54 26.678 -20.663 12.661 268 HD2 LYS 54 2HD LYS 54 28.436 -21.870 11.904 269 HD3 LYS 54 3HD LYS 54 29.619 -20.661 12.412 270 HE2 LYS 54 2HE LYS 54 28.461 -21.715 14.757 271 HE3 LYS 54 3HE LYS 54 28.835 -23.086 13.714 272 HZ1 LYS 54 1HZ LYS 54 30.842 -20.976 14.152 273 HZ2 LYS 54 2HZ LYS 54 31.073 -22.596 13.727 274 HZ3 LYS 54 3HZ LYS 54 30.631 -22.193 15.308 275 H GLU 55 H GLU 55 25.257 -20.521 10.849 276 HA GLU 55 HA GLU 55 26.779 -22.806 10.025 277 HB2 GLU 55 2HB GLU 55 23.949 -22.253 10.738 278 HB3 GLU 55 3HB GLU 55 24.254 -23.650 9.716 279 HG2 GLU 55 2HG GLU 55 25.991 -23.420 12.073 280 HG3 GLU 55 3HG GLU 55 24.284 -23.693 12.412 281 H LYS 56 H LYS 56 24.919 -20.353 8.442 282 HA LYS 56 HA LYS 56 24.801 -21.851 5.942 283 HB2 LYS 56 2HB LYS 56 23.449 -19.488 7.060 284 HB3 LYS 56 3HB LYS 56 23.838 -19.363 5.350 285 HG2 LYS 56 2HG LYS 56 22.463 -21.795 6.414 286 HG3 LYS 56 3HG LYS 56 21.553 -20.325 6.061 287 HD2 LYS 56 2HD LYS 56 22.072 -20.413 3.781 288 HD3 LYS 56 3HD LYS 56 23.414 -21.531 4.039 289 HE2 LYS 56 2HE LYS 56 21.913 -23.324 4.530 290 HE3 LYS 56 3HE LYS 56 20.530 -22.233 4.559 291 HZ1 LYS 56 1HZ LYS 56 21.232 -21.756 2.134 292 HZ2 LYS 56 2HZ LYS 56 20.377 -23.175 2.481 293 HZ3 LYS 56 3HZ LYS 56 22.052 -23.232 2.247 294 H PHE 57 H PHE 57 26.502 -19.177 7.418 295 HA PHE 57 HA PHE 57 27.915 -18.630 4.910 296 HB2 PHE 57 2HB PHE 57 27.856 -17.125 7.533 297 HB3 PHE 57 3HB PHE 57 28.823 -16.654 6.138 298 HD1 PHE 57 HD1 PHE 57 27.442 -16.435 3.891 299 HD2 PHE 57 HD2 PHE 57 25.804 -16.142 7.808 300 HE1 PHE 57 HE1 PHE 57 25.535 -15.166 2.994 301 HE2 PHE 57 HE2 PHE 57 23.893 -14.873 6.917 302 HZ PHE 57 HZ PHE 57 23.756 -14.385 4.508 303 H GLY 58 H GLY 58 28.262 -20.312 7.838 304 HA2 GLY 58 2HA GLY 58 29.991 -21.676 8.540 305 HA3 GLY 58 3HA GLY 58 30.913 -21.162 7.134 306 H MET 59 H MET 59 29.886 -18.409 8.609 307 HA MET 59 HA MET 59 32.213 -18.280 10.403 308 HB2 MET 59 2HB MET 59 31.384 -15.943 8.702 309 HB3 MET 59 3HB MET 59 32.898 -16.190 9.562 310 HG2 MET 59 2HG MET 59 32.001 -17.804 7.187 311 HG3 MET 59 3HG MET 59 33.089 -16.419 7.110 312 HE1 MET 59 1HE MET 59 33.505 -20.044 6.554 313 HE2 MET 59 2HE MET 59 34.046 -18.596 5.706 314 HE3 MET 59 3HE MET 59 35.228 -19.682 6.437 315 H THR 60 H THR 60 31.935 -17.152 12.281 316 HA THR 60 HA THR 60 29.291 -16.768 13.217 317 HB THR 60 HB THR 60 30.260 -15.994 15.272 318 HG1 THR 60 HG1 THR 60 32.633 -15.660 15.278 319 HG21 THR 60 1HG2 THR 60 30.487 -18.377 14.885 320 HG22 THR 60 2HG2 THR 60 31.910 -17.777 15.738 321 HG23 THR 60 3HG2 THR 60 31.996 -18.118 14.010 322 H LYS 61 H LYS 61 29.144 -14.500 14.627 323 HA LYS 61 HA LYS 61 28.456 -12.562 12.691 324 HB2 LYS 61 2HB LYS 61 28.099 -11.073 14.683 325 HB3 LYS 61 3HB LYS 61 27.239 -12.606 14.746 326 HG2 LYS 61 2HG LYS 61 29.510 -13.280 16.029 327 HG3 LYS 61 3HG LYS 61 29.397 -11.571 16.455 328 HD2 LYS 61 2HD LYS 61 27.222 -11.879 17.396 329 HD3 LYS 61 3HD LYS 61 27.124 -13.526 16.771 330 HE2 LYS 61 2HE LYS 61 28.841 -14.265 18.261 331 HE3 LYS 61 3HE LYS 61 29.197 -12.612 18.758 332 HZ1 LYS 61 1HZ LYS 61 27.481 -14.349 19.994 333 HZ2 LYS 61 2HZ LYS 61 26.456 -13.279 19.179 334 HZ3 LYS 61 3HZ LYS 61 27.597 -12.686 20.278 335 H GLU 62 H GLU 62 31.071 -12.629 15.111 336 HA GLU 62 HA GLU 62 32.267 -10.220 14.152 337 HB2 GLU 62 2HB GLU 62 32.901 -12.272 16.193 338 HB3 GLU 62 3HB GLU 62 34.264 -11.367 15.551 339 HG2 GLU 62 2HG GLU 62 33.309 -9.295 16.249 340 HG3 GLU 62 3HG GLU 62 31.801 -10.086 16.703 341 H ALA 63 H ALA 63 32.633 -13.616 13.451 342 HA ALA 63 HA ALA 63 35.132 -13.403 12.089 343 HB1 ALA 63 1HB ALA 63 34.831 -15.664 11.478 344 HB2 ALA 63 2HB ALA 63 34.139 -15.502 13.092 345 HB3 ALA 63 3HB ALA 63 33.082 -15.566 11.681 346 H PHE 64 H PHE 64 31.773 -13.760 10.945 347 HA PHE 64 HA PHE 64 32.344 -13.580 8.208 348 HB2 PHE 64 2HB PHE 64 30.177 -14.345 9.239 349 HB3 PHE 64 3HB PHE 64 29.800 -12.654 9.551 350 HD1 PHE 64 HD1 PHE 64 30.180 -15.229 6.983 351 HD2 PHE 64 HD2 PHE 64 29.198 -11.161 7.759 352 HE1 PHE 64 HE1 PHE 64 29.228 -15.031 4.723 353 HE2 PHE 64 HE2 PHE 64 28.244 -10.957 5.500 354 HZ PHE 64 HZ PHE 64 28.258 -12.893 3.979 355 H TYR 65 H TYR 65 31.097 -11.049 10.391 356 HA TYR 65 HA TYR 65 31.146 -8.934 8.605 357 HB2 TYR 65 2HB TYR 65 31.443 -9.077 11.591 358 HB3 TYR 65 3HB TYR 65 31.548 -7.533 10.753 359 HD1 TYR 65 HD1 TYR 65 29.506 -7.760 8.687 360 HD2 TYR 65 HD2 TYR 65 29.422 -9.076 12.733 361 HE1 TYR 65 HE1 TYR 65 27.053 -7.589 8.686 362 HE2 TYR 65 HE2 TYR 65 26.969 -8.909 12.742 363 HH TYR 65 HH TYR 65 25.208 -7.611 11.465 364 H LYS 66 H LYS 66 33.766 -10.526 10.200 365 HA LYS 66 HA LYS 66 35.728 -8.546 10.153 366 HB2 LYS 66 2HB LYS 66 35.640 -11.172 10.903 367 HB3 LYS 66 3HB LYS 66 36.660 -11.255 9.471 368 HG2 LYS 66 2HG LYS 66 38.113 -9.513 10.465 369 HG3 LYS 66 3HG LYS 66 37.129 -9.579 11.928 370 HD2 LYS 66 2HD LYS 66 37.768 -11.818 12.367 371 HD3 LYS 66 3HD LYS 66 38.479 -12.003 10.762 372 HE2 LYS 66 2HE LYS 66 39.881 -9.884 11.725 373 HE3 LYS 66 3HE LYS 66 39.592 -10.801 13.202 374 HZ1 LYS 66 1HZ LYS 66 40.496 -12.327 10.897 375 HZ2 LYS 66 2HZ LYS 66 40.916 -12.477 12.528 376 HZ3 LYS 66 3HZ LYS 66 41.630 -11.272 11.579 377 H LEU 67 H LEU 67 34.427 -10.523 7.594 378 HA LEU 67 HA LEU 67 36.502 -10.074 5.705 379 HB2 LEU 67 2HB LEU 67 33.806 -11.240 5.711 380 HB3 LEU 67 3HB LEU 67 34.304 -10.539 4.174 381 HG LEU 67 HG LEU 67 36.205 -12.021 4.064 382 HD11 LEU 67 1HD1 LEU 67 36.306 -13.874 5.837 383 HD12 LEU 67 2HD1 LEU 67 35.355 -12.776 6.837 384 HD13 LEU 67 3HD1 LEU 67 36.946 -12.285 6.256 385 HD21 LEU 67 1HD2 LEU 67 35.015 -13.777 3.317 386 HD22 LEU 67 2HD2 LEU 67 33.627 -12.757 3.701 387 HD23 LEU 67 3HD2 LEU 67 34.162 -13.986 4.847 388 HA PRO 68 HA PRO 68 35.621 -6.107 4.051 389 HB2 PRO 68 2HB PRO 68 35.819 -6.486 1.370 390 HB3 PRO 68 3HB PRO 68 37.220 -6.500 2.448 391 HG2 PRO 68 2HG PRO 68 35.689 -8.802 1.299 392 HG3 PRO 68 3HG PRO 68 37.442 -8.596 1.465 393 HD2 PRO 68 2HD PRO 68 35.982 -10.096 3.182 394 HD3 PRO 68 3HD PRO 68 37.429 -9.201 3.689 395 H LYS 69 H LYS 69 34.221 -4.875 2.488 396 HA LYS 69 HA LYS 69 31.513 -5.619 2.829 397 HB2 LYS 69 2HB LYS 69 32.996 -3.366 1.670 398 HB3 LYS 69 3HB LYS 69 31.457 -3.685 0.879 399 HG2 LYS 69 2HG LYS 69 31.230 -2.037 2.659 400 HG3 LYS 69 3HG LYS 69 30.299 -3.496 3.006 401 HD2 LYS 69 2HD LYS 69 31.402 -3.800 4.914 402 HD3 LYS 69 3HD LYS 69 32.951 -3.758 4.070 403 HE2 LYS 69 2HE LYS 69 32.832 -1.267 4.132 404 HE3 LYS 69 3HE LYS 69 31.387 -1.409 5.133 405 HZ1 LYS 69 1HZ LYS 69 33.022 -2.930 6.522 406 HZ2 LYS 69 2HZ LYS 69 32.934 -1.258 6.757 407 HZ3 LYS 69 3HZ LYS 69 34.178 -1.915 5.816 408 H TRP 70 H TRP 70 33.623 -5.544 -0.029 409 HA TRP 70 HA TRP 70 31.756 -6.364 -1.925 410 HB2 TRP 70 2HB TRP 70 33.579 -6.817 -3.352 411 HB3 TRP 70 3HB TRP 70 34.152 -5.538 -2.285 412 HD1 TRP 70 HD1 TRP 70 36.069 -6.159 -0.536 413 HE1 TRP 70 HE1 TRP 70 37.712 -8.136 -0.406 414 HE3 TRP 70 HE3 TRP 70 33.783 -9.332 -3.829 415 HZ2 TRP 70 HZ2 TRP 70 38.001 -10.701 -1.548 416 HZ3 TRP 70 HZ3 TRP 70 34.808 -11.528 -4.255 417 HH2 TRP 70 HH2 TRP 70 36.873 -12.196 -3.138 418 H LYS 71 H LYS 71 33.851 -8.293 0.181 419 HA LYS 71 HA LYS 71 32.930 -10.795 -0.880 420 HB2 LYS 71 2HB LYS 71 35.192 -10.399 0.170 421 HB3 LYS 71 3HB LYS 71 34.379 -10.327 1.728 422 HG2 LYS 71 2HG LYS 71 33.806 -12.581 1.673 423 HG3 LYS 71 3HG LYS 71 34.058 -12.699 -0.070 424 HD2 LYS 71 2HD LYS 71 36.508 -12.188 0.415 425 HD3 LYS 71 3HD LYS 71 36.122 -12.504 2.109 426 HE2 LYS 71 2HE LYS 71 35.877 -14.733 1.776 427 HE3 LYS 71 3HE LYS 71 35.231 -14.530 0.148 428 HZ1 LYS 71 1HZ LYS 71 38.054 -13.899 0.639 429 HZ2 LYS 71 2HZ LYS 71 37.309 -14.470 -0.768 430 HZ3 LYS 71 3HZ LYS 71 37.595 -15.523 0.524 431 H GLN 72 H GLN 72 32.065 -8.705 1.784 432 HA GLN 72 HA GLN 72 30.522 -10.555 3.255 433 HB2 GLN 72 2HB GLN 72 31.288 -8.447 4.221 434 HB3 GLN 72 3HB GLN 72 30.294 -7.546 3.084 435 HG2 GLN 72 2HG GLN 72 28.465 -9.195 4.265 436 HG3 GLN 72 3HG GLN 72 29.573 -8.848 5.592 437 HE21 GLN 72 1HE2 GLN 72 28.719 -7.318 6.800 438 HE22 GLN 72 2HE2 GLN 72 27.983 -5.863 6.230 439 H ASN 73 H ASN 73 29.740 -8.356 0.609 440 HA ASN 73 HA ASN 73 26.929 -8.901 0.688 441 HB2 ASN 73 2HB ASN 73 28.703 -7.138 -0.749 442 HB3 ASN 73 3HB ASN 73 27.603 -7.934 -1.872 443 HD21 ASN 73 1HD2 ASN 73 27.118 -6.931 1.484 444 HD22 ASN 73 2HD2 ASN 73 25.804 -5.857 1.156 445 H LYS 74 H LYS 74 29.698 -10.310 -0.861 446 HA LYS 74 HA LYS 74 28.304 -11.732 -2.892 447 HB2 LYS 74 2HB LYS 74 31.021 -12.109 -1.635 448 HB3 LYS 74 3HB LYS 74 30.426 -13.125 -2.942 449 HG2 LYS 74 2HG LYS 74 30.391 -10.175 -3.306 450 HG3 LYS 74 3HG LYS 74 31.932 -11.030 -3.418 451 HD2 LYS 74 2HD LYS 74 31.143 -12.384 -5.206 452 HD3 LYS 74 3HD LYS 74 29.480 -11.841 -4.970 453 HE2 LYS 74 2HE LYS 74 30.574 -9.475 -5.415 454 HE3 LYS 74 3HE LYS 74 31.776 -10.453 -6.256 455 HZ1 LYS 74 1HZ LYS 74 30.264 -10.015 -7.908 456 HZ2 LYS 74 2HZ LYS 74 28.926 -10.081 -6.876 457 HZ3 LYS 74 3HZ LYS 74 29.699 -11.508 -7.351 458 H PHE 75 H PHE 75 29.671 -12.764 0.234 459 HA PHE 75 HA PHE 75 28.743 -15.401 0.150 460 HB2 PHE 75 2HB PHE 75 30.055 -13.703 2.035 461 HB3 PHE 75 3HB PHE 75 28.733 -14.525 2.856 462 HD1 PHE 75 HD1 PHE 75 28.656 -17.125 1.593 463 HD2 PHE 75 HD2 PHE 75 32.009 -14.737 2.676 464 HE1 PHE 75 HE1 PHE 75 30.035 -19.153 1.783 465 HE2 PHE 75 HE2 PHE 75 33.393 -16.763 2.866 466 HZ PHE 75 HZ PHE 75 32.407 -18.974 2.419 467 H LYS 76 H LYS 76 27.214 -12.443 1.307 468 HA LYS 76 HA LYS 76 25.045 -13.383 2.678 469 HB2 LYS 76 2HB LYS 76 25.563 -11.004 0.997 470 HB3 LYS 76 3HB LYS 76 23.869 -11.371 1.303 471 HG2 LYS 76 2HG LYS 76 24.125 -11.129 3.625 472 HG3 LYS 76 3HG LYS 76 25.886 -11.184 3.518 473 HD2 LYS 76 2HD LYS 76 25.392 -9.060 1.941 474 HD3 LYS 76 3HD LYS 76 24.020 -8.942 3.046 475 HE2 LYS 76 2HE LYS 76 26.184 -9.476 4.697 476 HE3 LYS 76 3HE LYS 76 26.826 -8.358 3.494 477 HZ1 LYS 76 1HZ LYS 76 25.314 -7.724 5.707 478 HZ2 LYS 76 2HZ LYS 76 24.271 -7.514 4.393 479 HZ3 LYS 76 3HZ LYS 76 25.747 -6.688 4.441 480 H MET 77 H MET 77 24.990 -12.669 -0.822 481 HA MET 77 HA MET 77 22.519 -13.990 -1.250 482 HB2 MET 77 2HB MET 77 23.068 -13.754 -3.655 483 HB3 MET 77 3HB MET 77 23.247 -12.250 -2.761 484 HG2 MET 77 2HG MET 77 25.695 -12.722 -2.619 485 HG3 MET 77 3HG MET 77 25.431 -14.081 -3.709 486 HE1 MET 77 1HE MET 77 26.145 -13.519 -6.394 487 HE2 MET 77 2HE MET 77 27.050 -12.008 -6.330 488 HE3 MET 77 3HE MET 77 27.239 -13.204 -5.048 489 H ALA 78 H ALA 78 25.823 -15.048 -1.197 490 HA ALA 78 HA ALA 78 25.731 -17.353 -2.729 491 HB1 ALA 78 1HB ALA 78 27.729 -16.301 -1.560 492 HB2 ALA 78 2HB ALA 78 27.223 -17.196 -0.126 493 HB3 ALA 78 3HB ALA 78 27.664 -18.063 -1.598 494 H VAL 79 H VAL 79 24.744 -16.869 0.635 495 HA VAL 79 HA VAL 79 23.827 -19.642 0.790 496 HB VAL 79 HB VAL 79 23.789 -19.455 3.091 497 HG11 VAL 79 1HG1 VAL 79 25.852 -18.420 3.784 498 HG12 VAL 79 2HG1 VAL 79 26.078 -19.145 2.190 499 HG13 VAL 79 3HG1 VAL 79 25.867 -17.400 2.346 500 HG21 VAL 79 1HG2 VAL 79 23.420 -16.497 2.681 501 HG22 VAL 79 2HG2 VAL 79 22.290 -17.648 3.396 502 HG23 VAL 79 3HG2 VAL 79 23.765 -17.209 4.258 503 H GLN 80 H GLN 80 22.562 -17.194 -0.651 504 HA GLN 80 HA GLN 80 20.442 -16.608 -1.242 505 HB2 GLN 80 2HB GLN 80 19.399 -18.681 0.677 506 HB3 GLN 80 3HB GLN 80 18.626 -18.056 -0.773 507 HG2 GLN 80 2HG GLN 80 20.227 -19.187 -2.170 508 HG3 GLN 80 3HG GLN 80 21.132 -19.721 -0.754 509 HE21 GLN 80 1HE2 GLN 80 20.658 -21.637 0.070 510 HE22 GLN 80 2HE2 GLN 80 19.251 -22.571 -0.293 511 H LEU 81 H LEU 81 21.848 -15.432 1.033 512 HA LEU 81 HA LEU 81 19.513 -14.396 2.501 513 HB2 LEU 81 2HB LEU 81 22.239 -15.142 3.483 514 HB3 LEU 81 3HB LEU 81 21.298 -13.909 4.321 515 HG LEU 81 HG LEU 81 20.586 -16.816 3.958 516 HD11 LEU 81 1HD1 LEU 81 22.267 -15.953 5.742 517 HD12 LEU 81 2HD1 LEU 81 20.994 -17.079 6.212 518 HD13 LEU 81 3HD1 LEU 81 20.819 -15.358 6.554 519 HD21 LEU 81 1HD2 LEU 81 18.970 -14.520 5.043 520 HD22 LEU 81 2HD2 LEU 81 18.614 -16.211 5.400 521 HD23 LEU 81 3HD2 LEU 81 18.546 -15.626 3.736 522 H PHE 82 H PHE 82 19.208 -12.582 1.266 523 HA PHE 82 HA PHE 82 21.160 -10.462 1.644 524 HB2 PHE 82 2HB PHE 82 21.722 -11.607 -0.535 525 HB3 PHE 82 3HB PHE 82 20.149 -11.091 -1.132 526 HD1 PHE 82 HD1 PHE 82 19.761 -8.855 -1.823 527 HD2 PHE 82 HD2 PHE 82 23.451 -9.933 0.005 528 HE1 PHE 82 HE1 PHE 82 20.725 -6.695 -2.504 529 HE2 PHE 82 HE2 PHE 82 24.421 -7.774 -0.673 530 HZ PHE 82 HZ PHE 82 23.057 -6.152 -1.928 Start of MODEL 5 1 H1 LEU 20 H LEU 20 19.139 -9.492 20.309 2 HA LEU 20 HA LEU 20 16.518 -8.169 20.353 3 HB2 LEU 20 2HB LEU 20 18.923 -7.930 18.700 4 HB3 LEU 20 3HB LEU 20 17.419 -7.955 17.782 5 HG LEU 20 HG LEU 20 16.910 -6.126 19.786 6 HD11 LEU 20 1HD1 LEU 20 19.529 -6.381 20.069 7 HD12 LEU 20 2HD1 LEU 20 18.722 -4.821 20.220 8 HD13 LEU 20 3HD1 LEU 20 19.535 -5.250 18.716 9 HD21 LEU 20 1HD2 LEU 20 16.472 -6.136 17.255 10 HD22 LEU 20 2HD2 LEU 20 18.043 -5.345 17.121 11 HD23 LEU 20 3HD2 LEU 20 16.748 -4.583 18.046 12 HA PRO 21 HA PRO 21 14.449 -11.495 18.375 13 HB2 PRO 21 2HB PRO 21 12.826 -10.215 16.616 14 HB3 PRO 21 3HB PRO 21 12.559 -10.190 18.363 15 HG2 PRO 21 2HG PRO 21 13.837 -8.124 16.613 16 HG3 PRO 21 3HG PRO 21 12.680 -7.906 17.939 17 HD2 PRO 21 2HD PRO 21 15.339 -7.496 18.244 18 HD3 PRO 21 3HD PRO 21 14.309 -8.096 19.559 19 H ALA 22 H ALA 22 14.858 -12.908 16.775 20 HA ALA 22 HA ALA 22 16.036 -11.889 14.276 21 HB1 ALA 22 1HB ALA 22 17.941 -12.900 14.816 22 HB2 ALA 22 2HB ALA 22 17.206 -13.677 16.218 23 HB3 ALA 22 3HB ALA 22 17.093 -14.437 14.630 24 H HIS 23 H HIS 23 15.873 -13.447 12.459 25 HA HIS 23 HA HIS 23 13.403 -15.042 12.658 26 HB2 HIS 23 2HB HIS 23 14.441 -13.676 10.171 27 HB3 HIS 23 3HB HIS 23 12.881 -14.469 10.381 28 HD1 HIS 23 HD1 HIS 23 11.416 -13.252 12.451 29 HD2 HIS 23 HD2 HIS 23 14.250 -10.999 10.414 30 HE1 HIS 23 HE1 HIS 23 10.793 -10.851 12.867 31 HA PRO 24 HA PRO 24 15.730 -18.565 11.435 32 HB2 PRO 24 2HB PRO 24 13.760 -20.042 10.290 33 HB3 PRO 24 3HB PRO 24 13.893 -19.808 12.037 34 HG2 PRO 24 2HG PRO 24 12.132 -18.402 10.068 35 HG3 PRO 24 3HG PRO 24 11.738 -19.011 11.686 36 HD2 PRO 24 2HD PRO 24 12.258 -16.398 11.200 37 HD3 PRO 24 3HD PRO 24 12.669 -17.184 12.738 38 H TYR 25 H TYR 25 16.526 -19.703 9.595 39 HA TYR 25 HA TYR 25 16.854 -18.089 7.292 40 HB2 TYR 25 2HB TYR 25 18.593 -19.638 8.011 41 HB3 TYR 25 3HB TYR 25 17.518 -21.006 7.749 42 HD1 TYR 25 HD1 TYR 25 16.924 -21.695 5.457 43 HD2 TYR 25 HD2 TYR 25 19.734 -18.585 6.183 44 HE1 TYR 25 HE1 TYR 25 17.720 -21.882 3.137 45 HE2 TYR 25 HE2 TYR 25 20.538 -18.762 3.866 46 HH TYR 25 HH TYR 25 18.878 -20.566 1.477 47 H ASP 26 H ASP 26 14.747 -20.775 8.077 48 HA ASP 26 HA ASP 26 13.878 -21.422 5.488 49 HB2 ASP 26 2HB ASP 26 13.335 -22.319 8.054 50 HB3 ASP 26 3HB ASP 26 11.793 -21.660 7.514 51 H ARG 27 H ARG 27 13.081 -18.789 7.599 52 HA ARG 27 HA ARG 27 10.792 -18.016 5.954 53 HB2 ARG 27 2HB ARG 27 11.884 -16.995 8.571 54 HB3 ARG 27 3HB ARG 27 10.614 -16.156 7.690 55 HG2 ARG 27 2HG ARG 27 10.375 -19.037 8.499 56 HG3 ARG 27 3HG ARG 27 9.885 -17.707 9.550 57 HD2 ARG 27 2HD ARG 27 8.864 -17.578 6.794 58 HD3 ARG 27 3HD ARG 27 8.260 -18.926 7.757 59 HE ARG 27 HE ARG 27 8.106 -16.466 9.181 60 HH11 ARG 27 1HH1 ARG 27 6.553 -18.356 6.704 61 HH12 ARG 27 2HH1 ARG 27 4.990 -17.659 6.970 62 HH21 ARG 27 1HH2 ARG 27 6.052 -15.540 9.541 63 HH22 ARG 27 2HH2 ARG 27 4.706 -16.057 8.583 64 H LEU 28 H LEU 28 14.117 -17.333 6.352 65 HA LEU 28 HA LEU 28 13.921 -14.717 5.075 66 HB2 LEU 28 2HB LEU 28 16.053 -16.232 6.489 67 HB3 LEU 28 3HB LEU 28 16.538 -15.020 5.304 68 HG LEU 28 HG LEU 28 14.596 -14.198 7.396 69 HD11 LEU 28 1HD1 LEU 28 17.365 -15.106 7.927 70 HD12 LEU 28 2HD1 LEU 28 15.947 -15.110 8.974 71 HD13 LEU 28 3HD1 LEU 28 16.835 -13.612 8.702 72 HD21 LEU 28 1HD2 LEU 28 15.378 -12.107 6.956 73 HD22 LEU 28 2HD2 LEU 28 15.750 -12.867 5.409 74 HD23 LEU 28 3HD2 LEU 28 17.016 -12.667 6.621 75 H LYS 29 H LYS 29 14.416 -14.323 2.996 76 HA LYS 29 HA LYS 29 15.628 -16.491 1.420 77 HB2 LYS 29 2HB LYS 29 12.988 -15.832 1.232 78 HB3 LYS 29 3HB LYS 29 13.687 -14.791 -0.001 79 HG2 LYS 29 2HG LYS 29 14.081 -16.498 -1.387 80 HG3 LYS 29 3HG LYS 29 14.658 -17.545 -0.090 81 HD2 LYS 29 2HD LYS 29 12.618 -18.464 0.255 82 HD3 LYS 29 3HD LYS 29 11.765 -16.957 -0.089 83 HE2 LYS 29 2HE LYS 29 13.132 -18.482 -2.276 84 HE3 LYS 29 3HE LYS 29 11.521 -18.943 -1.728 85 HZ1 LYS 29 1HZ LYS 29 12.286 -16.808 -3.431 86 HZ2 LYS 29 2HZ LYS 29 11.439 -16.212 -2.094 87 HZ3 LYS 29 3HZ LYS 29 10.737 -17.393 -3.083 88 H THR 30 H THR 30 16.823 -15.831 -0.422 89 HA THR 30 HA THR 30 18.510 -13.688 -0.102 90 HB THR 30 HB THR 30 17.931 -14.304 -2.925 91 HG1 THR 30 HG1 THR 30 17.516 -16.349 -2.327 92 HG21 THR 30 1HG2 THR 30 20.395 -14.479 -1.186 93 HG22 THR 30 2HG2 THR 30 19.962 -13.153 -2.266 94 HG23 THR 30 3HG2 THR 30 20.367 -14.736 -2.930 95 H THR 31 H THR 31 15.460 -13.801 -1.890 96 HA THR 31 HA THR 31 15.510 -10.859 -1.998 97 HB THR 31 HB THR 31 14.152 -11.081 -4.139 98 HG1 THR 31 HG1 THR 31 15.364 -13.627 -4.366 99 HG21 THR 31 1HG2 THR 31 16.112 -11.249 -5.538 100 HG22 THR 31 2HG2 THR 31 16.996 -12.086 -4.262 101 HG23 THR 31 3HG2 THR 31 16.540 -10.396 -4.055 102 H SER 32 H SER 32 14.349 -12.240 0.093 103 HA SER 32 HA SER 32 11.517 -12.535 -0.427 104 HB2 SER 32 2HB SER 32 11.937 -14.031 1.222 105 HB3 SER 32 3HB SER 32 13.363 -13.158 1.783 106 HG SER 32 HG SER 32 11.648 -13.144 3.318 107 H THR 33 H THR 33 9.875 -11.293 0.568 108 HA THR 33 HA THR 33 10.735 -8.580 1.337 109 HB THR 33 HB THR 33 8.364 -7.936 0.547 110 HG1 THR 33 HG1 THR 33 7.586 -10.070 0.259 111 HG21 THR 33 1HG2 THR 33 9.140 -7.507 -1.672 112 HG22 THR 33 2HG2 THR 33 10.301 -8.832 -1.584 113 HG23 THR 33 3HG2 THR 33 10.533 -7.390 -0.598 114 H ASP 34 H ASP 34 9.741 -11.290 2.705 115 HA ASP 34 HA ASP 34 7.444 -10.817 4.154 116 HB2 ASP 34 2HB ASP 34 9.891 -12.440 4.591 117 HB3 ASP 34 3HB ASP 34 8.873 -12.151 5.999 118 HA PRO 35 HA PRO 35 8.213 -7.637 7.073 119 HB2 PRO 35 2HB PRO 35 7.022 -8.586 9.321 120 HB3 PRO 35 3HB PRO 35 6.110 -8.023 7.916 121 HG2 PRO 35 2HG PRO 35 6.806 -10.819 8.727 122 HG3 PRO 35 3HG PRO 35 5.272 -10.184 8.104 123 HD2 PRO 35 2HD PRO 35 7.033 -11.526 6.545 124 HD3 PRO 35 3HD PRO 35 5.995 -10.228 5.916 125 H VAL 36 H VAL 36 9.383 -7.025 8.972 126 HA VAL 36 HA VAL 36 11.065 -9.106 10.175 127 HB VAL 36 HB VAL 36 12.969 -7.351 10.070 128 HG11 VAL 36 1HG1 VAL 36 13.812 -8.324 8.053 129 HG12 VAL 36 2HG1 VAL 36 12.886 -9.560 8.907 130 HG13 VAL 36 3HG1 VAL 36 12.186 -8.739 7.512 131 HG21 VAL 36 1HG2 VAL 36 11.514 -5.549 9.181 132 HG22 VAL 36 2HG2 VAL 36 12.932 -5.861 8.180 133 HG23 VAL 36 3HG2 VAL 36 11.353 -6.467 7.682 134 H SER 37 H SER 37 12.413 -8.065 12.020 135 HA SER 37 HA SER 37 10.516 -6.706 13.741 136 HB2 SER 37 2HB SER 37 13.017 -8.253 14.117 137 HB3 SER 37 3HB SER 37 12.699 -6.986 15.303 138 HG SER 37 HG SER 37 10.907 -9.069 14.585 139 H ASP 38 H ASP 38 12.246 -5.496 11.439 140 HA ASP 38 HA ASP 38 13.037 -3.410 10.972 141 HB2 ASP 38 2HB ASP 38 12.575 -2.534 13.804 142 HB3 ASP 38 3HB ASP 38 12.431 -1.602 12.316 143 H ILE 39 H ILE 39 15.087 -4.599 10.863 144 HA ILE 39 HA ILE 39 16.978 -3.581 12.873 145 HB ILE 39 HB ILE 39 18.138 -5.926 11.954 146 HG12 ILE 39 2HG1 ILE 39 15.732 -6.430 11.146 147 HG13 ILE 39 3HG1 ILE 39 16.578 -7.669 12.066 148 HG21 ILE 39 1HG2 ILE 39 18.508 -5.326 14.155 149 HG22 ILE 39 2HG2 ILE 39 16.793 -5.094 14.488 150 HG23 ILE 39 3HG2 ILE 39 17.447 -6.724 14.325 151 HD11 ILE 39 1HD1 ILE 39 14.950 -5.787 13.637 152 HD12 ILE 39 2HD1 ILE 39 14.071 -6.890 12.576 153 HD13 ILE 39 3HD1 ILE 39 15.162 -7.529 13.805 154 H ASP 40 H ASP 40 19.328 -4.373 11.841 155 HA ASP 40 HA ASP 40 19.965 -2.530 9.922 156 HB2 ASP 40 2HB ASP 40 21.265 -5.227 10.360 157 HB3 ASP 40 3HB ASP 40 21.985 -3.895 9.462 158 H VAL 41 H VAL 41 18.671 -2.338 8.157 159 HA VAL 41 HA VAL 41 17.619 -4.440 6.633 160 HB VAL 41 HB VAL 41 18.240 -1.612 5.768 161 HG11 VAL 41 1HG1 VAL 41 16.309 -2.169 4.137 162 HG12 VAL 41 2HG1 VAL 41 17.936 -2.743 3.764 163 HG13 VAL 41 3HG1 VAL 41 16.746 -3.847 4.452 164 HG21 VAL 41 1HG2 VAL 41 15.682 -2.842 6.790 165 HG22 VAL 41 2HG2 VAL 41 16.728 -1.743 7.689 166 HG23 VAL 41 3HG2 VAL 41 15.886 -1.177 6.246 167 H THR 42 H THR 42 20.588 -2.549 6.234 168 HA THR 42 HA