NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | position | program | type |
7103 | 1jzu | 4664 | cing | recoord | 1-original | 9 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 1H MET 1 HT1 MET 1 -13.731 -2.941 -16.390 2 2H MET 1 HT2 MET 1 -14.166 -2.322 -17.902 3 3H MET 1 HT3 MET 1 -13.376 -3.814 -17.795 4 HA MET 1 HA MET 1 -15.320 -4.643 -16.482 5 1HB MET 1 HB2 MET 1 -16.494 -2.084 -17.590 6 2HB MET 1 HB1 MET 1 -17.405 -3.349 -16.777 7 1HG MET 1 HG2 MET 1 -15.223 -1.676 -15.554 8 2HG MET 1 HG1 MET 1 -16.955 -1.482 -15.290 9 1HE MET 1 HE1 MET 1 -17.900 -4.712 -13.350 10 2HE MET 1 HE2 MET 1 -17.823 -4.691 -15.112 11 3HE MET 1 HE3 MET 1 -18.469 -3.300 -14.242 12 H THR 2 HN THR 2 -16.323 -6.200 -17.621 13 HA THR 2 HA THR 2 -17.423 -5.943 -20.179 14 HB THR 2 HB THR 2 -15.127 -5.666 -20.948 15 HG1 THR 2 HG1 THR 2 -16.675 -7.017 -22.141 16 1HG2 THR 2 HG21 THR 2 -13.441 -7.336 -20.722 17 2HG2 THR 2 HG22 THR 2 -14.543 -8.402 -19.849 18 3HG2 THR 2 HG23 THR 2 -14.004 -6.894 -19.111 19 H VAL 3 HN VAL 3 -15.666 -8.177 -18.053 20 HA VAL 3 HA VAL 3 -17.969 -9.907 -17.915 21 HB VAL 3 HB VAL 3 -15.392 -11.004 -19.053 22 1HG1 VAL 3 HG11 VAL 3 -16.634 -13.103 -19.272 23 2HG1 VAL 3 HG12 VAL 3 -18.026 -12.360 -18.483 24 3HG1 VAL 3 HG13 VAL 3 -16.523 -12.590 -17.589 25 1HG2 VAL 3 HG21 VAL 3 -18.067 -10.478 -20.336 26 2HG2 VAL 3 HG22 VAL 3 -16.818 -11.496 -21.053 27 3HG2 VAL 3 HG23 VAL 3 -16.505 -9.784 -20.774 28 HA PRO 4 HA PRO 4 -16.410 -10.340 -13.781 29 1HB PRO 4 HB2 PRO 4 -17.682 -13.023 -13.905 30 2HB PRO 4 HB1 PRO 4 -17.910 -11.722 -12.732 31 1HG PRO 4 HG2 PRO 4 -19.766 -12.242 -14.571 32 2HG PRO 4 HG1 PRO 4 -19.394 -10.575 -14.093 33 1HD PRO 4 HD2 PRO 4 -18.601 -12.064 -16.558 34 2HD PRO 4 HD1 PRO 4 -19.052 -10.358 -16.364 35 H ASP 5 HN ASP 5 -14.646 -11.218 -12.808 36 HA ASP 5 HA ASP 5 -13.585 -13.768 -13.369 37 1HB ASP 5 HB2 ASP 5 -12.987 -12.770 -15.522 38 2HB ASP 5 HB1 ASP 5 -12.159 -11.453 -14.698 39 H ARG 6 HN ARG 6 -12.507 -14.331 -11.605 40 HA ARG 6 HA ARG 6 -11.928 -12.495 -9.535 41 1HB ARG 6 HB2 ARG 6 -10.995 -15.345 -9.915 42 2HB ARG 6 HB1 ARG 6 -10.835 -14.423 -8.426 43 1HG ARG 6 HG2 ARG 6 -13.411 -15.233 -9.761 44 2HG ARG 6 HG1 ARG 6 -12.725 -15.917 -8.285 45 1HD ARG 6 HD2 ARG 6 -12.949 -13.772 -7.163 46 2HD ARG 6 HD1 ARG 6 -13.574 -13.045 -8.643 47 HE ARG 6 HE ARG 6 -15.192 -15.227 -7.977 48 1HH1 ARG 6 HH11 ARG 6 -14.382 -12.057 -6.765 49 2HH1 ARG 6 HH12 ARG 6 -15.920 -11.816 -6.007 50 1HH2 ARG 6 HH21 ARG 6 -17.219 -14.909 -6.982 51 2HH2 ARG 6 HH22 ARG 6 -17.529 -13.434 -6.129 52 H SER 7 HN SER 7 -10.026 -13.919 -12.093 53 HA SER 7 HA SER 7 -7.450 -13.446 -11.260 54 1HB SER 7 HB2 SER 7 -8.575 -13.093 -14.050 55 2HB SER 7 HB1 SER 7 -6.863 -13.256 -13.658 56 HG SER 7 HG SER 7 -7.309 -15.332 -12.854 57 H GLU 8 HN GLU 8 -9.802 -11.147 -12.520 58 HA GLU 8 HA GLU 8 -8.351 -8.972 -13.208 59 1HB GLU 8 HB2 GLU 8 -10.184 -7.576 -12.490 60 2HB GLU 8 HB1 GLU 8 -10.835 -9.078 -13.131 61 1HG GLU 8 HG2 GLU 8 -10.972 -9.890 -10.745 62 2HG GLU 8 HG1 GLU 8 -10.611 -8.236 -10.261 63 H ILE 9 HN ILE 9 -9.110 -9.934 -9.877 64 HA ILE 9 HA ILE 9 -7.546 -7.796 -8.745 65 HB ILE 9 HB ILE 9 -8.727 -10.239 -7.413 66 1HG1 ILE 9 HG12 ILE 9 -10.456 -8.816 -8.374 67 2HG1 ILE 9 HG11 ILE 9 -10.467 -8.668 -6.621 68 1HG2 ILE 9 HG21 ILE 9 -8.492 -8.357 -5.471 69 2HG2 ILE 9 HG22 ILE 9 -7.048 -8.044 -6.431 70 3HG2 ILE 9 HG23 ILE 9 -7.329 -9.650 -5.759 71 1HD1 ILE 9 HD11 ILE 9 -10.124 -6.644 -8.627 72 2HD1 ILE 9 HD12 ILE 9 -8.760 -6.654 -7.509 73 3HD1 ILE 9 HD13 ILE 9 -10.404 -6.476 -6.895 74 H ALA 10 HN ALA 10 -7.174 -11.281 -9.237 75 HA ALA 10 HA ALA 10 -4.687 -11.517 -7.889 76 1HB ALA 10 HB1 ALA 10 -5.226 -13.422 -10.064 77 2HB ALA 10 HB2 ALA 10 -6.493 -13.293 -8.844 78 3HB ALA 10 HB3 ALA 10 -4.848 -13.712 -8.366 79 H GLY 11 HN GLY 11 -2.645 -11.104 -8.561 80 1HA GLY 11 HA2 GLY 11 -1.508 -11.409 -11.002 81 2HA GLY 11 HA1 GLY 11 -2.295 -9.847 -11.146 82 H LYS 12 HN LYS 12 -0.436 -8.655 -11.346 83 HA LYS 12 HA LYS 12 1.479 -8.766 -9.124 84 1HB LYS 12 HB2 LYS 12 2.436 -9.034 -11.360 85 2HB LYS 12 HB1 LYS 12 1.741 -7.496 -11.854 86 1HG LYS 12 HG2 LYS 12 4.104 -7.260 -11.366 87 2HG LYS 12 HG1 LYS 12 3.135 -6.337 -10.216 88 1HD LYS 12 HD2 LYS 12 3.381 -8.107 -8.565 89 2HD LYS 12 HD1 LYS 12 4.302 -9.074 -9.715 90 1HE LYS 12 HE2 LYS 12 5.112 -6.371 -8.646 91 2HE LYS 12 HE1 LYS 12 5.755 -7.921 -8.105 92 1HZ LYS 12 HZ1 LYS 12 7.220 -7.854 -9.744 93 2HZ LYS 12 HZ2 LYS 12 6.625 -6.351 -10.241 94 3HZ LYS 12 HZ3 LYS 12 5.987 -7.772 -10.899 95 H TRP 13 HN TRP 13 1.612 -7.194 -7.695 96 HA TRP 13 HA TRP 13 0.186 -4.663 -8.204 97 1HB TRP 13 HB2 TRP 13 0.568 -6.283 -5.688 98 2HB TRP 13 HB1 TRP 13 0.123 -4.585 -5.630 99 HD1 TRP 13 HD1 TRP 13 -1.489 -6.391 -8.476 100 HE1 TRP 13 HE1 TRP 13 -3.965 -6.834 -7.939 101 HE3 TRP 13 HE3 TRP 13 -1.466 -5.212 -3.505 102 HZ2 TRP 13 HZ2 TRP 13 -5.680 -6.706 -5.709 103 HZ3 TRP 13 HZ3 TRP 13 -3.567 -5.402 -2.239 104 HH2 TRP 13 HH2 TRP 13 -5.631 -6.135 -3.321 105 H TYR 14 HN TYR 14 1.402 -2.815 -8.146 106 HA TYR 14 HA TYR 14 4.145 -3.074 -7.089 107 1HB TYR 14 HB2 TYR 14 4.070 -2.622 -9.506 108 2HB TYR 14 HB1 TYR 14 3.125 -1.167 -9.205 109 HD1 TYR 14 HD1 TYR 14 6.104 -2.462 -7.390 110 HD2 TYR 14 HD2 TYR 14 4.502 0.593 -9.879 111 HE1 TYR 14 HE1 TYR 14 8.179 -1.171 -7.128 112 HE2 TYR 14 HE2 TYR 14 6.574 1.893 -9.626 113 HH TYR 14 HH TYR 14 9.312 0.862 -8.854 114 H VAL 15 HN VAL 15 4.349 -2.161 -5.145 115 HA VAL 15 HA VAL 15 2.646 0.093 -4.462 116 HB VAL 15 HB VAL 15 2.578 -1.291 -2.651 117 1HG1 VAL 15 HG11 VAL 15 5.339 -2.035 -3.395 118 2HG1 VAL 15 HG12 VAL 15 3.957 -3.053 -3.023 119 3HG1 VAL 15 HG13 VAL 15 4.842 -2.259 -1.722 120 1HG2 VAL 15 HG21 VAL 15 4.916 0.518 -2.045 121 2HG2 VAL 15 HG22 VAL 15 3.988 -0.363 -0.835 122 3HG2 VAL 15 HG23 VAL 15 3.203 0.875 -1.813 123 H VAL 16 HN VAL 16 3.226 2.047 -4.821 124 HA VAL 16 HA VAL 16 6.037 2.851 -4.524 125 HB VAL 16 HB VAL 16 5.064 2.456 -6.973 126 1HG1 VAL 16 HG11 VAL 16 3.216 4.159 -6.495 127 2HG1 VAL 16 HG12 VAL 16 4.084 4.296 -8.020 128 3HG1 VAL 16 HG13 VAL 16 4.472 5.381 -6.686 129 1HG2 VAL 16 HG21 VAL 16 6.832 3.690 -7.807 130 2HG2 VAL 16 HG22 VAL 16 7.331 3.335 -6.154 131 3HG2 VAL 16 HG23 VAL 16 6.692 4.928 -6.559 132 H ALA 17 HN ALA 17 2.652 3.862 -4.770 133 HA ALA 17 HA ALA 17 3.204 6.467 -3.627 134 1HB ALA 17 HB1 ALA 17 0.403 5.790 -3.724 135 2HB ALA 17 HB2 ALA 17 1.194 5.407 -5.253 136 3HB ALA 17 HB3 ALA 17 1.283 7.042 -4.599 137 H LEU 18 HN LEU 18 2.676 7.123 -1.545 138 HA LEU 18 HA LEU 18 1.306 5.287 0.235 139 1HB LEU 18 HB2 LEU 18 3.824 4.717 0.150 140 2HB LEU 18 HB1 LEU 18 4.068 6.221 1.008 141 HG LEU 18 HG LEU 18 2.431 3.898 2.027 142 1HD1 LEU 18 HD11 LEU 18 4.248 3.476 3.549 143 2HD1 LEU 18 HD12 LEU 18 5.164 4.825 2.876 144 3HD1 LEU 18 HD13 LEU 18 4.834 3.402 1.887 145 1HD2 LEU 18 HD21 LEU 18 2.761 6.657 2.915 146 2HD2 LEU 18 HD22 LEU 18 3.120 5.468 4.164 147 3HD2 LEU 18 HD23 LEU 18 1.549 5.457 3.366 148 H ALA 19 HN ALA 19 0.497 6.322 2.115 149 HA ALA 19 HA ALA 19 1.096 9.166 2.468 150 1HB ALA 19 HB1 ALA 19 -1.286 8.219 1.196 151 2HB ALA 19 HB2 ALA 19 -0.787 9.874 1.526 152 3HB ALA 19 HB3 ALA 19 -1.713 8.977 2.731 153 H SER 20 HN SER 20 1.345 9.598 4.647 154 HA SER 20 HA SER 20 -0.242 7.984 6.520 155 1HB SER 20 HB2 SER 20 1.803 7.353 7.792 156 2HB SER 20 HB1 SER 20 1.736 6.646 6.176 157 HG SER 20 HG SER 20 3.437 7.759 5.624 158 H ASN 21 HN ASN 21 0.370 8.476 8.825 159 HA ASN 21 HA ASN 21 1.271 11.177 9.364 160 1HB ASN 21 HB2 ASN 21 -1.310 10.416 10.682 161 2HB ASN 21 HB1 ASN 21 -0.645 12.011 10.365 162 1HD2 ASN 21 HD21 ASN 21 -1.669 9.189 8.490 163 2HD2 ASN 21 HD22 ASN 21 -2.601 10.072 7.344 164 H THR 22 HN THR 22 2.691 10.894 10.954 165 HA THR 22 HA THR 22 2.064 9.444 13.341 166 HB THR 22 HB THR 22 3.974 7.827 13.114 167 HG1 THR 22 HG1 THR 22 3.846 8.631 10.400 168 1HG2 THR 22 HG21 THR 22 1.535 7.240 12.582 169 2HG2 THR 22 HG22 THR 22 2.810 6.155 12.029 170 3HG2 THR 22 HG23 THR 22 2.054 7.276 10.897 171 H GLU 23 HN GLU 23 3.346 10.071 15.022 172 HA GLU 23 HA GLU 23 4.938 12.364 14.788 173 1HB GLU 23 HB2 GLU 23 3.863 11.665 16.892 174 2HB GLU 23 HB1 GLU 23 4.942 10.280 16.981 175 1HG GLU 23 HG2 GLU 23 6.854 11.751 17.212 176 2HG GLU 23 HG1 GLU 23 5.809 13.161 17.051 177 H PHE 24 HN PHE 24 5.703 8.952 14.693 178 HA PHE 24 HA PHE 24 8.562 9.390 14.701 179 1HB PHE 24 HB2 PHE 24 6.913 6.897 14.238 180 2HB PHE 24 HB1 PHE 24 8.670 6.926 14.282 181 HD1 PHE 24 HD1 PHE 24 9.491 5.984 16.180 182 HD2 PHE 24 HD2 PHE 24 5.968 8.358 16.454 183 HE1 PHE 24 HE1 PHE 24 9.435 5.617 18.611 184 HE2 PHE 24 HE2 PHE 24 5.912 8.000 18.883 185 HZ PHE 24 HZ PHE 24 7.645 6.627 19.966 186 H PHE 25 HN PHE 25 6.567 10.323 12.475 187 HA PHE 25 HA PHE 25 7.054 8.982 10.108 188 1HB PHE 25 HB2 PHE 25 5.412 10.778 10.285 189 2HB PHE 25 HB1 PHE 25 6.695 11.955 10.540 190 HD1 PHE 25 HD1 PHE 25 6.442 9.175 8.077 191 HD2 PHE 25 HD2 PHE 25 6.615 13.378 8.722 192 HE1 PHE 25 HE1 PHE 25 6.581 9.539 5.647 193 HE2 PHE 25 HE2 PHE 25 6.754 13.750 6.294 194 HZ PHE 25 HZ PHE 25 6.737 11.829 4.753 195 H LEU 26 HN LEU 26 9.030 11.362 11.777 196 HA LEU 26 HA LEU 26 10.905 11.852 9.759 197 1HB LEU 26 HB2 LEU 26 11.169 11.897 12.761 198 2HB LEU 26 HB1 LEU 26 12.453 12.407 11.684 199 HG LEU 26 HG LEU 26 11.280 14.347 12.493 200 1HD1 LEU 26 HD11 LEU 26 10.211 14.126 9.729 201 2HD1 LEU 26 HD12 LEU 26 11.952 13.996 9.975 202 3HD1 LEU 26 HD13 LEU 26 11.092 15.444 10.500 203 1HD2 LEU 26 HD21 LEU 26 8.753 13.366 11.205 204 2HD2 LEU 26 HD22 LEU 26 8.972 14.699 12.339 205 3HD2 LEU 26 HD23 LEU 26 9.125 13.033 12.897 206 H ARG 27 HN ARG 27 10.894 9.418 12.343 207 HA ARG 27 HA ARG 27 13.380 8.258 11.653 208 1HB ARG 27 HB2 ARG 27 12.369 7.940 13.854 209 2HB ARG 27 HB1 ARG 27 11.026 7.066 13.129 210 1HG ARG 27 HG2 ARG 27 12.600 5.531 14.140 211 2HG ARG 27 HG1 ARG 27 12.566 5.315 12.390 212 1HD ARG 27 HD2 ARG 27 14.854 5.261 13.226 213 2HD ARG 27 HD1 ARG 27 14.598 6.659 12.182 214 HE ARG 27 HE ARG 27 15.151 7.977 13.948 215 1HH1 ARG 27 HH11 ARG 27 14.061 4.907 15.201 216 2HH1 ARG 27 HH12 ARG 27 14.326 5.347 16.854 217 1HH2 ARG 27 HH21 ARG 27 15.502 8.555 16.121 218 2HH2 ARG 27 HH22 ARG 27 15.146 7.416 17.376 219 H GLU 28 HN GLU 28 10.125 7.793 10.490 220 HA GLU 28 HA GLU 28 10.593 5.297 9.208 221 1HB GLU 28 HB2 GLU 28 8.434 7.355 8.736 222 2HB GLU 28 HB1 GLU 28 8.433 5.719 8.089 223 1HG GLU 28 HG2 GLU 28 8.379 6.457 11.005 224 2HG