THR 42 21.384 -3.696 3.782 169 HB THR 42 HB THR 42 23.754 -2.989 4.704 170 HG1 THR 42 HG1 THR 42 23.129 -2.664 6.854 171 HG21 THR 42 1HG2 THR 42 21.489 -1.166 3.925 172 HG22 THR 42 2HG2 THR 42 22.801 -1.779 2.918 173 HG23 THR 42 3HG2 THR 42 23.133 -0.574 4.162 174 H ARG 43 H ARG 43 21.377 -4.921 6.970 175 HA ARG 43 HA ARG 43 23.114 -7.151 6.133 176 HB2 ARG 43 2HB ARG 43 22.777 -5.949 8.885 177 HB3 ARG 43 3HB ARG 43 23.648 -7.442 8.558 178 HG2 ARG 43 2HG ARG 43 25.484 -6.329 8.020 179 HG3 ARG 43 3HG ARG 43 24.605 -5.332 6.858 180 HD2 ARG 43 2HD ARG 43 24.285 -3.637 8.345 181 HD3 ARG 43 3HD ARG 43 24.231 -4.722 9.735 182 HE ARG 43 HE ARG 43 26.497 -4.475 9.978 183 HH11 ARG 43 1HH1 ARG 43 25.533 -3.268 6.859 184 HH12 ARG 43 2HH1 ARG 43 27.080 -2.572 6.506 185 HH21 ARG 43 1HH2 ARG 43 28.538 -3.565 9.525 186 HH22 ARG 43 2HH2 ARG 43 28.789 -2.742 8.021 187 H ARG 44 H ARG 44 20.483 -7.273 5.483 188 HA ARG 44 HA ARG 44 18.663 -8.266 7.298 189 HB2 ARG 44 2HB ARG 44 18.111 -7.742 4.963 190 HB3 ARG 44 3HB ARG 44 19.041 -9.135 4.428 191 HG2 ARG 44 2HG ARG 44 17.236 -10.396 4.608 192 HG3 ARG 44 3HG ARG 44 17.175 -10.055 6.339 193 HD2 ARG 44 2HD ARG 44 15.997 -7.887 5.702 194 HD3 ARG 44 3HD ARG 44 15.813 -8.591 4.095 195 HE ARG 44 HE ARG 44 14.382 -9.321 6.489 196 HH11 ARG 44 1HH1 ARG 44 15.379 -10.312 3.304 197 HH12 ARG 44 2HH1 ARG 44 14.105 -11.473 3.125 198 HH21 ARG 44 1HH2 ARG 44 12.700 -10.845 6.265 199 HH22 ARG 44 2HH2 ARG 44 12.581 -11.774 4.810 200 H GLU 45 H GLU 45 21.272 -9.963 5.641 201 HA GLU 45 HA GLU 45 20.608 -12.584 6.303 202 HB2 GLU 45 2HB GLU 45 22.871 -13.153 5.825 203 HB3 GLU 45 3HB GLU 45 22.437 -11.836 4.743 204 HG2 GLU 45 2HG GLU 45 23.945 -11.475 7.320 205 HG3 GLU 45 3HG GLU 45 24.705 -11.650 5.739 206 H ALA 46 H ALA 46 22.042 -10.054 8.227 207 HA ALA 46 HA ALA 46 23.013 -11.701 10.328 208 HB1 ALA 46 1HB ALA 46 22.203 -8.808 10.539 209 HB2 ALA 46 2HB ALA 46 23.352 -9.685 11.552 210 HB3 ALA 46 3HB ALA 46 23.740 -9.350 9.864 211 H TYR 47 H TYR 47 19.888 -10.831 9.384 212 HA TYR 47 HA TYR 47 18.570 -10.604 11.856 213 HB2 TYR 47 2HB TYR 47 17.562 -11.584 9.179 214 HB3 TYR 47 3HB TYR 47 16.526 -11.248 10.563 215 HD1 TYR 47 HD1 TYR 47 15.744 -9.847 8.298 216 HD2 TYR 47 HD2 TYR 47 18.967 -8.896 10.908 217 HE1 TYR 47 HE1 TYR 47 15.597 -7.489 7.612 218 HE2 TYR 47 HE2 TYR 47 18.828 -6.536 10.229 219 HH TYR 47 HH TYR 47 16.231 -5.229 8.637 220 H LEU 48 H LEU 48 20.088 -13.256 10.422 221 HA LEU 48 HA LEU 48 18.413 -15.277 11.643 222 HB2 LEU 48 2HB LEU 48 20.474 -15.184 9.638 223 HB3 LEU 48 3HB LEU 48 20.832 -16.433 10.830 224 HG LEU 48 HG LEU 48 18.234 -16.236 9.310 225 HD11 LEU 48 1HD1 LEU 48 20.672 -16.892 8.233 226 HD12 LEU 48 2HD1 LEU 48 19.100 -17.406 7.619 227 HD13 LEU 48 3HD1 LEU 48 20.014 -18.462 8.697 228 HD21 LEU 48 1HD2 LEU 48 19.254 -17.928 11.476 229 HD22 LEU 48 2HD2 LEU 48 18.553 -18.816 10.123 230 HD23 LEU 48 3HD2 LEU 48 17.596 -17.601 10.972 231 H SER 49 H SER 49 19.343 -16.913 13.100 232 HA SER 49 HA SER 49 20.557 -15.689 15.352 233 HB2 SER 49 2HB SER 49 19.380 -18.266 14.696 234 HB3 SER 49 3HB SER 49 20.810 -18.443 15.713 235 HG SER 49 HG SER 49 19.839 -17.376 17.304 236 H SER 50 H SER 50 22.582 -16.140 16.315 237 HA SER 50 HA SER 50 24.787 -15.994 14.664 238 HB2 SER 50 2HB SER 50 25.405 -15.387 16.771 239 HB3 SER 50 3HB SER 50 24.352 -16.578 17.534 240 HG SER 50 HG SER 50 26.547 -17.107 17.826 241 H GLU 51 H GLU 51 23.060 -18.805 15.773 242 HA GLU 51 HA GLU 51 25.099 -20.689 15.051 243 HB2 GLU 51 2HB GLU 51 22.167 -21.273 15.444 244 HB3 GLU 51 3HB GLU 51 23.518 -22.383 15.618 245 HG2 GLU 51 2HG GLU 51 24.297 -20.827 17.500 246 HG3 GLU 51 3HG GLU 51 22.663 -20.169 17.440 247 H GLU 52 H GLU 52 21.864 -20.005 13.708 248 HA GLU 52 HA GLU 52 22.187 -21.553 11.389 249 HB2 GLU 52 2HB GLU 52 20.318 -19.425 12.281 250 HB3 GLU 52 3HB GLU 52 20.391 -19.746 10.554 251 HG2 GLU 52 2HG GLU 52 19.998 -21.954 12.539 252 HG3 GLU 52 3HG GLU 52 18.646 -20.992 11.943 253 H PHE 53 H PHE 53 22.482 -18.029 11.825 254 HA PHE 53 HA PHE 53 23.181 -17.307 9.266 255 HB2 PHE 53 2HB PHE 53 22.833 -15.543 10.775 256 HB3 PHE 53 3HB PHE 53 23.972 -16.199 11.946 257 HD1 PHE 53 HD1 PHE 53 26.386 -15.958 11.600 258 HD2 PHE 53 HD2 PHE 53 23.560 -14.170 8.965 259 HE1 PHE 53 HE1 PHE 53 28.153 -14.500 10.700 260 HE2 PHE 53 HE2 PHE 53 25.323 -12.711 8.060 261 HZ PHE 53 HZ PHE 53 27.622 -12.875 8.928 262 H LYS 54 H LYS 54 25.452 -18.119 11.893 263 HA LYS 54 HA LYS 54 27.751 -18.077 10.244 264 HB2 LYS 54 2HB LYS 54 28.933 -18.674 12.125 265 HB3 LYS 54 3HB LYS 54 27.483 -18.003 12.860 266 HG2 LYS 54 2HG LYS 54 26.575 -20.265 13.115 267 HG3 LYS 54 3HG LYS 54 28.050 -20.926 12.406 268 HD2 LYS 54 2HD LYS 54 28.526 -19.087 14.633 269 HD3 LYS 54 3HD LYS 54 27.613 -20.530 15.081 270 HE2 LYS 54 2HE LYS 54 29.977 -20.950 13.360 271 HE3 LYS 54 3HE LYS 54 30.296 -20.435 15.015 272 HZ1 LYS 54 1HZ LYS 54 28.552 -22.339 15.495 273 HZ2 LYS 54 2HZ LYS 54 30.205 -22.661 15.334 274 HZ3 LYS 54 3HZ LYS 54 29.159 -22.937 14.033 275 H GLU 55 H GLU 55 25.324 -20.460 10.848 276 HA GLU 55 HA GLU 55 26.876 -22.720 10.011 277 HB2 GLU 55 2HB GLU 55 24.043 -22.212 10.745 278 HB3 GLU 55 3HB GLU 55 24.364 -23.604 9.721 279 HG2 GLU 55 2HG GLU 55 25.721 -24.622 11.348 280 HG3 GLU 55 3HG GLU 55 25.836 -23.138 12.292 281 H LYS 56 H LYS 56 24.989 -20.288 8.439 282 HA LYS 56 HA LYS 56 24.867 -21.792 5.941 283 HB2 LYS 56 2HB LYS 56 23.498 -19.442 7.065 284 HB3 LYS 56 3HB LYS 56 23.871 -19.316 5.352 285 HG2 LYS 56 2HG LYS 56 22.536 -21.764 6.428 286 HG3 LYS 56 3HG LYS 56 21.602 -20.304 6.089 287 HD2 LYS 56 2HD LYS 56 22.121 -20.372 3.800 288 HD3 LYS 56 3HD LYS 56 23.451 -21.506 4.048 289 HE2 LYS 56 2HE LYS 56 20.579 -22.198 4.620 290 HE3 LYS 56 3HE LYS 56 21.331 -22.464 3.049 291 HZ1 LYS 56 1HZ LYS 56 21.366 -24.183 5.174 292 HZ2 LYS 56 2HZ LYS 56 22.916 -23.506 5.180 293 HZ3 LYS 56 3HZ LYS 56 22.338 -24.281 3.793 294 H PHE 57 H PHE 57 26.549 -19.100 7.406 295 HA PHE 57 HA PHE 57 27.937 -18.536 4.889 296 HB2 PHE 57 2HB PHE 57 27.879 -17.036 7.514 297 HB3 PHE 57 3HB PHE 57 28.839 -16.554 6.120 298 HD1 PHE 57 HD1 PHE 57 27.453 -16.341 3.875 299 HD2 PHE 57 HD2 PHE 57 25.820 -16.070 7.797 300 HE1 PHE 57 HE1 PHE 57 25.534 -15.085 2.985 301 HE2 PHE 57 HE2 PHE 57 23.897 -14.814 6.913 302 HZ PHE 57 HZ PHE 57 23.752 -14.320 4.504 303 H GLY 58 H GLY 58 28.346 -20.118 7.896 304 HA2 GLY 58 2HA GLY 58 30.094 -21.547 8.479 305 HA3 GLY 58 3HA GLY 58 31.036 -20.900 7.144 306 H MET 59 H MET 59 30.034 -18.194 8.513 307 HA MET 59 HA MET 59 32.196 -18.134 10.515 308 HB2 MET 59 2HB MET 59 31.462 -15.727 8.878 309 HB3 MET 59 3HB MET 59 32.946 -16.049 9.764 310 HG2 MET 59 2HG MET 59 32.063 -17.429 7.238 311 HG3 MET 59 3HG MET 59 33.291 -16.171 7.359 312 HE1 MET 59 1HE MET 59 33.595 -18.500 5.869 313 HE2 MET 59 2HE MET 59 35.328 -18.581 6.184 314 HE3 MET 59 3HE MET 59 34.300 -19.969 6.546 315 H THR 60 H THR 60 31.795 -17.074 12.408 316 HA THR 60 HA THR 60 29.145 -16.797 13.272 317 HB THR 60 HB THR 60 29.997 -15.962 15.323 318 HG1 THR 60 HG1 THR 60 31.825 -14.810 15.483 319 HG21 THR 60 1HG2 THR 60 32.304 -17.606 14.321 320 HG22 THR 60 2HG2 THR 60 30.705 -18.310 14.562 321 HG23 THR 60 3HG2 THR 60 31.569 -17.597 15.923 322 H LYS 61 H LYS 61 28.421 -14.663 14.399 323 HA LYS 61 HA LYS 61 27.745 -12.814 12.449 324 HB2 LYS 61 2HB LYS 61 27.975 -12.171 15.389 325 HB3 LYS 61 3HB LYS 61 26.895 -11.435 14.212 326 HG2 LYS 61 2HG LYS 61 26.131 -14.011 14.014 327 HG3 LYS 61 3HG LYS 61 26.637 -13.956 15.704 328 HD2 LYS 61 2HD LYS 61 24.918 -11.753 14.684 329 HD3 LYS 61 3HD LYS 61 24.172 -13.329 14.958 330 HE2 LYS 61 2HE LYS 61 23.975 -12.745 17.098 331 HE3 LYS 61 3HE LYS 61 25.727 -12.902 17.217 332 HZ1 LYS 61 1HZ LYS 61 24.089 -10.525 17.179 333 HZ2 LYS 61 2HZ LYS 61 25.454 -10.438 16.186 334 HZ3 LYS 61 3HZ LYS 61 25.629 -10.768 17.836 335 H GLU 62 H GLU 62 30.224 -12.479 14.990 336 HA GLU 62 HA GLU 62 31.216 -10.020 13.905 337 HB2 GLU 62 2HB GLU 62 31.399 -11.259 16.347 338 HB3 GLU 62 3HB GLU 62 33.010 -11.506 15.688 339 HG2 GLU 62 2HG GLU 62 33.214 -9.092 15.312 340 HG3 GLU 62 3HG GLU 62 31.613 -8.860 16.014 341 H ALA 63 H ALA 63 32.383 -13.372 13.981 342 HA ALA 63 HA ALA 63 34.820 -13.037 12.712 343 HB1 ALA 63 1HB ALA 63 32.946 -15.377 12.388 344 HB2 ALA 63 2HB ALA 63 34.688 -15.378 12.110 345 HB3 ALA 63 3HB ALA 63 34.055 -15.141 13.739 346 H PHE 64 H PHE 64 31.598 -13.385 11.299 347 HA PHE 64 HA PHE 64 32.397 -13.590 8.611 348 HB2 PHE 64 2HB PHE 64 30.121 -14.129 9.424 349 HB3 PHE 64 3HB PHE 64 29.835 -12.416 9.712 350 HD1 PHE 64 HD1 PHE 64 29.274 -10.944 7.938 351 HD2 PHE 64 HD2 PHE 64 30.377 -14.972 7.120 352 HE1 PHE 64 HE1 PHE 64 28.477 -10.688 5.624 353 HE2 PHE 64 HE2 PHE 64 29.583 -14.723 4.805 354 HZ PHE 64 HZ PHE 64 28.633 -12.578 4.053 355 H TYR 65 H TYR 65 31.558 -10.782 10.602 356 HA TYR 65 HA TYR 65 31.658 -8.820 8.630 357 HB2 TYR 65 2HB TYR 65 32.427 -8.596 11.548 358 HB3 TYR 65 3HB TYR 65 32.103 -7.236 10.478 359 HD1 TYR 65 HD1 TYR 65 29.737 -8.449 9.011 360 HD2 TYR 65 HD2 TYR 65 30.715 -8.251 13.147 361 HE1 TYR 65 HE1 TYR 65 27.346 -8.570 9.576 362 HE2 TYR 65 HE2 TYR 65 28.327 -8.373 13.723 363 HH TYR 65 HH TYR 65 26.260 -8.753 12.937 364 H LYS 66 H LYS 66 34.187 -10.650 10.053 365 HA LYS 66 HA LYS 66 36.370 -8.938 9.817 366 HB2 LYS 66 2HB LYS 66 36.219 -11.317 10.819 367 HB3 LYS 66 3HB LYS 66 36.552 -11.872 9.184 368 HG2 LYS 66 2HG LYS 66 38.708 -11.670 9.641 369 HG3 LYS 66 3HG LYS 66 38.476 -9.921 9.686 370 HD2 LYS 66 2HD LYS 66 37.761 -10.276 12.124 371 HD3 LYS 66 3HD LYS 66 38.487 -11.877 11.966 372 HE2 LYS 66 2HE LYS 66 40.596 -10.754 11.228 373 HE3 LYS 66 3HE LYS 66 39.845 -9.207 11.621 374 HZ1 LYS 66 1HZ LYS 66 40.273 -9.498 13.766 375 HZ2 LYS 66 2HZ LYS 66 41.251 -10.809 13.333 376 HZ3 LYS 66 3HZ LYS 66 39.638 -11.067 13.774 377 H LEU 67 H LEU 67 34.825 -11.003 7.405 378 HA LEU 67 HA LEU 67 36.696 -10.715 5.349 379 HB2 LEU 67 2HB LEU 67 33.869 -11.501 5.570 380 HB3 LEU 67 3HB LEU 67 34.362 -10.904 3.986 381 HG LEU 67 HG LEU 67 36.045 -12.640 3.821 382 HD11 LEU 67 1HD1 LEU 67 36.772 -12.918 6.053 383 HD12 LEU 67 2HD1 LEU 67 36.046 -14.453 5.576 384 HD13 LEU 67 3HD1 LEU 67 35.151 -13.337 6.607 385 HD21 LEU 67 1HD2 LEU 67 34.572 -14.179 3.118 386 HD22 LEU 67 2HD2 LEU 67 33.358 -12.994 3.599 387 HD23 LEU 67 3HD2 LEU 67 33.796 -14.304 4.697 388 HA PRO 68 HA PRO 68 36.223 -6.664 3.733 389 HB2 PRO 68 2HB PRO 68 36.229 -7.070 1.048 390 HB3 PRO 68 3HB PRO 68 37.674 -7.252 2.050 391 HG2 PRO 68 2HG PRO 68 35.816 -9.353 1.004 392 HG3 PRO 68 3HG PRO 68 37.587 -9.362 1.075 393 HD2 PRO 68 2HD PRO 68 36.052 -10.669 2.882 394 HD3 PRO 68 3HD PRO 68 37.621 -9.956 3.303 395 H LYS 69 H LYS 69 34.898 -5.266 2.260 396 HA LYS 69 HA LYS 69 32.140 -5.696 2.734 397 HB2 LYS 69 2HB LYS 69 33.812 -3.616 1.497 398 HB3 LYS 69 3HB LYS 69 32.189 -3.734 0.828 399 HG2 LYS 69 2HG LYS 69 31.181 -3.181 2.843 400 HG3 LYS 69 3HG LYS 69 32.612 -3.603 3.787 401 HD2 LYS 69 2HD LYS 69 33.348 -1.563 1.958 402 HD3 LYS 69 3HD LYS 69 31.848 -1.066 2.744 403 HE2 LYS 69 2HE LYS 69 32.949 -1.658 4.938 404 HE3 LYS 69 3HE LYS 69 34.458 -1.820 4.041 405 HZ1 LYS 69 1HZ LYS 69 32.965 0.648 3.647 406 HZ2 LYS 69 2HZ LYS 69 34.634 0.398 3.758 407 HZ3 LYS 69 3HZ LYS 69 33.691 0.445 5.161 408 H TRP 70 H TRP 70 34.111 -5.839 -0.216 409 HA TRP 70 HA TRP 70 32.072 -6.396 -2.032 410 HB2 TRP 70 2HB TRP 70 33.759 -7.044 -3.545 411 HB3 TRP 70 3HB TRP 70 34.537 -5.865 -2.492 412 HD1 TRP 70 HD1 TRP 70 36.448 -6.744 -0.859 413 HE1 TRP 70 HE1 TRP 70 37.829 -8.915 -0.821 414 HE3 TRP 70 HE3 TRP 70 33.608 -9.566 -4.037 415 HZ2 TRP 70 HZ2 TRP 70 37.729 -11.485 -1.986 416 HZ3 TRP 70 HZ3 TRP 70 34.320 -11.871 -4.524 417 HH2 TRP 70 HH2 TRP 70 36.338 -12.807 -3.519 418 H LYS 71 H LYS 71 34.000 -8.592 -0.033 419 HA LYS 71 HA LYS 71 32.738 -10.950 -1.074 420 HB2 LYS 71 2HB LYS 71 35.068 -10.868 -0.129 421 HB3 LYS 71 3HB LYS 71 34.352 -10.674 1.465 422 HG2 LYS 71 2HG LYS 71 33.502 -12.832 1.489 423 HG3 LYS 71 3HG LYS 71 33.605 -12.995 -0.266 424 HD2 LYS 71 2HD LYS 71 36.167 -12.714 0.145 425 HD3 LYS 71 3HD LYS 71 35.763 -13.204 1.791 426 HE2 LYS 71 2HE LYS 71 34.461 -15.121 0.541 427 HE3 LYS 71 3HE LYS 71 35.596 -14.746 -0.755 428 HZ1 LYS 71 1HZ LYS 71 36.833 -16.253 0.356 429 HZ2 LYS 71 2HZ LYS 71 36.082 -15.967 1.844 430 HZ3 LYS 71 3HZ LYS 71 37.271 -14.904 1.280 431 H GLN 72 H GLN 72 32.297 -8.852 1.703 432 HA GLN 72 HA GLN 72 30.632 -10.463 3.254 433 HB2 GLN 72 2HB GLN 72 31.494 -8.450 4.197 434 HB3 GLN 72 3HB GLN 72 30.768 -7.468 2.931 435 HG2 GLN 72 2HG GLN 72 28.756 -8.990 4.311 436 HG3 GLN 72 3HG GLN 72 29.718 -8.045 5.446 437 HE21 GLN 72 1HE2 GLN 72 28.810 -6.180 5.885 438 HE22 GLN 72 2HE2 GLN 72 27.943 -5.176 4.778 439 H ASN 73 H ASN 73 29.850 -8.260 0.595 440 HA ASN 73 HA ASN 73 27.025 -8.701 0.795 441 HB2 ASN 73 2HB ASN 73 28.697 -6.872 -0.525 442 HB3 ASN 73 3HB ASN 73 27.865 -7.752 -1.804 443 HD21 ASN 73 1HD2 ASN 73 26.589 -6.064 -2.436 444 HD22 ASN 73 2HD2 ASN 73 25.315 -5.424 -1.460 445 H LYS 74 H LYS 74 29.673 -10.194 -0.883 446 HA LYS 74 HA LYS 74 28.128 -11.563 -2.846 447 HB2 LYS 74 2HB LYS 74 30.905 -12.004 -1.754 448 HB3 LYS 74 3HB LYS 74 30.211 -13.011 -3.017 449 HG2 LYS 74 2HG LYS 74 30.235 -10.056 -3.379 450 HG3 LYS 74 3HG LYS 74 31.729 -10.965 -3.607 451 HD2 LYS 74 2HD LYS 74 29.239 -11.927 -4.935 452 HD3 LYS 74 3HD LYS 74 30.087 -10.536 -5.616 453 HE2 LYS 74 2HE LYS 74 32.054 -12.458 -5.039 454 HE3 LYS 74 3HE LYS 74 30.724 -13.330 -5.800 455 HZ1 LYS 74 1HZ LYS 74 32.388 -11.164 -6.896 456 HZ2 LYS 74 2HZ LYS 74 30.823 -11.398 -7.492 457 HZ3 LYS 74 3HZ LYS 74 31.961 -12.644 -7.596 458 H PHE 75 H PHE 75 29.661 -12.656 0.183 459 HA PHE 75 HA PHE 75 28.736 -15.269 0.172 460 HB2 PHE 75 2HB PHE 75 30.019 -13.521 2.027 461 HB3 PHE 75 3HB PHE 75 28.705 -14.341 2.864 462 HD1 PHE 75 HD1 PHE 75 28.672 -16.964 1.612 463 HD2 PHE 75 HD2 PHE 75 31.971 -14.524 2.738 464 HE1 PHE 75 HE1 PHE 75 30.073 -18.973 1.846 465 HE2 PHE 75 HE2 PHE 75 33.378 -16.529 2.974 466 HZ PHE 75 HZ PHE 75 32.430 -18.757 2.527 467 H LYS 76 H LYS 76 27.158 -12.332 1.333 468 HA LYS 76 HA LYS 76 25.001 -13.314 2.690 469 HB2 LYS 76 2HB LYS 76 25.508 -10.910 1.055 470 HB3 LYS 76 3HB LYS 76 23.811 -11.308 1.294 471 HG2 LYS 76 2HG LYS 76 23.938 -11.025 3.594 472 HG3 LYS 76 3HG LYS 76 25.695 -11.189 3.615 473 HD2 LYS 76 2HD LYS 76 25.424 -9.024 2.023 474 HD3 LYS 76 3HD LYS 76 24.012 -8.830 3.065 475 HE2 LYS 76 2HE LYS 76 25.875 -9.429 4.910 476 HE3 LYS 76 3HE LYS 76 26.891 -8.644 3.702 477 HZ1 LYS 76 1HZ LYS 76 25.842 -7.194 5.491 478 HZ2 LYS 76 2HZ LYS 76 24.387 -7.394 4.653 479 HZ3 LYS 76 3HZ LYS 76 25.709 -6.663 3.890 480 H MET 77 H MET 77 24.943 -12.576 -0.804 481 HA MET 77 HA MET 77 22.491 -13.927 -1.248 482 HB2 MET 77 2HB MET 77 23.150 -13.734 -3.678 483 HB3 MET 77 3HB MET 77 23.096 -12.219 -2.786 484 HG2 MET 77 2HG MET 77 25.495 -12.197 -2.587 485 HG3 MET 77 3HG MET 77 25.603 -13.786 -3.340 486 HE1 MET 77 1HE MET 77 27.225 -12.794 -5.857 487 HE2 MET 77 2HE MET 77 26.278 -14.153 -5.251 488 HE3 MET 77 3HE MET 77 25.856 -13.400 -6.790 489 H ALA 78 H ALA 78 25.806 -14.946 -1.186 490 HA ALA 78 HA ALA 78 25.746 -17.246 -2.728 491 HB1 ALA 78 1HB ALA 78 27.230 -17.103 -0.122 492 HB2 ALA 78 2HB ALA 78 27.692 -17.925 -1.613 493 HB3 ALA 78 3HB ALA 78 27.724 -16.164 -1.531 494 H VAL 79 H VAL 79 24.749 -16.785 0.637 495 HA VAL 79 HA VAL 79 23.860 -19.571 0.777 496 HB VAL 79 HB VAL 79 23.829 -19.400 3.079 497 HG11 VAL 79 1HG1 VAL 79 25.882 -17.320 2.337 498 HG12 VAL 79 2HG1 VAL 79 25.881 -18.344 3.774 499 HG13 VAL 79 3HG1 VAL 79 26.111 -19.061 2.178 500 HG21 VAL 79 1HG2 VAL 79 23.796 -17.152 4.254 501 HG22 VAL 79 2HG2 VAL 79 23.409 -16.447 2.685 502 HG23 VAL 79 3HG2 VAL 79 22.316 -17.621 3.418 503 H GLN 80 H GLN 80 22.571 -17.123 -0.644 504 HA GLN 80 HA GLN 80 20.445 -16.549 -1.226 505 HB2 GLN 80 2HB GLN 80 19.404 -18.632 0.680 506 HB3 GLN 80 3HB GLN 80 18.652 -18.022 -0.788 507 HG2 GLN 80 2HG GLN 80 20.986 -19.065 -1.739 508 HG3 GLN 80 3HG GLN 80 20.596 -20.167 -0.420 509 HE21 GLN 80 1HE2 GLN 80 19.965 -19.297 -3.616 510 HE22 GLN 80 2HE2 GLN 80 18.615 -20.338 -3.897 511 H LEU 81 H LEU 81 21.841 -15.367 1.043 512 HA LEU 81 HA LEU 81 19.502 -14.367 2.528 513 HB2 LEU 81 2HB LEU 81 22.236 -15.096 3.502 514 HB3 LEU 81 3HB LEU 81 21.281 -13.883 4.352 515 HG LEU 81 HG LEU 81 20.607 -16.794 3.963 516 HD11 LEU 81 1HD1 LEU 81 21.015 -17.070 6.212 517 HD12 LEU 81 2HD1 LEU 81 20.802 -15.357 6.571 518 HD13 LEU 81 3HD1 LEU 81 22.266 -15.912 5.762 519 HD21 LEU 81 1HD2 LEU 81 18.619 -16.227 5.399 520 HD22 LEU 81 2HD2 LEU 81 18.550 -15.635 3.740 521 HD23 LEU 81 3HD2 LEU 81 18.953 -14.530 5.056 522 H PHE 82 H PHE 82 19.186 -12.547 1.300 523 HA PHE 82 HA PHE 82 21.133 -10.421 1.686 524 HB2 PHE 82 2HB PHE 82 21.670 -11.537 -0.512 525 HB3 PHE 82 3HB PHE 82 20.082 -11.030 -1.080 526 HD1 PHE 82 HD1 PHE 82 19.667 -8.795 -1.754 527 HD2 PHE 82 HD2 PHE 82 23.389 -9.847 0.022 528 HE1 PHE 82 HE1 PHE 82 20.601 -6.622 -2.432 529 HE2 PHE 82 HE2 PHE 82 24.328 -7.677 -0.651 530 HZ PHE 82 HZ PHE 82 22.935 -6.060 -1.879 Start of MODEL 6 1 H1 LEU 20 H LEU 20 19.302 -9.426 20.368 2 HA LEU 20 HA LEU 20 16.671 -8.166 20.373 3 HB2 LEU 20 2HB LEU 20 19.110 -7.925 18.816 4 HB3 LEU 20 3HB LEU 20 17.677 -8.031 17.797 5 HG LEU 20 HG LEU 20 16.858 -6.155 19.542 6 HD11 LEU 20 1HD1 LEU 20 19.820 -6.185 19.634 7 HD12 LEU 20 2HD1 LEU 20 18.651 -5.707 20.863 8 HD13 LEU 20 3HD1 LEU 20 19.021 -4.617 19.527 9 HD21 LEU 20 1HD2 LEU 20 17.979 -4.544 17.755 10 HD22 LEU 20 2HD2 LEU 20 16.596 -5.565 17.361 11 HD23 LEU 20 3HD2 LEU 20 18.224 -6.073 16.910 12 HA PRO 21 HA PRO 21 14.513 -11.407 18.352 13 HB2 PRO 21 2HB PRO 21 12.951 -10.061 16.585 14 HB3 PRO 21 3HB PRO 21 12.667 -10.039 18.329 15 HG2 PRO 21 2HG PRO 21 14.032 -8.007 16.606 16 HG3 PRO 21 3HG PRO 21 12.870 -7.758 17.922 17 HD2 PRO 21 2HD PRO 21 15.538 -7.440 18.255 18 HD3 PRO 21 3HD PRO 21 14.474 -8.013 19.556 19 H ALA 22 H ALA 22 14.942 -12.830 16.775 20 HA ALA 22 HA ALA 22 16.146 -11.835 14.277 21 HB1 ALA 22 1HB ALA 22 17.142 -14.415 14.671 22 HB2 ALA 22 2HB ALA 22 18.026 -12.895 14.801 23 HB3 ALA 22 3HB ALA 22 17.288 -13.611 16.234 24 H HIS 23 H HIS 23 15.969 -13.394 12.461 25 HA HIS 23 HA HIS 23 13.469 -14.944 12.648 26 HB2 HIS 23 2HB HIS 23 14.554 -13.575 10.181 27 HB3 HIS 23 3HB HIS 23 12.997 -14.380 10.346 28 HD1 HIS 23 HD1 HIS 23 11.429 -13.193 12.325 29 HD2 HIS 23 HD2 HIS 23 14.384 -10.902 10.513 30 HE1 HIS 23 HE1 HIS 23 10.791 -10.801 12.766 31 HA PRO 24 HA PRO 24 15.743 -18.510 11.448 32 HB2 PRO 24 2HB PRO 24 13.756 -19.955 10.294 33 HB3 PRO 24 3HB PRO 24 13.882 -19.721 12.042 34 HG2 PRO 24 2HG PRO 24 12.157 -18.289 10.057 35 HG3 PRO 24 3HG PRO 24 11.742 -18.888 11.674 36 HD2 PRO 24 2HD PRO 24 12.311 -16.286 11.186 37 HD3 PRO 24 3HD PRO 24 12.699 -17.075 12.728 38 H TYR 25 H TYR 25 16.509 -19.686 9.610 39 HA TYR 25 HA TYR 25 16.904 -18.081 7.311 40 HB2 TYR 25 2HB TYR 25 18.587 -19.686 8.028 41 HB3 TYR 25 3HB TYR 25 17.465 -21.018 7.773 42 HD1 TYR 25 HD1 TYR 25 16.902 -21.755 5.510 43 HD2 TYR 25 HD2 TYR 25 19.709 -18.627 6.171 44 HE1 TYR 25 HE1 TYR 25 17.690 -21.981 3.192 45 HE2 TYR 25 HE2 TYR 25 20.505 -18.844 3.854 46 HH TYR 25 HH TYR 25 20.538 -20.694 2.085 47 H ASP 26 H ASP 26 14.706 -20.702 8.074 48 HA ASP 26 HA ASP 26 13.827 -21.295 5.474 49 HB2 ASP 26 2HB ASP 26 12.966 -21.872 8.205 50 HB3 ASP 26 3HB ASP 26 11.618 -21.729 7.080 51 H ARG 27 H ARG 27 13.102 -18.670 7.619 52 HA ARG 27 HA ARG 27 10.805 -17.826 6.033 53 HB2 ARG 27 2HB ARG 27 12.030 -16.874 8.609 54 HB3 ARG 27 3HB ARG 27 10.843 -15.899 7.752 55 HG2 ARG 27 2HG ARG 27 10.225 -18.747 8.391 56 HG3 ARG 27 3HG ARG 27 10.093 -17.513 9.645 57 HD2 ARG 27 2HD ARG 27 8.018 -17.211 8.857 58 HD3 ARG 27 3HD ARG 27 8.806 -16.328 7.550 59 HE ARG 27 HE ARG 27 8.159 -17.986 6.131 60 HH11 ARG 27 1HH1 ARG 27 8.171 -19.253 9.373 61 HH12 ARG 27 2HH1 ARG 27 7.518 -20.792 8.914 62 HH21 ARG 27 1HH2 ARG 27 7.299 -20.007 5.513 63 HH22 ARG 27 2HH2 ARG 27 7.024 -21.219 6.718 64 H LEU 28 H LEU 28 14.168 -17.150 6.415 65 HA LEU 28 HA LEU 28 13.993 -14.599 5.025 66 HB2 LEU 28 2HB LEU 28 16.165 -16.125 6.389 67 HB3 LEU 28 3HB LEU 28 16.587 -14.870 5.227 68 HG LEU 28 HG LEU 28 14.671 -14.056 7.308 69 HD11 LEU 28 1HD1 LEU 28 16.791 -13.688 8.813 70 HD12 LEU 28 2HD1 LEU 28 17.375 -15.116 7.959 71 HD13 LEU 28 3HD1 LEU 28 15.876 -15.195 8.885 72 HD21 LEU 28 1HD2 LEU 28 15.746 -12.014 7.120 73 HD22 LEU 28 2HD2 LEU 28 15.889 -12.673 5.489 74 HD23 LEU 28 3HD2 LEU 28 17.263 -12.744 6.594 75 H LYS 29 H LYS 29 14.440 -14.283 2.926 76 HA LYS 29 HA LYS 29 15.610 -16.507 1.397 77 HB2 LYS 29 2HB LYS 29 12.973 -15.901 1.246 78 HB3 LYS 29 3HB LYS 29 13.611 -14.837 -0.001 79 HG2 LYS 29 2HG LYS 29 14.870 -17.130 -0.644 80 HG3 LYS 29 3HG LYS 29 13.378 -17.768 0.053 81 HD2 LYS 29 2HD LYS 29 12.093 -16.282 -1.463 82 HD3 LYS 29 3HD LYS 29 13.613 -15.779 -2.205 83 HE2 LYS 29 2HE LYS 29 12.488 -18.577 -2.139 84 HE3 LYS 29 3HE LYS 29 12.546 -17.506 -3.538 85 HZ1 LYS 29 1HZ LYS 29 14.504 -18.414 -3.986 86 HZ2 LYS 29 2HZ LYS 29 14.566 -19.220 -2.501 87 HZ3 LYS 29 3HZ LYS 29 15.129 -17.630 -2.623 88 H THR 30 H THR 30 16.820 -15.926 -0.437 89 HA THR 30 HA THR 30 18.468 -13.738 -0.235 90 HB THR 30 HB THR 30 17.942 -14.504 -3.022 91 HG1 THR 30 HG1 THR 30 17.448 -16.501 -2.247 92 HG21 THR 30 1HG2 THR 30 20.373 -14.650 -1.235 93 HG22 THR 30 2HG2 THR 30 19.969 -13.337 -2.340 94 HG23 THR 30 3HG2 THR 30 20.366 -14.932 -2.974 95 H THR 31 H THR 31 15.433 -14.011 -2.029 96 HA THR 31 HA THR 31 15.458 -11.081 -2.354 97 HB THR 31 HB THR 31 14.102 -11.424 -4.439 98 HG1 THR 31 HG1 THR 31 13.533 -13.643 -3.945 99 HG21 THR 31 1HG2 THR 31 16.840 -12.690 -4.540 100 HG22 THR 31 2HG2 THR 31 16.549 -10.952 -4.460 101 HG23 THR 31 3HG2 THR 31 15.996 -11.876 -5.856 102 H SER 32 H SER 32 14.362 -12.278 -0.119 103 HA SER 32 HA SER 32 11.510 -12.588 -0.539 104 HB2 SER 32 2HB SER 32 13.391 -13.351 1.484 105 HB3 SER 32 3HB SER 32 12.105 -12.405 2.232 106 HG SER 32 HG SER 32 10.701 -13.935 1.790 107 H THR 33 H THR 33 9.944 -11.327 0.702 108 HA THR 33 HA THR 33 10.851 -8.569 1.210 109 HB THR 33 HB THR 33 8.535 -7.865 0.406 110 HG1 THR 33 HG1 THR 33 7.615 -9.971 0.338 111 HG21 THR 33 1HG2 THR 33 9.810 -7.148 -1.278 112 HG22 THR 33 2HG2 THR 33 9.501 -8.681 -2.094 113 HG23 THR 33 3HG2 THR 33 10.925 -8.498 -1.070 114 H ASP 34 H ASP 34 9.775 -11.222 2.671 115 HA ASP 34 HA ASP 34 7.528 -10.604 4.143 116 HB2 ASP 34 2HB ASP 34 9.752 -12.458 4.377 117 HB3 ASP 34 3HB ASP 34 9.191 -11.918 5.956 118 HA PRO 35 HA PRO 35 8.505 -7.390 6.961 119 HB2 PRO 35 2HB PRO 35 7.273 -8.206 9.238 120 HB3 PRO 35 3HB PRO 35 6.388 -7.626 7.822 121 HG2 PRO 35 2HG PRO 35 6.918 -10.437 8.704 122 HG3 PRO 35 3HG PRO 35 5.423 -9.727 8.071 123 HD2 PRO 35 2HD PRO 35 7.090 -11.213 6.540 124 HD3 PRO 35 3HD PRO 35 6.130 -9.872 5.882 125 H VAL 36 H VAL 36 9.636 -6.827 8.941 126 HA VAL 36 HA VAL 36 11.262 -8.973 10.106 127 HB VAL 36 HB VAL 36 13.203 -7.254 10.061 128 HG11 VAL 36 1HG1 VAL 36 12.296 -8.782 7.627 129 HG12 VAL 36 2HG1 VAL 36 13.909 -8.090 7.816 130 HG13 VAL 36 3HG1 VAL 36 13.354 -9.351 8.919 131 HG21 VAL 36 1HG2 VAL 36 11.629 -6.294 7.675 132 HG22 VAL 36 2HG2 VAL 36 11.794 -5.405 9.189 133 HG23 VAL 36 3HG2 VAL 36 13.215 -5.728 8.195 134 H SER 37 H SER 37 12.624 -7.996 11.982 135 HA SER 37 HA SER 37 10.739 -6.647 13.725 136 HB2 SER 37 2HB SER 37 13.204 -8.251 14.074 137 HB3 SER 37 3HB SER 37 12.924 -6.997 15.281 138 HG SER 37 HG SER 37 10.809 -8.693 14.573 139 H ASP 38 H ASP 38 12.503 -5.413 11.460 140 HA ASP 38 HA ASP 38 13.328 -3.330 11.043 141 HB2 ASP 38 2HB ASP 38 11.490 -2.753 12.806 142 HB3 ASP 38 3HB ASP 38 12.856 -2.508 13.890 143 H ILE 39 H ILE 39 15.356 -4.575 10.940 144 HA ILE 39 HA ILE 39 17.250 -3.610 12.972 145 HB ILE 39 HB ILE 39 18.370 -5.971 12.034 146 HG12 ILE 39 2HG1 ILE 39 15.956 -6.418 11.218 147 HG13 ILE 39 3HG1 ILE 39 16.772 -7.682 12.132 148 HG21 ILE 39 1HG2 ILE 39 17.766 -6.784 14.377 149 HG22 ILE 39 2HG2 ILE 39 18.702 -5.294 14.254 150 HG23 ILE 39 3HG2 ILE 39 16.971 -5.223 14.584 151 HD11 ILE 39 1HD1 ILE 39 14.280 -6.849 12.640 152 HD12 ILE 39 2HD1 ILE 39 15.353 -7.523 13.867 153 HD13 ILE 39 3HD1 ILE 39 15.180 -5.775 13.709 154 H ASP 40 H ASP 40 19.591 -4.467 11.938 155 HA ASP 40 HA ASP 40 20.299 -2.610 10.061 156 HB2 ASP 40 2HB ASP 40 21.547 -5.357 10.211 157 HB3 ASP 40 3HB ASP 40 22.317 -3.857 9.702 158 H VAL 41 H VAL 41 18.997 -2.334 8.309 159 HA VAL 41 HA VAL 41 17.891 -4.370 6.730 160 HB VAL 41 HB VAL 41 18.559 -1.528 5.952 161 HG11 VAL 41 1HG1 VAL 41 18.241 -2.611 3.917 162 HG12 VAL 41 2HG1 VAL 41 17.002 -3.685 4.572 163 HG13 VAL 41 3HG1 VAL 41 16.638 -1.982 4.297 164 HG21 VAL 41 1HG2 VAL 41 15.909 -2.678 6.807 165 HG22 VAL 41 2HG2 VAL 41 17.017 -1.855 7.906 166 HG23 VAL 41 3HG2 VAL 41 16.316 -0.982 6.544 167 H THR 42 H THR 42 20.908 -2.551 6.406 168 HA THR 42 HA THR 42 21.671 -3.618 3.905 169 HB THR 42 HB THR 42 23.905 -2.784 4.389 170 HG1 THR 42 HG1 THR 42 24.577 -2.450 6.388 171 HG21 THR 42 1HG2 THR 42 22.059 -0.756 5.603 172 HG22 THR 42 2HG2 THR 42 21.887 -1.230 3.912 173 HG23 THR 42 3HG2 THR 42 23.396 -0.513 4.480 174 H ARG 43 H ARG 43 21.608 -4.977 7.029 175 HA ARG 43 HA ARG 43 23.269 -7.225 6.097 176 HB2 ARG 43 2HB ARG 43 23.041 -6.135 8.909 177 HB3 ARG 43 3HB ARG 43 23.902 -7.603 8.467 178 HG2 ARG 43 2HG ARG 43 25.244 -6.077 6.884 179 HG3 ARG 43 3HG ARG 43 24.595 -4.758 7.861 180 HD2 ARG 43 2HD ARG 43 25.448 -6.438 9.798 181 HD3 ARG 43 3HD ARG 43 26.612 -6.800 8.524 182 HE ARG 43 HE ARG 43 27.559 -4.743 8.855 183 HH11 ARG 43 1HH1 ARG 43 24.419 -4.807 10.357 184 HH12 ARG 43 2HH1 ARG 43 24.618 -3.272 11.138 185 HH21 ARG 43 1HH2 ARG 43 27.833 -2.722 9.876 186 HH22 ARG 43 2HH2 ARG 43 26.559 -2.087 10.862 187 H ARG 44 H ARG 44 20.649 -7.283 5.494 188 HA ARG 44 HA ARG 44 18.818 -8.228 7.325 189 HB2 ARG 44 2HB ARG 44 18.227 -7.680 5.021 190 HB3 ARG 44 3HB ARG 44 19.151 -9.057 4.437 191 HG2 ARG 44 2HG ARG 44 17.254 -10.205 4.505 192 HG3 ARG 44 3HG ARG 44 17.397 -10.165 6.264 193 HD2 ARG 44 2HD ARG 44 15.508 -9.001 6.351 194 HD3 ARG 44 3HD ARG 44 16.317 -7.686 5.498 195 HE ARG 44 HE ARG 44 15.236 -8.305 3.560 196 HH11 ARG 44 1HH1 ARG 44 14.776 -10.738 6.007 197 HH12 ARG 44 2HH1 ARG 44 13.558 -11.589 5.117 198 HH21 ARG 44 1HH2 ARG 44 13.632 -9.417 2.379 199 HH22 ARG 44 2HH2 ARG 44 12.908 -10.837 3.053 200 H GLU 45 H GLU 45 21.347 -10.000 5.618 201 HA GLU 45 HA GLU 45 20.611 -12.600 6.286 202 HB2 GLU 45 2HB GLU 45 22.850 -13.240 5.770 203 HB3 GLU 45 3HB GLU 45 22.431 -11.915 4.693 204 HG2 GLU 45 2HG GLU 45 23.996 -11.581 7.238 205 HG3 GLU 45 3HG GLU 45 24.724 -11.797 5.649 206 H ALA 46 H ALA 46 22.157 -10.123 8.189 207 HA ALA 46 HA ALA 46 23.121 -11.804 10.267 208 HB1 ALA 46 1HB ALA 46 23.896 -9.467 9.795 209 HB2 ALA 46 2HB ALA 46 22.389 -8.893 10.510 210 HB3 ALA 46 3HB ALA 46 23.539 -9.805 11.488 211 H TYR 47 H TYR 47 20.002 -10.874 9.378 212 HA TYR 47 HA TYR 47 18.738 -10.618 11.879 213 HB2 TYR 47 2HB TYR 47 17.654 -11.553 9.216 214 HB3 TYR 47 3HB TYR 47 16.653 -11.200 10.621 215 HD1 TYR 47 HD1 TYR 47 15.874 -9.765 8.370 216 HD2 TYR 47 HD2 TYR 47 19.152 -8.912 10.946 217 HE1 TYR 47 HE1 TYR 47 15.776 -7.401 7.702 218 HE2 TYR 47 HE2 TYR 47 19.061 -6.545 10.286 219 HH TYR 47 HH TYR 47 16.551 -5.112 8.912 220 H LEU 48 H LEU 48 20.172 -13.294 10.415 221 HA LEU 48 HA LEU 48 18.462 -15.286 11.635 222 HB2 LEU 48 2HB LEU 48 20.496 -15.225 9.610 223 HB3 LEU 48 3HB LEU 48 20.866 -16.472 10.797 224 HG LEU 48 HG LEU 48 18.247 -16.261 9.316 225 HD11 LEU 48 1HD1 LEU 48 20.652 -16.933 8.199 226 HD12 LEU 48 2HD1 LEU 48 19.070 -17.465 7.626 227 HD13 LEU 48 3HD1 LEU 48 20.013 -18.500 8.697 228 HD21 LEU 48 1HD2 LEU 48 17.621 -17.606 10.999 229 HD22 LEU 48 2HD2 LEU 48 19.283 -17.955 11.475 230 HD23 LEU 48 3HD2 LEU 48 18.543 -18.837 10.138 231 H SER 49 H SER 49 19.326 -16.924 13.104 232 HA SER 49 HA SER 49 20.573 -15.756 15.353 233 HB2 SER 49 2HB SER 49 20.705 -18.675 15.278 234 HB3 SER 49 3HB SER 49 19.866 -17.616 16.411 235 HG SER 49 HG SER 49 18.208 -17.403 14.818 236 H SER 50 H SER 50 22.600 -16.184 16.295 237 HA SER 50 HA SER 50 24.800 -16.050 14.639 238 HB2 SER 50 2HB SER 50 26.113 -16.164 16.556 239 HB3 SER 50 3HB SER 50 24.557 -15.664 17.218 240 HG SER 50 HG SER 50 25.946 -18.006 17.566 241 H GLU 51 H GLU 51 23.071 -18.854 15.757 242 HA GLU 51 HA GLU 51 25.109 -20.743 15.040 243 HB2 GLU 51 2HB GLU 51 22.168 -21.270 15.484 244 HB3 GLU 51 3HB GLU 51 23.479 -22.440 15.561 245 HG2 GLU 51 2HG GLU 51 24.394 -21.265 17.511 246 HG3 GLU 51 3HG GLU 51 23.043 -20.136 17.447 247 H GLU 52 H GLU 52 21.871 -20.064 13.698 248 HA GLU 52 HA GLU 52 22.191 -21.618 11.385 249 HB2 GLU 52 2HB GLU 52 20.314 -19.515 12.296 250 HB3 GLU 52 3HB GLU 52 20.400 -19.779 10.560 251 HG2 GLU 52 2HG GLU 52 20.211 -22.259 12.056 252 HG3 GLU 52 3HG GLU 52 18.851 -21.177 12.350 253 H PHE 53 H PHE 53 22.483 -18.091 11.806 254 HA PHE 53 HA PHE 53 23.180 -17.377 9.245 255 HB2 PHE 53 2HB PHE 53 22.836 -15.606 10.744 256 HB3 PHE 53 3HB PHE 53 23.968 -16.261 11.922 257 HD1 PHE 53 HD1 PHE 53 26.376 -16.006 11.610 258 HD2 PHE 53 HD2 PHE 53 23.585 -14.263 8.911 259 HE1 PHE 53 HE1 PHE 53 28.152 -14.557 10.714 260 HE2 PHE 53 HE2 PHE 53 25.356 -12.812 8.011 261 HZ PHE 53 HZ PHE 53 27.643 -12.959 8.911 262 H LYS 54 H LYS 54 25.454 -18.183 11.872 263 HA LYS 54 HA LYS 54 27.749 -18.148 10.215 264 HB2 LYS 54 2HB LYS 54 28.937 -18.713 12.099 265 HB3 LYS 54 3HB LYS 54 27.480 -18.062 12.838 266 HG2 LYS 54 2HG LYS 54 27.617 -19.973 14.029 267 HG3 LYS 54 3HG LYS 54 26.734 -20.615 12.642 268 HD2 LYS 54 2HD LYS 54 28.445 -21.922 12.033 269 HD3 LYS 54 3HD LYS 54 29.619 -20.621 12.246 270 HE2 LYS 54 2HE LYS 54 30.304 -22.121 13.852 271 HE3 LYS 54 3HE LYS 54 29.235 -21.075 14.786 272 HZ1 LYS 54 1HZ LYS 54 29.064 -23.806 14.540 273 HZ2 LYS 54 2HZ LYS 54 27.796 -23.215 13.589 274 HZ3 LYS 54 3HZ LYS 54 27.904 -22.778 15.220 275 H GLU 55 H GLU 55 25.320 -20.519 10.828 276 HA GLU 55 HA GLU 55 26.871 -22.789 10.015 277 HB2 GLU 55 2HB GLU 55 24.040 -22.272 10.747 278 HB3 GLU 55 3HB GLU 55 24.354 -23.667 9.725 279 HG2 GLU 55 2HG GLU 55 26.178 -23.515 11.974 280 HG3 GLU 55 3HG GLU 55 24.490 -23.581 12.475 281 H LYS 56 H LYS 56 24.985 -20.367 8.422 282 HA LYS 56 HA LYS 56 24.863 -21.888 5.935 283 HB2 LYS 56 2HB LYS 56 23.494 -19.533 7.044 284 HB3 LYS 56 3HB LYS 56 23.875 -19.412 5.332 285 HG2 LYS 56 2HG LYS 56 21.627 -20.313 5.750 286 HG3 LYS 56 3HG LYS 56 22.661 -21.442 4.871 287 HD2 LYS 56 2HD LYS 56 22.806 -21.745 7.773 288 HD3 LYS 56 3HD LYS 56 21.193 -22.031 7.115 289 HE2 LYS 56 2HE LYS 56 22.659 -23.409 5.339 290 HE3 LYS 56 3HE LYS 56 23.697 -23.560 6.755 291 HZ1 LYS 56 1HZ LYS 56 21.622 -25.169 6.214 292 HZ2 LYS 56 2HZ LYS 56 20.895 -24.054 7.256 293 HZ3 LYS 56 3HZ LYS 56 22.255 -24.921 7.763 294 H PHE 57 H PHE 57 26.549 -19.189 7.382 295 HA PHE 57 HA PHE 57 27.940 -18.644 4.861 296 HB2 PHE 57 2HB PHE 57 27.885 -17.128 7.477 297 HB3 PHE 57 3HB PHE 57 28.844 -16.657 6.077 298 HD1 PHE 57 HD1 PHE 57 27.449 -16.463 3.832 299 HD2 PHE 57 HD2 PHE 57 25.832 -16.151 7.758 300 HE1 PHE 57 HE1 PHE 57 25.529 -15.211 2.938 301 HE2 PHE 57 HE2 PHE 57 23.909 -14.898 6.869 302 HZ PHE 57 HZ PHE 57 23.756 -14.427 4.458 303 H GLY 58 H GLY 58 28.348 -20.192 7.892 304 HA2 GLY 58 2HA GLY 58 30.090 -21.618 8.494 305 HA3 GLY 58 3HA GLY 58 31.029 -21.003 7.141 306 H MET 59 H MET 59 30.058 -18.263 8.459 307 HA MET 59 HA MET 59 32.276 -18.167 10.395 308 HB2 MET 59 2HB MET 59 31.373 -15.783 8.805 309 HB3 MET 59 3HB MET 59 32.898 -16.030 9.645 310 HG2 MET 59 2HG MET 59 32.007 -17.443 7.142 311 HG3 MET 59 3HG MET 59 33.186 -16.138 7.239 312 HE1 MET 59 1HE MET 59 36.218 -17.611 7.166 313 HE2 MET 59 2HE MET 59 35.269 -18.530 5.999 314 HE3 MET 59 3HE MET 59 34.914 -16.824 6.277 315 H THR 60 H THR 60 31.941 -17.127 12.316 316 HA THR 60 HA THR 60 29.345 -16.973 13.339 317 HB THR 60 HB THR 60 31.137 -15.213 14.775 318 HG1 THR 60 HG1 THR 60 32.107 -17.831 14.190 319 HG21 THR 60 1HG2 THR 60 29.504 -17.632 15.236 320 HG22 THR 60 2HG2 THR 60 29.634 -16.153 16.188 321 HG23 THR 60 3HG2 THR 60 30.872 -17.402 16.324 322 H LYS 61 H LYS 61 28.460 -14.936 14.418 323 HA LYS 61 HA LYS 61 27.658 -13.111 12.496 324 HB2 LYS 61 2HB LYS 61 27.836 -12.507 15.448 325 HB3 LYS 61 3HB LYS 61 26.717 -11.815 14.281 326 HG2 LYS 61 2HG LYS 61 25.986 -14.319 13.979 327 HG3 LYS 61 3HG LYS 61 26.687 -14.486 15.591 328 HD2 LYS 61 2HD LYS 61 24.570 -13.922 16.199 329 HD3 LYS 61 3HD LYS 61 25.229 -12.295 16.011 330 HE2 LYS 61 2HE LYS 61 24.358 -12.234 13.710 331 HE3 LYS 61 3HE LYS 61 23.667 -13.839 13.943 332 HZ1 LYS 61 1HZ LYS 61 22.188 -11.779 14.283 333 HZ2 LYS 61 2HZ LYS 61 22.967 -11.643 15.778 334 HZ3 LYS 61 3HZ LYS 61 22.090 -13.041 15.405 335 H GLU 62 H GLU 62 30.085 -12.613 15.061 336 HA GLU 62 HA GLU 62 30.906 -10.085 13.985 337 HB2 GLU 62 2HB GLU 62 32.082 -11.860 16.126 338 HB3 GLU 62 3HB GLU 62 32.752 -10.295 15.689 339 HG2 GLU 62 2HG GLU 62 30.091 -9.742 16.125 340 HG3 GLU 62 3HG GLU 62 30.468 -10.946 17.355 341 H ALA 63 H ALA 63 32.268 -13.357 14.045 342 HA ALA 63 HA ALA 63 34.717 -12.865 12.851 343 HB1 ALA 63 1HB ALA 63 33.064 -15.313 12.292 344 HB2 ALA 63 2HB ALA 63 34.821 -15.172 12.347 345 HB3 ALA 63 3HB ALA 63 33.878 -15.037 13.832 346 H PHE 64 H PHE 64 31.559 -13.376 11.346 347 HA PHE 64 HA PHE 64 32.448 -13.472 8.677 348 HB2 PHE 64 2HB PHE 64 30.201 -14.201 9.389 349 HB3 PHE 64 3HB PHE 64 29.777 -12.529 9.742 350 HD1 PHE 64 HD1 PHE 64 30.364 -14.997 7.117 351 HD2 PHE 64 HD2 PHE 64 29.359 -10.948 7.958 352 HE1 PHE 64 HE1 PHE 64 29.608 -14.705 4.794 353 HE2 PHE 64 HE2 PHE 64 28.601 -10.650 5.636 354 HZ PHE 64 HZ PHE 64 28.724 -12.530 4.051 355 H TYR 65 H TYR 65 31.298 -10.776 10.675 356 HA TYR 65 HA TYR 65 31.315 -8.768 8.763 357 HB2 TYR 65 2HB TYR 65 32.017 -8.556 11.698 358 HB3 TYR 65 3HB TYR 65 31.613 -7.200 10.653 359 HD1 TYR 65 HD1 TYR 65 29.370 -8.569 9.115 360 HD2 TYR 65 HD2 TYR 65 30.255 -8.353 13.272 361 HE1 TYR 65 HE1 TYR 65 26.985 -8.878 9.633 362 HE2 TYR 65 HE2 TYR 65 27.873 -8.662 13.802 363 HH TYR 65 HH TYR 65 25.847 -9.097 12.986 364 H LYS 66 H LYS 66 33.957 -10.382 10.292 365 HA LYS 66 HA LYS 66 35.991 -8.495 10.049 366 HB2 LYS 66 2HB LYS 66 36.253 -11.481 9.666 367 HB3 LYS 66 3HB LYS 66 37.539 -10.368 10.111 368 HG2 LYS 66 2HG LYS 66 35.107 -10.974 11.780 369 HG3 LYS 66 3HG LYS 66 36.718 -11.652 12.025 370 HD2 LYS 66 2HD LYS 66 36.028 -8.714 12.127 371 HD3 LYS 66 3HD LYS 66 36.245 -9.758 13.535 372 HE2 LYS 66 2HE LYS 66 38.527 -10.163 11.996 373 HE3 LYS 66 3HE LYS 66 38.223 -8.430 11.889 374 HZ1 LYS 66 1HZ LYS 66 38.096 -8.387 14.336 375 HZ2 LYS 66 2HZ LYS 66 39.614 -8.873 13.769 376 HZ3 LYS 66 3HZ LYS 66 38.531 -10.022 14.376 377 H LEU 67 H LEU 67 34.343 -10.320 7.632 378 HA LEU 67 HA LEU 67 36.363 -10.076 5.611 379 HB2 LEU 67 2HB LEU 67 33.519 -10.980 5.685 380 HB3 LEU 67 3HB LEU 67 34.276 -10.634 4.131 381 HG LEU 67 HG LEU 67 35.308 -12.642 6.133 382 HD11 LEU 67 1HD1 LEU 67 33.124 -12.816 4.305 383 HD12 LEU 67 2HD1 LEU 67 33.773 -14.052 5.383 384 HD13 LEU 67 3HD1 LEU 67 34.426 -13.870 3.754 385 HD21 LEU 67 1HD2 LEU 67 36.707 -13.391 4.273 386 HD22 LEU 67 2HD2 LEU 67 37.037 -11.707 4.688 387 HD23 LEU 67 3HD2 LEU 67 36.067 -12.092 3.265 388 HA PRO 68 HA PRO 68 35.505 -6.102 3.961 389 HB2 PRO 68 2HB PRO 68 35.711 -6.520 1.287 390 HB3 PRO 68 3HB PRO 68 37.109 -6.520 2.369 391 HG2 PRO 68 2HG PRO 68 35.581 -8.838 1.250 392 HG3 PRO 68 3HG PRO 68 37.334 -8.630 1.417 393 HD2 PRO 68 2HD PRO 68 35.869 -10.104 3.153 394 HD3 PRO 68 3HD PRO 68 37.314 -9.201 3.651 395 H LYS 69 H LYS 69 34.103 -4.884 2.403 396 HA LYS 69 HA LYS 69 31.396 -5.643 2.730 397 HB2 LYS 69 2HB LYS 69 32.873 -3.379 1.592 398 HB3 LYS 69 3HB LYS 69 31.348 -3.705 0.781 399 HG2 LYS 69 2HG LYS 69 30.095 -3.158 2.607 400 HG3 LYS 69 3HG LYS 69 31.365 -3.604 3.749 401 HD2 LYS 69 2HD LYS 69 32.431 -1.494 2.269 402 HD3 LYS 69 3HD LYS 69 30.756 -1.031 2.580 403 HE2 LYS 69 2HE LYS 69 31.079 -0.860 4.819 404 HE3 LYS 69 3HE LYS 69 32.259 -2.169 4.857 405 HZ1 LYS 69 1HZ LYS 69 32.763 0.551 4.926 406 HZ2 LYS 69 2HZ LYS 69 33.292 0.025 3.408 407 HZ3 LYS 69 3HZ LYS 69 33.896 -0.701 4.811 408 H TRP 70 H TRP 70 33.535 -5.577 -0.104 409 HA TRP 70 HA TRP 70 31.680 -6.391 -2.019 410 HB2 TRP 70 2HB TRP 70 33.515 -6.839 -3.430 411 HB3 TRP 70 3HB TRP 70 34.083 -5.565 -2.355 412 HD1 TRP 70 HD1 TRP 70 35.997 -6.188 -0.611 413 HE1 TRP 70 HE1 TRP 70 37.628 -8.174 -0.466 414 HE3 TRP 70 HE3 TRP 70 33.696 -9.368 -3.886 415 HZ2 TRP 70 HZ2 TRP 70 37.903 -10.748 -1.593 416 HZ3 TRP 70 HZ3 TRP 70 34.708 -11.573 -4.297 417 HH2 TRP 70 HH2 TRP 70 36.768 -12.247 -3.173 418 H LYS 71 H LYS 71 33.750 -8.317 0.112 419 HA LYS 71 HA LYS 71 32.842 -10.821 -0.959 420 HB2 LYS 71 2HB LYS 71 35.090 -10.468 0.091 421 HB3 LYS 71 3HB LYS 71 34.286 -10.310 1.646 422 HG2 LYS 71 2HG LYS 71 35.077 -12.523 1.537 423 HG3 LYS 71 3HG LYS 71 33.336 -12.613 1.254 424 HD2 LYS 71 2HD LYS 71 34.132 -12.389 -1.273 425 HD3 LYS 71 3HD LYS 71 35.598 -13.108 -0.606 426 HE2 LYS 71 2HE LYS 71 32.977 -14.324 0.103 427 HE3 LYS 71 3HE LYS 71 33.608 -14.592 -1.521 428 HZ1 LYS 71 1HZ LYS 71 35.604 -15.520 -0.591 429 HZ2 LYS 71 2HZ LYS 71 34.269 -16.329 0.059 430 HZ3 LYS 71 3HZ LYS 71 35.091 -15.176 0.984 431 H GLN 72 H GLN 72 31.956 -8.736 1.705 432 HA GLN 72 HA GLN 72 30.397 -10.578 3.161 433 HB2 GLN 72 2HB GLN 72 31.043 -8.563 4.246 434 HB3 GLN 72 3HB GLN 72 30.343 -7.570 2.974 435 HG2 GLN 72 2HG GLN 72 28.359 -9.287 4.172 436 HG3 GLN 72 3HG GLN 72 29.166 -8.289 5.380 437 HE21 GLN 72 1HE2 GLN 72 27.693 -6.778 5.820 438 HE22 GLN 72 2HE2 GLN 72 26.973 -5.723 4.657 439 H ASN 73 H ASN 73 29.606 -8.352 0.531 440 HA ASN 73 HA ASN 73 26.809 -8.928 0.568 441 HB2 ASN 73 2HB ASN 73 28.579 -7.156 -0.844 442 HB3 ASN 73 3HB ASN 73 27.528 -7.977 -1.993 443 HD21 ASN 73 1HD2 ASN 73 26.247 -6.281 -2.510 444 HD22 ASN 73 2HD2 ASN 73 25.189 -5.496 -1.392 445 H LYS 74 H LYS 74 29.597 -10.334 -0.950 446 HA LYS 74 HA LYS 74 28.214 -11.783 -2.974 447 HB2 LYS 74 2HB LYS 74 30.942 -12.122 -1.727 448 HB3 LYS 74 3HB LYS 74 30.353 -13.143 -3.033 449 HG2 LYS 74 2HG LYS 74 30.285 -10.190 -3.390 450 HG3 LYS 74 3HG LYS 74 31.832 -11.030 -3.513 451 HD2 LYS 74 2HD LYS 74 30.557 -12.625 -5.111 452 HD3 LYS 74 3HD LYS 74 29.386 -11.309 -5.219 453 HE2 LYS 74 2HE LYS 74 32.335 -11.080 -5.810 454 HE3 LYS 74 3HE LYS 74 31.063 -11.230 -7.021 455 HZ1 LYS 74 1HZ LYS 74 30.585 -9.078 -6.860 456 HZ2 LYS 74 2HZ LYS 74 32.033 -8.901 -6.005 457 HZ3 LYS 74 3HZ LYS 74 30.577 -9.102 -5.168 458 H PHE 75 H PHE 75 29.602 -12.766 0.159 459 HA PHE 75 HA PHE 75 28.720 -15.419 0.100 460 HB2 PHE 75 2HB PHE 75 30.008 -13.685 1.965 461 HB3 PHE 75 3HB PHE 75 28.694 -14.508 2.798 462 HD1 PHE 75 HD1 PHE 75 28.646 -17.126 1.566 463 HD2 PHE 75 HD2 PHE 75 31.970 -14.690 2.627 464 HE1 PHE 75 HE1 PHE 75 30.044 -19.138 1.786 465 HE2 PHE 75 HE2 PHE 75 33.375 -16.698 2.847 466 HZ PHE 75 HZ PHE 75 32.414 -18.926 2.426 467 H LYS 76 H LYS 76 27.142 -12.480 1.243 468 HA LYS 76 HA LYS 76 24.988 -13.453 2.614 469 HB2 LYS 76 2HB LYS 76 25.541 -11.051 1.028 470 HB3 LYS 76 3HB LYS 76 23.831 -11.452 1.121 471 HG2 LYS 76 2HG LYS 76 23.706 -11.025 3.349 472 HG3 LYS 76 3HG LYS 76 25.383 -11.492 3.646 473 HD2 LYS 76 2HD LYS 76 25.070 -9.090 3.957 474 HD3 LYS 76 3HD LYS 76 26.147 -9.417 2.597 475 HE2 LYS 76 2HE LYS 76 24.594 -8.749 1.034 476 HE3 LYS 76 3HE LYS 76 23.226 -9.080 2.095 477 HZ1 LYS 76 1HZ LYS 76 23.823 -7.148 3.413 478 HZ2 LYS 76 2HZ LYS 76 23.565 -6.708 1.801 479 HZ3 LYS 76 3HZ LYS 76 25.142 -6.831 2.401 480 H MET 77 H MET 77 24.924 -12.746 -0.887 481 HA MET 77 HA MET 77 22.473 -14.098 -1.319 482 HB2 MET 77 2HB MET 77 23.035 -13.877 -3.724 483 HB3 MET 77 3HB MET 77 23.193 -12.363 -2.841 484 HG2 MET 77 2HG MET 77 25.644 -12.803 -2.682 485 HG3 MET 77 3HG MET 77 25.404 -14.183 -3.752 486 HE1 MET 77 1HE MET 77 26.688 -13.868 -5.410 487 HE2 MET 77 2HE MET 77 25.616 -13.528 -6.768 488 HE3 MET 77 3HE MET 77 26.966 -12.447 -6.419 489 H ALA 78 H ALA 78 25.787 -15.125 -1.245 490 HA ALA 78 HA ALA 78 25.717 -17.446 -2.757 491 HB1 ALA 78 1HB ALA 78 27.703 -16.357 -1.587 492 HB2 ALA 78 2HB ALA 78 27.208 -17.262 -0.156 493 HB3 ALA 78 3HB ALA 78 27.661 -18.119 -1.629 494 H VAL 79 H VAL 79 24.727 -16.938 0.603 495 HA VAL 79 HA VAL 79 23.832 -19.718 0.783 496 HB VAL 79 HB VAL 79 23.802 -19.514 3.082 497 HG11 VAL 79 1HG1 VAL 79 26.085 -19.192 2.173 498 HG12 VAL 79 2HG1 VAL 79 25.861 -17.447 2.316 