GLU 28 HG1 GLU 28 7.002 5.918 10.048 225 H LYS 29 HN LYS 29 12.055 8.112 8.454 226 HA LYS 29 HA LYS 29 11.594 8.188 5.630 227 1HB LYS 29 HB2 LYS 29 13.315 9.858 5.527 228 2HB LYS 29 HB1 LYS 29 12.327 10.172 6.944 229 1HG LYS 29 HG2 LYS 29 14.022 9.245 8.387 230 2HG LYS 29 HG1 LYS 29 14.988 8.769 6.993 231 1HD LYS 29 HD2 LYS 29 15.888 10.799 7.959 232 2HD LYS 29 HD1 LYS 29 15.220 11.140 6.365 233 1HE LYS 29 HE2 LYS 29 13.718 11.610 8.933 234 2HE LYS 29 HE1 LYS 29 14.708 12.838 8.152 235 1HZ LYS 29 HZ1 LYS 29 13.079 11.911 6.163 236 2HZ LYS 29 HZ2 LYS 29 12.890 13.358 7.016 237 3HZ LYS 29 HZ3 LYS 29 12.064 11.971 7.516 238 H ASP 30 HN ASP 30 14.076 6.821 7.733 239 HA ASP 30 HA ASP 30 15.832 5.979 5.693 240 1HB ASP 30 HB2 ASP 30 16.509 6.168 8.051 241 2HB ASP 30 HB1 ASP 30 15.448 4.824 8.461 242 H LYS 31 HN LYS 31 13.240 4.270 7.419 243 HA LYS 31 HA LYS 31 13.585 1.748 6.309 244 1HB LYS 31 HB2 LYS 31 10.997 3.075 7.133 245 2HB LYS 31 HB1 LYS 31 11.218 1.350 6.874 246 1HG LYS 31 HG2 LYS 31 12.602 3.010 8.971 247 2HG LYS 31 HG1 LYS 31 11.257 1.898 9.239 248 1HD LYS 31 HD2 LYS 31 12.642 0.034 8.478 249 2HD LYS 31 HD1 LYS 31 13.984 1.142 8.189 250 1HE LYS 31 HE2 LYS 31 14.255 -0.025 10.312 251 2HE LYS 31 HE1 LYS 31 14.035 1.705 10.565 252 1HZ LYS 31 HZ1 LYS 31 12.723 -0.008 11.989 253 2HZ LYS 31 HZ2 LYS 31 11.689 -0.058 10.652 254 3HZ LYS 31 HZ3 LYS 31 11.962 1.405 11.454 255 H MET 32 HN MET 32 12.277 4.611 4.865 256 HA MET 32 HA MET 32 10.600 3.621 2.917 257 1HB MET 32 HB2 MET 32 12.576 5.880 2.578 258 2HB MET 32 HB1 MET 32 11.131 5.614 1.614 259 1HG MET 32 HG2 MET 32 11.177 6.226 4.558 260 2HG MET 32 HG1 MET 32 10.842 7.385 3.279 261 1HE MET 32 HE1 MET 32 10.005 4.310 5.093 262 2HE MET 32 HE2 MET 32 8.933 3.542 3.922 263 3HE MET 32 HE3 MET 32 8.257 4.393 5.310 264 H LYS 33 HN LYS 33 10.784 2.548 1.065 265 HA LYS 33 HA LYS 33 13.218 2.374 -0.450 266 1HB LYS 33 HB2 LYS 33 12.176 -0.140 0.882 267 2HB LYS 33 HB1 LYS 33 13.480 -0.063 -0.292 268 1HG LYS 33 HG2 LYS 33 14.815 1.251 1.285 269 2HG LYS 33 HG1 LYS 33 13.508 1.146 2.465 270 1HD LYS 33 HD2 LYS 33 13.707 -1.313 2.427 271 2HD LYS 33 HD1 LYS 33 15.064 -1.166 1.310 272 1HE LYS 33 HE2 LYS 33 15.868 -1.488 3.577 273 2HE LYS 33 HE1 LYS 33 16.299 0.119 2.996 274 1HZ LYS 33 HZ1 LYS 33 15.303 -0.168 5.349 275 2HZ LYS 33 HZ2 LYS 33 13.822 -0.254 4.537 276 3HZ LYS 33 HZ3 LYS 33 14.790 1.125 4.386 277 H MET 34 HN MET 34 12.877 0.955 -2.436 278 HA MET 34 HA MET 34 10.347 1.533 -3.598 279 1HB MET 34 HB2 MET 34 12.441 -0.463 -4.502 280 2HB MET 34 HB1 MET 34 11.117 0.150 -5.483 281 1HG MET 34 HG2 MET 34 13.393 1.776 -4.371 282 2HG MET 34 HG1 MET 34 13.218 1.235 -6.039 283 1HE MET 34 HE1 MET 34 12.616 4.959 -6.598 284 2HE MET 34 HE2 MET 34 13.773 3.628 -6.600 285 3HE MET 34 HE3 MET 34 13.505 4.561 -5.128 286 H ALA 35 HN ALA 35 8.541 0.075 -4.040 287 HA ALA 35 HA ALA 35 8.799 -2.493 -2.637 288 1HB ALA 35 HB1 ALA 35 7.740 -0.788 -1.178 289 2HB ALA 35 HB2 ALA 35 6.746 -2.210 -1.483 290 3HB ALA 35 HB3 ALA 35 6.411 -0.701 -2.333 291 H MET 36 HN MET 36 7.908 -4.178 -3.527 292 HA MET 36 HA MET 36 6.103 -3.837 -5.827 293 1HB MET 36 HB2 MET 36 8.241 -5.960 -5.496 294 2HB MET 36 HB1 MET 36 7.141 -5.802 -6.859 295 1HG MET 36 HG2 MET 36 8.147 -3.675 -7.452 296 2HG MET 36 HG1 MET 36 9.222 -3.783 -6.060 297 1HE MET 36 HE1 MET 36 9.035 -5.840 -9.949 298 2HE MET 36 HE2 MET 36 7.768 -5.847 -8.722 299 3HE MET 36 HE3 MET 36 8.913 -7.185 -8.814 300 H ALA 37 HN ALA 37 4.552 -5.642 -6.063 301 HA ALA 37 HA ALA 37 4.371 -7.489 -3.844 302 1HB ALA 37 HB1 ALA 37 2.202 -6.745 -3.064 303 2HB ALA 37 HB2 ALA 37 2.212 -5.433 -4.243 304 3HB ALA 37 HB3 ALA 37 3.386 -5.445 -2.927 305 H ARG 38 HN ARG 38 2.672 -9.040 -4.018 306 HA ARG 38 HA ARG 38 1.358 -9.253 -6.623 307 1HB ARG 38 HB2 ARG 38 3.036 -11.444 -5.378 308 2HB ARG 38 HB1 ARG 38 2.036 -11.626 -6.812 309 1HG ARG 38 HG2 ARG 38 3.418 -9.999 -7.991 310 2HG ARG 38 HG1 ARG 38 4.417 -9.798 -6.551 311 1HD ARG 38 HD2 ARG 38 5.048 -12.158 -6.660 312 2HD ARG 38 HD1 ARG 38 4.038 -12.365 -8.089 313 HE ARG 38 HE ARG 38 5.878 -10.311 -8.586 314 1HH1 ARG 38 HH11 ARG 38 5.819 -13.765 -8.087 315 2HH1 ARG 38 HH12 ARG 38 7.227 -14.056 -9.051 316 1HH2 ARG 38 HH21 ARG 38 7.736 -10.696 -9.859 317 2HH2 ARG 38 HH22 ARG 38 8.314 -12.317 -10.056 318 H ILE 39 HN ILE 39 -0.735 -9.806 -6.354 319 HA ILE 39 HA ILE 39 -1.546 -10.782 -3.713 320 HB ILE 39 HB ILE 39 -2.652 -8.749 -4.419 321 1HG1 ILE 39 HG12 ILE 39 -4.512 -11.135 -4.515 322 2HG1 ILE 39 HG11 ILE 39 -3.928 -10.340 -3.056 323 1HG2 ILE 39 HG21 ILE 39 -4.138 -8.699 -6.363 324 2HG2 ILE 39 HG22 ILE 39 -3.632 -10.333 -6.788 325 3HG2 ILE 39 HG23 ILE 39 -2.466 -9.013 -6.827 326 1HD1 ILE 39 HD11 ILE 39 -6.287 -9.799 -3.921 327 2HD1 ILE 39 HD12 ILE 39 -5.453 -8.806 -5.117 328 3HD1 ILE 39 HD13 ILE 39 -5.249 -8.473 -3.397 329 H SER 40 HN SER 40 -2.707 -12.610 -3.385 330 HA SER 40 HA SER 40 -3.753 -14.188 -5.553 331 1HB SER 40 HB2 SER 40 -1.386 -14.828 -5.656 332 2HB SER 40 HB1 SER 40 -1.411 -15.237 -3.940 333 HG SER 40 HG SER 40 -3.000 -16.466 -5.947 334 H PHE 41 HN PHE 41 -5.340 -15.563 -4.874 335 HA PHE 41 HA PHE 41 -6.251 -15.252 -2.159 336 1HB PHE 41 HB2 PHE 41 -7.388 -16.828 -4.476 