499 HG13 VAL 79 3HG1 VAL 79 25.858 -18.460 3.761 500 HG21 VAL 79 1HG2 VAL 79 23.775 -17.250 4.226 501 HG22 VAL 79 2HG2 VAL 79 23.392 -16.565 2.647 502 HG23 VAL 79 3HG2 VAL 79 22.293 -17.724 3.395 503 H GLN 80 H GLN 80 22.548 -17.283 -0.667 504 HA GLN 80 HA GLN 80 20.421 -16.723 -1.260 505 HB2 GLN 80 2HB GLN 80 19.368 -18.752 0.694 506 HB3 GLN 80 3HB GLN 80 18.629 -18.183 -0.797 507 HG2 GLN 80 2HG GLN 80 20.990 -20.015 -0.494 508 HG3 GLN 80 3HG GLN 80 19.409 -20.385 -1.182 509 HE21 GLN 80 1HE2 GLN 80 18.813 -19.025 -3.105 510 HE22 GLN 80 2HE2 GLN 80 20.059 -18.717 -4.262 511 H LEU 81 H LEU 81 21.836 -15.526 1.009 512 HA LEU 81 HA LEU 81 19.502 -14.475 2.467 513 HB2 LEU 81 2HB LEU 81 22.234 -15.197 3.449 514 HB3 LEU 81 3HB LEU 81 21.287 -13.963 4.276 515 HG LEU 81 HG LEU 81 20.594 -16.878 3.944 516 HD11 LEU 81 1HD1 LEU 81 22.274 -16.000 5.713 517 HD12 LEU 81 2HD1 LEU 81 20.996 -17.111 6.205 518 HD13 LEU 81 3HD1 LEU 81 20.833 -15.384 6.521 519 HD21 LEU 81 1HD2 LEU 81 18.965 -14.581 5.009 520 HD22 LEU 81 2HD2 LEU 81 18.621 -16.269 5.385 521 HD23 LEU 81 3HD2 LEU 81 18.544 -15.705 3.716 522 H PHE 82 H PHE 82 19.189 -12.677 1.208 523 HA PHE 82 HA PHE 82 21.157 -10.558 1.537 524 HB2 PHE 82 2HB PHE 82 21.655 -11.707 -0.648 525 HB3 PHE 82 3HB PHE 82 20.058 -11.214 -1.201 526 HD1 PHE 82 HD1 PHE 82 19.631 -8.996 -1.918 527 HD2 PHE 82 HD2 PHE 82 23.379 -10.003 -0.170 528 HE1 PHE 82 HE1 PHE 82 20.551 -6.835 -2.654 529 HE2 PHE 82 HE2 PHE 82 24.304 -7.845 -0.903 530 HZ PHE 82 HZ PHE 82 22.889 -6.256 -2.145 Start of MODEL 7 1 H1 LEU 20 H LEU 20 14.067 -6.401 19.771 2 HA LEU 20 HA LEU 20 12.229 -8.472 20.086 3 HB2 LEU 20 2HB LEU 20 13.225 -6.916 17.742 4 HB3 LEU 20 3HB LEU 20 12.161 -8.296 17.477 5 HG LEU 20 HG LEU 20 10.940 -6.172 17.488 6 HD11 LEU 20 1HD1 LEU 20 9.814 -8.216 18.203 7 HD12 LEU 20 2HD1 LEU 20 9.204 -6.810 19.076 8 HD13 LEU 20 3HD1 LEU 20 10.324 -7.920 19.866 9 HD21 LEU 20 1HD2 LEU 20 10.764 -4.809 19.438 10 HD22 LEU 20 2HD2 LEU 20 12.479 -5.026 19.089 11 HD23 LEU 20 3HD2 LEU 20 11.720 -5.947 20.389 12 HA PRO 21 HA PRO 21 14.286 -12.201 19.032 13 HB2 PRO 21 2HB PRO 21 12.390 -13.518 17.604 14 HB3 PRO 21 3HB PRO 21 12.283 -13.280 19.352 15 HG2 PRO 21 2HG PRO 21 10.957 -11.749 17.147 16 HG3 PRO 21 3HG PRO 21 10.278 -12.308 18.686 17 HD2 PRO 21 2HD PRO 21 11.084 -9.754 18.292 18 HD3 PRO 21 3HD PRO 21 11.195 -10.556 19.871 19 H ALA 22 H ALA 22 14.791 -13.690 17.131 20 HA ALA 22 HA ALA 22 15.445 -12.017 14.811 21 HB1 ALA 22 1HB ALA 22 17.426 -13.032 14.753 22 HB2 ALA 22 2HB ALA 22 17.014 -13.718 16.326 23 HB3 ALA 22 3HB ALA 22 16.693 -14.634 14.852 24 H HIS 23 H HIS 23 15.714 -13.497 12.742 25 HA HIS 23 HA HIS 23 13.216 -15.038 12.465 26 HB2 HIS 23 2HB HIS 23 14.559 -13.681 10.148 27 HB3 HIS 23 3HB HIS 23 12.875 -14.167 10.323 28 HD1 HIS 23 HD1 HIS 23 11.994 -12.759 12.808 29 HD2 HIS 23 HD2 HIS 23 14.512 -10.985 10.019 30 HE1 HIS 23 HE1 HIS 23 11.737 -10.281 13.151 31 HA PRO 24 HA PRO 24 15.797 -18.472 11.441 32 HB2 PRO 24 2HB PRO 24 13.873 -20.069 10.381 33 HB3 PRO 24 3HB PRO 24 14.039 -19.787 12.118 34 HG2 PRO 24 2HG PRO 24 12.162 -18.514 10.164 35 HG3 PRO 24 3HG PRO 24 11.839 -19.103 11.804 36 HD2 PRO 24 2HD PRO 24 12.219 -16.481 11.247 37 HD3 PRO 24 3HD PRO 24 12.706 -17.209 12.791 38 H TYR 25 H TYR 25 16.576 -19.638 9.601 39 HA TYR 25 HA TYR 25 16.796 -18.062 7.259 40 HB2 TYR 25 2HB TYR 25 18.594 -19.553 7.974 41 HB3 TYR 25 3HB TYR 25 17.553 -20.953 7.737 42 HD1 TYR 25 HD1 TYR 25 16.880 -21.614 5.436 43 HD2 TYR 25 HD2 TYR 25 19.735 -18.540 6.145 44 HE1 TYR 25 HE1 TYR 25 17.643 -21.792 3.105 45 HE2 TYR 25 HE2 TYR 25 20.505 -18.710 3.816 46 HH TYR 25 HH TYR 25 20.507 -20.295 1.989 47 H ASP 26 H ASP 26 14.781 -20.780 8.156 48 HA ASP 26 HA ASP 26 13.871 -21.530 5.615 49 HB2 ASP 26 2HB ASP 26 12.823 -21.815 8.397 50 HB3 ASP 26 3HB ASP 26 11.742 -22.177 7.053 51 H ARG 27 H ARG 27 13.060 -18.833 7.640 52 HA ARG 27 HA ARG 27 10.763 -18.149 5.959 53 HB2 ARG 27 2HB ARG 27 10.986 -18.011 8.627 54 HB3 ARG 27 3HB ARG 27 11.576 -16.405 8.221 55 HG2 ARG 27 2HG ARG 27 9.534 -15.830 7.158 56 HG3 ARG 27 3HG ARG 27 8.958 -17.497 7.228 57 HD2 ARG 27 2HD ARG 27 9.570 -15.831 9.663 58 HD3 ARG 27 3HD ARG 27 7.967 -15.951 8.940 59 HE ARG 27 HE ARG 27 9.229 -17.870 10.621 60 HH11 ARG 27 1HH1 ARG 27 7.046 -17.529 7.930 61 HH12 ARG 27 2HH1 ARG 27 6.215 -19.015 8.250 62 HH21 ARG 27 1HH2 ARG 27 8.141 -19.827 11.052 63 HH22 ARG 27 2HH2 ARG 27 6.836 -20.320 10.026 64 H LEU 28 H LEU 28 14.050 -17.298 6.538 65 HA LEU 28 HA LEU 28 13.815 -14.727 5.194 66 HB2 LEU 28 2HB LEU 28 15.506 -15.729 7.140 67 HB3 LEU 28 3HB LEU 28 16.514 -15.683 5.694 68 HG LEU 28 HG LEU 28 15.641 -13.229 5.507 69 HD11 LEU 28 1HD1 LEU 28 15.581 -13.292 8.463 70 HD12 LEU 28 2HD1 LEU 28 14.141 -13.859 7.620 71 HD13 LEU 28 3HD1 LEU 28 14.746 -12.229 7.330 72 HD21 LEU 28 1HD2 LEU 28 17.467 -13.057 7.669 73 HD22 LEU 28 2HD2 LEU 28 17.787 -12.881 5.944 74 HD23 LEU 28 3HD2 LEU 28 17.900 -14.469 6.703 75 H LYS 29 H LYS 29 14.371 -14.331 3.131 76 HA LYS 29 HA LYS 29 15.695 -16.475 1.612 77 HB2 LYS 29 2HB LYS 29 13.050 -15.889 1.327 78 HB3 LYS 29 3HB LYS 29 13.761 -14.825 0.120 79 HG2 LYS 29 2HG LYS 29 15.017 -17.307 -0.211 80 HG3 LYS 29 3HG LYS 29 13.300 -17.651 0.011 81 HD2 LYS 29 2HD LYS 29 14.092 -15.447 -1.832 82 HD3 LYS 29 3HD LYS 29 14.292 -17.116 -2.373 83 HE2 LYS 29 2HE LYS 29 12.157 -16.684 -3.096 84 HE3 LYS 29 3HE LYS 29 11.832 -17.363 -1.502 85 HZ1 LYS 29 1HZ LYS 29 10.791 -15.082 -2.323 86 HZ2 LYS 29 2HZ LYS 29 12.218 -14.480 -1.644 87 HZ3 LYS 29 3HZ LYS 29 11.146 -15.383 -0.696 88 H THR 30 H THR 30 16.723 -15.724 -0.392 89 HA THR 30 HA THR 30 18.443 -13.578 0.023 90 HB THR 30 HB THR 30 17.910 -14.148 -2.810 91 HG1 THR 30 HG1 THR 30 17.943 -16.258 -2.683 92 HG21 THR 30 1HG2 THR 30 20.397 -14.784 -2.595 93 HG22 THR 30 2HG2 THR 30 20.273 -14.145 -0.956 94 HG23 THR 30 3HG2 THR 30 19.948 -13.099 -2.338 95 H THR 31 H THR 31 15.409 -13.730 -1.791 96 HA THR 31 HA THR 31 15.397 -10.786 -1.856 97 HB THR 31 HB THR 31 14.257 -10.842 -4.026 98 HG1 THR 31 HG1 THR 31 13.565 -12.671 -4.844 99 HG21 THR 31 1HG2 THR 31 16.956 -11.327 -3.555 100 HG22 THR 31 2HG2 THR 31 16.235 -10.758 -5.061 101 HG23 THR 31 3HG2 THR 31 16.512 -12.481 -4.813 102 H SER 32 H SER 32 14.240 -12.228 0.198 103 HA SER 32 HA SER 32 11.409 -12.519 -0.381 104 HB2 SER 32 2HB SER 32 11.881 -14.145 1.145 105 HB3 SER 32 3HB SER 32 13.217 -13.239 1.853 106 HG SER 32 HG SER 32 11.796 -12.978 3.403 107 H THR 33 H THR 33 9.764 -11.293 0.564 108 HA THR 33 HA THR 33 10.622 -8.630 1.478 109 HB THR 33 HB THR 33 7.824 -8.745 0.795 110 HG1 THR 33 HG1 THR 33 9.511 -9.296 -1.411 111 HG21 THR 33 1HG2 THR 33 9.935 -7.317 -0.780 112 HG22 THR 33 2HG2 THR 33 9.557 -6.809 0.866 113 HG23 THR 33 3HG2 THR 33 8.301 -6.795 -0.372 114 H ASP 34 H ASP 34 9.890 -11.344 2.893 115 HA ASP 34 HA ASP 34 7.640 -11.052 4.462 116 HB2 ASP 34 2HB ASP 34 10.227 -12.471 4.759 117 HB3 ASP 34 3HB ASP 34 9.286 -12.243 6.231 118 HA PRO 35 HA PRO 35 8.300 -7.784 7.310 119 HB2 PRO 35 2HB PRO 35 7.280 -8.794 9.614 120 HB3 PRO 35 3HB PRO 35 6.270 -8.313 8.246 121 HG2 PRO 35 2HG PRO 35 7.202 -11.043 9.046 122 HG3 PRO 35 3HG PRO 35 5.600 -10.527 8.487 123 HD2 PRO 35 2HD PRO 35 7.385 -11.754 6.862 124 HD3 PRO 35 3HD PRO 35 6.231 -10.542 6.270 125 H VAL 36 H VAL 36 9.553 -7.048 9.080 126 HA VAL 36 HA VAL 36 11.392 -8.991 10.285 127 HB VAL 36 HB VAL 36 13.209 -7.176 10.004 128 HG11 VAL 36 1HG1 VAL 36 14.003 -8.205 8.022 129 HG12 VAL 36 2HG1 VAL 36 13.084 -9.436 8.890 130 HG13 VAL 36 3HG1 VAL 36 12.370 -8.618 7.500 131 HG21 VAL 36 1HG2 VAL 36 13.007 -5.743 8.081 132 HG22 VAL 36 2HG2 VAL 36 11.427 -6.423 7.689 133 HG23 VAL 36 3HG2 VAL 36 11.633 -5.456 9.149 134 H SER 37 H SER 37 12.763 -7.832 12.025 135 HA SER 37 HA SER 37 10.890 -6.425 13.747 136 HB2 SER 37 2HB SER 37 13.445 -7.906 14.137 137 HB3 SER 37 3HB SER 37 13.046 -6.651 15.308 138 HG SER 37 HG SER 37 11.029 -7.723 15.616 139 H ASP 38 H ASP 38 12.569 -5.313 11.358 140 HA ASP 38 HA ASP 38 13.370 -3.259 10.788 141 HB2 ASP 38 2HB ASP 38 11.548 -2.588 12.533 142 HB3 ASP 38 3HB ASP 38 12.925 -2.249 13.577 143 H ILE 39 H ILE 39 15.419 -4.453 10.723 144 HA ILE 39 HA ILE 39 17.318 -3.356 12.686 145 HB ILE 39 HB ILE 39 18.469 -5.730 11.794 146 HG12 ILE 39 2HG1 ILE 39 16.047 -6.261 11.080 147 HG13 ILE 39 3HG1 ILE 39 16.907 -7.464 12.037 148 HG21 ILE 39 1HG2 ILE 39 18.914 -5.049 13.961 149 HG22 ILE 39 2HG2 ILE 39 17.210 -4.816 14.346 150 HG23 ILE 39 3HG2 ILE 39 17.869 -6.446 14.212 151 HD11 ILE 39 1HD1 ILE 39 15.523 -7.241 13.791 152 HD12 ILE 39 2HD1 ILE 39 15.334 -5.502 13.562 153 HD13 ILE 39 3HD1 ILE 39 14.415 -6.629 12.564 154 H ASP 40 H ASP 40 19.666 -4.187 11.648 155 HA ASP 40 HA ASP 40 20.295 -2.379 9.695 156 HB2 ASP 40 2HB ASP 40 21.614 -5.084 9.997 157 HB3 ASP 40 3HB ASP 40 22.336 -3.626 9.321 158 H VAL 41 H VAL 41 18.992 -2.204 7.936 159 HA VAL 41 HA VAL 41 17.894 -4.310 6.458 160 HB VAL 41 HB VAL 41 18.572 -1.517 5.528 161 HG11 VAL 41 1HG1 VAL 41 18.233 -2.706 3.557 162 HG12 VAL 41 2HG1 VAL 41 16.996 -3.738 4.277 163 HG13 VAL 41 3HG1 VAL 41 16.637 -2.050 3.913 164 HG21 VAL 41 1HG2 VAL 41 16.253 -0.999 6.027 165 HG22 VAL 41 2HG2 VAL 41 15.978 -2.654 6.570 166 HG23 VAL 41 3HG2 VAL 41 17.067 -1.599 7.471 167 H THR 42 H THR 42 20.913 -2.514 6.027 168 HA THR 42 HA THR 42 21.667 -3.725 3.588 169 HB THR 42 HB THR 42 24.013 -3.045 5.044 170 HG1 THR 42 HG1 THR 42 23.300 -0.789 5.489 171 HG21 THR 42 1HG2 THR 42 24.429 -1.808 3.196 172 HG22 THR 42 2HG2 THR 42 22.840 -1.043 3.225 173 HG23 THR 42 3HG2 THR 42 23.027 -2.663 2.553 174 H ARG 43 H ARG 43 21.638 -4.883 6.798 175 HA ARG 43 HA ARG 43 23.339 -7.158 6.012 176 HB2 ARG 43 2HB ARG 43 23.045 -5.797 8.686 177 HB3 ARG 43 3HB ARG 43 23.731 -7.408 8.521 178 HG2 ARG 43 2HG ARG 43 25.601 -6.628 7.375 179 HG3 ARG 43 3HG ARG 43 24.825 -5.098 6.962 180 HD2 ARG 43 2HD ARG 43 25.462 -5.908 9.789 181 HD3 ARG 43 3HD ARG 43 26.584 -5.001 8.774 182 HE ARG 43 HE ARG 43 24.263 -3.991 10.102 183 HH11 ARG 43 1HH1 ARG 43 26.320 -3.590 7.322 184 HH12 ARG 43 2HH1 ARG 43 25.944 -1.910 7.122 185 HH21 ARG 43 1HH2 ARG 43 23.760 -1.780 9.850 186 HH22 ARG 43 2HH2 ARG 43 24.489 -0.882 8.563 187 H ARG 44 H ARG 44 20.704 -7.233 5.344 188 HA ARG 44 HA ARG 44 18.857 -8.176 7.160 189 HB2 ARG 44 2HB ARG 44 18.291 -7.667 4.841 190 HB3 ARG 44 3HB ARG 44 19.244 -9.038 4.288 191 HG2 ARG 44 2HG ARG 44 17.363 -10.212 4.342 192 HG3 ARG 44 3HG ARG 44 17.480 -10.151 6.101 193 HD2 ARG 44 2HD ARG 44 15.470 -9.169 6.009 194 HD3 ARG 44 3HD ARG 44 16.363 -7.729 5.525 195 HE ARG 44 HE ARG 44 15.624 -9.460 3.343 196 HH11 ARG 44 1HH1 ARG 44 14.669 -6.787 5.359 197 HH12 ARG 44 2HH1 ARG 44 13.547 -6.147 4.203 198 HH21 ARG 44 1HH2 ARG 44 14.150 -8.627 1.814 199 HH22 ARG 44 2HH2 ARG 44 13.252 -7.196 2.187 200 H GLU 45 H GLU 45 21.439 -9.937 5.524 201 HA GLU 45 HA GLU 45 20.724 -12.539 6.210 202 HB2 GLU 45 2HB GLU 45 22.976 -13.156 5.740 203 HB3 GLU 45 3HB GLU 45 22.571 -11.840 4.647 204 HG2 GLU 45 2HG GLU 45 24.077 -11.486 7.226 205 HG3 GLU 45 3HG GLU 45 24.839 -11.693 5.650 206 H ALA 46 H ALA 46 22.205 -10.020 8.112 207 HA ALA 46 HA ALA 46 23.136 -11.668 10.231 208 HB1 ALA 46 1HB ALA 46 23.915 -9.339 9.745 209 HB2 ALA 46 2HB ALA 46 22.390 -8.757 10.415 210 HB3 ALA 46 3HB ALA 46 23.518 -9.648 11.435 211 H TYR 47 H TYR 47 20.032 -10.734 9.273 212 HA TYR 47 HA TYR 47 18.718 -10.460 11.743 213 HB2 TYR 47 2HB TYR 47 17.686 -11.431 9.072 214 HB3 TYR 47 3HB TYR 47 16.660 -11.058 10.452 215 HD1 TYR 47 HD1 TYR 47 15.918 -9.653 8.175 216 HD2 TYR 47 HD2 TYR 47 19.160 -8.768 10.784 217 HE1 TYR 47 HE1 TYR 47 15.833 -7.297 7.471 218 HE2 TYR 47 HE2 TYR 47 19.085 -6.410 10.087 219 HH TYR 47 HH TYR 47 16.513 -5.166 8.087 220 H LEU 48 H LEU 48 20.176 -13.155 10.330 221 HA LEU 48 HA LEU 48 18.448 -15.129 11.553 222 HB2 LEU 48 2HB LEU 48 20.516 -15.095 9.556 223 HB3 LEU 48 3HB LEU 48 20.850 -16.339 10.758 224 HG LEU 48 HG LEU 48 18.260 -16.109 9.230 225 HD11 LEU 48 1HD1 LEU 48 19.106 -17.317 7.556 226 HD12 LEU 48 2HD1 LEU 48 20.004 -18.371 8.648 227 HD13 LEU 48 3HD1 LEU 48 20.685 -16.817 8.165 228 HD21 LEU 48 1HD2 LEU 48 17.607 -17.423 10.934 229 HD22 LEU 48 2HD2 LEU 48 19.260 -17.826 11.398 230 HD23 LEU 48 3HD2 LEU 48 18.487 -18.677 10.059 231 H SER 49 H SER 49 19.362 -16.797 13.004 232 HA SER 49 HA SER 49 20.582 -15.584 15.264 233 HB2 SER 49 2HB SER 49 20.667 -18.502 15.254 234 HB3 SER 49 3HB SER 49 19.824 -17.405 16.349 235 HG SER 49 HG SER 49 18.190 -18.368 15.334 236 H SER 50 H SER 50 22.593 -16.071 16.235 237 HA SER 50 HA SER 50 24.806 -15.983 14.591 238 HB2 SER 50 2HB SER 50 24.829 -15.393 16.996 239 HB3 SER 50 3HB SER 50 24.707 -17.105 17.403 240 HG SER 50 HG SER 50 26.852 -16.602 17.467 241 H GLU 51 H GLU 51 23.014 -18.748 15.709 242 HA GLU 51 HA GLU 51 25.015 -20.681 15.011 243 HB2 GLU 51 2HB GLU 51 22.062 -21.164 15.415 244 HB3 GLU 51 3HB GLU 51 23.363 -22.340 15.544 245 HG2 GLU 51 2HG GLU 51 24.227 -21.193 17.507 246 HG3 GLU 51 3HG GLU 51 22.952 -19.982 17.370 247 H GLU 52 H GLU 52 21.806 -19.928 13.640 248 HA GLU 52 HA GLU 52 22.117 -21.496 11.330 249 HB2 GLU 52 2HB GLU 52 20.270 -19.349 12.213 250 HB3 GLU 52 3HB GLU 52 20.354 -19.654 10.484 251 HG2 GLU 52 2HG GLU 52 19.775 -21.747 12.568 252 HG3 GLU 52 3HG GLU 52 18.554 -20.901 11.619 253 H PHE 53 H PHE 53 22.460 -17.975 11.758 254 HA PHE 53 HA PHE 53 23.182 -17.267 9.203 255 HB2 PHE 53 2HB PHE 53 22.857 -15.494 10.705 256 HB3 PHE 53 3HB PHE 53 23.975 -16.170 11.886 257 HD1 PHE 53 HD1 PHE 53 26.388 -15.945 11.585 258 HD2 PHE 53 HD2 PHE 53 23.632 -14.164 8.874 259 HE1 PHE 53 HE1 PHE 53 28.187 -14.520 10.697 260 HE2 PHE 53 HE2 PHE 53 25.427 -12.737 7.981 261 HZ PHE 53 HZ PHE 53 27.708 -12.914 8.893 262 H LYS 54 H LYS 54 25.434 -18.100 11.840 263 HA LYS 54 HA LYS 54 27.735 -18.105 10.191 264 HB2 LYS 54 2HB LYS 54 28.908 -18.686 12.080 265 HB3 LYS 54 3HB LYS 54 27.459 -18.008 12.811 266 HG2 LYS 54 2HG LYS 54 26.544 -20.286 13.042 267 HG3 LYS 54 3HG LYS 54 28.053 -20.930 12.390 268 HD2 LYS 54 2HD LYS 54 28.203 -19.073 14.709 269 HD3 LYS 54 3HD LYS 54 27.640 -20.722 14.996 270 HE2 LYS 54 2HE LYS 54 29.740 -21.399 13.630 271 HE3 LYS 54 3HE LYS 54 30.300 -19.770 14.004 272 HZ1 LYS 54 1HZ LYS 54 31.135 -21.158 15.687 273 HZ2 LYS 54 2HZ LYS 54 29.658 -21.952 15.901 274 HZ3 LYS 54 3HZ LYS 54 29.833 -20.344 16.395 275 H GLU 55 H GLU 55 25.275 -20.447 10.819 276 HA GLU 55 HA GLU 55 26.797 -22.736 10.004 277 HB2 GLU 55 2HB GLU 55 24.945 -23.090 11.487 278 HB3 GLU 55 3HB GLU 55 23.837 -22.283 10.386 279 HG2 GLU 55 2HG GLU 55 23.631 -24.749 10.399 280 HG3 GLU 55 3HG GLU 55 23.985 -24.069 8.813 281 H LYS 56 H LYS 56 24.947 -20.292 8.409 282 HA LYS 56 HA LYS 56 24.786 -21.818 5.929 283 HB2 LYS 56 2HB LYS 56 23.480 -19.418 7.027 284 HB3 LYS 56 3HB LYS 56 23.845 -19.332 5.310 285 HG2 LYS 56 2HG LYS 56 22.456 -21.726 6.437 286 HG3 LYS 56 3HG LYS 56 21.557 -20.250 6.078 287 HD2 LYS 56 2HD LYS 56 22.065 -20.371 3.787 288 HD3 LYS 56 3HD LYS 56 23.361 -21.540 4.050 289 HE2 LYS 56 2HE LYS 56 21.783 -23.256 4.597 290 HE3 LYS 56 3HE LYS 56 20.450 -22.103 4.596 291 HZ1 LYS 56 1HZ LYS 56 21.463 -23.588 2.448 292 HZ2 LYS 56 2HZ LYS 56 21.732 -21.951 2.118 293 HZ3 LYS 56 3HZ LYS 56 20.168 -22.500 2.451 294 H PHE 57 H PHE 57 26.545 -19.162 7.363 295 HA PHE 57 HA PHE 57 27.937 -18.658 4.834 296 HB2 PHE 57 2HB PHE 57 27.924 -17.124 7.440 297 HB3 PHE 57 3HB PHE 57 28.886 -16.682 6.032 298 HD1 PHE 57 HD1 PHE 57 27.488 -16.469 3.794 299 HD2 PHE 57 HD2 PHE 57 25.889 -16.107 7.722 300 HE1 PHE 57 HE1 PHE 57 25.591 -15.182 2.900 301 HE2 PHE 57 HE2 PHE 57 23.990 -14.820 6.834 302 HZ PHE 57 HZ PHE 57 23.838 -14.356 4.419 303 H GLY 58 H GLY 58 28.319 -20.185 7.880 304 HA2 GLY 58 2HA GLY 58 30.031 -21.644 8.494 305 HA3 GLY 58 3HA GLY 58 30.976 -21.071 7.127 306 H MET 59 H MET 59 30.073 -18.293 8.421 307 HA MET 59 HA MET 59 32.331 -18.215 10.312 308 HB2 MET 59 2HB MET 59 31.383 -15.818 8.770 309 HB3 MET 59 3HB MET 59 32.935 -16.078 9.554 310 HG2 MET 59 2HG MET 59 32.978 -18.070 7.745 311 HG3 MET 59 3HG MET 59 31.998 -16.883 6.887 312 HE1 MET 59 1HE MET 59 35.990 -16.949 5.835 313 HE2 MET 59 2HE MET 59 35.027 -18.256 6.523 314 HE3 MET 59 3HE MET 59 34.405 -17.325 5.160 315 H THR 60 H THR 60 32.062 -17.167 12.243 316 HA THR 60 HA THR 60 29.505 -17.033 13.359 317 HB THR 60 HB THR 60 31.256 -15.251 14.769 318 HG1 THR 60 HG1 THR 60 32.418 -17.772 14.119 319 HG21 THR 60 1HG2 THR 60 31.075 -16.958 16.511 320 HG22 THR 60 2HG2 THR 60 30.404 -18.093 15.339 321 HG23 THR 60 3HG2 THR 60 29.504 -16.640 15.775 322 H LYS 61 H LYS 61 28.618 -15.013 14.448 323 HA LYS 61 HA LYS 61 27.751 -13.196 12.544 324 HB2 LYS 61 2HB LYS 61 27.968 -12.595 15.494 325 HB3 LYS 61 3HB LYS 61 26.814 -11.928 14.347 326 HG2 LYS 61 2HG LYS 61 26.477 -14.701 14.225 327 HG3 LYS 61 3HG LYS 61 26.638 -14.308 15.939 328 HD2 LYS 61 2HD LYS 61 24.354 -14.085 15.552 329 HD3 LYS 61 3HD LYS 61 24.945 -12.426 15.436 330 HE2 LYS 61 2HE LYS 61 25.033 -13.851 12.897 331 HE3 LYS 61 3HE LYS 61 23.405 -13.741 13.566 332 HZ1 LYS 61 1HZ LYS 61 25.098 -11.664 12.485 333 HZ2 LYS 61 2HZ LYS 61 24.321 -11.246 13.928 334 HZ3 LYS 61 3HZ LYS 61 23.411 -11.741 12.590 335 H GLU 62 H GLU 62 30.207 -12.665 15.075 336 HA GLU 62 HA GLU 62 30.973 -10.123 13.994 337 HB2 GLU 62 2HB GLU 62 31.327 -11.450 16.423 338 HB3 GLU 62 3HB GLU 62 32.945 -11.333 15.746 339 HG2 GLU 62 2HG GLU 62 32.451 -8.869 15.385 340 HG3 GLU 62 3HG GLU 62 31.047 -9.113 16.422 341 H ALA 63 H ALA 63 32.358 -13.382 13.994 342 HA ALA 63 HA ALA 63 34.795 -12.858 12.783 343 HB1 ALA 63 1HB ALA 63 34.898 -15.158 12.228 344 HB2 ALA 63 2HB ALA 63 33.995 -15.048 13.740 345 HB3 ALA 63 3HB ALA 63 33.141 -15.306 12.218 346 H PHE 64 H PHE 64 31.648 -13.490 11.272 347 HA PHE 64 HA PHE 64 32.498 -13.505 8.608 348 HB2 PHE 64 2HB PHE 64 30.257 -14.241 9.350 349 HB3 PHE 64 3HB PHE 64 29.835 -12.567 9.696 350 HD1 PHE 64 HD1 PHE 64 29.340 -11.016 7.926 351 HD2 PHE 64 HD2 PHE 64 30.465 -15.029 7.063 352 HE1 PHE 64 HE1 PHE 64 28.565 -10.731 5.609 353 HE2 PHE 64 HE2 PHE 64 29.693 -14.751 4.744 354 HZ PHE 64 HZ PHE 64 28.742 -12.599 4.014 355 H TYR 65 H TYR 65 31.318 -10.825 10.617 356 HA TYR 65 HA TYR 65 31.326 -8.805 8.728 357 HB2 TYR 65 2HB TYR 65 32.059 -8.607 11.656 358 HB3 TYR 65 3HB TYR 65 31.630 -7.248 10.623 359 HD1 TYR 65 HD1 TYR 65 29.381 -8.644 9.108 360 HD2 TYR 65 HD2 TYR 65 30.314 -8.411 13.253 361 HE1 TYR 65 HE1 TYR 65 27.006 -8.976 9.655 362 HE2 TYR 65 HE2 TYR 65 27.942 -8.742 13.811 363 HH TYR 65 HH TYR 65 25.715 -8.371 12.675 364 H LYS 66 H LYS 66 33.993 -10.385 10.270 365 HA LYS 66 HA LYS 66 36.007 -8.482 9.976 366 HB2 LYS 66 2HB LYS 66 36.002 -10.873 11.065 367 HB3 LYS 66 3HB LYS 66 36.576 -11.379 9.482 368 HG2 LYS 66 2HG LYS 66 38.607 -10.960 10.304 369 HG3 LYS 66 3HG LYS 66 38.212 -9.266 10.012 370 HD2 LYS 66 2HD LYS 66 37.753 -8.851 12.236 371 HD3 LYS 66 3HD LYS 66 37.391 -10.544 12.584 372 HE2 LYS 66 2HE LYS 66 40.028 -10.614 11.796 373 HE3 LYS 66 3HE LYS 66 39.924 -9.104 12.701 374 HZ1 LYS 66 1HZ LYS 66 38.635 -11.387 13.938 375 HZ2 LYS 66 2HZ LYS 66 39.602 -10.183 14.628 376 HZ3 LYS 66 3HZ LYS 66 40.320 -11.488 13.827 377 H LEU 67 H LEU 67 34.415 -10.453 7.614 378 HA LEU 67 HA LEU 67 36.392 -10.281 5.578 379 HB2 LEU 67 2HB LEU 67 33.498 -11.005 5.672 380 HB3 LEU 67 3HB LEU 67 34.271 -10.733 4.112 381 HG LEU 67 HG LEU 67 35.185 -12.767 6.143 382 HD11 LEU 67 1HD1 LEU 67 33.355 -12.974 3.778 383 HD12 LEU 67 2HD1 LEU 67 33.120 -13.575 5.418 384 HD13 LEU 67 3HD1 LEU 67 34.285 -14.359 4.351 385 HD21 LEU 67 1HD2 LEU 67 35.959 -12.313 3.263 386 HD22 LEU 67 2HD2 LEU 67 36.523 -13.634 4.289 387 HD23 LEU 67 3HD2 LEU 67 36.959 -11.969 4.675 388 HA PRO 68 HA PRO 68 35.777 -6.290 3.862 389 HB2 PRO 68 2HB PRO 68 35.945 -6.765 1.195 390 HB3 PRO 68 3HB PRO 68 37.344 -6.834 2.273 391 HG2 PRO 68 2HG PRO 68 35.669 -9.071 1.198 392 HG3 PRO 68 3HG PRO 68 37.432 -8.970 1.357 393 HD2 PRO 68 2HD PRO 68 35.886 -10.320 3.121 394 HD3 PRO 68 3HD PRO 68 37.387 -9.501 3.599 395 H LYS 69 H LYS 69 34.428 -4.991 2.360 396 HA LYS 69 HA LYS 69 31.685 -5.617 2.671 397 HB2 LYS 69 2HB LYS 69 31.339 -3.602 1.195 398 HB3 LYS 69 3HB LYS 69 32.309 -3.318 2.635 399 HG2 LYS 69 2HG LYS 69 33.901 -2.468 1.361 400 HG3 LYS 69 3HG LYS 69 34.100 -4.042 0.588 401 HD2 LYS 69 2HD LYS 69 32.632 -3.490 -1.159 402 HD3 LYS 69 3HD LYS 69 31.963 -2.116 -0.278 403 HE2 LYS 69 2HE LYS 69 34.836 -2.254 -1.160 404 HE3 LYS 69 3HE LYS 69 33.560 -1.571 -2.166 405 HZ1 LYS 69 1HZ LYS 69 33.108 -0.224 0.038 406 HZ2 LYS 69 2HZ LYS 69 34.242 0.295 -1.104 407 HZ3 LYS 69 3HZ LYS 69 34.755 -0.524 0.285 408 H TRP 70 H TRP 70 33.929 -5.876 -0.029 409 HA TRP 70 HA TRP 70 32.010 -6.467 -2.019 410 HB2 TRP 70 2HB TRP 70 33.825 -6.990 -3.419 411 HB3 TRP 70 3HB TRP 70 34.470 -5.780 -2.313 412 HD1 TRP 70 HD1 TRP 70 36.409 -6.515 -0.688 413 HE1 TRP 70 HE1 TRP 70 37.870 -8.629 -0.531 414 HE3 TRP 70 HE3 TRP 70 33.724 -9.586 -3.770 415 HZ2 TRP 70 HZ2 TRP 70 37.882 -11.251 -1.577 416 HZ3 TRP 70 HZ3 TRP 70 34.529 -11.882 -4.140 417 HH2 TRP 70 HH2 TRP 70 36.565 -12.695 -3.066 418 H LYS 71 H LYS 71 33.897 -8.495 0.174 419 HA LYS 71 HA LYS 71 32.906 -10.953 -0.935 420 HB2 LYS 71 2HB LYS 71 35.130 -10.730 0.183 421 HB3 LYS 71 3HB LYS 71 34.292 -10.501 1.713 422 HG2 LYS 71 2HG LYS 71 34.375 -12.696 1.984 423 HG3 LYS 71 3HG LYS 71 33.210 -12.836 0.664 424 HD2 LYS 71 2HD LYS 71 34.859 -13.294 -0.909 425 HD3 LYS 71 3HD LYS 71 36.138 -12.589 0.083 426 HE2 LYS 71 2HE LYS 71 36.607 -14.592 0.917 427 HE3 LYS 71 3HE LYS 71 34.962 -14.731 1.535 428 HZ1 LYS 71 1HZ LYS 71 34.727 -16.399 0.110 429 HZ2 LYS 71 2HZ LYS 71 36.171 -16.039 -0.693 430 HZ3 LYS 71 3HZ LYS 71 34.739 -15.256 -1.138 431 H GLN 72 H GLN 72 32.148 -8.920 1.842 432 HA GLN 72 HA GLN 72 30.418 -10.642 3.192 433 HB2 GLN 72 2HB GLN 72 30.916 -7.737 3.138 434 HB3 GLN 72 3HB GLN 72 29.315 -8.206 3.693 435 HG2 GLN 72 2HG GLN 72 30.713 -9.889 5.172 436 HG3 GLN 72 3HG GLN 72 31.968 -8.675 4.929 437 HE21 GLN 72 1HE2 GLN 72 32.027 -7.083 6.338 438 HE22 GLN 72 2HE2 GLN 72 30.721 -6.563 7.343 439 H ASN 73 H ASN 73 29.827 -8.434 0.504 440 HA ASN 73 HA ASN 73 26.995 -8.866 0.478 441 HB2 ASN 73 2HB ASN 73 28.884 -7.177 -0.885 442 HB3 ASN 73 3HB ASN 73 27.827 -7.951 -2.063 443 HD21 ASN 73 1HD2 ASN 73 26.885 -5.951 -2.544 444 HD22 ASN 73 2HD2 ASN 73 25.738 -5.213 -1.482 445 H LYS 74 H LYS 74 29.764 -10.382 -0.979 446 HA LYS 74 HA LYS 74 28.345 -11.791 -3.014 447 HB2 LYS 74 2HB LYS 74 31.066 -12.195 -1.773 448 HB3 LYS 74 3HB LYS 74 30.452 -13.195 -3.082 449 HG2 LYS 74 2HG LYS 74 30.460 -10.239 -3.422 450 HG3 LYS 74 3HG LYS 74 31.982 -11.123 -3.559 451 HD2 LYS 74 2HD LYS 74 29.651 -12.206 -5.037 452 HD3 LYS 74 3HD LYS 74 30.360 -10.707 -5.640 453 HE2 LYS 74 2HE LYS 74 32.271 -12.839 -4.945 454 HE3 LYS 74 3HE LYS 74 31.223 -13.173 -6.323 455 HZ1 LYS 74 1HZ LYS 74 32.725 -12.019 -7.476 456 HZ2 LYS 74 2HZ LYS 74 33.420 -11.332 -6.096 457 HZ3 LYS 74 3HZ LYS 74 32.038 -10.638 -6.783 458 H PHE 75 H PHE 75 29.731 -12.809 0.109 459 HA PHE 75 HA PHE 75 28.778 -15.437 0.056 460 HB2 PHE 75 2HB PHE 75 30.133 -13.742 1.907 461 HB3 PHE 75 3HB PHE 75 28.801 -14.523 2.754 462 HD1 PHE 75 HD1 PHE 75 28.667 -17.139 1.499 463 HD2 PHE 75 HD2 PHE 75 32.061 -14.810 2.584 464 HE1 PHE 75 HE1 PHE 75 30.005 -19.193 1.711 465 HE2 PHE 75 HE2 PHE 75 33.405 -16.861 2.797 466 HZ PHE 75 HZ PHE 75 32.377 -19.056 2.360 467 H LYS 76 H LYS 76 27.296 -12.464 1.246 468 HA LYS 76 HA LYS 76 25.125 -13.390 2.620 469 HB2 LYS 76 2HB LYS 76 25.702 -10.992 1.013 470 HB3 LYS 76 3HB LYS 76 23.990 -11.344 1.214 471 HG2 LYS 76 2HG LYS 76 24.053 -11.025 3.493 472 HG3 LYS 76 3HG LYS 76 25.784 -11.351 3.598 473 HD2 LYS 76 2HD LYS 76 25.725 -9.150 1.986 474 HD3 LYS 76 3HD LYS 76 24.363 -8.841 3.066 475 HE2 LYS 76 2HE LYS 76 26.192 -9.645 4.859 476 HE3 LYS 76 3HE LYS 76 27.262 -8.960 3.638 477 HZ1 LYS 76 1HZ LYS 76 25.012 -7.563 4.981 478 HZ2 LYS 76 2HZ LYS 76 25.965 -6.900 3.752 479 HZ3 LYS 76 3HZ LYS 76 26.662 -7.289 5.243 480 H MET 77 H MET 77 25.054 -12.639 -0.871 481 HA MET 77 HA MET 77 22.561 -13.920 -1.294 482 HB2 MET 77 2HB MET 77 23.101 -13.673 -3.701 483 HB3 MET 77 3HB MET 77 23.304 -12.179 -2.797 484 HG2 MET 77 2HG MET 77 25.742 -12.663 -2.679 485 HG3 MET 77 3HG MET 77 25.468 -14.038 -3.747 486 HE1 MET 77 1HE MET 77 25.087 -9.593 -4.813 487 HE2 MET 77 2HE MET 77 24.638 -10.336 -3.277 488 HE3 MET 77 3HE MET 77 26.338 -10.204 -3.730 489 H ALA 78 H ALA 78 25.848 -15.029 -1.269 490 HA ALA 78 HA ALA 78 25.708 -17.321 -2.819 491 HB1 ALA 78 1HB ALA 78 27.647 -18.056 -1.732 492 HB2 ALA 78 2HB ALA 78 27.727 -16.295 -1.636 493 HB3 ALA 78 3HB ALA 78 27.223 -17.234 -0.231 494 H VAL 79 H VAL 79 24.758 -16.846 0.556 495 HA VAL 79 HA VAL 79 23.798 -19.606 0.699 496 HB VAL 79 HB VAL 79 23.791 -19.439 3.001 497 HG11 VAL 79 1HG1 VAL 79 26.074 -19.162 2.095 498 HG12 VAL 79 2HG1 VAL 79 25.890 -17.413 2.236 499 HG13 VAL 79 3HG1 VAL 79 25.873 -18.423 3.682 500 HG21 VAL 79 1HG2 VAL 79 23.824 -17.192 4.179 501 HG22 VAL 79 2HG2 VAL 79 23.437 -16.477 2.614 502 HG23 VAL 79 3HG2 VAL 79 22.325 -17.625 3.359 503 H GLN 80 H GLN 80 22.559 -17.133 -0.713 504 HA GLN 80 HA GLN 80 20.443 -16.504 -1.275 505 HB2 GLN 80 2HB GLN 80 19.362 -18.556 0.641 506 HB3 GLN 80 3HB GLN 80 18.619 -17.933 -0.827 507 HG2 GLN 80 2HG GLN 80 20.858 -19.024 -1.850 508 HG3 GLN 80 3HG GLN 80 20.592 -20.082 -0.466 509 HE21 GLN 80 1HE2 GLN 80 19.827 -19.504 -3.651 510 HE22 GLN 80 2HE2 GLN 80 18.439 -20.523 -3.785 511 H LEU 81 H LEU 81 21.885 -15.346 0.970 512 HA LEU 81 HA LEU 81 19.585 -14.282 2.470 513 HB2 LEU 81 2HB LEU 81 22.300 -15.089 3.440 514 HB3 LEU 81 3HB LEU 81 21.371 -13.859 4.295 515 HG LEU 81 HG LEU 81 20.627 -16.752 3.884 516 HD11 LEU 81 1HD1 LEU 81 21.093 -17.079 6.098 517 HD12 LEU 81 2HD1 LEU 81 20.825 -15.389 6.522 518 HD13 LEU 81 3HD1 LEU 81 22.310 -15.867 5.699 519 HD21 LEU 81 1HD2 LEU 81 18.677 -16.109 5.382 520 HD22 LEU 81 2HD2 LEU 81 18.588 -15.594 3.696 521 HD23 LEU 81 3HD2 LEU 81 19.035 -14.436 4.950 522 H PHE 82 H PHE 82 19.315 -12.443 1.272 523 HA PHE 82 HA PHE 82 21.340 -10.388 1.640 524 HB2 PHE 82 2HB PHE 82 21.817 -11.506 -0.567 525 HB3 PHE 82 3HB PHE 82 20.238 -10.955 -1.116 526 HD1 PHE 82 HD1 PHE 82 19.879 -8.710 -1.785 527 HD2 PHE 82 HD2 PHE 82 23.588 -9.865 -0.046 528 HE1 PHE 82 HE1 PHE 82 20.866 -6.562 -2.469 529 HE2 PHE 82 HE2 PHE 82 24.580 -7.719 -0.725 530 HZ PHE 82 HZ PHE 82 23.219 -6.063 -1.939 Start of MODEL 8 1 H1 LEU 20 H LEU 20 19.056 -9.572 20.489 2 HA LEU 20 HA LEU 20 16.560 -8.055 20.220 3 HB2 LEU 20 2HB LEU 20 18.415 -8.479 17.936 4 HB3 LEU 20 3HB LEU 20 17.409 -7.086 18.328 5 HG LEU 20 HG LEU 20 20.033 -7.833 19.614 6 HD11 LEU 20 1HD1 LEU 20 21.028 -6.309 18.297 7 HD12 LEU 20 2HD1 LEU 20 19.642 -5.219 18.330 8 HD13 LEU 20 3HD1 LEU 20 19.648 -6.601 17.236 9 HD21 LEU 20 1HD2 LEU 20 17.855 -6.065 20.470 10 HD22 LEU 20 2HD2 LEU 20 19.449 -5.308 20.446 11 HD23 LEU 20 3HD2 LEU 20 19.181 -6.769 21.397 12 HA PRO 21 HA PRO 21 14.394 -11.343 18.281 13 HB2 PRO 21 2HB PRO 21 12.873 -9.994 16.481 14 HB3 PRO 21 3HB PRO 21 12.567 -9.951 18.221 15 HG2 PRO 21 2HG PRO 21 13.981 -7.954 16.497 16 HG3 PRO 21 3HG PRO 21 12.806 -7.677 17.795 17 HD2 PRO 21 2HD PRO 21 15.474 -7.393 18.160 18 HD3 PRO 21 3HD PRO 21 14.386 -7.939 19.453 19 H ALA 22 H ALA 22 14.820 -12.787 16.720 20 HA ALA 22 HA ALA 22 16.054 -11.832 14.222 21 HB1 ALA 22 1HB ALA 22 17.040 -14.413 14.681 22 HB2 ALA 22 2HB ALA 22 17.931 -12.891 14.758 23 HB3 ALA 22 3HB ALA 22 17.196 -13.556 16.216 24 H HIS 23 H HIS 23 15.866 -13.383 12.419 25 HA HIS 23 HA HIS 23 13.384 -14.960 12.623 26 HB2 HIS 23 2HB HIS 23 14.438 -13.618 10.129 27 HB3 HIS 23 3HB HIS 23 12.872 -14.395 10.342 28 HD1 HIS 23 HD1 HIS 23 11.384 -13.152 12.357 29 HD2 HIS 23 HD2 HIS 23 14.306 -10.938 10.400 30 HE1 HIS 23 HE1 HIS 23 10.791 -10.743 12.769 31 HA PRO 24 HA PRO 24 15.689 -18.508 11.425 32 HB2 PRO 24 2HB PRO 24 13.711 -19.977 10.285 33 HB3 PRO 24 3HB PRO 24 13.843 -19.734 12.031 34 HG2 PRO 24 2HG PRO 24 12.095 -18.327 10.049 35 HG3 PRO 24 3HG PRO 24 11.693 -18.924 11.670 36 HD2 PRO 24 2HD PRO 24 12.233 -16.318 11.171 37 HD3 PRO 24 3HD PRO 24 12.636 -17.097 12.714 38 H TYR 25 H TYR 25 16.471 -19.671 9.591 39 HA TYR 25 HA TYR 25 16.824 -18.072 7.281 40 HB2 TYR 25 2HB TYR 25 18.541 -19.639 8.009 41 HB3 TYR 25 3HB TYR 25 17.449 -20.994 7.753 42 HD1 TYR 25 HD1 TYR 25 16.844 -21.683 5.462 43 HD2 TYR 25 HD2 TYR 25 19.703 -18.616 6.178 44 HE1 TYR 25 HE1 TYR 25 17.641 -21.892 3.144 45 HE2 TYR 25 HE2 TYR 25 20.507 -18.815 3.862 46 HH TYR 25 HH TYR 25 19.711 -21.407 1.859 47 H ASP 26 H ASP 26 14.681 -20.726 8.074 48 HA ASP 26 HA ASP 26 13.808 -21.376 5.489 49 HB2 ASP 26 2HB ASP 26 12.929 -21.887 8.234 50 HB3 ASP 26 3HB ASP 26 11.599 -21.812 7.082 51 H ARG 27 H ARG 27 13.048 -18.714 7.574 52 HA ARG 27 HA ARG 27 10.775 -17.920 5.919 53 HB2 ARG 27 2HB ARG 27 10.682 -17.821 8.440 54 HB3 ARG 27 3HB ARG 27 11.867 -16.523 8.363 55 HG2 ARG 27 2HG ARG 27 10.140 -15.133 8.257 56 HG3 ARG 27 3HG ARG 27 9.907 -15.706 6.604 57 HD2 ARG 27 2HD ARG 27 7.885 -16.386 7.243 58 HD3 ARG 27 3HD ARG 27 8.700 -17.648 8.167 59 HE ARG 27 HE ARG 27 8.511 -15.178 9.599 60 HH11 ARG 27 1HH1 ARG 27 6.795 -18.078 8.725 61 HH12 ARG 27 2HH1 ARG 27 5.741 -18.026 10.098 62 HH21 ARG 27 1HH2 ARG 27 7.129 -15.098 11.412 63 HH22 ARG 27 2HH2 ARG 27 5.931 -16.329 11.626 64 H LEU 28 H LEU 28 14.110 -17.264 6.346 65 HA LEU 28 HA LEU 28 13.957 -14.663 5.037 66 HB2 LEU 28 2HB LEU 28 16.064 -16.204 6.464 67 HB3 LEU 28 3HB LEU 28 16.568 -15.005 5.273 68 HG LEU 28 HG LEU 28 14.635 -14.138 7.354 69 HD11 LEU 28 1HD1 LEU 28 17.388 -15.089 7.904 70 HD12 LEU 28 2HD1 LEU 28 15.962 -15.074 8.941 71 HD13 LEU 28 3HD1 LEU 28 16.872 -13.587 8.672 72 HD21 LEU 28 1HD2 LEU 28 15.456 -12.065 6.907 73 HD22 LEU 28 2HD2 LEU 28 15.824 -12.841 5.366 74 HD23 LEU 28 3HD2 LEU 28 17.087 -12.656 6.585 75 H LYS 29 H LYS 29 14.454 -14.295 2.956 76 HA LYS 29 HA LYS 29 15.645 -16.488 1.398 77 HB2 LYS 29 2HB LYS 29 13.020 -15.883 1.202 78 HB3 LYS 29 3HB LYS 29 13.675 -14.759 0.019 79 HG2 LYS 29 2HG LYS 29 14.340 -16.417 -1.399 80 HG3 LYS 29 3HG LYS 29 14.564 -17.590 -0.099 81 HD2 LYS 29 2HD LYS 29 11.866 -17.073 0.004 82 HD3 LYS 29 3HD LYS 29 12.208 -17.017 -1.728 83 HE2 LYS 29 2HE LYS 29 11.774 -19.255 -1.432 84 HE3 LYS 29 3HE LYS 29 13.526 -19.221 -1.237 85 HZ1 LYS 29 1HZ LYS 29 11.907 -18.857 1.164 86 HZ2 LYS 29 2HZ LYS 29 13.383 -19.658 0.967 87 HZ3 LYS 29 3HZ LYS 29 11.944 -20.409 0.491 88 H THR 30 H THR 30 16.852 -15.855 -0.442 89 HA THR 30 HA THR 30 18.549 -13.719 -0.145 90 HB THR 30 HB THR 30 17.976 -14.355 -2.963 91 HG1 THR 30 HG1 THR 30 18.755 -16.517 -2.716 92 HG21 THR 30 1HG2 THR 30 20.425 -14.533 -1.205 93 HG22 THR 30 2HG2 THR 30 20.018 -13.227 -2.318 94 HG23 THR 30 3HG2 THR 30 20.410 -14.830 -2.942 95 H THR 31 H THR 31 15.504 -13.832 -1.939 96 HA THR 31 HA THR 31 15.573 -10.891 -2.080 97 HB THR 31 HB THR 31 14.374 -10.991 -4.230 98 HG1 THR 31 HG1 THR 31 13.403 -12.970 -4.241 99 HG21 THR 31 1HG2 THR 31 16.898 -12.629 -4.409 100 HG22 THR 31 2HG2 THR 31 16.895 -10.896 -4.076 101 HG23 THR 31 3HG2 THR 31 16.247 -11.503 -5.600 102 H SER 32 H SER 32 14.405 -12.236 0.029 103 HA SER 32 HA SER 32 11.573 -12.532 -0.479 104 HB2 SER 32 2HB SER 32 13.402 -13.349 1.565 105 HB3 SER 32 3HB SER 32 12.091 -12.438 2.314 106 HG SER 32 HG SER 32 10.620 -13.851 1.382 107 H THR 33 H THR 33 9.932 -11.280 0.538 108 HA THR 33 HA THR 33 10.792 -8.542 1.213 109 HB THR 33 HB THR 33 8.571 -7.788 0.352 110 HG1 THR 33 HG1 THR 33 7.252 -9.485 0.217 111 HG21 THR 33 1HG2 THR 33 10.658 -9.036 -1.370 112 HG22 THR 33 2HG2 THR 33 10.200 -7.342 -1.202 113 HG23 THR 33 3HG2 THR 33 9.184 -8.442 -2.132 114 H ASP 34 H ASP 34 9.781 -11.228 2.637 115 HA ASP 34 HA ASP 34 7.498 -10.690 4.091 116 HB2 ASP 34 2HB ASP 34 9.906 -12.367 4.519 117 HB3 ASP 34 3HB ASP 34 8.927 -12.028 5.943 118 HA PRO 35 HA PRO 35 8.356 -7.486 6.959 119 HB2 PRO 35 2HB PRO 35 7.143 -8.370 9.220 120 HB3 PRO 35 3HB PRO 35 6.245 -7.803 7.808 121 HG2 PRO 35 2HG PRO 35 6.866 -10.606 8.657 122 HG3 PRO 35 3HG PRO 35 5.349 -9.937 8.027 123 HD2 PRO 35 2HD PRO 35 7.071 -11.348 6.486 124 HD3 PRO 35 3HD PRO 35 6.069 -10.032 5.840 125 H VAL 36 H VAL 36 9.521 -6.887 8.877 126 HA VAL 36 HA VAL 36 11.168 -8.995 10.081 127 HB VAL 36 HB VAL 36 13.095 -7.264 9.988 128 HG11 VAL 36 1HG1 VAL 36 13.873 -8.183 7.867 129 HG12 VAL 36 2HG1 VAL 36 13.117 -9.432 8.857 130 HG13 VAL 36 3HG1 VAL 36 12.238 -8.731 7.495 131 HG21 VAL 36 1HG2 VAL 36 11.496 -6.354 7.599 132 HG22 VAL 36 2HG2 VAL 36 11.667 -5.440 9.098 133 HG23 VAL 36 3HG2 VAL 36 13.083 -5.770 8.099 134 H SER 37 H SER 37 12.524 -7.980 11.934 135 HA SER 37 HA SER 37 10.639 -6.605 13.655 136 HB2 SER 37 2HB SER 37 12.790 -8.445 14.031 137 HB3 SER 37 3HB SER 37 13.143 -6.988 14.959 138 HG SER 37 HG SER 37 11.029 -8.803 15.216 139 H ASP 38 H ASP 38 12.394 -5.407 11.362 140 HA ASP 38 HA ASP 38 13.213 -3.331 10.903 141 HB2 ASP 38 2HB ASP 38 11.372 -2.722 12.647 142 HB3 ASP 38 3HB ASP 38 12.732 -2.459 13.735 143 H ILE 39 H ILE 39 15.248 -4.562 10.822 144 HA ILE 39 HA ILE 39 17.136 -3.553 12.839 145 HB ILE 39 HB ILE 39 18.269 -5.924 11.940 146 HG12 ILE 39 2HG1 ILE 39 15.861 -6.400 11.127 147 HG13 ILE 39 3HG1 ILE 39 16.681 -7.642 12.067 148 HG21 ILE 39 1HG2 ILE 39 17.409 -6.656 14.344 149 HG22 ILE 39 2HG2 ILE 39 18.686 -5.462 14.126 150 HG23 ILE 39 3HG2 ILE 39 17.034 -4.936 14.448 151 HD11 ILE 39 1HD1 ILE 39 15.249 -7.465 13.788 152 HD12 ILE 39 2HD1 ILE 39 15.079 -5.719 13.611 153 HD13 ILE 39 3HD1 ILE 39 14.182 -6.804 12.550 154 H ASP 40 H ASP 40 19.483 -4.401 11.825 155 HA ASP 40 HA ASP 40 20.173 -2.574 9.911 156 HB2 ASP 40 2HB ASP 40 21.464 -5.298 10.089 157 HB3 ASP 40 3HB ASP 40 22.213 -3.778 9.607 158 H VAL 41 H VAL 41 18.881 -2.348 8.146 159 HA VAL 41 HA VAL 41 17.791 -4.422 6.610 160 HB VAL 41 HB VAL 41 18.464 -1.600 5.768 161 HG11 VAL 41 1HG1 VAL 41 18.169 -2.741 3.758 162 HG12 VAL 41 2HG1 VAL 41 16.916 -3.788 4.426 163 HG13 VAL 41 3HG1 VAL 41 16.567 -2.090 4.101 164 HG21 VAL 41 1HG2 VAL 41 15.838 -2.766 6.682 165 HG22 VAL 41 2HG2 VAL 41 16.919 -1.813 7.700 166 HG23 VAL 41 3HG2 VAL 41 16.170 -1.081 6.280 167 H THR 42 H THR 42 20.799 -2.590 6.231 168 HA THR 42 HA THR 42 21.577 -3.744 3.774 169 HB THR 42 HB THR 42 23.912 -3.090 5.252 170 HG1 THR 42 HG1 THR 42 23.392 -1.268 6.293 171 HG21 THR 42 1HG2 THR 42 24.302 -1.685 3.493 172 HG22 THR 42 2HG2 THR 42 22.637 -1.105 3.445 173 HG23 THR 42 3HG2 THR 42 23.040 -2.684 2.773 174 H ARG 43 H ARG 43 21.524 -4.986 6.948 175 HA ARG 43 HA ARG 43 23.225 -7.241 6.111 176 HB2 ARG 43 2HB ARG 43 22.908 -6.071 8.879 177 HB3 ARG 43 3HB ARG 43 23.792 -7.546 8.511 178 HG2 ARG 43 2HG ARG 43 25.612 -6.391 8.016 179 HG3 ARG 43 3HG ARG 43 24.727 -5.415 6.843 180 HD2 ARG 43 2HD ARG 43 25.728 -4.006 8.555 181 HD3 ARG 43 3HD ARG 43 23.968 -3.944 8.645 182 HE ARG 43 HE ARG 43 24.631 -5.885 10.421 183 HH11 ARG 43 1HH1 ARG 43 25.632 -2.581 9.968 184 HH12 ARG 43 2HH1 ARG 43 25.945 -2.308 11.650 185 HH21 ARG 43 1HH2 ARG 43 25.039 -5.538 12.637 186 HH22 ARG 43 2HH2 ARG 43 25.609 -3.991 13.168 187 H ARG 44 H ARG 44 20.599 -7.324 5.460 188 HA ARG 44 HA ARG 44 18.757 -8.275 7.276 189 HB2 ARG 44 2HB ARG 44 18.185 -7.757 4.961 190 HB3 ARG 44 3HB ARG 44 19.138 -9.124 4.400 191 HG2 ARG 44 2HG ARG 44 17.264 -10.306 4.456 192 HG3 ARG 44 3HG ARG 44 17.378 -10.243 6.217 193 HD2 ARG 44 2HD ARG 44 15.361 -9.271 6.112 194 HD3 ARG 44 3HD ARG 44 16.256 -7.826 5.643 195 HE ARG 44 HE ARG 44 15.534 -9.544 3.445 196 HH11 ARG 44 1HH1 ARG 44 14.559 -6.887 5.472 197 HH12 ARG 44 2HH1 ARG 44 13.444 -6.242 4.313 198 HH21 ARG 44 1HH2 ARG 44 14.068 -8.706 1.912 199 HH22 ARG 44 2HH2 ARG 44 13.165 -7.278 2.289 200 H GLU 45 H GLU 45 21.335 -10.028 5.629 201 HA GLU 45 HA GLU 45 20.623 -12.633 6.306 202 HB2 GLU 45 2HB GLU 45 22.877 -13.247 5.832 203 HB3 GLU 45 3HB GLU 45 22.465 -11.932 4.742 204 HG2 GLU 45 2HG GLU 45 23.976 -11.570 7.317 205 HG3 GLU 45 3HG GLU 45 24.737 -11.782 5.741 206 H ALA 46 H ALA 46 22.103 -10.120 8.216 207 HA ALA 46 HA ALA 46 23.047 -11.769 10.326 208 HB1 ALA 46 1HB ALA 46 23.804 -9.429 9.850 209 HB2 ALA 46 2HB ALA 46 22.275 -8.865 10.527 210 HB3 ALA 46 3HB ALA 46 23.414 -9.754 11.539 211 H TYR 47 H TYR 47 19.933 -10.852 9.380 212 HA TYR 47 HA TYR 47 18.623 -10.605 11.853 213 HB2 TYR 47 2HB TYR 47 17.592 -11.571 9.179 214 HB3 TYR 47 3HB TYR 47 16.567 -11.210 10.564 215 HD1 TYR 47 HD1 TYR 47 15.812 -9.802 8.291 216 HD2 TYR 47 HD2 TYR 47 19.049 -8.904 10.901 217 HE1 TYR 47 HE1 TYR 47 15.710 -7.445 7.597 218 HE2 TYR 47 HE2 TYR 47 18.955 -6.544 10.216 219 HH TYR 47 HH TYR 47 16.363 -5.292 8.285 220 H LEU 48 H LEU 48 20.099 -13.280 10.419 221 HA LEU 48 HA LEU 48 18.390 -15.278 11.631 222 HB2 LEU 48 2HB LEU 48 20.465 -15.212 9.639 223 HB3 LEU 48 3HB LEU 48 20.800 -16.465 10.833 224 HG LEU 48 HG LEU 48 18.217 -16.233 9.293 225 HD11 LEU 48 1HD1 LEU 48 19.976 -18.482 8.702 226 HD12 LEU 48 2HD1 LEU 48 20.647 -16.920 8.233 227 HD13 LEU 48 3HD1 LEU 48 19.075 -17.426 7.614 228 HD21 LEU 48 1HD2 LEU 48 18.475 -18.812 10.109 229 HD22 LEU 48 2HD2 LEU 48 17.547 -17.578 10.961 230 HD23 LEU 48 3HD2 LEU 48 19.198 -17.944 11.465 231 H SER 49 H SER 49 19.294 -16.932 13.088 232 HA SER 49 HA SER 49 20.507 -15.725 15.351 233 HB2 SER 49 2HB SER 49 19.268 -18.260 14.698 234 HB3 SER 49 3HB SER 49 20.720 -18.501 15.672 235 HG SER 49 HG SER 49 18.308 -17.318 16.337 236 H SER 50 H SER 50 22.519 -16.212 16.330 237 HA SER 50 HA SER 50 24.737 -16.090 14.694 238 HB2 SER 50 2HB SER 50 25.996 -16.134 16.619 239 HB3 SER 50 3HB SER 50 24.414 -15.791 17.317 240 HG SER 50 HG SER 50 25.826 -17.645 18.147 241 H GLU 51 H GLU 51 22.964 -18.879 15.782 242 HA GLU 51 HA GLU 51 24.981 -20.790 15.073 243 HB2 GLU 51 2HB GLU 51 22.033 -21.313 15.447 244 HB3 GLU 51 3HB GLU 51 23.353 -22.465 15.596 245 HG2 GLU 51 2HG GLU 51 24.188 -21.045 17.519 246 HG3 GLU 51 3HG GLU 51 22.636 -20.216 17.447 247 H GLU 52 H GLU 52 21.774 -20.044 13.693 248 HA GLU 52 HA GLU 52 22.105 -21.591 11.372 249 HB2 GLU 52 2HB GLU 52 20.237 -19.478 12.280 250 HB3 GLU 52 3HB GLU 52 20.341 -19.729 10.543 251 HG2 GLU 52 2HG GLU 52 19.050 -21.513 10.679 252 HG3 GLU 52 3HG GLU 52 20.143 -22.261 11.842 253 H PHE 53 H PHE 53 22.430 -18.072 11.834 254 HA PHE 53 HA PHE 53 23.162 -17.339 9.286 255 HB2 PHE 53 2HB PHE 53 22.814 -15.584 10.805 256 HB3 PHE 53 3HB PHE 53 23.938 -16.257 11.981 257 HD1 PHE 53 HD1 PHE 53 26.355 -16.027 11.662 258 HD2 PHE 53 HD2 PHE 53 23.570 -14.211 9.004 259 HE1 PHE 53 HE1 PHE 53 28.141 -14.579 10.786 260 HE2 PHE 53 HE2 PHE 53 25.351 -12.760 8.124 261 HZ PHE 53 HZ PHE 53 27.640 -12.943 9.013 262 H LYS 54 H LYS 54 25.404 -18.175 11.930 263 HA LYS 54 HA LYS 54 27.715 -18.154 10.299 264 HB2 LYS 54 2HB LYS 54 28.877 -18.748 12.190 265 HB3 LYS 54 3HB LYS 54 27.421 -18.082 12.917 266 HG2 LYS 54 2HG LYS 54 26.514 -20.364 13.123 267 HG3 LYS 54 3HG LYS 54 28.027 -20.999 12.472 268 HD2 LYS 54 2HD LYS 54 28.280 -19.150 14.758 269 HD3 LYS 54 3HD LYS 54 27.532 -20.711 15.107 270 HE2 LYS 54 2HE LYS 54 30.092 -20.536 13.558 271 HE3 LYS 54 3HE LYS 54 30.096 -20.476 15.320 272 HZ1 LYS 54 1HZ LYS 54 29.847 -22.661 15.404 273 HZ2 LYS 54 2HZ LYS 54 30.017 -22.729 13.722 274 HZ3 LYS 54 3HZ LYS 54 28.477 -22.612 14.413 275 H GLU 55 H GLU 55 25.265 -20.517 10.887 276 HA GLU 55 HA GLU 55 26.802 -22.792 10.068 277 HB2 GLU 55 2HB GLU 55 24.926 -23.157 11.520 278 HB3 GLU 55 3HB GLU 55 23.835 -22.352 10.401 279 HG2 GLU 55 2HG GLU 55 23.837 -24.133 8.915 280 HG3 GLU 55 3HG GLU 55 25.328 -24.805 9.573 281 H LYS 56 H LYS 56 24.940 -20.350 8.470 282 HA LYS 56 HA LYS 56 24.841 -21.852 5.972 283 HB2 LYS 56 2HB LYS 56 23.486 -19.484 7.076 284 HB3 LYS 56 3HB LYS 56 23.885 -19.363 5.367 285 HG2 LYS 56 2HG LYS 56 21.625 -20.239 5.760 286 HG3 LYS 56 3HG LYS 56 22.653 -21.380 4.892 287 HD2 LYS 56 2HD LYS 56 22.815 -22.810 6.696 288 HD3 LYS 56 3HD LYS 56 22.476 -21.536 7.870 289 HE2 LYS 56 2HE LYS 56 20.222 -21.727 7.630 290 HE3 LYS 56 3HE LYS 56 20.333 -22.193 5.933 291 HZ1 LYS 56 1HZ LYS 56 21.504 -24.228 7.417 292 HZ2 LYS 56 2HZ LYS 56 20.045 -24.281 6.562 293 HZ3 LYS 56 3HZ LYS 56 20.051 -23.845 8.197 294 H PHE 57 H PHE 57 26.542 -19.184 7.455 295 HA PHE 57 HA PHE 57 27.978 -18.655 4.954 296 HB2 PHE 57 2HB PHE 57 27.904 -17.115 7.555 297 HB3 PHE 57 3HB PHE 57 28.854 -16.655 6.146 298 HD1 PHE 57 HD1 PHE 57 27.450 -16.484 3.907 299 HD2 PHE 57 HD2 PHE 57 25.846 -16.144 7.835 300 HE1 PHE 57 HE1 PHE 57 25.522 -15.246 3.009 301 