337 2HB PHE 41 HB1 PHE 41 -8.181 -16.626 -2.920 338 HD1 PHE 41 HD1 PHE 41 -6.449 -14.244 -5.247 339 HD2 PHE 41 HD2 PHE 41 -9.994 -15.251 -3.114 340 HE1 PHE 41 HE1 PHE 41 -7.507 -12.181 -6.045 341 HE2 PHE 41 HE2 PHE 41 -11.060 -13.184 -3.917 342 HZ PHE 41 HZ PHE 41 -9.817 -11.647 -5.384 343 H LEU 42 HN LEU 42 -5.694 -16.521 -0.506 344 HA LEU 42 HA LEU 42 -4.341 -19.030 -0.962 345 1HB LEU 42 HB2 LEU 42 -3.798 -17.335 0.866 346 2HB LEU 42 HB1 LEU 42 -5.231 -17.909 1.690 347 HG LEU 42 HG LEU 42 -2.822 -19.593 1.009 348 1HD1 LEU 42 HD11 LEU 42 -2.221 -19.460 3.282 349 2HD1 LEU 42 HD12 LEU 42 -3.762 -18.728 3.728 350 3HD1 LEU 42 HD13 LEU 42 -2.586 -17.804 2.795 351 1HD2 LEU 42 HD21 LEU 42 -5.502 -20.208 2.142 352 2HD2 LEU 42 HD22 LEU 42 -4.101 -21.050 2.803 353 3HD2 LEU 42 HD23 LEU 42 -4.473 -21.173 1.084 354 H GLY 43 HN GLY 43 -5.325 -20.904 -1.205 355 1HA GLY 43 HA2 GLY 43 -8.125 -21.240 -0.976 356 2HA GLY 43 HA1 GLY 43 -6.954 -22.512 -1.269 357 H GLU 44 HN GLU 44 -7.801 -20.383 1.479 358 HA GLU 44 HA GLU 44 -8.604 -22.630 3.069 359 1HB GLU 44 HB2 GLU 44 -6.077 -21.144 3.824 360 2HB GLU 44 HB1 GLU 44 -6.924 -22.284 4.860 361 1HG GLU 44 HG2 GLU 44 -6.529 -24.041 3.155 362 2HG GLU 44 HG1 GLU 44 -5.560 -22.882 2.247 363 H ASP 45 HN ASP 45 -9.797 -20.229 2.165 364 HA ASP 45 HA ASP 45 -11.204 -18.617 2.929 365 1HB ASP 45 HB2 ASP 45 -10.487 -19.675 5.677 366 2HB ASP 45 HB1 ASP 45 -11.802 -18.561 5.320 367 H GLU 46 HN GLU 46 -8.422 -18.078 2.412 368 HA GLU 46 HA GLU 46 -8.249 -15.552 3.821 369 1HB GLU 46 HB2 GLU 46 -6.103 -17.651 4.049 370 2HB GLU 46 HB1 GLU 46 -5.775 -15.945 4.297 371 1HG GLU 46 HG2 GLU 46 -6.107 -16.639 6.441 372 2HG GLU 46 HG1 GLU 46 -7.735 -16.114 6.012 373 H LEU 47 HN LEU 47 -7.179 -13.978 2.736 374 HA LEU 47 HA LEU 47 -6.109 -14.713 0.090 375 1HB LEU 47 HB2 LEU 47 -7.380 -12.082 0.854 376 2HB LEU 47 HB1 LEU 47 -6.899 -12.595 -0.753 377 HG LEU 47 HG LEU 47 -9.206 -13.618 0.894 378 1HD1 LEU 47 HD11 LEU 47 -9.377 -12.729 -1.935 379 2HD1 LEU 47 HD12 LEU 47 -9.240 -11.513 -0.669 380 3HD1 LEU 47 HD13 LEU 47 -10.583 -12.656 -0.652 381 1HD2 LEU 47 HD21 LEU 47 -9.643 -15.193 -0.962 382 2HD2 LEU 47 HD22 LEU 47 -8.162 -15.560 -0.081 383 3HD2 LEU 47 HD23 LEU 47 -8.078 -14.768 -1.652 384 H LYS 48 HN LYS 48 -4.039 -14.059 -0.365 385 HA LYS 48 HA LYS 48 -2.780 -12.236 1.578 386 1HB LYS 48 HB2 LYS 48 -0.839 -13.599 1.695 387 2HB LYS 48 HB1 LYS 48 -2.220 -14.654 1.939 388 1HG LYS 48 HG2 LYS 48 -0.928 -15.912 0.535 389 2HG LYS 48 HG1 LYS 48 -1.987 -15.097 -0.618 390 1HD LYS 48 HD2 LYS 48 -0.263 -13.482 -1.123 391 2HD LYS 48 HD1 LYS 48 0.770 -14.136 0.147 392 1HE LYS 48 HE2 LYS 48 -0.137 -15.609 -2.323 393 2HE LYS 48 HE1 LYS 48 1.456 -14.892 -2.081 394 1HZ LYS 48 HZ1 LYS 48 1.521 -16.386 -0.012 395 2HZ LYS 48 HZ2 LYS 48 1.768 -17.100 -1.524 396 3HZ LYS 48 HZ3 LYS 48 0.267 -17.243 -0.757 397 H VAL 49 HN VAL 49 -1.015 -11.015 0.913 398 HA VAL 49 HA VAL 49 -0.412 -10.949 -1.944 399 HB VAL 49 HB VAL 49 -2.154 -9.214 -1.501 400 1HG1 VAL 49 HG11 VAL 49 -1.979 -7.576 0.037 401 2HG1 VAL 49 HG12 VAL 49 -0.228 -7.461 -0.114 402 3HG1 VAL 49 HG13 VAL 49 -0.946 -8.756 0.844 403 1HG2 VAL 49 HG21 VAL 49 -0.845 -8.785 -3.380 404 2HG2 VAL 49 HG22 VAL 49 0.583 -8.400 -2.418 405 3HG2 VAL 49 HG23 VAL 49 -0.781 -7.282 -2.459 406 H SER 50 HN SER 50 1.695 -11.255 -2.077 407 HA SER 50 HA SER 50 3.443 -10.611 0.153 408 1HB SER 50 HB2 SER 50 3.998 -11.964 -2.502 409 2HB SER 50 HB1 SER 50 5.162 -11.798 -1.190 410 HG SER 50 HG SER 50 3.946 -13.152 0.058 411 H TYR 51 HN TYR 51 5.060 -9.061 0.095 412 HA TYR 51 HA TYR 51 5.294 -7.516 -2.377 413 1HB TYR 51 HB2 TYR 51 5.386 -5.419 -0.996 414 2HB TYR 51 HB1 TYR 51 3.809 -6.195 -1.061 415 HD1 TYR 51 HD1 TYR 51 6.855 -5.938 1.072 416 HD2 TYR 51 HD2 TYR 51 2.668 -6.667 0.903 417 HE1 TYR 51 HE1 TYR 51 6.766 -5.964 3.528 418 HE2 TYR 51 HE2 TYR 51 2.566 -6.691 3.359 419 HH TYR 51 HH TYR 51 4.478 -5.452 5.293 420 H ALA 52 HN ALA 52 7.295 -7.208 -3.010 421 HA ALA 52 HA ALA 52 9.457 -7.745 -1.088 422 1HB ALA 52 HB1 ALA 52 10.832 -8.327 -3.027 423 2HB ALA 52 HB2 ALA 52 9.483 -7.954 -4.099 424 3HB ALA 52 HB3 ALA 52 9.362 -9.300 -2.967 425 H VAL 53 HN VAL 53 10.207 -5.874 -0.293 426 HA VAL 53 HA VAL 53 10.347 -3.525 -2.005 427 HB VAL 53 HB VAL 53 10.929 -2.279 0.006 428 1HG1 VAL 53 HG11 VAL 53 8.675 -2.210 -0.095 429 2HG1 VAL 53 HG12 VAL 53 8.805 -3.158 1.387 430 3HG1 VAL 53 HG13 VAL 53 8.512 -3.965 -0.154 431 1HG2 VAL 53 HG21 VAL 53 10.694 -3.614 2.219 432 2HG2 VAL 53 HG22 VAL 53 12.225 -3.659 1.344 433 3HG2 VAL 53 HG23 VAL 53 11.098 -5.011 1.222 434 HA PRO 54 HA PRO 54 14.749 -4.435 -2.445 435 1HB PRO 54 HB2 PRO 54 14.922 -3.366 -4.961 436 2HB PRO 54 HB1 PRO 54 14.386 -5.011 -4.620 437 1HG PRO 54 HG2 PRO 54 12.847 -2.798 -5.642 438 2HG PRO 54 HG1 PRO 54 12.339 -4.476 -5.402 439 1HD PRO 54 HD2 PRO 54 11.888 -2.121 -3.700 440 2HD PRO 54 HD1 PRO 54 11.015 -3.664 -3.742 441 H LYS 55 HN LYS 55 16.611 -3.214 -2.399 442 HA LYS 55 HA LYS 55 16.937 -0.538 -3.061 443 1HB LYS 55 HB2 LYS 55 15.314 -0.119 -1.239 444 2HB LYS 55 HB1 LYS 55 16.387 -0.934 -0.113 445 1HG LYS 55 HG2 LYS 55 16.523 1.504 0.057 446 2HG LYS 55 HG1 LYS 55 18.063 0.783 -0.403 447 1HD LYS 55 HD2 LYS 