HE2 PHE 57 HE2 PHE 57 23.917 -14.906 6.944 302 HZ PHE 57 HZ PHE 57 23.752 -14.456 4.528 303 H GLY 58 H GLY 58 28.274 -20.400 7.814 304 HA2 GLY 58 2HA GLY 58 30.001 -21.686 8.626 305 HA3 GLY 58 3HA GLY 58 30.914 -21.256 7.187 306 H MET 59 H MET 59 29.831 -18.499 8.759 307 HA MET 59 HA MET 59 32.263 -18.293 10.392 308 HB2 MET 59 2HB MET 59 31.324 -15.954 8.764 309 HB3 MET 59 3HB MET 59 32.902 -16.235 9.486 310 HG2 MET 59 2HG MET 59 32.828 -18.295 7.781 311 HG3 MET 59 3HG MET 59 31.798 -17.157 6.914 312 HE1 MET 59 1HE MET 59 35.320 -18.273 7.744 313 HE2 MET 59 2HE MET 59 34.758 -18.436 6.080 314 HE3 MET 59 3HE MET 59 36.122 -17.379 6.451 315 H THR 60 H THR 60 32.043 -17.177 12.282 316 HA THR 60 HA THR 60 29.436 -16.825 13.327 317 HB THR 60 HB THR 60 31.487 -15.372 14.796 318 HG1 THR 60 HG1 THR 60 32.834 -17.144 15.174 319 HG21 THR 60 1HG2 THR 60 30.127 -17.930 15.590 320 HG22 THR 60 2HG2 THR 60 29.264 -16.392 15.577 321 HG23 THR 60 3HG2 THR 60 30.672 -16.605 16.617 322 H LYS 61 H LYS 61 29.265 -14.576 14.722 323 HA LYS 61 HA LYS 61 28.507 -12.639 12.818 324 HB2 LYS 61 2HB LYS 61 28.193 -11.161 14.829 325 HB3 LYS 61 3HB LYS 61 27.347 -12.700 14.901 326 HG2 LYS 61 2HG LYS 61 29.667 -13.355 16.117 327 HG3 LYS 61 3HG LYS 61 29.525 -11.656 16.572 328 HD2 LYS 61 2HD LYS 61 27.115 -13.378 16.827 329 HD3 LYS 61 3HD LYS 61 28.412 -13.587 18.006 330 HE2 LYS 61 2HE LYS 61 27.589 -10.808 17.428 331 HE3 LYS 61 3HE LYS 61 26.421 -11.808 18.291 332 HZ1 LYS 61 1HZ LYS 61 29.241 -11.595 19.159 333 HZ2 LYS 61 2HZ LYS 61 27.911 -12.146 20.045 334 HZ3 LYS 61 3HZ LYS 61 28.060 -10.501 19.681 335 H GLU 62 H GLU 62 31.186 -12.665 15.167 336 HA GLU 62 HA GLU 62 32.320 -10.240 14.172 337 HB2 GLU 62 2HB GLU 62 33.190 -12.345 16.117 338 HB3 GLU 62 3HB GLU 62 34.353 -11.156 15.547 339 HG2 GLU 62 2HG GLU 62 31.721 -10.435 16.807 340 HG3 GLU 62 3HG GLU 62 33.228 -10.601 17.707 341 H ALA 63 H ALA 63 32.723 -13.633 13.477 342 HA ALA 63 HA ALA 63 35.187 -13.400 12.065 343 HB1 ALA 63 1HB ALA 63 34.218 -15.506 13.078 344 HB2 ALA 63 2HB ALA 63 33.141 -15.571 11.681 345 HB3 ALA 63 3HB ALA 63 34.888 -15.660 11.452 346 H PHE 64 H PHE 64 31.808 -13.744 10.986 347 HA PHE 64 HA PHE 64 32.346 -13.542 8.235 348 HB2 PHE 64 2HB PHE 64 30.213 -14.379 9.262 349 HB3 PHE 64 3HB PHE 64 29.799 -12.708 9.632 350 HD1 PHE 64 HD1 PHE 64 30.099 -15.227 7.022 351 HD2 PHE 64 HD2 PHE 64 29.236 -11.143 7.853 352 HE1 PHE 64 HE1 PHE 64 29.108 -14.985 4.783 353 HE2 PHE 64 HE2 PHE 64 28.242 -10.894 5.616 354 HZ PHE 64 HZ PHE 64 28.176 -12.817 4.079 355 H TYR 65 H TYR 65 31.071 -11.072 10.469 356 HA TYR 65 HA TYR 65 31.025 -8.928 8.726 357 HB2 TYR 65 2HB TYR 65 31.409 -9.128 11.696 358 HB3 TYR 65 3HB TYR 65 31.498 -7.562 10.896 359 HD1 TYR 65 HD1 TYR 65 29.409 -7.728 8.875 360 HD2 TYR 65 HD2 TYR 65 29.416 -9.159 12.881 361 HE1 TYR 65 HE1 TYR 65 26.957 -7.553 8.935 362 HE2 TYR 65 HE2 TYR 65 26.963 -8.990 12.952 363 HH TYR 65 HH TYR 65 25.113 -7.908 10.120 364 H LYS 66 H LYS 66 33.735 -10.453 10.263 365 HA LYS 66 HA LYS 66 35.640 -8.420 10.124 366 HB2 LYS 66 2HB LYS 66 35.619 -11.109 10.831 367 HB3 LYS 66 3HB LYS 66 36.737 -11.038 9.475 368 HG2 LYS 66 2HG LYS 66 38.294 -9.924 10.648 369 HG3 LYS 66 3HG LYS 66 37.102 -8.944 11.505 370 HD2 LYS 66 2HD LYS 66 38.189 -10.351 13.106 371 HD3 LYS 66 3HD LYS 66 36.547 -10.958 12.877 372 HE2 LYS 66 2HE LYS 66 37.269 -12.914 12.059 373 HE3 LYS 66 3HE LYS 66 38.494 -12.144 11.052 374 HZ1 LYS 66 1HZ LYS 66 39.995 -12.895 12.476 375 HZ2 LYS 66 2HZ LYS 66 38.806 -13.460 13.537 376 HZ3 LYS 66 3HZ LYS 66 39.358 -11.866 13.659 377 H LEU 67 H LEU 67 34.272 -10.417 7.638 378 HA LEU 67 HA LEU 67 36.296 -10.022 5.682 379 HB2 LEU 67 2HB LEU 67 33.466 -10.968 5.647 380 HB3 LEU 67 3HB LEU 67 34.266 -10.578 4.126 381 HG LEU 67 HG LEU 67 35.269 -12.612 6.117 382 HD11 LEU 67 1HD1 LEU 67 33.187 -12.772 4.126 383 HD12 LEU 67 2HD1 LEU 67 33.697 -13.962 5.323 384 HD13 LEU 67 3HD1 LEU 67 34.509 -13.880 3.760 385 HD21 LEU 67 1HD2 LEU 67 37.019 -11.613 4.734 386 HD22 LEU 67 2HD2 LEU 67 36.099 -12.003 3.280 387 HD23 LEU 67 3HD2 LEU 67 36.738 -13.298 4.292 388 HA PRO 68 HA PRO 68 35.432 -6.036 4.064 389 HB2 PRO 68 2HB PRO 68 35.689 -6.411 1.387 390 HB3 PRO 68 3HB PRO 68 37.066 -6.416 2.495 391 HG2 PRO 68 2HG PRO 68 35.578 -8.728 1.313 392 HG3 PRO 68 3HG PRO 68 37.326 -8.509 1.516 393 HD2 PRO 68 2HD PRO 68 35.843 -10.022 3.201 394 HD3 PRO 68 3HD PRO 68 37.271 -9.116 3.739 395 H LYS 69 H LYS 69 34.064 -4.821 2.447 396 HA LYS 69 HA LYS 69 31.352 -5.564 2.746 397 HB2 LYS 69 2HB LYS 69 32.851 -3.339 1.536 398 HB3 LYS 69 3HB LYS 69 31.297 -3.667 0.781 399 HG2 LYS 69 2HG LYS 69 30.794 -2.091 2.404 400 HG3 LYS 69 3HG LYS 69 30.356 -3.620 3.170 401 HD2 LYS 69 2HD LYS 69 31.562 -2.699 4.871 402 HD3 LYS 69 3HD LYS 69 32.877 -3.488 3.996 403 HE2 LYS 69 2HE LYS 69 33.511 -1.445 2.952 404 HE3 LYS 69 3HE LYS 69 32.055 -0.631 3.520 405 HZ1 LYS 69 1HZ LYS 69 34.551 -1.038 4.861 406 HZ2 LYS 69 2HZ LYS 69 33.234 -1.526 5.802 407 HZ3 LYS 69 3HZ LYS 69 33.308 0.055 5.207 408 H TRP 70 H TRP 70 33.494 -5.502 -0.091 409 HA TRP 70 HA TRP 70 31.664 -6.377 -1.995 410 HB2 TRP 70 2HB TRP 70 33.512 -6.843 -3.388 411 HB3 TRP 70 3HB TRP 70 34.056 -5.536 -2.340 412 HD1 TRP 70 HD1 TRP 70 35.938 -6.109 -0.530 413 HE1 TRP 70 HE1 TRP 70 37.607 -8.060 -0.344 414 HE3 TRP 70 HE3 TRP 70 33.774 -9.350 -3.839 415 HZ2 TRP 70 HZ2 TRP 70 37.960 -10.631 -1.452 416 HZ3 TRP 70 HZ3 TRP 70 34.840 -11.534 -4.220 417 HH2 TRP 70 HH2 TRP 70 36.891 -12.160 -3.051 418 H LYS 71 H LYS 71 33.718 -8.246 0.197 419 HA LYS 71 HA LYS 71 32.866 -10.779 -0.847 420 HB2 LYS 71 2HB LYS 71 35.079 -10.408 0.242 421 HB3 LYS 71 3HB LYS 71 34.248 -10.176 1.774 422 HG2 LYS 71 2HG LYS 71 34.463 -12.355 2.111 423 HG3 LYS 71 3HG LYS 71 33.285 -12.601 0.819 424 HD2 LYS 71 2HD LYS 71 34.952 -12.962 -0.787 425 HD3 LYS 71 3HD LYS 71 36.205 -12.239 0.224 426 HE2 LYS 71 2HE LYS 71 36.665 -14.197 1.181 427 HE3 LYS 71 3HE LYS 71 34.964 -14.485 1.548 428 HZ1 LYS 71 1HZ LYS 71 35.294 -14.858 -1.188 429 HZ2 LYS 71 2HZ LYS 71 34.956 -16.031 -0.016 430 HZ3 LYS 71 3HZ LYS 71 36.560 -15.688 -0.432 431 H GLN 72 H GLN 72 31.941 -8.701 1.828 432 HA GLN 72 HA GLN 72 30.339 -10.530 3.235 433 HB2 GLN 72 2HB GLN 72 30.685 -7.603 3.164 434 HB3 GLN 72 3HB GLN 72 29.116 -8.155 3.734 435 HG2 GLN 72 2HG GLN 72 30.704 -9.769 5.166 436 HG3 GLN 72 3HG GLN 72 31.775 -8.381 4.980 437 HE21 GLN 72 1HE2 GLN 72 31.525 -6.727 6.316 438 HE22 GLN 72 2HE2 GLN 72 30.177 -6.478 7.368 439 H ASN 73 H ASN 73 29.631 -8.376 0.532 440 HA ASN 73 HA ASN 73 26.823 -8.937 0.522 441 HB2 ASN 73 2HB ASN 73 28.661 -7.230 -0.936 442 HB3 ASN 73 3HB ASN 73 27.515 -8.011 -2.023 443 HD21 ASN 73 1HD2 ASN 73 26.379 -6.176 -2.494 444 HD22 ASN 73 2HD2 ASN 73 25.385 -5.356 -1.342 445 H LYS 74 H LYS 74 29.649 -10.366 -0.897 446 HA LYS 74 HA LYS 74 28.312 -11.844 -2.935 447 HB2 LYS 74 2HB LYS 74 31.018 -12.152 -1.634 448 HB3 LYS 74 3HB LYS 74 30.459 -13.192 -2.937 449 HG2 LYS 74 2HG LYS 74 30.373 -10.248 -3.342 450 HG3 LYS 74 3HG LYS 74 31.935 -11.069 -3.407 451 HD2 LYS 74 2HD LYS 74 29.675 -12.245 -4.939 452 HD3 LYS 74 3HD LYS 74 30.415 -10.768 -5.560 453 HE2 LYS 74 2HE LYS 74 32.633 -11.906 -5.396 454 HE3 LYS 74 3HE LYS 74 31.781 -13.392 -4.976 455 HZ1 LYS 74 1HZ LYS 74 30.646 -12.291 -7.305 456 HZ2 LYS 74 2HZ LYS 74 31.426 -13.778 -7.112 457 HZ3 LYS 74 3HZ LYS 74 32.321 -12.401 -7.516 458 H PHE 75 H PHE 75 29.654 -12.779 0.233 459 HA PHE 75 HA PHE 75 28.756 -15.435 0.183 460 HB2 PHE 75 2HB PHE 75 30.086 -13.713 2.025 461 HB3 PHE 75 3HB PHE 75 28.762 -14.501 2.877 462 HD1 PHE 75 HD1 PHE 75 28.668 -17.125 1.604 463 HD2 PHE 75 HD2 PHE 75 32.014 -14.757 2.751 464 HE1 PHE 75 HE1 PHE 75 30.027 -19.163 1.833 465 HE2 PHE 75 HE2 PHE 75 33.379 -16.792 2.982 466 HZ PHE 75 HZ PHE 75 32.386 -18.999 2.522 467 H LYS 76 H LYS 76 27.238 -12.479 1.380 468 HA LYS 76 HA LYS 76 25.074 -13.438 2.743 469 HB2 LYS 76 2HB LYS 76 25.602 -11.027 1.120 470 HB3 LYS 76 3HB LYS 76 23.903 -11.396 1.391 471 HG2 LYS 76 2HG LYS 76 24.069 -11.109 3.679 472 HG3 LYS 76 3HG LYS 76 25.817 -11.352 3.686 473 HD2 LYS 76 2HD LYS 76 25.642 -9.167 2.113 474 HD3 LYS 76 3HD LYS 76 24.239 -8.916 3.155 475 HE2 LYS 76 2HE LYS 76 26.033 -9.582 5.018 476 HE3 LYS 76 3HE LYS 76 27.128 -8.910 3.811 477 HZ1 LYS 76 1HZ LYS 76 24.986 -7.574 5.318 478 HZ2 LYS 76 2HZ LYS 76 25.433 -6.972 3.803 479 HZ3 LYS 76 3HZ LYS 76 26.578 -7.070 5.045 480 H MET 77 H MET 77 25.016 -12.674 -0.746 481 HA MET 77 HA MET 77 22.532 -13.974 -1.183 482 HB2 MET 77 2HB MET 77 23.120 -13.732 -3.602 483 HB3 MET 77 3HB MET 77 23.209 -12.233 -2.686 484 HG2 MET 77 2HG MET 77 25.635 -12.462 -2.542 485 HG3 MET 77 3HG MET 77 25.546 -13.966 -3.457 486 HE1 MET 77 1HE MET 77 25.688 -13.483 -6.688 487 HE2 MET 77 2HE MET 77 27.106 -12.584 -6.147 488 HE3 MET 77 3HE MET 77 26.543 -13.981 -5.228 489 H ALA 78 H ALA 78 25.832 -15.046 -1.159 490 HA ALA 78 HA ALA 78 25.724 -17.326 -2.728 491 HB1 ALA 78 1HB ALA 78 27.657 -18.065 -1.612 492 HB2 ALA 78 2HB ALA 78 27.733 -16.304 -1.553 493 HB3 ALA 78 3HB ALA 78 27.228 -17.212 -0.129 494 H VAL 79 H VAL 79 24.756 -16.891 0.649 495 HA VAL 79 HA VAL 79 23.836 -19.665 0.772 496 HB VAL 79 HB VAL 79 23.792 -19.498 3.075 497 HG11 VAL 79 1HG1 VAL 79 25.872 -17.444 2.334 498 HG12 VAL 79 2HG1 VAL 79 25.851 -18.452 3.782 499 HG13 VAL 79 3HG1 VAL 79 26.082 -19.189 2.197 500 HG21 VAL 79 1HG2 VAL 79 23.763 -17.266 4.263 501 HG22 VAL 79 2HG2 VAL 79 23.424 -16.535 2.694 502 HG23 VAL 79 3HG2 VAL 79 22.291 -17.695 3.390 503 H GLN 80 H GLN 80 22.569 -17.201 -0.644 504 HA GLN 80 HA GLN 80 20.449 -16.616 -1.236 505 HB2 GLN 80 2HB GLN 80 19.381 -18.690 0.663 506 HB3 GLN 80 3HB GLN 80 18.648 -18.080 -0.814 507 HG2 GLN 80 2HG GLN 80 21.022 -19.152 -1.693 508 HG3 GLN 80 3HG GLN 80 20.519 -20.265 -0.421 509 HE21 GLN 80 1HE2 GLN 80 20.131 -19.353 -3.631 510 HE22 GLN 80 2HE2 GLN 80 18.749 -20.320 -4.005 511 H LEU 81 H LEU 81 21.843 -15.441 1.034 512 HA LEU 81 HA LEU 81 19.507 -14.438 2.521 513 HB2 LEU 81 2HB LEU 81 22.240 -15.172 3.485 514 HB3 LEU 81 3HB LEU 81 21.305 -13.942 4.332 515 HG LEU 81 HG LEU 81 20.601 -16.851 3.972 516 HD11 LEU 81 1HD1 LEU 81 22.282 -15.984 5.749 517 HD12 LEU 81 2HD1 LEU 81 21.009 -17.106 6.228 518 HD13 LEU 81 3HD1 LEU 81 20.837 -15.383 6.563 519 HD21 LEU 81 1HD2 LEU 81 18.553 -15.674 3.754 520 HD22 LEU 81 2HD2 LEU 81 18.975 -14.561 5.055 521 HD23 LEU 81 3HD2 LEU 81 18.628 -16.251 5.418 522 H PHE 82 H PHE 82 19.176 -12.616 1.304 523 HA PHE 82 HA PHE 82 21.081 -10.468 1.708 524 HB2 PHE 82 2HB PHE 82 21.727 -11.611 -0.454 525 HB3 PHE 82 3HB PHE 82 20.168 -11.110 -1.098 526 HD1 PHE 82 HD1 PHE 82 19.787 -8.886 -1.816 527 HD2 PHE 82 HD2 PHE 82 23.412 -9.910 0.163 528 HE1 PHE 82 HE1 PHE 82 20.749 -6.715 -2.461 529 HE2 PHE 82 HE2 PHE 82 24.380 -7.742 -0.477 530 HZ PHE 82 HZ PHE 82 23.047 -6.140 -1.791 Start of MODEL 9 1 H1 LEU 20 H LEU 20 16.247 -8.327 21.063 2 HA LEU 20 HA LEU 20 13.491 -8.773 20.766 3 HB2 LEU 20 2HB LEU 20 15.616 -7.451 19.300 4 HB3 LEU 20 3HB LEU 20 14.440 -8.204 18.223 5 HG LEU 20 HG LEU 20 12.673 -6.941 19.596 6 HD11 LEU 20 1HD1 LEU 20 15.148 -5.983 20.806 7 HD12 LEU 20 2HD1 LEU 20 13.488 -5.904 21.397 8 HD13 LEU 20 3HD1 LEU 20 14.078 -4.687 20.265 9 HD21 LEU 20 1HD2 LEU 20 14.149 -4.845 18.245 10 HD22 LEU 20 2HD2 LEU 20 12.594 -5.574 17.840 11 HD23 LEU 20 3HD2 LEU 20 14.092 -6.332 17.299 12 HA PRO 21 HA PRO 21 13.103 -12.642 18.733 13 HB2 PRO 21 2HB PRO 21 11.167 -12.147 16.895 14 HB3 PRO 21 3HB PRO 21 10.841 -12.255 18.630 15 HG2 PRO 21 2HG PRO 21 11.202 -9.826 16.917 16 HG3 PRO 21 3HG PRO 21 10.007 -10.130 18.191 17 HD2 PRO 21 2HD PRO 21 12.228 -8.639 18.604 18 HD3 PRO 21 3HD PRO 21 11.493 -9.631 19.880 19 H ALA 22 H ALA 22 13.934 -13.791 17.047 20 HA ALA 22 HA ALA 22 15.135 -12.231 14.860 21 HB1 ALA 22 1HB ALA 22 16.990 -13.265 15.547 22 HB2 ALA 22 2HB ALA 22 16.088 -14.453 16.490 23 HB3 ALA 22 3HB ALA 22 16.329 -14.698 14.760 24 H HIS 23 H HIS 23 15.505 -13.718 12.844 25 HA HIS 23 HA HIS 23 12.991 -15.156 12.294 26 HB2 HIS 23 2HB HIS 23 14.498 -13.725 10.133 27 HB3 HIS 23 3HB HIS 23 12.796 -14.171 10.192 28 HD1 HIS 23 HD1 HIS 23 11.937 -12.847 12.796 29 HD2 HIS 23 HD2 HIS 23 14.399 -11.018 9.994 30 HE1 HIS 23 HE1 HIS 23 11.692 -10.377 13.197 31 HA PRO 24 HA PRO 24 15.696 -18.538 11.366 32 HB2 PRO 24 2HB PRO 24 13.815 -20.178 10.296 33 HB3 PRO 24 3HB PRO 24 13.964 -19.893 12.034 34 HG2 PRO 24 2HG PRO 24 12.071 -18.664 10.068 35 HG3 PRO 24 3HG PRO 24 11.751 -19.258 11.707 36 HD2 PRO 24 2HD PRO 24 12.076 -16.629 11.150 37 HD3 PRO 24 3HD PRO 24 12.569 -17.345 12.697 38 H TYR 25 H TYR 25 16.520 -19.680 9.533 39 HA TYR 25 HA TYR 25 16.715 -18.103 7.193 40 HB2 TYR 25 2HB TYR 25 18.540 -19.554 7.920 41 HB3 TYR 25 3HB TYR 25 17.533 -20.976 7.674 42 HD1 TYR 25 HD1 TYR 25 16.881 -21.637 5.362 43 HD2 TYR 25 HD2 TYR 25 19.684 -18.523 6.105 44 HE1 TYR 25 HE1 TYR 25 17.664 -21.795 3.036 45 HE2 TYR 25 HE2 TYR 25 20.474 -18.672 3.782 46 HH TYR 25 HH TYR 25 19.481 -21.236 1.664 47 H ASP 26 H ASP 26 14.756 -20.866 8.076 48 HA ASP 26 HA ASP 26 13.880 -21.642 5.534 49 HB2 ASP 26 2HB ASP 26 13.271 -22.293 8.231 50 HB3 ASP 26 3HB ASP 26 11.747 -21.946 7.418 51 H ARG 27 H ARG 27 13.002 -18.947 7.533 52 HA ARG 27 HA ARG 27 10.718 -18.310 5.811 53 HB2 ARG 27 2HB ARG 27 11.619 -17.355 8.510 54 HB3 ARG 27 3HB ARG 27 10.489 -16.398 7.561 55 HG2 ARG 27 2HG ARG 27 8.974 -18.344 7.468 56 HG3 ARG 27 3HG ARG 27 10.091 -19.227 8.510 57 HD2 ARG 27 2HD ARG 27 8.708 -18.422 10.119 58 HD3 ARG 27 3HD ARG 27 9.791 -17.036 9.997 59 HE ARG 27 HE ARG 27 7.757 -16.624 8.163 60 HH11 ARG 27 1HH1 ARG 27 8.087 -16.971 11.612 61 HH12 ARG 27 2HH1 ARG 27 6.723 -15.966 11.974 62 HH21 ARG 27 1HH2 ARG 27 5.959 -15.300 8.628 63 HH22 ARG 27 2HH2 ARG 27 5.513 -15.017 10.276 64 H LEU 28 H LEU 28 13.964 -17.359 6.511 65 HA LEU 28 HA LEU 28 13.707 -14.801 5.156 66 HB2 LEU 28 2HB LEU 28 15.353 -15.740 7.149 67 HB3 LEU 28 3HB LEU 28 16.408 -15.734 5.738 68 HG LEU 28 HG LEU 28 15.471 -13.278 5.480 69 HD11 LEU 28 1HD1 LEU 28 14.562 -12.298 7.284 70 HD12 LEU 28 2HD1 LEU 28 15.574 -13.199 8.414 71 HD13 LEU 28 3HD1 LEU 28 14.129 -13.949 7.734 72 HD21 LEU 28 1HD2 LEU 28 17.642 -12.949 5.787 73 HD22 LEU 28 2HD2 LEU 28 17.786 -14.483 6.646 74 HD23 LEU 28 3HD2 LEU 28 17.386 -13.010 7.531 75 H LYS 29 H LYS 29 14.314 -14.376 3.111 76 HA LYS 29 HA LYS 29 15.710 -16.487 1.611 77 HB2 LYS 29 2HB LYS 29 13.076 -15.995 1.258 78 HB3 LYS 29 3HB LYS 29 13.755 -14.832 0.127 79 HG2 LYS 29 2HG LYS 29 14.736 -16.492 -1.181 80 HG3 LYS 29 3HG LYS 29 14.616 -17.700 0.100 81 HD2 LYS 29 2HD LYS 29 12.690 -18.389 -0.769 82 HD3 LYS 29 3HD LYS 29 11.993 -16.803 -0.429 83 HE2 LYS 29 2HE LYS 29 11.659 -16.868 -2.679 84 HE3 LYS 29 3HE LYS 29 13.283 -16.180 -2.661 85 HZ1 LYS 29 1HZ LYS 29 12.764 -18.179 -4.186 86 HZ2 LYS 29 2HZ LYS 29 12.932 -19.099 -2.778 87 HZ3 LYS 29 3HZ LYS 29 14.222 -18.154 -3.329 88 H THR 30 H THR 30 16.717 -15.682 -0.412 89 HA THR 30 HA THR 30 18.424 -13.530 0.078 90 HB THR 30 HB THR 30 17.949 -14.057 -2.771 91 HG1 THR 30 HG1 THR 30 17.514 -16.125 -2.306 92 HG21 THR 30 1HG2 THR 30 20.438 -14.702 -2.501 93 HG22 THR 30 2HG2 THR 30 20.269 -14.059 -0.868 94 HG23 THR 30 3HG2 THR 30 19.975 -13.018 -2.261 95 H THR 31 H THR 31 15.419 -13.690 -1.782 96 HA THR 31 HA THR 31 15.378 -10.745 -1.809 97 HB THR 31 HB THR 31 14.116 -10.912 -3.990 98 HG1 THR 31 HG1 THR 31 14.315 -12.855 -5.135 99 HG21 THR 31 1HG2 THR 31 16.925 -12.001 -4.138 100 HG22 THR 31 2HG2 THR 31 16.551 -10.317 -3.774 101 HG23 THR 31 3HG2 THR 31 16.089 -11.007 -5.331 102 H SER 32 H SER 32 14.210 -12.225 0.211 103 HA SER 32 HA SER 32 11.387 -12.526 -0.408 104 HB2 SER 32 2HB SER 32 13.189 -13.488 1.645 105 HB3 SER 32 3HB SER 32 11.736 -12.792 2.361 106 HG SER 32 HG SER 32 10.669 -14.152 0.601 107 H THR 33 H THR 33 9.726 -11.327 0.541 108 HA THR 33 HA THR 33 10.559 -8.679 1.519 109 HB THR 33 HB THR 33 8.403 -7.837 0.758 110 HG1 THR 33 HG1 THR 33 6.980 -9.479 0.883 111 HG21 THR 33 1HG2 THR 33 9.236 -9.387 -1.622 112 HG22 THR 33 2HG2 THR 33 10.484 -8.424 -0.831 113 HG23 THR 33 3HG2 THR 33 9.015 -7.649 -1.421 114 H ASP 34 H ASP 34 9.867 -11.410 2.895 115 HA ASP 34 HA ASP 34 7.595 -11.186 4.443 116 HB2 ASP 34 2HB ASP 34 10.075 -12.688 4.551 117 HB3 ASP 34 3HB ASP 34 9.506 -12.273 6.166 118 HA PRO 35 HA PRO 35 8.156 -7.943 7.341 119 HB2 PRO 35 2HB PRO 35 7.152 -9.009 9.628 120 HB3 PRO 35 3HB PRO 35 6.136 -8.538 8.261 121 HG2 PRO 35 2HG PRO 35 7.136 -11.252 9.030 122 HG3 PRO 35 3HG PRO 35 5.523 -10.771 8.470 123 HD2 PRO 35 2HD PRO 35 7.347 -11.930 6.838 124 HD3 PRO 35 3HD PRO 35 6.164 -10.741 6.256 125 H VAL 36 H VAL 36 9.415 -7.184 9.080 126 HA VAL 36 HA VAL 36 11.271 -9.095 10.309 127 HB VAL 36 HB VAL 36 13.071 -7.268 10.008 128 HG11 VAL 36 1HG1 VAL 36 12.085 -9.135 7.883 129 HG12 VAL 36 2HG1 VAL 36 13.527 -8.149 7.629 130 HG13 VAL 36 3HG1 VAL 36 13.472 -9.306 8.960 131 HG21 VAL 36 1HG2 VAL 36 11.480 -5.571 9.140 132 HG22 VAL 36 2HG2 VAL 36 12.856 -5.852 8.075 133 HG23 VAL 36 3HG2 VAL 36 11.285 -6.552 7.686 134 H SER 37 H SER 37 12.625 -7.906 12.038 135 HA SER 37 HA SER 37 10.739 -6.501 13.744 136 HB2 SER 37 2HB SER 37 13.396 -7.829 14.176 137 HB3 SER 37 3HB SER 37 12.772 -6.697 15.376 138 HG SER 37 HG SER 37 12.211 -9.167 15.322 139 H ASP 38 H ASP 38 12.415 -5.400 11.343 140 HA ASP 38 HA ASP 38 13.196 -3.346 10.747 141 HB2 ASP 38 2HB ASP 38 11.344 -2.679 12.470 142 HB3 ASP 38 3HB ASP 38 12.711 -2.286 13.509 143 H ILE 39 H ILE 39 15.276 -4.434 10.685 144 HA ILE 39 HA ILE 39 17.129 -3.297 12.663 145 HB ILE 39 HB ILE 39 18.287 -5.703 11.780 146 HG12 ILE 39 2HG1 ILE 39 15.434 -6.083 12.713 147 HG13 ILE 39 3HG1 ILE 39 16.075 -6.501 11.128 148 HG21 ILE 39 1HG2 ILE 39 18.576 -6.101 14.028 149 HG22 ILE 39 2HG2 ILE 39 18.303 -4.359 14.018 150 HG23 ILE 39 3HG2 ILE 39 16.992 -5.455 14.455 151 HD11 ILE 39 1HD1 ILE 39 16.262 -7.929 13.683 152 HD12 ILE 39 2HD1 ILE 39 16.239 -8.544 12.030 153 HD13 ILE 39 3HD1 ILE 39 17.735 -7.911 12.714 154 H ASP 40 H ASP 40 19.501 -4.120 11.661 155 HA ASP 40 HA ASP 40 20.129 -2.338 9.686 156 HB2 ASP 40 2HB ASP 40 21.424 -5.013 10.244 157 HB3 ASP 40 3HB ASP 40 22.137 -3.757 9.238 158 H VAL 41 H VAL 41 18.832 -2.198 7.918 159 HA VAL 41 HA VAL 41 17.767 -4.336 6.461 160 HB VAL 41 HB VAL 41 18.412 -1.543 5.509 161 HG11 VAL 41 1HG1 VAL 41 16.480 -2.140 3.890 162 HG12 VAL 41 2HG1 VAL 41 18.108 -2.722 3.536 163 HG13 VAL 41 3HG1 VAL 41 16.918 -3.810 4.252 164 HG21 VAL 41 1HG2 VAL 41 15.840 -2.724 6.553 165 HG22 VAL 41 2HG2 VAL 41 16.889 -1.608 7.427 166 HG23 VAL 41 3HG2 VAL 41 16.061 -1.077 5.964 167 H THR 42 H THR 42 20.774 -2.521 6.044 168 HA THR 42 HA THR 42 21.555 -3.742 3.616 169 HB THR 42 HB THR 42 23.904 -3.043 5.002 170 HG1 THR 42 HG1 THR 42 21.979 -0.984 5.327 171 HG21 THR 42 1HG2 THR 42 22.405 -1.144 3.230 172 HG22 THR 42 2HG2 THR 42 23.073 -2.642 2.580 173 HG23 THR 42 3HG2 THR 42 24.140 -1.448 3.322 174 H ARG 43 H ARG 43 21.515 -4.872 6.836 175 HA ARG 43 HA ARG 43 23.250 -7.133 6.085 176 HB2 ARG 43 2HB ARG 43 22.852 -5.856 8.794 177 HB3 ARG 43 3HB ARG 43 23.703 -7.374 8.540 178 HG2 ARG 43 2HG ARG 43 25.557 -6.358 7.788 179 HG3 ARG 43 3HG ARG 43 24.649 -5.138 6.892 180 HD2 ARG 43 2HD ARG 43 24.194 -3.944 8.975 181 HD3 ARG 43 3HD ARG 43 25.086 -5.169 9.876 182 HE ARG 43 HE ARG 43 26.810 -4.189 7.944 183 HH11 ARG 43 1HH1 ARG 43 25.072 -2.969 10.703 184 HH12 ARG 43 2HH1 ARG 43 26.242 -1.743 11.062 185 HH21 ARG 43 1HH2 ARG 43 28.358 -2.579 8.407 186 HH22 ARG 43 2HH2 ARG 43 28.111 -1.521 9.756 187 H ARG 44 H ARG 44 20.616 -7.230 5.385 188 HA ARG 44 HA ARG 44 18.765 -8.199 7.182 189 HB2 ARG 44 2HB ARG 44 18.260 -7.682 4.830 190 HB3 ARG 44 3HB ARG 44 19.170 -9.101 4.325 191 HG2 ARG 44 2HG ARG 44 17.334 -10.318 4.490 192 HG3 ARG 44 3HG ARG 44 17.264 -9.966 6.219 193 HD2 ARG 44 2HD ARG 44 16.143 -7.773 5.546 194 HD3 ARG 44 3HD ARG 44 15.945 -8.500 3.952 195 HE ARG 44 HE ARG 44 14.958 -10.109 6.132 196 HH11 ARG 44 1HH1 ARG 44 14.216 -7.633 3.800 197 HH12 ARG 44 2HH1 ARG 44 12.509 -7.924 3.838 198 HH21 ARG 44 1HH2 ARG 44 12.711 -10.503 6.192 199 HH22 ARG 44 2HH2 ARG 44 11.654 -9.557 5.199 200 H GLU 45 H GLU 45 21.380 -9.926 5.567 201 HA GLU 45 HA GLU 45 20.689 -12.538 6.233 202 HB2 GLU 45 