55 16.233 1.699 -2.563 448 2HD LYS 55 HD1 LYS 55 17.098 2.920 -1.630 449 1HE LYS 55 HE2 LYS 55 19.222 1.832 -2.183 450 2HE LYS 55 HE1 LYS 55 18.360 0.616 -3.119 451 1HZ LYS 55 HZ1 LYS 55 19.005 2.111 -4.721 452 2HZ LYS 55 HZ2 LYS 55 18.783 3.461 -3.727 453 3HZ LYS 55 HZ3 LYS 55 17.442 2.660 -4.376 454 HA PRO 56 HA PRO 56 20.522 -3.387 -1.695 455 1HB PRO 56 HB2 PRO 56 21.735 -3.267 -4.179 456 2HB PRO 56 HB1 PRO 56 20.696 -4.582 -3.624 457 1HG PRO 56 HG2 PRO 56 20.027 -2.236 -5.353 458 2HG PRO 56 HG1 PRO 56 19.499 -3.924 -5.495 459 1HD PRO 56 HD2 PRO 56 17.882 -2.043 -4.490 460 2HD PRO 56 HD1 PRO 56 17.896 -3.692 -3.831 461 H ASN 57 HN ASN 57 20.600 -0.647 -3.983 462 HA ASN 57 HA ASN 57 23.154 0.252 -3.037 463 1HB ASN 57 HB2 ASN 57 21.111 1.635 -4.792 464 2HB ASN 57 HB1 ASN 57 22.760 2.192 -4.517 465 1HD2 ASN 57 HD21 ASN 57 20.853 0.637 -6.639 466 2HD2 ASN 57 HD22 ASN 57 22.029 -0.332 -7.454 467 H GLY 58 HN GLY 58 21.724 0.034 -0.787 468 1HA GLY 58 HA2 GLY 58 21.887 2.565 0.387 469 2HA GLY 58 HA1 GLY 58 20.203 2.271 -0.021 470 H CYS 59 HN CYS 59 20.024 -0.468 0.490 471 HA CYS 59 HA CYS 59 20.955 -0.897 3.208 472 1HB CYS 59 HB2 CYS 59 17.999 -0.809 2.571 473 2HB CYS 59 HB1 CYS 59 18.708 -1.251 4.118 474 H ARG 60 HN ARG 60 18.296 -2.248 1.241 475 HA ARG 60 HA ARG 60 19.577 -4.511 0.290 476 1HB ARG 60 HB2 ARG 60 18.845 -6.255 1.890 477 2HB ARG 60 HB1 ARG 60 19.987 -5.133 2.609 478 1HG ARG 60 HG2 ARG 60 18.166 -3.958 3.716 479 2HG ARG 60 HG1 ARG 60 16.999 -5.056 2.978 480 1HD ARG 60 HD2 ARG 60 19.203 -5.827 4.888 481 2HD ARG 60 HD1 ARG 60 17.489 -5.698 5.283 482 HE ARG 60 HE ARG 60 17.760 -7.483 3.151 483 1HH1 ARG 60 HH11 ARG 60 18.596 -7.263 6.531 484 2HH1 ARG 60 HH12 ARG 60 18.535 -8.974 6.787 485 1HH2 ARG 60 HH21 ARG 60 17.679 -9.736 3.486 486 2HH2 ARG 60 HH22 ARG 60 18.015 -10.379 5.059 487 H LYS 61 HN LYS 61 17.110 -6.175 1.384 488 HA LYS 61 HA LYS 61 14.909 -4.888 0.058 489 1HB LYS 61 HB2 LYS 61 14.516 -6.616 -1.592 490 2HB LYS 61 HB1 LYS 61 16.122 -5.948 -1.830 491 1HG LYS 61 HG2 LYS 61 15.536 -8.528 -0.392 492 2HG LYS 61 HG1 LYS 61 16.017 -8.402 -2.083 493 1HD LYS 61 HD2 LYS 61 18.107 -7.269 -1.336 494 2HD LYS 61 HD1 LYS 61 17.629 -7.587 0.331 495 1HE LYS 61 HE2 LYS 61 17.618 -9.988 -0.126 496 2HE LYS 61 HE1 LYS 61 18.099 -9.671 -1.792 497 1HZ LYS 61 HZ1 LYS 61 19.786 -8.543 0.299 498 2HZ LYS 61 HZ2 LYS 61 20.214 -9.213 -1.193 499 3HZ LYS 61 HZ3 LYS 61 19.837 -10.223 0.109 500 H TRP 62 HN TRP 62 12.901 -5.747 0.721 501 HA TRP 62 HA TRP 62 13.082 -8.057 2.541 502 1HB TRP 62 HB2 TRP 62 13.037 -5.946 3.840 503 2HB TRP 62 HB1 TRP 62 11.483 -5.561 3.111 504 HD1 TRP 62 HD1 TRP 62 9.730 -5.866 4.949 505 HE1 TRP 62 HE1 TRP 62 9.175 -7.679 6.688 506 HE3 TRP 62 HE3 TRP 62 13.665 -9.034 4.121 507 HZ2 TRP 62 HZ2 TRP 62 10.252 -10.124 7.589 508 HZ3 TRP 62 HZ3 TRP 62 13.823 -11.088 5.465 509 HH2 TRP 62 HH2 TRP 62 12.152 -11.620 7.163 510 H GLU 63 HN GLU 63 11.294 -9.355 2.750 511 HA GLU 63 HA GLU 63 9.029 -8.820 0.969 512 1HB GLU 63 HB2 GLU 63 10.458 -11.476 1.190 513 2HB GLU 63 HB1 GLU 63 9.024 -11.151 0.225 514 1HG GLU 63 HG2 GLU 63 10.296 -9.573 -1.132 515 2HG GLU 63 HG1 GLU 63 11.737 -9.916 -0.178 516 H THR 64 HN THR 64 7.054 -9.461 1.745 517 HA THR 64 HA THR 64 6.876 -11.191 4.059 518 HB THR 64 HB THR 64 6.063 -8.284 4.216 519 HG1 THR 64 HG1 THR 64 7.805 -8.037 5.342 520 1HG2 THR 64 HG21 THR 64 4.459 -9.829 5.350 521 2HG2 THR 64 HG22 THR 64 5.254 -8.661 6.406 522 3HG2 THR 64 HG23 THR 64 5.791 -10.340 6.386 523 H THR 65 HN THR 65 4.969 -12.223 4.184 524 HA THR 65 HA THR 65 2.974 -11.567 2.137 525 HB THR 65 HB THR 65 3.547 -14.109 3.663 526 HG1 THR 65 HG1 THR 65 4.913 -14.152 2.050 527 1HG2 THR 65 HG21 THR 65 1.210 -13.392 1.994 528 2HG2 THR 65 HG22 THR 65 1.335 -14.482 3.375 529 3HG2 THR 65 HG23 THR 65 1.912 -14.998 1.791 530 H PHE 66 HN PHE 66 1.282 -10.420 2.836 531 HA PHE 66 HA PHE 66 0.337 -10.871 5.590 532 1HB PHE 66 HB2 PHE 66 0.345 -8.483 3.822 533 2HB PHE 66 HB1 PHE 66 -1.069 -8.696 4.848 534 HD1 PHE 66 HD1 PHE 66 -0.786 -6.922 6.354 535 HD2 PHE 66 HD2 PHE 66 2.414 -9.649 5.690 536 HE1 PHE 66 HE1 PHE 66 0.429 -5.956 8.265 537 HE2 PHE 66 HE2 PHE 66 3.633 -8.687 7.599 538 HZ PHE 66 HZ PHE 66 2.641 -6.839 8.889 539 H LYS 67 HN LYS 67 -1.710 -11.644 5.959 540 HA LYS 67 HA LYS 67 -3.640 -11.738 3.812 541 1HB LYS 67 HB2 LYS 67 -3.735 -14.064 3.504 542 2HB LYS 67 HB1 LYS 67 -2.025 -13.667 3.477 543 1HG LYS 67 HG2 LYS 67 -3.485 -14.790 5.855 544 2HG LYS 67 HG1 LYS 67 -2.510 -15.726 4.722 545 1HD LYS 67 HD2 LYS 67 -0.556 -14.315 5.325 546 2HD LYS 67 HD1 LYS 67 -1.555 -13.519 6.544 547 1HE LYS 67 HE2 LYS 67 -0.907 -16.464 6.434 548 2HE LYS 67 HE1 LYS 67 -0.176 -15.290 7.527 549 1HZ LYS 67 HZ1 LYS 67 -2.569 -14.855 8.268 550 2HZ LYS 67 HZ2 LYS 67 -1.832 -16.285 8.788 551 3HZ LYS 67 HZ3 LYS 67 -2.941 -16.322 7.512 552 H LYS 68 HN LYS 68 -5.697 -12.595 4.426 553 HA LYS 68 HA LYS 68 -6.415 -13.529 6.935 554 1HB LYS 68 HB2 LYS 68 -5.582 -11.302 7.687 555 2HB LYS 68 HB1 LYS 68 -6.821 -10.550 6.696 556 1HG LYS 68 HG2 LYS 68 -7.642 -10.574 8.917 557 2HG LYS 68 HG1 LYS 68 -8.522 -11.827 8.044 558 1HD LYS 68 HD2 LYS 68 -7.055 -13.531 8.984 559 2HD LYS 68 HD1 LYS 68 -6.128 -12.283 