2HB GLU 45 22.952 -13.127 5.789 203 HB3 GLU 45 3HB GLU 45 22.550 -11.806 4.702 204 HG2 GLU 45 2HG GLU 45 24.026 -11.472 7.302 205 HG3 GLU 45 3HG GLU 45 24.800 -11.634 5.727 206 H ALA 46 H ALA 46 22.109 -10.009 8.169 207 HA ALA 46 HA ALA 46 23.031 -11.656 10.294 208 HB1 ALA 46 1HB ALA 46 22.234 -8.769 10.552 209 HB2 ALA 46 2HB ALA 46 23.440 -9.661 11.480 210 HB3 ALA 46 3HB ALA 46 23.739 -9.276 9.785 211 H TYR 47 H TYR 47 19.930 -10.725 9.302 212 HA TYR 47 HA TYR 47 18.580 -10.486 11.752 213 HB2 TYR 47 2HB TYR 47 17.594 -11.454 9.064 214 HB3 TYR 47 3HB TYR 47 16.546 -11.093 10.431 215 HD1 TYR 47 HD1 TYR 47 15.826 -9.687 8.145 216 HD2 TYR 47 HD2 TYR 47 19.020 -8.784 10.807 217 HE1 TYR 47 HE1 TYR 47 15.733 -7.330 7.448 218 HE2 TYR 47 HE2 TYR 47 18.935 -6.425 10.120 219 HH TYR 47 HH TYR 47 16.369 -5.169 8.174 220 H LEU 48 H LEU 48 20.075 -13.162 10.336 221 HA LEU 48 HA LEU 48 18.351 -15.156 11.535 222 HB2 LEU 48 2HB LEU 48 20.435 -15.097 9.554 223 HB3 LEU 48 3HB LEU 48 20.766 -16.346 10.752 224 HG LEU 48 HG LEU 48 18.195 -16.119 9.192 225 HD11 LEU 48 1HD1 LEU 48 19.948 -18.382 8.643 226 HD12 LEU 48 2HD1 LEU 48 20.634 -16.830 8.166 227 HD13 LEU 48 3HD1 LEU 48 19.067 -17.332 7.534 228 HD21 LEU 48 1HD2 LEU 48 19.155 -17.827 11.381 229 HD22 LEU 48 2HD2 LEU 48 18.413 -18.687 10.032 230 HD23 LEU 48 3HD2 LEU 48 17.509 -17.434 10.883 231 H SER 49 H SER 49 19.237 -16.809 13.001 232 HA SER 49 HA SER 49 20.443 -15.604 15.269 233 HB2 SER 49 2HB SER 49 19.560 -18.372 14.552 234 HB3 SER 49 3HB SER 49 20.589 -18.146 15.966 235 HG SER 49 HG SER 49 18.667 -17.829 16.836 236 H SER 50 H SER 50 22.447 -16.101 16.261 237 HA SER 50 HA SER 50 24.675 -15.992 14.639 238 HB2 SER 50 2HB SER 50 25.891 -16.893 16.753 239 HB3 SER 50 3HB SER 50 25.036 -15.354 16.861 240 HG SER 50 HG SER 50 24.650 -16.975 18.580 241 H GLU 51 H GLU 51 22.880 -18.770 15.721 242 HA GLU 51 HA GLU 51 24.892 -20.694 15.027 243 HB2 GLU 51 2HB GLU 51 21.938 -21.196 15.388 244 HB3 GLU 51 3HB GLU 51 23.247 -22.360 15.538 245 HG2 GLU 51 2HG GLU 51 24.056 -21.249 17.525 246 HG3 GLU 51 3HG GLU 51 22.826 -19.997 17.355 247 H GLU 52 H GLU 52 21.692 -19.950 13.630 248 HA GLU 52 HA GLU 52 22.027 -21.497 11.313 249 HB2 GLU 52 2HB GLU 52 20.167 -19.380 12.214 250 HB3 GLU 52 3HB GLU 52 20.287 -19.607 10.474 251 HG2 GLU 52 2HG GLU 52 19.723 -21.838 12.408 252 HG3 GLU 52 3HG GLU 52 18.469 -20.900 11.597 253 H PHE 53 H PHE 53 22.385 -17.981 11.770 254 HA PHE 53 HA PHE 53 23.134 -17.260 9.225 255 HB2 PHE 53 2HB PHE 53 22.800 -15.497 10.739 256 HB3 PHE 53 3HB PHE 53 23.909 -16.183 11.922 257 HD1 PHE 53 HD1 PHE 53 26.329 -15.981 11.619 258 HD2 PHE 53 HD2 PHE 53 23.582 -14.136 8.941 259 HE1 PHE 53 HE1 PHE 53 28.138 -14.554 10.752 260 HE2 PHE 53 HE2 PHE 53 25.386 -12.707 8.069 261 HZ PHE 53 HZ PHE 53 27.667 -12.916 8.974 262 H LYS 54 H LYS 54 25.355 -18.120 11.879 263 HA LYS 54 HA LYS 54 27.674 -18.122 10.258 264 HB2 LYS 54 2HB LYS 54 28.820 -18.724 12.156 265 HB3 LYS 54 3HB LYS 54 27.364 -18.053 12.877 266 HG2 LYS 54 2HG LYS 54 27.450 -19.977 14.054 267 HG3 LYS 54 3HG LYS 54 26.575 -20.590 12.649 268 HD2 LYS 54 2HD LYS 54 28.245 -21.969 12.123 269 HD3 LYS 54 3HD LYS 54 29.430 -20.664 12.214 270 HE2 LYS 54 2HE LYS 54 29.545 -20.943 14.642 271 HE3 LYS 54 3HE LYS 54 28.356 -22.241 14.552 272 HZ1 LYS 54 1HZ LYS 54 30.992 -22.305 13.189 273 HZ2 LYS 54 2HZ LYS 54 29.878 -23.573 13.309 274 HZ3 LYS 54 3HZ LYS 54 30.683 -23.022 14.691 275 H GLU 55 H GLU 55 25.189 -20.449 10.814 276 HA GLU 55 HA GLU 55 26.703 -22.747 10.015 277 HB2 GLU 55 2HB GLU 55 23.870 -22.165 10.685 278 HB3 GLU 55 3HB GLU 55 24.169 -23.558 9.655 279 HG2 GLU 55 2HG GLU 55 25.495 -24.613 11.301 280 HG3 GLU 55 3HG GLU 55 25.570 -23.147 12.277 281 H LYS 56 H LYS 56 24.887 -20.282 8.396 282 HA LYS 56 HA LYS 56 24.805 -21.780 5.895 283 HB2 LYS 56 2HB LYS 56 23.458 -19.404 6.987 284 HB3 LYS 56 3HB LYS 56 23.886 -19.277 5.286 285 HG2 LYS 56 2HG LYS 56 21.608 -20.136 5.649 286 HG3 LYS 56 3HG LYS 56 22.637 -21.268 4.771 287 HD2 LYS 56 2HD LYS 56 22.801 -22.715 6.574 288 HD3 LYS 56 3HD LYS 56 22.397 -21.460 7.747 289 HE2 LYS 56 2HE LYS 56 20.144 -21.641 7.368 290 HE3 LYS 56 3HE LYS 56 20.358 -22.213 5.714 291 HZ1 LYS 56 1HZ LYS 56 19.946 -24.224 6.527 292 HZ2 LYS 56 2HZ LYS 56 20.102 -23.713 8.132 293 HZ3 LYS 56 3HZ LYS 56 21.473 -24.170 7.253 294 H PHE 57 H PHE 57 26.513 -19.128 7.402 295 HA PHE 57 HA PHE 57 27.984 -18.611 4.919 296 HB2 PHE 57 2HB PHE 57 27.902 -17.077 7.525 297 HB3 PHE 57 3HB PHE 57 28.867 -16.622 6.125 298 HD1 PHE 57 HD1 PHE 57 27.479 -16.432 3.877 299 HD2 PHE 57 HD2 PHE 57 25.854 -16.086 7.795 300 HE1 PHE 57 HE1 PHE 57 25.570 -15.173 2.970 301 HE2 PHE 57 HE2 PHE 57 23.943 -14.827 6.895 302 HZ PHE 57 HZ PHE 57 23.798 -14.369 4.480 303 H GLY 58 H GLY 58 28.229 -20.365 7.779 304 HA2 GLY 58 2HA GLY 58 29.932 -21.671 8.609 305 HA3 GLY 58 3HA GLY 58 30.864 -21.254 7.178 306 H MET 59 H MET 59 29.798 -18.486 8.748 307 HA MET 59 HA MET 59 32.215 -18.310 10.404 308 HB2 MET 59 2HB MET 59 31.333 -15.956 8.767 309 HB3 MET 59 3HB MET 59 32.901 -16.268 9.499 310 HG2 MET 59 2HG MET 59 32.891 -18.297 7.813 311 HG3 MET 59 3HG MET 59 31.764 -17.257 6.944 312 HE1 MET 59 1HE MET 59 34.764 -18.511 6.456 313 HE2 MET 59 2HE MET 59 36.002 -17.278 6.218 314 HE3 MET 59 3HE MET 59 35.605 -17.827 7.847 315 H THR 60 H THR 60 31.994 -17.175 12.284 316 HA THR 60 HA THR 60 29.382 -16.792 13.305 317 HB THR 60 HB THR 60 31.497 -15.360 14.744 318 HG1 THR 60 HG1 THR 60 32.539 -17.406 15.305 319 HG21 THR 60 1HG2 THR 60 29.803 -15.822 16.173 320 HG22 THR 60 2HG2 THR 60 30.661 -17.351 16.367 321 HG23 THR 60 3HG2 THR 60 29.287 -17.244 15.267 322 H LYS 61 H LYS 61 29.210 -14.534 14.680 323 HA LYS 61 HA LYS 61 28.486 -12.605 12.756 324 HB2 LYS 61 2HB LYS 61 28.196 -11.105 14.773 325 HB3 LYS 61 3HB LYS 61 27.293 -12.614 14.807 326 HG2 LYS 61 2HG LYS 61 28.129 -12.870 16.854 327 HG3 LYS 61 3HG LYS 61 29.639 -13.300 16.046 328 HD2 LYS 61 2HD LYS 61 30.596 -11.570 17.067 329 HD3 LYS 61 3HD LYS 61 29.581 -10.501 16.096 330 HE2 LYS 61 2HE LYS 61 28.490 -11.727 18.594 331 HE3 LYS 61 3HE LYS 61 29.556 -10.326 18.700 332 HZ1 LYS 61 1HZ LYS 61 27.335 -9.540 18.633 333 HZ2 LYS 61 2HZ LYS 61 26.950 -10.500 17.295 334 HZ3 LYS 61 3HZ LYS 61 28.015 -9.196 17.122 335 H GLU 62 H GLU 62 31.140 -12.628 15.134 336 HA GLU 62 HA GLU 62 32.302 -10.223 14.124 337 HB2 GLU 62 2HB GLU 62 32.606 -11.794 16.413 338 HB3 GLU 62 3HB GLU 62 34.152 -11.911 15.585 339 HG2 GLU 62 2HG GLU 62 34.723 -9.839 16.142 340 HG3 GLU 62 3HG GLU 62 33.155 -9.191 15.662 341 H ALA 63 H ALA 63 32.693 -13.627 13.481 342 HA ALA 63 HA ALA 63 35.177 -13.430 12.101 343 HB1 ALA 63 1HB ALA 63 34.179 -15.517 13.124 344 HB2 ALA 63 2HB ALA 63 33.119 -15.589 11.715 345 HB3 ALA 63 3HB ALA 63 34.868 -15.695 11.510 346 H PHE 64 H PHE 64 31.808 -13.748 10.982 347 HA PHE 64 HA PHE 64 32.377 -13.601 8.236 348 HB2 PHE 64 2HB PHE 64 30.216 -14.372 9.243 349 HB3 PHE 64 3HB PHE 64 29.839 -12.690 9.603 350 HD1 PHE 64 HD1 PHE 64 30.138 -15.215 6.990 351 HD2 PHE 64 HD2 PHE 64 29.281 -11.132 7.831 352 HE1 PHE 64 HE1 PHE 64 29.168 -14.959 4.744 353 HE2 PHE 64 HE2 PHE 64 28.308 -10.869 5.587 354 HZ PHE 64 HZ PHE 64 28.249 -12.785 4.040 355 H TYR 65 H TYR 65 31.143 -11.060 10.415 356 HA TYR 65 HA TYR 65 31.187 -8.953 8.616 357 HB2 TYR 65 2HB TYR 65 31.488 -9.078 11.604 358 HB3 TYR 65 3HB TYR 65 31.580 -7.539 10.754 359 HD1 TYR 65 HD1 TYR 65 29.533 -7.791 8.699 360 HD2 TYR 65 HD2 TYR 65 29.473 -9.087 12.750 361 HE1 TYR 65 HE1 TYR 65 27.078 -7.637 8.705 362 HE2 TYR 65 HE2 TYR 65 27.018 -8.938 12.767 363 HH TYR 65 HH TYR 65 25.236 -7.760 11.550 364 H LYS 66 H LYS 66 33.806 -10.533 10.226 365 HA LYS 66 HA LYS 66 35.767 -8.551 10.164 366 HB2 LYS 66 2HB LYS 66 35.659 -11.226 10.866 367 HB3 LYS 66 3HB LYS 66 36.781 -11.210 9.511 368 HG2 LYS 66 2HG LYS 66 38.371 -10.092 10.659 369 HG3 LYS 66 3HG LYS 66 37.198 -9.145 11.578 370 HD2 LYS 66 2HD LYS 66 37.039 -10.696 13.229 371 HD3 LYS 66 3HD LYS 66 37.281 -12.053 12.126 372 HE2 LYS 66 2HE LYS 66 39.634 -10.362 12.337 373 HE3 LYS 66 3HE LYS 66 39.137 -11.015 13.898 374 HZ1 LYS 66 1HZ LYS 66 39.188 -13.231 12.960 375 HZ2 LYS 66 2HZ LYS 66 40.690 -12.481 12.755 376 HZ3 LYS 66 3HZ LYS 66 39.628 -12.618 11.446 377 H LEU 67 H LEU 67 34.526 -10.621 7.631 378 HA LEU 67 HA LEU 67 36.583 -10.183 5.741 379 HB2 LEU 67 2HB LEU 67 33.866 -11.305 5.746 380 HB3 LEU 67 3HB LEU 67 34.392 -10.635 4.203 381 HG LEU 67 HG LEU 67 36.247 -12.159 4.110 382 HD11 LEU 67 1HD1 LEU 67 35.393 -12.942 6.886 383 HD12 LEU 67 2HD1 LEU 67 36.947 -12.287 6.370 384 HD13 LEU 67 3HD1 LEU 67 36.474 -13.918 5.892 385 HD21 LEU 67 1HD2 LEU 67 35.077 -14.081 3.618 386 HD22 LEU 67 2HD2 LEU 67 33.790 -12.875 3.601 387 HD23 LEU 67 3HD2 LEU 67 34.007 -13.916 5.010 388 HA PRO 68 HA PRO 68 35.767 -6.218 4.052 389 HB2 PRO 68 2HB PRO 68 35.992 -6.621 1.376 390 HB3 PRO 68 3HB PRO 68 37.380 -6.642 2.471 391 HG2 PRO 68 2HG PRO 68 35.836 -8.937 1.323 392 HG3 PRO 68 3HG PRO 68 37.590 -8.749 1.509 393 HD2 PRO 68 2HD PRO 68 36.095 -10.218 3.222 394 HD3 PRO 68 3HD PRO 68 37.545 -9.334 3.737 395 H LYS 69 H LYS 69 34.393 -4.976 2.484 396 HA LYS 69 HA LYS 69 31.675 -5.699 2.790 397 HB2 LYS 69 2HB LYS 69 32.618 -3.355 2.597 398 HB3 LYS 69 3HB LYS 69 32.764 -3.642 0.868 399 HG2 LYS 69 2HG LYS 69 30.450 -3.738 0.568 400 HG3 LYS 69 3HG LYS 69 30.148 -3.976 2.290 401 HD2 LYS 69 2HD LYS 69 31.003 -1.682 2.704 402 HD3 LYS 69 3HD LYS 69 31.155 -1.461 0.959 403 HE2 LYS 69 2HE LYS 69 28.999 -0.945 0.789 404 HE3 LYS 69 3HE LYS 69 28.534 -2.440 1.600 405 HZ1 LYS 69 1HZ LYS 69 29.495 -0.769 3.575 406 HZ2 LYS 69 2HZ LYS 69 27.882 -1.195 3.295 407 HZ3 LYS 69 3HZ LYS 69 28.519 0.211 2.600 408 H TRP 70 H TRP 70 33.800 -5.606 -0.060 409 HA TRP 70 HA TRP 70 31.960 -6.416 -1.975 410 HB2 TRP 70 2HB TRP 70 33.797 -6.893 -3.375 411 HB3 TRP 70 3HB TRP 70 34.379 -5.630 -2.293 412 HD1 TRP 70 HD1 TRP 70 36.259 -6.295 -0.521 413 HE1 TRP 70 HE1 TRP 70 37.861 -8.305 -0.375 414 HE3 TRP 70 HE3 TRP 70 33.956 -9.412 -3.856 415 HZ2 TRP 70 HZ2 TRP 70 38.114 -10.873 -1.522 416 HZ3 TRP 70 HZ3 TRP 70 34.942 -11.626 -4.275 417 HH2 TRP 70 HH2 TRP 70 36.978 -12.340 -3.132 418 H LYS 71 H LYS 71 33.976 -8.374 0.178 419 HA LYS 71 HA LYS 71 33.051 -10.865 -0.905 420 HB2 LYS 71 2HB LYS 71 35.285 -10.503 0.212 421 HB3 LYS 71 3HB LYS 71 34.427 -10.406 1.744 422 HG2 LYS 71 2HG LYS 71 33.735 -12.661 1.610 423 HG3 LYS 71 3HG LYS 71 34.228 -12.784 -0.081 424 HD2 LYS 71 2HD LYS 71 36.226 -12.133 2.057 425 HD3 LYS 71 3HD LYS 71 35.750 -13.804 1.746 426 HE2 LYS 71 2HE LYS 71 36.243 -12.840 -0.774 427 HE3 LYS 71 3HE LYS 71 37.461 -12.013 0.195 428 HZ1 LYS 71 1HZ LYS 71 37.879 -14.393 -0.804 429 HZ2 LYS 71 2HZ LYS 71 37.104 -14.885 0.615 430 HZ3 LYS 71 3HZ LYS 71 38.510 -13.947 0.701 431 H GLN 72 H GLN 72 32.188 -8.800 1.797 432 HA GLN 72 HA GLN 72 30.558 -10.613 3.195 433 HB2 GLN 72 2HB GLN 72 30.984 -7.699 3.167 434 HB3 GLN 72 3HB GLN 72 29.393 -8.205 3.720 435 HG2 GLN 72 2HG GLN 72 30.544 -9.738 5.333 436 HG3 GLN 72 3HG GLN 72 32.063 -8.971 4.869 437 HE21 GLN 72 1HE2 GLN 72 28.795 -7.775 5.575 438 HE22 GLN 72 2HE2 GLN 72 29.291 -6.620 6.760 439 H ASN 73 H ASN 73 29.845 -8.345 0.577 440 HA ASN 73 HA ASN 73 27.040 -8.856 0.565 441 HB2 ASN 73 2HB ASN 73 28.900 -7.170 -0.869 442 HB3 ASN 73 3HB ASN 73 27.769 -7.932 -1.983 443 HD21 ASN 73 1HD2 ASN 73 26.470 -6.275 -2.477 444 HD22 ASN 73 2HD2 ASN 73 25.533 -5.382 -1.331 445 H LYS 74 H LYS 74 29.809 -10.349 -0.902 446 HA LYS 74 HA LYS 74 28.404 -11.772 -2.933 447 HB2 LYS 74 2HB LYS 74 31.119 -12.170 -1.677 448 HB3 LYS 74 3HB LYS 74 30.513 -13.169 -2.991 449 HG2 LYS 74 2HG LYS 74 30.508 -10.217 -3.338 450 HG3 LYS 74 3HG LYS 74 32.042 -11.083 -3.445 451 HD2 LYS 74 2HD LYS 74 31.104 -12.533 -5.177 452 HD3 LYS 74 3HD LYS 74 29.564 -11.678 -5.063 453 HE2 LYS 74 2HE LYS 74 30.304 -9.935 -6.275 454 HE3 LYS 74 3HE LYS 74 31.889 -9.946 -5.503 455 HZ1 LYS 74 1HZ LYS 74 31.322 -10.775 -8.043 456 HZ2 LYS 74 2HZ LYS 74 31.498 -12.220 -7.184 457 HZ3 LYS 74 3HZ LYS 74 32.750 -11.082 -7.189 458 H PHE 75 H PHE 75 29.758 -12.760 0.212 459 HA PHE 75 HA PHE 75 28.824 -15.398 0.162 460 HB2 PHE 75 2HB PHE 75 30.164 -13.694 2.010 461 HB3 PHE 75 3HB PHE 75 28.817 -14.451 2.855 462 HD1 PHE 75 HD1 PHE 75 28.685 -17.081 1.597 463 HD2 PHE 75 HD2 PHE 75 32.064 -14.770 2.760 464 HE1 PHE 75 HE1 PHE 75 30.002 -19.144 1.851 465 HE2 PHE 75 HE2 PHE 75 33.388 -16.829 3.015 466 HZ PHE 75 HZ PHE 75 32.358 -19.018 2.559 467 H LYS 76 H LYS 76 27.320 -12.429 1.344 468 HA LYS 76 HA LYS 76 25.138 -13.370 2.690 469 HB2 LYS 76 2HB LYS 76 25.779 -10.947 1.187 470 HB3 LYS 76 3HB LYS 76 24.057 -11.303 1.204 471 HG2 LYS 76 2HG LYS 76 23.854 -10.914 3.427 472 HG3 LYS 76 3HG LYS 76 25.490 -11.472 3.788 473 HD2 LYS 76 2HD LYS 76 25.261 -9.062 4.156 474 HD3 LYS 76 3HD LYS 76 26.408 -9.411 2.860 475 HE2 LYS 76 2HE LYS 76 24.905 -8.732 1.197 476 HE3 LYS 76 3HE LYS 76 23.521 -8.829 2.284 477 HZ1 LYS 76 1HZ LYS 76 24.615 -6.965 3.554 478 HZ2 LYS 76 2HZ LYS 76 23.992 -6.559 2.036 479 HZ3 LYS 76 3HZ LYS 76 25.658 -6.780 2.234 480 H MET 77 H MET 77 25.099 -12.586 -0.795 481 HA MET 77 HA MET 77 22.614 -13.865 -1.257 482 HB2 MET 77 2HB MET 77 23.177 -13.599 -3.656 483 HB3 MET 77 3HB MET 77 23.382 -12.113 -2.738 484 HG2 MET 77 2HG MET 77 25.821 -12.642 -2.593 485 HG3 MET 77 3HG MET 77 25.532 -13.972 -3.712 486 HE1 MET 77 1HE MET 77 25.451 -13.195 -6.755 487 HE2 MET 77 2HE MET 77 26.977 -12.364 -6.451 488 HE3 MET 77 3HE MET 77 26.544 -13.788 -5.504 489 H ALA 78 H ALA 78 25.900 -14.977 -1.202 490 HA ALA 78 HA ALA 78 25.776 -17.258 -2.770 491 HB1 ALA 78 1HB ALA 78 27.700 -18.005 -1.658 492 HB2 ALA 78 2HB ALA 78 27.783 -16.246 -1.562 493 HB3 ALA 78 3HB ALA 78 27.261 -17.182 -0.161 494 H VAL 79 H VAL 79 24.785 -16.804 0.598 495 HA VAL 79 HA VAL 79 23.822 -19.564 0.710 496 HB VAL 79 HB VAL 79 23.792 -19.416 3.012 497 HG11 VAL 79 1HG1 VAL 79 26.084 -19.129 2.141 498 HG12 VAL 79 2HG1 VAL 79 25.894 -17.380 2.279 499 HG13 VAL 79 3HG1 VAL 79 25.861 -18.388 3.726 500 HG21 VAL 79 1HG2 VAL 79 22.314 -17.606 3.358 501 HG22 VAL 79 2HG2 VAL 79 23.797 -17.184 4.214 502 HG23 VAL 79 3HG2 VAL 79 23.442 -16.450 2.650 503 H GLN 80 H GLN 80 22.602 -17.075 -0.695 504 HA GLN 80 HA GLN 80 20.493 -16.445 -1.280 505 HB2 GLN 80 2HB GLN 80 19.386 -18.502 0.616 506 HB3 GLN 80 3HB GLN 80 18.662 -17.872 -0.858 507 HG2 GLN 80 2HG GLN 80 20.976 -18.979 -1.790 508 HG3 GLN 80 3HG GLN 80 20.542 -20.071 -0.475 509 HE21 GLN 80 1HE2 GLN 80 20.540 -20.418 -3.414 510 HE22 GLN 80 2HE2 GLN 80 18.942 -20.940 -3.810 511 H LEU 81 H LEU 81 21.914 -15.301 0.987 512 HA LEU 81 HA LEU 81 19.600 -14.239 2.467 513 HB2 LEU 81 2HB LEU 81 22.301 -15.059 3.459 514 HB3 LEU 81 3HB LEU 81 21.376 -13.823 4.308 515 HG LEU 81 HG LEU 81 20.624 -16.713 3.897 516 HD11 LEU 81 1HD1 LEU 81 20.831 -15.284 6.511 517 HD12 LEU 81 2HD1 LEU 81 22.285 -15.892 5.719 518 HD13 LEU 81 3HD1 LEU 81 20.987 -17.004 6.156 519 HD21 LEU 81 1HD2 LEU 81 18.589 -15.561 3.667 520 HD22 LEU 81 2HD2 LEU 81 19.016 -14.386 4.912 521 HD23 LEU 81 3HD2 LEU 81 18.651 -16.053 5.361 522 H PHE 82 H PHE 82 19.343 -12.394 1.275 523 HA PHE 82 HA PHE 82 21.372 -10.346 1.665 524 HB2 PHE 82 2HB PHE 82 21.856 -11.447 -0.545 525 HB3 PHE 82 3HB PHE 82 20.275 -10.901 -1.095 526 HD1 PHE 82 HD1 PHE 82 19.906 -8.656 -1.758 527 HD2 PHE 82 HD2 PHE 82 23.618 -9.798 -0.015 528 HE1 PHE 82 HE1 PHE 82 20.884 -6.501 -2.435 529 HE2 PHE 82 HE2 PHE 82 24.600 -7.646 -0.688 530 HZ PHE 82 HZ PHE 82 23.233 -5.993 -1.899 Start of MODEL 10 1 H1 LEU 20 H LEU 20 16.632 -7.551 19.933 2 HA LEU 20 HA LEU 20 13.786 -8.172 20.303 3 HB2 LEU 20 2HB LEU 20 15.336 -6.719 18.284 4 HB3 LEU 20 3HB LEU 20 14.115 -7.803 17.620 5 HG LEU 20 HG LEU 20 12.365 -6.636 18.787 6 HD11 LEU 20 1HD1 LEU 20 12.825 -5.679 20.737 7 HD12 LEU 20 2HD1 LEU 20 13.560 -4.352 19.840 8 HD13 LEU 20 3HD1 LEU 20 14.557 -5.692 20.406 9 HD21 LEU 20 1HD2 LEU 20 12.263 -4.987 17.278 10 HD22 LEU 20 2HD2 LEU 20 13.808 -5.614 16.700 11 HD23 LEU 20 3HD2 LEU 20 13.772 -4.259 17.831 12 HA PRO 21 HA PRO 21 14.178 -12.296 18.858 13 HB2 PRO 21 2HB PRO 21 11.967 -12.586 17.311 14 HB3 PRO 21 3HB PRO 21 11.899 -12.488 19.075 15 HG2 PRO 21 2HG PRO 21 11.393 -10.353 17.039 16 HG3 PRO 21 3HG PRO 21 10.488 -10.726 18.517 17 HD2 PRO 21 2HD PRO 21 12.276 -8.698 18.378 18 HD3 PRO 21 3HD PRO 21 11.991 -9.618 19.868 19 H ALA 22 H ALA 22 14.808 -13.582 17.112 20 HA ALA 22 HA ALA 22 15.585 -12.076 14.714 21 HB1 ALA 22 1HB ALA 22 17.554 -13.029 15.133 22 HB2 ALA 22 2HB ALA 22 16.849 -14.155 16.293 23 HB3 ALA 22 3HB ALA 22 16.833 -14.537 14.571 24 H HIS 23 H HIS 23 15.730 -13.571 12.698 25 HA HIS 23 HA HIS 23 13.208 -15.084 12.507 26 HB2 HIS 23 2HB HIS 23 14.517 -13.736 10.160 27 HB3 HIS 23 3HB HIS 23 12.845 -14.260 10.337 28 HD1 HIS 23 HD1 HIS 23 11.850 -12.866 12.741 29 HD2 HIS 23 HD2 HIS 23 14.495 -11.042 10.106 30 HE1 HIS 23 HE1 HIS 23 11.560 -10.395 13.101 31 HA PRO 24 HA PRO 24 15.671 -18.574 11.414 32 HB2 PRO 24 2HB PRO 24 13.724 -20.086 10.278 33 HB3 PRO 24 3HB PRO 24 13.857 -19.845 12.024 34 HG2 PRO 24 2HG PRO 24 12.069 -18.473 10.054 35 HG3 PRO 24 3HG PRO 24 11.687 -19.085 11.674 36 HD2 PRO 24 2HD PRO 24 12.165 -16.465 11.180 37 HD3 PRO 24 3HD PRO 24 12.592 -17.239 12.719 38 H TYR 25 H TYR 25 16.489 -19.698 9.578 39 HA TYR 25 HA TYR 25 16.781 -18.088 7.267 40 HB2 TYR 25 2HB TYR 25 18.551 -19.596 7.986 41 HB3 TYR 25 3HB TYR 25 17.503 -20.988 7.737 42 HD1 TYR 25 HD1 TYR 25 16.883 -21.675 5.441 43 HD2 TYR 25 HD2 TYR 25 19.696 -18.564 6.159 44 HE1 TYR 25 HE1 TYR 25 17.674 -21.862 3.119 45 HE2 TYR 25 HE2 TYR 25 20.493 -18.740 3.839 46 HH TYR 25 HH TYR 25 20.345 -20.987 2.010 47 H ASP 26 H ASP 26 14.713 -20.793 8.076 48 HA ASP 26 HA ASP 26 13.859 -21.495 5.500 49 HB2 ASP 26 2HB ASP 26 13.350 -22.415 8.023 50 HB3 ASP 26 3HB ASP 26 11.811 -21.666 7.607 51 H ARG 27 H ARG 27 13.027 -18.824 7.550 52 HA ARG 27 HA ARG 27 10.756 -18.097 5.856 53 HB2 ARG 27 2HB ARG 27 10.813 -17.992 8.462 54 HB3 ARG 27 3HB ARG 27 11.695 -16.492 8.210 55 HG2 ARG 27 2HG ARG 27 9.442 -15.884 8.486 56 HG3 ARG 27 3HG ARG 27 9.770 -15.749 6.757 57 HD2 ARG 27 2HD ARG 27 8.527 -17.629 6.241 58 HD3 ARG 27 3HD ARG 27 8.678 -18.299 7.866 59 HE ARG 27 HE ARG 27 6.690 -16.435 6.929 60 HH11 ARG 27 1HH1 ARG 27 8.346 -17.731 9.704 61 HH12 ARG 27 2HH1 ARG 27 7.086 -17.310 10.816 62 HH21 ARG 27 1HH2 ARG 27 5.024 -15.876 8.383 63 HH22 ARG 27 2HH2 ARG 27 5.196 -16.257 10.064 64 H LEU 28 H LEU 28 14.057 -17.287 6.436 65 HA LEU 28 HA LEU 28 13.861 -14.720 5.086 66 HB2 LEU 28 2HB LEU 28 15.601 -15.846 6.976 67 HB3 LEU 28 3HB LEU 28 16.556 -15.625 5.512 68 HG LEU 28 HG LEU 28 15.608 -13.208 5.560 69 HD11 LEU 28 1HD1 LEU 28 14.787 -14.295 8.180 70 HD12 LEU 28 2HD1 LEU 28 14.070 -13.013 7.204 71 HD13 LEU 28 3HD1 LEU 28 15.502 -12.683 8.180 72 HD21 LEU 28 1HD2 LEU 28 17.901 -14.470 6.708 73 HD22 LEU 28 2HD2 LEU 28 17.422 -13.104 7.715 74 HD23 LEU 28 3HD2 LEU 28 17.754 -12.861 5.999 75 H LYS 29 H LYS 29 14.409 -14.333 3.019 76 HA LYS 29 HA LYS 29 15.688 -16.497 1.490 77 HB2 LYS 29 2HB LYS 29 13.068 -15.983 1.219 78 HB3 LYS 29 3HB LYS 29 13.702 -14.790 0.093 79 HG2 LYS 29 2HG LYS 29 13.930 -16.357 -1.448 80 HG3 LYS 29 3HG LYS 29 15.032 -17.247 -0.395 81 HD2 LYS 29 2HD LYS 29 13.014 -18.237 0.720 82 HD3 LYS 29 3HD LYS 29 12.031 -17.489 -0.541 83 HE2 LYS 29 2HE LYS 29 13.778 -18.722 -2.108 84 HE3 LYS 29 3HE LYS 29 13.925 -19.775 -0.701 85 HZ1 LYS 29 1HZ LYS 29 11.482 -20.041 -0.766 86 HZ2 LYS 29 2HZ LYS 29 12.254 -20.645 -2.144 87 HZ3 LYS 29 3HZ LYS 29 11.444 -19.162 -2.212 88 H THR 30 H THR 30 16.825 -15.804 -0.421 89 HA THR 30 HA THR 30 18.537 -13.676 -0.054 90 HB THR 30 HB THR 30 17.958 -14.238 -2.884 91 HG1 THR 30 HG1 THR 30 17.991 -16.348 -2.749 92 HG21 THR 30 1HG2 THR 30 20.404 -14.432 -1.127 93 HG22 THR 30 2HG2 THR 30 19.999 -13.131 -2.248 94 HG23 THR 30 3HG2 THR 30 20.400 -14.735 -2.863 95 H THR 31 H THR 31 15.486 -13.755 -1.840 96 HA THR 31 HA THR 31 15.537 -10.811 -1.893 97 HB THR 31 HB THR 31 14.422 -10.803 -4.053 98 HG1 THR 31 HG1 THR 31 13.600 -12.577 -4.883 99 HG21 THR 31 1HG2 THR 31 16.868 -10.779 -4.047 100 HG22 THR 31 2HG2 THR 31 16.251 -11.640 -5.457 101 HG23 THR 31 3HG2 THR 31 16.892 -12.541 -4.083 102 H SER 32 H SER 32 14.368 -12.235 0.165 103 HA SER 32 HA SER 32 11.533 -12.502 -0.377 104 HB2 SER 32 2HB SER 32 13.358 -13.426 1.647 105 HB3 SER 32 3HB SER 32 11.995 -12.605 2.409 106 HG SER 32 HG SER 32 10.724 -14.178 1.817 107 H THR 33 H THR 33 9.898 -11.267 0.609 108 HA THR 33 HA THR 33 10.775 -8.583 1.450 109 HB THR 33 HB THR 33 8.099 -8.342 0.789 110 HG1 THR 33 HG1 THR 33 7.660 -9.771 -0.699 111 HG21 THR 33 1HG2 THR 33 10.491 -7.845 -0.988 112 HG22 THR 33 2HG2 THR 33 9.912 -6.758 0.274 113 HG23 THR 33 3HG2 THR 33 8.906 -7.086 -1.137 114 H ASP 34 H ASP 34 9.919 -11.291 2.852 115 HA ASP 34 HA ASP 34 7.653 -10.906 4.375 116 HB2 ASP 34 2HB ASP 34 10.165 -12.440 4.708 117 HB3 ASP 34 3HB ASP 34 9.228 -12.163 6.174 118 HA PRO 35 HA PRO 35 8.391 -7.677 7.249 119 HB2 PRO 35 2HB PRO 35 7.297 -8.653 9.534 120 HB3 PRO 35 3HB PRO 35 6.327 -8.131 8.151 121 HG2 PRO 35 2HG PRO 35 7.142 -10.897 8.957 122 HG3 PRO 35 3HG PRO 35 5.570 -10.318 8.375 123 HD2 PRO 35 2HD PRO 35 7.333 -11.609 6.774 124 HD3 PRO 35 3HD PRO 35 6.235 -10.352 6.167 125 H VAL 36 H VAL 36 9.619 -7.002 9.072 126 HA VAL 36 HA VAL 36 11.383 -9.016 10.272 127 HB VAL 36 HB VAL 36 13.250 -7.241 10.061 128 HG11 VAL 36 1HG1 VAL 36 12.350 -8.734 7.601 129 HG12 VAL 36 2HG1 VAL 36 13.989 -8.189 7.958 130 HG13 VAL 36 3HG1 VAL 36 13.238 -9.438 8.950 131 HG21 VAL 36 1HG2 VAL 36 11.742 -5.467 9.207 132 HG22 VAL 36 2HG2 VAL 36 13.120 -5.776 8.152 133 HG23 VAL 36 3HG2 VAL 36 11.528 -6.407 7.730 134 H SER 37 H SER 37 12.760 -7.910 12.051 135 HA SER 37 HA SER 37 10.891 -6.527 13.787 136 HB2 SER 37 2HB SER 37 12.832 -8.437 14.236 137 HB3 SER 37 3HB SER 37 13.589 -6.963 14.838 138 HG SER 37 HG SER 37 11.067 -8.020 15.601 139 H ASP 38 H ASP 38 12.574 -5.369 11.419 140 HA ASP 38 HA ASP 38 13.360 -3.299 10.883 141 HB2 ASP 38 2HB ASP 38 11.531 -2.676 12.647 142 HB3 ASP 38 3HB ASP 38 12.913 -2.326 13.683 143 H ILE 39 H ILE 39 15.422 -4.444 10.785 144 HA ILE 39 HA ILE 39 17.315 -3.353 12.752 145 HB ILE 39 HB ILE 39 18.425 -5.772 11.855 146 HG12 ILE 39 2HG1 ILE 39 15.568 -6.114 12.792 147 HG13 ILE 39 3HG1 ILE 39 16.200 -6.533 11.204 148 HG21 ILE 39 1HG2 ILE 39 18.604 -4.514 14.065 149 HG22 ILE 39 2HG2 ILE 39 17.128 -5.359 14.532 150 HG23 ILE 39 3HG2 ILE 39 18.583 -6.277 14.142 151 HD11 ILE 39 1HD1 ILE 39 16.519 -7.924 13.804 152 HD12 ILE 39 2HD1 ILE 39 16.201 -8.579 12.196 153 HD13 ILE 39 3HD1 ILE 39 17.824 -8.037 12.624 154 H ASP 40 H ASP 40 19.659 -4.233 11.718 155 HA ASP 40 HA ASP 40 20.313 -2.450 9.757 156 HB2 ASP 40 2HB ASP 40 21.519 -5.144 10.385 157 HB3 ASP 40 3HB ASP 40 22.234 -4.035 9.218 158 H VAL 41 H VAL 41 18.991 -2.249 8.013 159 HA VAL 41 HA VAL 41 17.858 -4.345 6.539 160 HB VAL 41 HB VAL 41 18.524 -1.541 5.632 161 HG11 VAL 41 1HG1 VAL 41 18.181 -2.726 3.651 162 HG12 VAL 41 2HG1 VAL 41 16.928 -3.742 4.366 163 HG13 VAL 41 3HG1 VAL 41 16.595 -2.046 4.013 164 HG21 VAL 41 1HG2 VAL 41 17.038 -1.611 7.569 165 HG22 VAL 41 2HG2 VAL 41 16.180 -1.062 6.130 166 HG23 VAL 41 3HG2 VAL 41 15.962 -2.713 6.710 167 H THR 42 H THR 42 20.872 -2.546 6.078 168 HA THR 42 HA THR 42 21.590 -3.740 3.621 169 HB THR 42 HB THR 42 23.989 -3.070 4.470 170 HG1 THR 42 HG1 THR 42 24.033 -1.941 6.280 171 HG21 THR 42 1HG2 THR 42 22.615 -0.564 4.230 172 HG22 THR 42 2HG2 THR 42 21.907 -1.736 3.118 173 HG23 THR 42 3HG2 THR 42 23.635 -1.389 3.052 174 H ARG 43 H ARG 43 21.589 -4.932 6.814 175 HA ARG 43 HA ARG 43 23.275 -7.204 5.987 176 HB2 ARG 43 2HB ARG 43 22.990 -5.981 8.737 177 HB3 ARG 43 3HB ARG 43 23.848 -7.477 8.397 178 HG2 ARG 43 2HG ARG 43 25.670 -6.399 7.709 179 HG3 ARG 43 3HG ARG 43 24.735 -5.268 6.728 180 HD2 ARG 43 2HD ARG 43 24.713 -3.698 8.340 181 HD3 ARG 43 3HD ARG 43 24.483 -4.882 9.627 182 HE ARG 43 HE ARG 43 27.124 -4.924 8.505 183 HH11 ARG 43 1HH1 ARG 43 25.041 -3.383 10.831 184 HH12 ARG 43 2HH1 ARG 43 26.345 -2.862 11.847 185 HH21 ARG 43 1HH2 ARG 43 28.847 -4.243 9.833 186 HH22 ARG 43 2HH2 ARG 43 28.510 -3.350 11.277 187 H ARG 44 H ARG 44 20.632 -7.273 5.371 188 HA ARG 44 HA ARG 44 18.814 -8.207 7.218 189 HB2 ARG 44 2HB ARG 44 18.218 -7.704 4.902 190 HB3 ARG 44 3HB ARG 44 19.150 -9.088 4.346 191 HG2 ARG 44 2HG ARG 44 17.267 -10.253 4.444 192 HG3 ARG 44 3HG ARG 44 17.398 -10.159 6.201 193 HD2 ARG 44 2HD ARG 44 15.375 -9.193 6.072 194 HD3 ARG 44 3HD ARG 44 16.291 -7.752 5.635 195 HE ARG 44 HE ARG 44 15.576 -9.427 3.402 196 HH11 ARG 44 1HH1 ARG 44 14.608 -6.789 5.459 197 HH12 ARG 44 2HH1 ARG 44 13.515 -6.114 4.298 198 HH21 ARG 44 1HH2 ARG 44 14.139 -8.547 1.864 199 HH22 ARG 44 2HH2 ARG 44 13.247 -7.115 2.254 200 H GLU 45 H GLU 45 21.371 -9.976 5.557 201 HA GLU 45 HA GLU 45 20.661 -12.575 6.252 202 HB2 GLU 45 2HB GLU 45 22.912 -13.194 5.770 203 HB3 GLU 45 3HB GLU 45 22.495 -11.884 4.675 204 HG2 GLU 45 2HG GLU 45 24.013 -11.501 7.241 205 HG3 GLU 45 3HG GLU 45 24.774 -11.739 5.670 206 H ALA 46 H ALA 46 22.170 -10.058 8.139 207 HA ALA 46 HA ALA 46 23.118 -11.700 10.251 208 HB1 ALA 46 1HB ALA 46 23.497 -9.679 11.454 209 HB2 ALA 46 2HB ALA 46 23.877 -9.363 9.761 210 HB3 ALA 46 3HB ALA 46 22.354 -8.793 10.444 211 H TYR 47 H TYR 47 20.000 -10.767 9.324 212 HA TYR 47 HA TYR 47 18.707 -10.512 11.805 213 HB2 TYR 47 2HB TYR 47 17.653 -11.476 9.141 214 HB3 TYR 47 3HB TYR 47 16.640 -11.107 10.531 215 HD1 TYR 47 HD1 TYR 47 15.878 -9.699 8.259 216 HD2 TYR 47 HD2 TYR 47 19.136 -8.814 10.849 217 HE1 TYR 47 HE1 TYR 47 15.784 -7.343 7.561 218 HE2 TYR 47 HE2 TYR 47 19.051 -6.455 10.158 219 HH TYR 47 HH TYR 47 16.489 -5.239 8.082 220 H LEU 48 H LEU 48 20.156 -13.197 10.359 221 HA LEU 48 HA LEU 48 18.448 -15.181 11.599 222 HB2 LEU 48 2HB LEU 48 20.494 -15.134 9.574 223 HB3 LEU 48 3HB LEU 48 20.826 -16.395 10.760 224 HG LEU 48 HG LEU 48 18.228 -16.121 9.252 225 HD11 LEU 48 1HD1 LEU 48 19.954 -18.395 8.647 226 HD12 LEU 48 2HD1 LEU 48 20.628 -16.842 8.157 227 HD13 LEU 48 3HD1 LEU 48 19.043 -17.339 7.567 228 HD21 LEU 48 1HD2 LEU 48 17.487 -17.557 10.776 229 HD22 LEU 48 2HD2 LEU 48 19.089 -17.711 11.498 230 HD23 LEU 48 3HD2 LEU 48 18.633 -18.734 10.134 231 H SER 49 H SER 49 19.248 -16.757 13.124 232 HA SER 49 HA SER 49 20.548 -15.585 15.332 233 HB2 SER 49 2HB SER 49 19.856 -18.448 14.671 234 HB3 SER 49 3HB SER 49 20.613 -17.983 16.194 235 HG SER 49 HG SER 49 18.310 -18.074 16.314 236 H SER 50 H SER 50 22.566 -16.086 16.290 237 HA SER 50 HA SER 50 24.765 -15.989 14.622 238 HB2 SER 50 2HB SER 50 26.072 -16.744 16.668 239 HB3 SER 50 3HB SER 50 25.037 -15.334 16.898 240 HG SER 50 HG SER 50 25.021 -17.383 18.396 241 H GLU 51 H GLU 51 22.985 -18.754 15.760 242 HA GLU 51 HA GLU 51 24.979 -20.689 15.056 243 HB2 GLU 51 2HB GLU 51 22.027 -21.177 15.449 244 HB3 GLU 51 3HB GLU 51 23.334 -22.344 15.598 245 HG2 GLU 51 2HG GLU 51 24.143 -21.288 17.583 246 HG3 GLU 51 3HG GLU 51 23.009 -19.952 17.389 247 H GLU 52 H GLU 52 21.775 -19.925 13.682 248 HA GLU 52 HA GLU 52 22.076 -21.498 11.376 249 HB2 GLU 52 2HB GLU 52 20.305 -19.178 12.082 250 HB3 GLU 52 3HB GLU 52 20.281 -19.859 10.461 251 HG2 GLU 52 2HG GLU 52 19.884 -22.108 11.621 252 HG3 GLU 52 3HG GLU 52 19.498 -21.146 13.047 253 H PHE 53 H PHE 53 22.459 -17.980 11.798 254 HA PHE 53 HA PHE 53 23.195 -17.292 9.239 255 HB2 PHE 53 2HB PHE 53 22.868 -15.519 10.751 256 HB3 PHE 53 3HB PHE 53 24.011 -16.186 11.915 257 HD1 PHE 53 HD1 PHE 53 26.429 -16.003 11.519 258 HD2 PHE 53 HD2 PHE 53 23.591 -14.143 8.951 259 HE1 PHE 53 HE1 PHE 53 28.207 -14.575 10.593 260 HE2 PHE 53 HE2 PHE 53 25.363 -12.713 8.021 261 HZ PHE 53 HZ PHE 53 27.675 -12.929 8.841 262 H LYS 54 H LYS 54 25.431 -18.121 11.891 263 HA LYS 54 HA LYS 54 27.739 -18.153 10.256 264 HB2 LYS 54 2HB LYS 54 28.894 -18.734 12.155 265 HB3 LYS 54 3HB LYS 54 27.443 -18.051 12.877 266 HG2 LYS 54 2HG LYS 54 27.536 -19.961 14.076 267 HG3 LYS 54 3HG LYS 54 26.646 -20.586 12.686 268 HD2 LYS 54 2HD LYS 54 29.181 -20.925 11.827 269 HD3 LYS 54 3HD LYS 54 29.412 -21.114 13.567 270 HE2 LYS 54 2HE LYS 54 27.088 -22.544 12.505 271 HE3 LYS 54 3HE LYS 54 28.629 -23.092 11.846 272 HZ1 LYS 54 1HZ LYS 54 28.749 -24.314 13.689 273 HZ2 LYS 54 2HZ LYS 54 27.541 -23.435 14.483 274 HZ3 LYS 54 3HZ LYS 54 29.138 -22.878 14.493 275 H GLU 55 H GLU 55 25.250 -20.466 10.857 276 HA GLU 55 HA GLU 55 26.756 -22.775 10.069 277 HB2 GLU 55 2HB GLU 55 24.890 -23.124 11.522 278 HB3 GLU 55 3HB GLU 55 23.802 -22.279 10.429 279 HG2 GLU 55 2HG GLU 55 23.482 -24.083 9.141 280 HG3 GLU 55 3HG GLU 55 25.163 -24.598 9.261 281 H LYS 56 H LYS 56 24.935 -20.322 8.447 282 HA LYS 56 HA LYS 56 24.819 -21.851 5.964 283 HB2 LYS 56 2HB LYS 56 23.464 -19.476 7.049 284 HB3 LYS 56 3HB LYS 56 23.863 -19.367 5.340 285 HG2 LYS 56 2HG LYS 56 21.605 -20.240 5.727 286 HG3 LYS 56 3HG LYS 56 22.637 -21.395 4.882 287 HD2 LYS 56 2HD LYS 56 22.804 -22.788 6.723 288 HD3 LYS 56 3HD LYS 56 22.417 -21.497 7.862 289 HE2 LYS 56 2HE LYS 56 20.228 -21.923 7.742 290 HE3 LYS 56 3HE LYS 56 20.261 -21.992 5.982 291 HZ1 LYS 56 1HZ LYS 56 19.594 -24.095 7.128 292 HZ2 LYS 56 2HZ LYS 56 21.180 -24.223 7.703 293 HZ3 LYS 56 3HZ LYS 56 20.878 -24.257 6.039 294 H PHE 57 H PHE 57 26.528 -19.180 7.427 295 HA PHE 57 HA PHE 57 27.951 -18.656 4.919 296 HB2 PHE 57 2HB PHE 57 27.889 -17.126 7.528 297 HB3 PHE 57 3HB PHE 57 28.860 -16.670 6.132 298 HD1 PHE 57 HD1 PHE 57 27.479 -16.476 3.879 299 HD2 PHE 57 HD2 PHE 57 25.844 -16.128 7.793 300 HE1 PHE 57 HE1 PHE 57 25.575 -15.210 2.968 301 HE2 PHE 57 HE2 PHE 57 23.938 -14.862 6.889 302 HZ PHE 57 HZ PHE 57 23.802 -14.402 4.473 303 H GLY 58 H GLY 58 28.283 -20.285 7.888 304 HA2 GLY 58 2HA GLY 58 30.012 -21.721 8.502 305 HA3 GLY 58 3HA GLY 58 30.991 -21.057 7.202 306 H MET 59 H MET 59 29.959 -18.372 8.598 307 HA MET 59 HA MET 59 31.951 -18.377 10.757 308 HB2 MET 59 2HB MET 59 31.700 -15.964 9.012 309 HB3 MET 59 3HB MET 59 33.063 -16.501 9.984 310 HG2 MET 59 2HG MET 59 33.177 -18.461 8.302 311 HG3 MET 59 3HG MET 59 32.194 -17.418 7.278 312 HE1 MET 59 1HE MET 59 35.196 -18.731 8.112 313 HE2 MET 59 2HE MET 59 36.343 -17.850 7.103 314 HE3 MET 59 3HE MET 59 36.202 -17.465 8.820 315 H THR 60 H THR 60 31.444 -17.156 12.528 316 HA THR 60 HA THR 60 28.723 -16.505 12.951 317 HB THR 60 HB THR 60 30.366 -17.191 14.739 318 HG1 THR 60 HG1 THR 60 29.179 -16.125 16.227 319 HG21 THR 60 1HG2 THR 60 31.787 -15.539 15.740 320 HG22 THR 60 2HG2 THR 60 31.165 -14.282 14.670 321 HG23 THR 60 3HG2 THR 60 32.151 -15.590 14.015 322 H LYS 61 H LYS 61 28.521 -14.182 14.252 323 HA LYS 61 HA LYS 61 28.289 -12.268 12.230 324 HB2 LYS 61 2HB LYS 61 27.805 -12.417 15.082 325 HB3 LYS 61 3HB LYS 61 28.443 -10.842 14.633 326 HG2 LYS 61 2HG LYS 61 26.648 -10.830 12.815 327 HG3 LYS 61 3HG LYS 61 25.927 -12.176 13.702 328 HD2 LYS 61 2HD LYS 61 26.670 -9.709 15.200 329 HD3 LYS 61 3HD LYS 61 25.224 -9.681 14.188 330 HE2 LYS 61 2HE LYS 61 24.238 -11.467 15.402 331 HE3 LYS 61 3HE LYS 61 25.746 -11.815 16.245 332 HZ1 LYS 61 1HZ LYS 61 23.763 -10.330 17.255 333 HZ2 LYS 61 2HZ LYS 61 24.748 -9.124 16.594 334 HZ3 LYS 61 3HZ LYS 61 25.381 -10.201 17.734 335 H GLU 62 H GLU 62 30.623 -12.368 14.928 336 HA GLU 62 HA GLU 62 32.145 -10.165 14.104 337 HB2 GLU 62 2HB GLU 62 32.411 -12.340 16.041 338 HB3 GLU 62 3HB GLU 62 33.955 -11.798 15.398 339 HG2 GLU 62 2HG GLU 62 33.600 -9.587 16.157 340 HG3 GLU 62 3HG GLU 62 31.909 -9.917 16.535 341 H ALA 63 H ALA 63 32.793 -13.640 13.642 342 HA ALA 63 HA ALA 63 35.105 -13.419 12.129 343 HB1 ALA 63 1HB ALA 63 34.225 -15.530 13.053 344 HB2 ALA 63 2HB ALA 63 32.966 -15.521 11.817 345 HB3 ALA 63 3HB ALA 63 34.660 -15.662 11.349 346 H PHE 64 H PHE 64 31.761 -13.741 10.933 347 HA PHE 64 HA PHE 64 32.362 -13.494 8.212 348 HB2 PHE 64 2HB PHE 64 30.172 -14.252 9.244 349 HB3 PHE 64 3HB PHE 64 29.804 -12.550 9.508 350 HD1 PHE 64 HD1 PHE 64 30.101 -15.220 7.054 351 HD2 PHE 64 HD2 PHE 64 29.369 -11.065 7.624 352 HE1 PHE 64 HE1 PHE 64 29.200 -15.069 4.769 353 HE2 PHE 64 HE2 PHE 64 28.467 -10.908 5.341 354 HZ PHE 64 HZ PHE 64 28.381 -12.911 3.910 355 H TYR 65 H TYR 65 31.124 -11.004 10.445 356 HA TYR 65 HA TYR 65 31.159 -8.843 8.735 357 HB2 TYR 65 2HB TYR 65 31.539 -9.092 11.700 358 HB3 TYR 65 3HB TYR 65 31.691 -7.521 10.922 359 HD1 TYR 65 HD1 TYR 65 29.603 -7.524 8.920 360 HD2 TYR 65 HD2 TYR 65 29.540 -9.110 12.867 361 HE1 TYR 65 HE1 TYR 65 27.159 -7.253 8.983 362 HE2 TYR 65 HE2 TYR 65 27.096 -8.844 12.941 363 HH TYR 65 HH TYR 65 25.397 -7.013 11.354 364 H LYS 66 H LYS 66 33.823 -10.459 10.270 365 HA LYS 66 HA LYS 66 35.791 -8.489 10.131 366 HB2 LYS 66 2HB LYS 66 35.742 -11.042 11.004 367 HB3 LYS 66 3HB LYS 66 36.612 -11.265 9.492 368 HG2 LYS 66 2HG LYS 66 38.384 -9.910 10.173 369 HG3 LYS 66 3HG LYS 66 37.440 -9.171 11.468 370 HD2 LYS 66 2HD LYS 66 37.327 -11.621 12.379 371 HD3 LYS 66 3HD LYS 66 38.751 -11.854 11.363 372 HE2 LYS 66 2HE LYS 66 39.061 -9.426 12.820 373 HE3 LYS 66 3HE LYS 66 38.592 -10.698 13.947 374 HZ1 LYS 66 1HZ LYS 66 40.440 -11.954 12.487 375 HZ2 LYS 66 2HZ LYS 66 40.778 -11.137 13.929 376 HZ3 LYS 66 3HZ LYS 66 41.046 -10.375 12.444 377 H LEU 67 H LEU 67 34.409 -10.505 7.647 378 HA LEU 67 HA LEU 67 36.432 -10.119 5.693 379 HB2 LEU 67 2HB LEU 67 33.597 -11.049 5.655 380 HB3 LEU 67 3HB LEU 67 34.403 -10.672 4.133 381 HG LEU 67 HG LEU 67 35.390 -12.700 6.138 382 HD11 LEU 67 1HD1 LEU 67 34.602 -13.926 3.738 383 HD12 LEU 67 2HD1 LEU 67 33.276 -12.864 4.213 384 HD13 LEU 67 3HD1 LEU 67 33.866 -14.093 5.332 385 HD21 LEU 67 1HD2 LEU 67 37.148 -11.723 4.754 386 HD22 LEU 67 2HD2 LEU 67 36.227 -12.110 3.299 387 HD23 LEU 67 3HD2 LEU 67 36.855 -13.407 4.318 388 HA PRO 68 HA PRO 68 35.594 -6.139 4.050 389 HB2 PRO 68 2HB PRO 68 35.846 -6.531 1.375 390 HB3 PRO 68 3HB PRO 68 37.225 -6.540 2.481 391 HG2 PRO 68 2HG PRO 68 35.718 -8.849 1.314 392 HG3 PRO 68 3HG PRO 68 37.467 -8.641 1.513 393 HD2 PRO 68 2HD PRO 68 35.974 -10.132 3.210 394 HD3 PRO 68 3HD PRO 68 37.410 -9.234 3.740 395 H LYS 69 H LYS 69 34.226 -4.916 2.451 396 HA LYS 69 HA LYS 69 31.512 -5.647 2.747 397 HB2 LYS 69 2HB LYS 69 32.391 -3.304 2.545 398 HB3 LYS 69 3HB LYS 69 32.651 -3.605 0.832 399 HG2 LYS 69 2HG LYS 69 30.592 -2.412 1.122 400 HG3 LYS 69 3HG LYS 69 30.235 -4.054 0.581 401 HD2 LYS 69 2HD LYS 69 29.501 -4.713 2.716 402 HD3 LYS 69 3HD LYS 69 30.236 -3.306 3.492 403 HE2 LYS 69 2HE LYS 69 28.531 -1.915 2.890 404 HE3 LYS 69 3HE LYS 69 28.165 -2.818 1.422 405 HZ1 LYS 69 1HZ LYS 69 26.508 -2.924 3.340 406 HZ2 LYS 69 2HZ LYS 69 27.617 -3.959 4.090 407 HZ3 LYS 69 3HZ LYS 69 26.939 -4.382 2.598 408 H TRP 70 H TRP 70 33.651 -5.590 -0.094 409 HA TRP 70 HA TRP 70 31.819 -6.449 -1.999 410 HB2 TRP 70 2HB TRP 70 33.663 -6.928 -3.390 411 HB3 TRP 70 3HB TRP 70 34.223 -5.633 -2.334 412 HD1 TRP 70 HD1 TRP 70 36.108 -6.233 -0.542 413 HE1 TRP 70 HE1 TRP 70 37.745 -8.210 -0.357 414 HE3 TRP 70 HE3 TRP 70 33.874 -9.446 -3.830 415 HZ2 TRP 70 HZ2 TRP 70 38.051 -10.790 -1.460 416 HZ3 TRP 70 HZ3 TRP 70 34.903 -11.649 -4.210 417 HH2 TRP 70 HH2 TRP 70 36.948 -12.306 -3.048 418 H LYS 71 H LYS 71 33.854 -8.342 0.191 419 HA LYS 71 HA LYS 71 32.972 -10.864 -0.855 420 HB2 LYS 71 2HB LYS 71 35.191 -10.530 0.223 421 HB3 LYS 71 3HB LYS 71 34.374 -10.271 1.759 422 HG2 LYS 71 2HG LYS 71 34.032 -12.460 2.090 423 HG3 LYS 71 3HG LYS 71 33.641 -12.760 0.395 424 HD2 LYS 71 2HD LYS 71 36.437 -12.061 0.784 425 HD3 LYS 71 3HD LYS 71 35.968 -13.497 1.699 426 HE2 LYS 71 2HE LYS 71 34.953 -13.424 -1.050 427 HE3 LYS 71 3HE LYS 71 36.711 -13.479 -0.927 428 HZ1 LYS 71 1HZ LYS 71 36.365 -15.672 -0.762 429 HZ2 LYS 71 2HZ LYS 71 34.750 -15.507 -0.286 430 HZ3 LYS 71 3HZ LYS 71 35.990 -15.341 0.854 431 H GLN 72 H GLN 72 32.052 -8.761 1.796 432 HA GLN 72 HA GLN 72 30.439 -10.584 3.211 433 HB2 GLN 72 2HB GLN 72 30.836 -7.665 3.157 434 HB3 GLN 72 3HB GLN 72 29.249 -8.185 3.710 435 HG2 GLN 72 2HG GLN 72 30.686 -9.819 5.198 436 HG3 GLN 72 3HG GLN 72 31.918 -8.584 4.946 437 HE21 GLN 72 1HE2 GLN 72 31.840 -6.772 6.119 438 HE22 GLN 72 2HE2 GLN 72 30.569 -6.351 7.211 439 H ASN 73 H ASN 73 29.758 -8.409 0.520 440 HA ASN 73 HA ASN 73 26.942 -8.931 0.509 441 HB2 ASN 73 2HB ASN 73 28.803 -7.246 -0.948 442 HB3 ASN 73 3HB ASN 73 27.639 -8.003 -2.031 443 HD21 ASN 73 1HD2 ASN 73 27.282 -6.930 1.317 444 HD22 ASN 73 2HD2 ASN 73 26.017 -5.797 1.003 445 H LYS 74 H LYS 74 29.748 -10.391 -0.919 446 HA LYS 74 HA LYS 74 28.390 -11.843 -2.963 447 HB2 LYS 74 2HB LYS 74 31.092 -12.188 -1.665 448 HB3 LYS 74 3HB LYS 74 30.519 -13.222 -2.967 449 HG2 LYS 74 2HG LYS 74 30.479 -10.274 -3.364 450 HG3 LYS 74 3HG LYS 74 32.023 -11.127 -3.448 451 HD2 LYS 74 2HD LYS 74 31.529 -12.050 -5.432 452 HD3 LYS 74 3HD LYS 74 29.879 -12.440 -4.939 453 HE2 LYS 74 2HE LYS 74 29.541 -9.846 -5.170 454 HE3 LYS 74 3HE LYS 74 30.951 -9.969 -6.219 455 HZ1 LYS 74 1HZ LYS 74 29.004 -10.177 -7.549 456 HZ2 LYS 74 2HZ LYS 74 28.358 -11.373 -6.543 457 HZ3 LYS 74 3HZ LYS 74 29.730 -11.703 -7.476 458 H PHE 75 H PHE 75 29.723 -12.813 0.198 459 HA PHE 75 HA PHE 75 28.789 -15.455 0.138 460 HB2 PHE 75 2HB PHE 75 30.127 -13.750 1.995 461 HB3 PHE 75 3HB PHE 75 28.798 -14.543 2.834 462 HD1 PHE 75 HD1 PHE 75 28.697 -17.156 1.558 463 HD2 PHE 75 HD2 PHE 75 32.058 -14.804 2.693 464 HE1 PHE 75 HE1 PHE 75 30.050 -19.199 1.771 465 HE2 PHE 75 HE2 PHE 75 33.417 -16.843 2.906 466 HZ PHE 75 HZ PHE 75 32.415 -19.044 2.445 467 H LYS 76 H LYS 76 27.299 -12.483 1.325 468 HA LYS 76 HA LYS 76 25.124 -13.413 2.688 469 HB2 LYS 76 2HB LYS 76 25.689 -11.014 1.066 470 HB3 LYS 76 3HB LYS 76 23.982 -11.366 1.305 471 HG2 LYS 76 2HG LYS 76 24.112 -11.084 3.601 472 HG3 LYS 76 3HG LYS 76 25.859 -11.330 3.633 473 HD2 LYS 76 2HD LYS 76 25.717 -9.148 2.059 474 HD3 LYS 76 3HD LYS 76 24.290 -8.893 3.065 475 HE2 LYS 76 2HE LYS 76 26.083 -9.586 4.951 476 HE3 LYS 76 3HE LYS 76 27.156 -8.832 3.773 477 HZ1 LYS 76 1HZ LYS 76 24.735 -7.355 4.338 478 HZ2 LYS 76 2HZ LYS 76 26.329 -6.808 4.197 479 HZ3 LYS 76 3HZ LYS 76 25.795 -7.493 5.648 480 H MET 77 H MET 77 25.070 -12.659 -0.803 481 HA MET 77 HA MET 77 22.579 -13.942 -1.237 482 HB2 MET 77 2HB MET 77 23.135 -13.693 -3.645 483 HB3 MET 77 3HB MET 77 23.314 -12.198 -2.737 484 HG2 MET 77 2HG MET 77 25.757 -12.657 -2.597 485 HG3 MET 77 3HG MET 77 25.506 -14.032 -3.671 486 HE1 MET 77 1HE MET 77 25.374 -14.052 -5.950 487 HE2 MET 77 2HE MET 77 25.656 -12.702 -7.049 488 HE3 MET 77 3HE MET 77 26.935 -13.231 -5.955 489 H ALA 78 H ALA 78 25.867 -15.045 -1.204 490 HA ALA 78 HA ALA 78 25.739 -17.332 -2.761 491 HB1 ALA 78 1HB ALA 78 27.669 -18.074 -1.654 492 HB2 ALA 78 2HB ALA 78 27.753 -16.314 -1.578 493 HB3 ALA 78 3HB ALA 78 27.242 -17.234 -0.164 494 H VAL 79 H VAL 79 24.780 -16.873 0.616 495 HA VAL 79 HA VAL 79 23.826 -19.635 0.746 496 HB VAL 79 HB VAL 79 23.798 -19.468 3.048 497 HG11 VAL 79 1HG1 VAL 79 26.086 -19.179 2.158 498 HG12 VAL 79 2HG1 VAL 79 25.893 -17.430 2.303 499 HG13 VAL 79 3HG1 VAL 79 25.869 -18.444 3.747 500 HG21 VAL 79 1HG2 VAL 79 22.318 -17.660 3.386 501 HG22 VAL 79 2HG2 VAL 79 23.804 -17.224 4.231 502 HG23 VAL 79 3HG2 VAL 79 23.439 -16.507 2.662 503 H GLN 80 H GLN 80 22.583 -17.179 -0.683 504 HA GLN 80 HA GLN 80 20.469 -16.555 -1.260 505 HB2 GLN 80 2HB GLN 80 19.403 -18.634 0.640 506 HB3 GLN 80 3HB GLN 80 18.641 -17.991 -0.808 507 HG2 GLN 80 2HG GLN 80 20.233 -19.129 -2.209 508 HG3 GLN 80 3HG GLN 80 21.130 -19.682 -0.796 509 HE21 GLN 80 1HE2 GLN 80 20.677 -21.633 -0.068 510 HE22 GLN 80 2HE2 GLN 80 19.245 -22.537 -0.408 511 H LEU 81 H LEU 81 21.876 -15.369 0.976 512 HA LEU 81 HA LEU 81 19.559 -14.341 2.475 513 HB2 LEU 81 2HB LEU 81 22.282 -15.111 3.447 514 HB3 LEU 81 3HB LEU 81 21.346 -13.882 4.296 515 HG LEU 81 HG LEU 81 20.621 -16.782 3.905 516 HD11 LEU 81 1HD1 LEU 81 20.997 -17.055 6.176 517 HD12 LEU 81 2HD1 LEU 81 20.907 -15.325 6.503 518 HD13 LEU 81 3HD1 LEU 81 22.318 -15.994 5.683 519 HD21 LEU 81 1HD2 LEU 81 18.579 -15.610 3.711 520 HD22 LEU 81 2HD2 LEU 81 19.021 -14.478 4.991 521 HD23 LEU 81 3HD2 LEU 81 18.665 -16.160 5.385 522 H PHE 82 H PHE 82 19.263 -12.510 1.267 523 HA PHE 82 HA PHE 82 21.226 -10.409 1.657 524 HB2 PHE 82 2HB PHE 82 21.798 -11.550 -0.525 525 HB3 PHE 82 3HB PHE 82 20.236 -11.014 -1.133 526 HD1 PHE 82 HD1 PHE 82 19.887 -8.777 -1.831 527 HD2 PHE 82 HD2 PHE 82 23.533 -9.889 0.062 528 HE1 PHE 82 HE1 PHE 82 20.881 -6.624 -2.488 529 HE2 PHE 82 HE2 PHE 82 24.533 -7.739 -0.591 530 HZ PHE 82 HZ PHE 82 23.206 -6.102 -1.867
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