9.822 560 1HE LYS 68 HE2 LYS 68 -8.113 -11.662 11.104 561 2HE LYS 68 HE1 LYS 68 -9.050 -12.893 10.258 562 1HZ LYS 68 HZ1 LYS 68 -6.658 -13.482 11.912 563 2HZ LYS 68 HZ2 LYS 68 -7.730 -14.599 11.234 564 3HZ LYS 68 HZ3 LYS 68 -8.249 -13.582 12.482 565 H THR 69 HN THR 69 -8.598 -10.990 6.265 566 HA THR 69 HA THR 69 -10.170 -12.781 4.525 567 HB THR 69 HB THR 69 -12.201 -11.880 5.566 568 HG1 THR 69 HG1 THR 69 -10.340 -10.400 7.096 569 1HG2 THR 69 HG21 THR 69 -10.244 -13.452 7.001 570 2HG2 THR 69 HG22 THR 69 -11.993 -13.646 6.884 571 3HG2 THR 69 HG23 THR 69 -11.305 -12.555 8.086 572 H SER 70 HN SER 70 -11.794 -11.657 3.126 573 HA SER 70 HA SER 70 -11.104 -8.879 2.494 574 1HB SER 70 HB2 SER 70 -11.078 -11.121 0.464 575 2HB SER 70 HB1 SER 70 -10.938 -9.405 0.080 576 HG SER 70 HG SER 70 -8.921 -9.445 0.688 577 H ASP 71 HN ASP 71 -12.723 -7.682 1.531 578 HA ASP 71 HA ASP 71 -15.406 -8.783 1.773 579 1HB ASP 71 HB2 ASP 71 -14.428 -5.971 1.248 580 2HB ASP 71 HB1 ASP 71 -16.119 -6.420 1.443 581 H ASP 72 HN ASP 72 -17.039 -8.432 0.131 582 HA ASP 72 HA ASP 72 -16.046 -9.057 -2.508 583 1HB ASP 72 HB2 ASP 72 -18.876 -8.741 -1.490 584 2HB ASP 72 HB1 ASP 72 -18.429 -9.363 -3.074 585 H GLY 73 HN GLY 73 -17.992 -7.921 -4.163 586 1HA GLY 73 HA2 GLY 73 -18.456 -6.010 -5.364 587 2HA GLY 73 HA1 GLY 73 -18.304 -5.123 -3.852 588 H GLU 74 HN GLU 74 -15.969 -4.944 -3.084 589 HA GLU 74 HA GLU 74 -14.170 -4.366 -5.344 590 1HB GLU 74 HB2 GLU 74 -14.412 -2.837 -2.734 591 2HB GLU 74 HB1 GLU 74 -13.285 -2.476 -4.034 592 1HG GLU 74 HG2 GLU 74 -16.286 -2.311 -4.203 593 2HG GLU 74 HG1 GLU 74 -15.179 -0.951 -4.034 594 H VAL 75 HN VAL 75 -12.241 -3.635 -2.889 595 HA VAL 75 HA VAL 75 -11.871 -6.347 -1.889 596 HB VAL 75 HB VAL 75 -9.761 -4.875 -3.460 597 1HG1 VAL 75 HG11 VAL 75 -8.776 -5.706 -1.364 598 2HG1 VAL 75 HG12 VAL 75 -8.172 -6.593 -2.762 599 3HG1 VAL 75 HG13 VAL 75 -9.394 -7.317 -1.717 600 1HG2 VAL 75 HG21 VAL 75 -9.713 -7.390 -4.357 601 2HG2 VAL 75 HG22 VAL 75 -10.793 -6.163 -5.015 602 3HG2 VAL 75 HG23 VAL 75 -11.391 -7.320 -3.825 603 H TYR 76 HN TYR 76 -11.949 -6.063 0.204 604 HA TYR 76 HA TYR 76 -10.152 -4.117 1.458 605 1HB TYR 76 HB2 TYR 76 -12.261 -2.983 1.554 606 2HB TYR 76 HB1 TYR 76 -13.102 -4.451 2.039 607 HD1 TYR 76 HD1 TYR 76 -9.884 -3.637 3.576 608 HD2 TYR 76 HD2 TYR 76 -14.105 -3.283 3.929 609 HE1 TYR 76 HE1 TYR 76 -9.620 -2.976 5.926 610 HE2 TYR 76 HE2 TYR 76 -13.856 -2.625 6.282 611 HH TYR 76 HH TYR 76 -11.775 -1.457 7.656 612 H TYR 77 HN TYR 77 -8.791 -5.344 2.621 613 HA TYR 77 HA TYR 77 -9.894 -7.780 3.819 614 1HB TYR 77 HB2 TYR 77 -7.643 -8.706 3.766 615 2HB TYR 77 HB1 TYR 77 -8.133 -8.170 2.165 616 HD1 TYR 77 HD1 TYR 77 -6.658 -6.861 0.922 617 HD2 TYR 77 HD2 TYR 77 -6.239 -6.990 5.155 618 HE1 TYR 77 HE1 TYR 77 -4.581 -5.550 0.755 619 HE2 TYR 77 HE2 TYR 77 -4.172 -5.675 4.998 620 HH TYR 77 HH TYR 77 -3.063 -4.160 3.500 621 H SER 78 HN SER 78 -9.886 -8.134 5.891 622 HA SER 78 HA SER 78 -8.798 -6.084 7.660 623 1HB SER 78 HB2 SER 78 -10.581 -8.452 8.268 624 2HB SER 78 HB1 SER 78 -10.100 -7.208 9.418 625 HG SER 78 HG SER 78 -11.445 -6.581 7.013 626 H GLU 79 HN GLU 79 -7.495 -6.732 9.517 627 HA GLU 79 HA GLU 79 -6.387 -9.375 9.610 628 1HB GLU 79 HB2 GLU 79 -5.166 -8.256 7.700 629 2HB GLU 79 HB1 GLU 79 -4.521 -7.123 8.875 630 1HG GLU 79 HG2 GLU 79 -3.468 -8.986 10.081 631 2HG GLU 79 HG1 GLU 79 -4.071 -10.093 8.849 632 H GLU 80 HN GLU 80 -7.709 -8.304 11.562 633 HA GLU 80 HA GLU 80 -7.687 -7.772 13.759 634 1HB GLU 80 HB2 GLU 80 -4.722 -8.350 13.553 635 2HB GLU 80 HB1 GLU 80 -5.647 -8.222 15.047 636 1HG GLU 80 HG2 GLU 80 -6.991 -10.151 14.372 637 2HG GLU 80 HG1 GLU 80 -6.042 -10.290 12.893 638 H ALA 81 HN ALA 81 -7.278 -6.014 15.185 639 HA ALA 81 HA ALA 81 -7.228 -3.526 14.190 640 1HB ALA 81 HB1 ALA 81 -7.559 -3.245 16.371 641 2HB ALA 81 HB2 ALA 81 -5.805 -3.163 16.528 642 3HB ALA 81 HB3 ALA 81 -6.644 -4.695 16.778 643 H LYS 82 HN LYS 82 -4.279 -5.172 15.327 644 HA LYS 82 HA LYS 82 -2.362 -3.333 14.815 645 1HB LYS 82 HB2 LYS 82 -1.902 -5.541 15.753 646 2HB LYS 82 HB1 LYS 82 -2.229 -6.285 14.193 647 1HG LYS 82 HG2 LYS 82 -0.328 -5.093 13.228 648 2HG LYS 82 HG1 LYS 82 0.009 -4.370 14.802 649 1HD LYS 82 HD2 LYS 82 0.041 -7.318 14.160 650 2HD LYS 82 HD1 LYS 82 1.458 -6.290 14.381 651 1HE LYS 82 HE2 LYS 82 0.770 -5.849 16.692 652 2HE LYS 82 HE1 LYS 82 -0.637 -6.889 16.468 653 1HZ LYS 82 HZ1 LYS 82 2.217 -7.665 16.523 654 2HZ LYS 82 HZ2 LYS 82 1.025 -8.687 15.893 655 3HZ LYS 82 HZ3 LYS 82 0.961 -8.213 17.516 656 H LYS 83 HN LYS 83 -3.841 -5.508 12.415 657 HA LYS 83 HA LYS 83 -2.773 -3.715 10.344 658 1HB LYS 83 HB2 LYS 83 -1.546 -5.873 10.411 659 2HB LYS 83 HB1 LYS 83 -3.057 -6.708 10.084 660 1HG LYS 83 HG2 LYS 83 -1.679 -6.446 8.076 661 2HG LYS 83 HG1 LYS 83 -3.234 -5.625 7.929 662 1HD LYS 83 HD2 LYS 83 -2.188 -3.491 8.416 663 2HD LYS 83 HD1 LYS 83 -0.635 -4.285 8.683 664 1HE LYS 83 HE2 LYS 83 -0.549 -4.971 6.364 665 2HE LYS 83 HE1 LYS 83 -2.154 -4.304 6.076 666 1HZ LYS 83 HZ1 LYS 83 0.399 -2.902 6.478 667 2HZ LYS 83 HZ2 LYS 83 -1.042 -2.125 6.904 668 3HZ LYS 83 HZ3 LYS 83 -0.798 -2.637 5.311 669 H LYS 84 HN LYS 84 -4.298 -2.731 9.316 670 HA LYS 84 HA LYS 84 -6.692 -4.136 8.435 671 1HB LYS 84 HB2 LYS 84 -6.715 -1.627 10.121 672 2HB LYS 84 HB1 LYS 84 -8.079 -2.116 9.126 673 1HG LYS 84 HG2 LYS 84 -6.886 -3.830 11.290 674 2HG LYS 84 HG1 LYS 84 -8.256 -2.745 11.530 675 1HD LYS 84 HD2 LYS 84 -9.522 -3.960 9.829 676 2HD LYS 84 HD1 LYS 84 -8.148 -5.033 9.567 677 1HE LYS 84 HE2 LYS 84 -9.812 -6.086 11.002 678 2HE LYS 84 HE1 LYS 84 -8.311 -5.807 11.882 679 1HZ LYS 84 HZ1 LYS 84 -10.683 -4.027 12.009 680 2HZ LYS 84 HZ2 LYS 84 -9.278 -3.907 12.942 681 3HZ LYS 84 HZ3 LYS 84 -10.322 -5.220 13.154 682 H VAL 85 HN VAL 85 -6.837 -3.753 6.311 683 HA VAL 85 HA VAL 85 -6.251 -1.084 5.290 684 HB VAL 85 HB VAL 85 -4.860 -3.460 4.077 685 1HG1 VAL 85 HG11 VAL 85 -3.915 -0.663 3.870 686 2HG1 VAL 85 HG12 VAL 85 -5.334 -1.141 2.948 687 3HG1 VAL 85 HG13 VAL 85 -3.803 -1.986 2.718 688 1HG2 VAL 85 HG21 VAL 85 -2.781 -2.512 5.177 689 2HG2 VAL 85 HG22 VAL 85 -3.901 -3.373 6.232 690 3HG2 VAL 85 HG23 VAL 85 -3.867 -1.611 6.232 691 H GLU 86 HN GLU 86 -7.238 -0.625 3.312 692 HA GLU 86 HA GLU 86 -8.976 -2.748 2.229 693 1HB GLU 86 HB2 GLU 86 -10.675 -1.036 1.801 694 2HB GLU 86 HB1 GLU 86 -10.272 -1.121 3.510 695 1HG GLU 86 HG2 GLU 86 -8.855 0.846 3.290 696 2HG GLU 86 HG1 GLU 86 -9.225 0.927 1.569 697 H VAL 87 HN VAL 87 -8.851 -3.137 0.112 698 HA VAL 87 HA VAL 87 -7.161 -1.442 -1.548 699 HB VAL 87 HB VAL 87 -8.592 -3.943 -2.428 700 1HG1 VAL 87 HG11 VAL 87 -6.228 -3.848 -3.761 701 2HG1 VAL 87 HG12 VAL 87 -6.607 -2.134 -3.595 702 3HG1 VAL 87 HG13 VAL 87 -7.754 -3.219 -4.377 703 1HG2 VAL 87 HG21 VAL 87 -6.794 -5.291 -1.756 704 2HG2 VAL 87 HG22 VAL 87 -7.149 -4.271 -0.363 705 3HG2 VAL 87 HG23 VAL 87 -5.773 -3.898 -1.402 706 H LEU 88 HN LEU 88 -8.082 0.266 -2.480 707 HA LEU 88 HA LEU 88 -10.813 -0.022 -3.544 708 1HB LEU 88 HB2 LEU 88 -11.015 2.455 -3.223 709 2HB LEU 88 HB1 LEU 88 -10.906 1.525 -1.745 710 HG LEU 88 HG LEU 88 -8.459 2.798 -2.912 711 1HD1 LEU 88 HD11 LEU 88 -8.923 4.863 -2.106 712 2HD1 LEU 88 HD12 LEU 88 -9.945 4.246 -0.808 713 3HD1 LEU 88 HD13 LEU 88 -10.575 4.355 -2.451 714 1HD2 LEU 88 HD21 LEU 88 -8.836 1.125 -0.785 715 2HD2 LEU 88 HD22 LEU 88 -8.878 2.714 -0.023 716 3HD2 LEU 88 HD23 LEU 88 -7.479 2.233 -0.982 717 H ASP 89 HN ASP 89 -10.672 2.576 -4.904 718 HA ASP 89 HA ASP 89 -10.052 3.509 -6.868 719 1HB ASP 89 HB2 ASP 89 -7.749 3.372 -5.969 720 2HB ASP 89 HB1 ASP 89 -7.580 1.786 -6.703 721 H THR 90 HN THR 90 -8.218 0.972 -8.283 722 HA THR 90 HA THR 90 -10.559 -0.423 -9.279 723 HB THR 90 HB THR 90 -8.749 1.108 -11.151 724 HG1 THR 90 HG1 THR 90 -11.471 1.459 -10.443 725 1HG2 THR 90 HG21 THR 90 -11.223 -0.456 -11.841 726 2HG2 THR 90 HG22 THR 90 -9.582 -1.050 -12.081 727 3HG2 THR 90 HG23 THR 90 -10.134 0.383 -12.946 728 H ASP 91 HN ASP 91 -9.196 -1.999 -7.963 729 HA ASP 91 HA ASP 91 -6.808 -3.005 -9.222 730 1HB ASP 91 HB2 ASP 91 -7.030 -4.852 -7.532 731 2HB ASP 91 HB1 ASP 91 -6.967 -3.241 -6.828 732 H TYR 92 HN TYR 92 -8.984 -2.938 -11.037 733 HA TYR 92 HA TYR 92 -9.536 -5.801 -11.416 734 1HB TYR 92 HB2 TYR 92 -11.212 -3.391 -12.096 735 2HB TYR 92 HB1 TYR 92 -11.512 -4.973 -12.800 736 HD1 TYR 92 HD1 TYR 92 -13.393 -5.915 -11.881 737 HD2 TYR 92 HD2 TYR 92 -10.716 -3.820 -9.326 738 HE1 TYR 92 HE1 TYR 92 -14.771 -6.531 -9.941 739 HE2 TYR 92 HE2 TYR 92 -12.083 -4.436 -7.378 740 HH TYR 92 HH TYR 92 -13.753 -6.394 -6.845 741 H LYS 93 HN LYS 93 -8.430 -2.832 -12.973 742 HA LYS 93 HA LYS 93 -7.918 -4.456 -15.371 743 1HB LYS 93 HB2 LYS 93 -8.115 -2.343 -16.690 744 2HB LYS 93 HB1 LYS 93 -9.601 -2.922 -15.962 745 1HG LYS 93 HG2 LYS 93 -9.761 -0.704 -15.495 746 2HG LYS 93 HG1 LYS 93 -8.935 -1.264 -14.040 747 1HD LYS 93 HD2 LYS 93 -7.900 0.761 -14.909 748 2HD LYS 93 HD1 LYS 93 -6.791 -0.600 -15.017 749 1HE LYS 93 HE2 LYS 93 -7.312 -0.866 -17.379 750 2HE LYS 93 HE1 LYS 93 -8.481 0.448 -17.280 751 1HZ LYS 93 HZ1 LYS 93 -5.951 0.757 -18.046 752 2HZ LYS 93 HZ2 LYS 93 -5.797 1.089 -16.394 753 3HZ LYS 93 HZ3 LYS 93 -6.871 1.989 -17.341 754 H SER 94 HN SER 94 -6.482 -1.816 -13.376 755 HA SER 94 HA SER 94 -3.894 -2.801 -14.019 756 1HB SER 94 HB2 SER 94 -3.052 -0.965 -15.392 757 2HB SER 94 HB1 SER 94 -4.390 -1.794 -16.187 758 HG SER 94 HG SER 94 -4.257 0.779 -15.137 759 H TYR 95 HN TYR 95 -5.803 -0.226 -12.561 760 HA TYR 95 HA TYR 95 -3.458 0.294 -10.862 761 1HB TYR 95 HB2 TYR 95 -4.075 2.691 -10.802 762 2HB TYR 95 HB1 TYR 95 -3.580 2.132 -12.394 763 HD1 TYR 95 HD1 TYR 95 -4.973 2.436 -14.246 764 HD2 TYR 95 HD2 TYR 95 -6.578 2.896 -10.334 765 HE1 TYR 95 HE1 TYR 95 -7.052 3.325 -15.211 766 HE2 TYR 95 HE2 TYR 95 -8.664 3.782 -11.287 767 HH TYR 95 HH TYR 95 -9.002 4.998 -14.158 768 H ALA 96 HN ALA 96 -3.746 0.387 -8.758 769 HA ALA 96 HA ALA 96 -6.420 0.736 -7.645 770 1HB ALA 96 HB1 ALA 96 -5.018 -1.405 -6.278 771 2HB ALA 96 HB2 ALA 96 -5.371 -1.799 -7.961 772 3HB ALA 96 HB3 ALA 96 -6.677 -1.337 -6.872 773 H VAL 97 HN VAL 97 -6.450 1.447 -5.514 774 HA VAL 97 HA VAL 97 -3.852 2.124 -4.331 775 HB VAL 97 HB VAL 97 -4.557 4.282 -3.707 776 1HG1 VAL 97 HG11 VAL 97 -4.673 3.501 -6.430 777 2HG1 VAL 97 HG12 VAL 97 -4.220 5.066 -5.757 778 3HG1 VAL 97 HG13 VAL 97 -5.902 4.736 -6.174 779 1HG2 VAL 97 HG21 VAL 97 -6.672 4.239 -2.865 780 2HG2 VAL 97 HG22 VAL 97 -7.284 3.217 -4.163 781 3HG2 VAL 97 HG23 VAL 97 -7.029 4.937 -4.447 782 H ILE 98 HN ILE 98 -3.691 1.670 -2.179 783 HA ILE 98 HA ILE 98 -6.158 0.866 -0.809 784 HB ILE 98 HB ILE 98 -5.271 -1.199 -1.471 785 1HG1 ILE 98 HG12 ILE 98 -3.960 -0.999 1.195 786 2HG1 ILE 98 HG11 ILE 98 -5.697 -0.755 1.080 787 1HG2 ILE 98 HG21 ILE 98 -3.080 -0.400 -2.205 788 2HG2 ILE 98 HG22 ILE 98 -2.948 -1.854 -1.219 789 3HG2 ILE 98 HG23 ILE 98 -2.563 -0.281 -0.523 790 1HD1 ILE 98 HD11 ILE 98 -6.089 -2.935 0.474 791 2HD1 ILE 98 HD12 ILE 98 -4.750 -3.111 1.601 792 3HD1 ILE 98 HD13 ILE 98 -4.453 -3.177 -0.134 793 H TYR 99 HN TYR 99 -6.423 1.686 1.134 794 HA TYR 99 HA TYR 99 -4.206 3.131 2.383 795 1HB TYR 99 HB2 TYR 99 -6.214 4.429 2.106 796 2HB TYR 99 HB1 TYR 99 -7.191 3.170 2.850 797 HD1 TYR 99 HD1 TYR 99 -3.927 4.321 4.168 798 HD2 TYR 99 HD2 TYR 99 -8.160 4.491 4.558 799 HE1 TYR 99 HE1 TYR 99 -3.678 5.423 6.354 800 HE2 TYR 99 HE2 TYR 99 -7.920 5.591 6.742 801 HH TYR 99 HH TYR 99 -5.830 7.127 7.808 802 H ALA 100 HN ALA 100 -3.257 2.489 4.226 803 HA ALA 100 HA ALA 100 -4.369 0.117 5.573 804 1HB ALA 100 HB1 ALA 100 -2.177 -0.570 6.131 805 2HB ALA 100 HB2 ALA 100 -1.491 0.987 5.669 806 3HB ALA 100 HB3 ALA 100 -2.126 -0.097 4.432 807 H THR 101 HN THR 101 -4.572 0.040 7.751 808 HA THR 101 HA THR 101 -3.792 2.393 9.316 809 HB THR 101 HB THR 101 -5.970 2.342 10.482 810 HG1 THR 101 HG1 THR 101 -6.611 0.395 8.524 811 1HG2 THR 101 HG21 THR 101 -7.129 2.558 7.875 812 2HG2 THR 101 HG22 THR 101 -5.538 3.319 7.900 813 3HG2 THR 101 HG23 THR 101 -6.774 3.821 9.053 814 H ARG 102 HN ARG 102 -2.561 1.745 10.939 815 HA ARG 102 HA ARG 102 -2.743 -1.024 11.850 816 1HB ARG 102 HB2 ARG 102 -0.547 -0.371 11.182 817 2HB ARG 102 HB1 ARG 102 -0.613 1.080 12.165 818 1HG ARG 102 HG2 ARG 102 -0.613 -0.283 14.190 819 2HG ARG 102 HG1 ARG 102 -0.556 -1.744 13.204 820 1HD ARG 102 HD2 ARG 102 1.585 -1.027 12.267 821 2HD ARG 102 HD1 ARG 102 1.529 0.430 13.258 822 HE ARG 102 HE ARG 102 1.289 -1.792 14.940 823 1HH1 ARG 102 HH11 ARG 102 3.648 -0.283 12.862 824 2HH1 ARG 102 HH12 ARG 102 5.003 -0.848 13.778 825 1HH2 ARG 102 HH21 ARG 102 3.070 -2.539 16.150 826 2HH2 ARG 102 HH22 ARG 102 4.676 -2.130 15.645 827 H VAL 103 HN VAL 103 -3.045 -1.619 13.948 828 HA VAL 103 HA VAL 103 -3.437 0.401 16.008 829 HB VAL 103 HB VAL 103 -5.618 -1.569 15.302 830 1HG1 VAL 103 HG11 VAL 103 -5.345 0.457 17.504 831 2HG1 VAL 103 HG12 VAL 103 -5.635 -1.277 17.642 832 3HG1 VAL 103 HG13 VAL 103 -6.899 -0.219 17.015 833 1HG2 VAL 103 HG21 VAL 103 -6.948 0.378 14.686 834 2HG2 VAL 103 HG22 VAL 103 -5.492 0.273 13.697 835 3HG2 VAL 103 HG23 VAL 103 -5.575 1.434 15.022 836 H LYS 104 HN LYS 104 -2.042 -0.351 17.480 837 HA LYS 104 HA LYS 104 -2.465 -3.002 18.588 838 1HB LYS 104 HB2 LYS 104 -0.873 -3.407 16.769 839 2HB LYS 104 HB1 LYS 104 0.198 -2.175 17.421 840 1HG LYS 104 HG2 LYS 104 1.014 -4.359 18.002 841 2HG LYS 104 HG1 LYS 104 0.472 -3.522 19.459 842 1HD LYS 104 HD2 LYS 104 -1.644 -4.758 19.372 843 2HD LYS 104 HD1 LYS 104 -1.089 -5.599 17.924 844 1HE LYS 104 HE2 LYS 104 -0.789 -6.981 19.912 845 2HE LYS 104 HE1 LYS 104 0.763 -6.565 19.186 846 1HZ LYS 104 HZ1 LYS 104 0.772 -6.351 21.611 847 2HZ LYS 104 HZ2 LYS 104 -0.445 -5.180 21.519 848 3HZ LYS 104 HZ3 LYS 104 1.077 -4.870 20.850 849 H ASP 105 HN ASP 105 -1.655 -3.255 20.682 850 HA ASP 105 HA ASP 105 -1.364 -2.468 22.809 851 1HB ASP 105 HB2 ASP 105 0.855 -1.423 23.177 852 2HB ASP 105 HB1 ASP 105 0.937 -2.864 22.172 853 H GLY 106 HN GLY 106 -3.184 -0.877 21.392 854 1HA GLY 106 HA2 GLY 106 -4.303 1.108 21.632 855 2HA GLY 106 HA1 GLY 106 -3.313 1.387 23.056 856 H ARG 107 HN ARG 107 -2.502 1.152 19.589 857 HA ARG 107 HA ARG 107 -1.639 3.954 19.661 858 1HB ARG 107 HB2 ARG 107 0.502 3.538 18.799 859 2HB ARG 107 HB1 ARG 107 0.305 2.308 20.037 860 1HG ARG 107 HG2 ARG 107 -0.455 0.779 18.123 861 2HG ARG 107 HG1 ARG 107 0.233 2.002 17.060 862 1HD ARG 107 HD2 ARG 107 1.711 0.566 19.261 863 2HD ARG 107 HD1 ARG 107 1.826 0.198 17.541 864 HE ARG 107 HE ARG 107 2.444 2.895 17.879 865 1HH1 ARG 107 HH11 ARG 107 3.740 -0.225 18.758 866 2HH1 ARG 107 HH12 ARG 107 5.383 0.321 18.774 867 1HH2 ARG 107 HH21 ARG 107 4.604 3.616 17.895 868 2HH2 ARG 107 HH22 ARG 107 5.875 2.505 18.283 869 H THR 108 HN THR 108 -2.253 5.058 17.908 870 HA THR 108 HA THR 108 -3.282 3.508 15.625 871 HB THR 108 HB THR 108 -4.178 6.207 16.656 872 HG1 THR 108 HG1 THR 108 -5.473 3.685 16.672 873 1HG2 THR 108 HG21 THR 108 -4.464 5.197 14.078 874 2HG2 THR 108 HG22 THR 108 -5.337 6.544 14.808 875 3HG2 THR 108 HG23 THR 108 -6.014 4.916 14.871 876 H LEU 109 HN LEU 109 -2.408 3.837 13.694 877 HA LEU 109 HA LEU 109 -1.071 6.366 13.101 878 1HB LEU 109 HB2 LEU 109 0.896 5.199 12.166 879 2HB LEU 109 HB1 LEU 109 0.760 5.026 13.905 880 HG LEU 109 HG LEU 109 -0.145 2.914 11.955 881 1HD1 LEU 109 HD11 LEU 109 1.905 1.933 11.974 882 2HD1 LEU 109 HD12 LEU 109 2.334 2.598 13.550 883 3HD1 LEU 109 HD13 LEU 109 2.408 3.618 12.114 884 1HD2 LEU 109 HD21 LEU 109 -1.096 2.087 13.796 885 2HD2 LEU 109 HD22 LEU 109 -0.287 3.258 14.835 886 3HD2 LEU 109 HD23 LEU 109 0.536 1.767 14.379 887 H HIS 110 HN HIS 110 -1.277 6.965 10.975 888 HA HIS 110 HA HIS 110 -2.825 5.074 9.338 889 1HB HIS 110 HB2 HIS 110 -2.612 8.069 9.088 890 2HB HIS 110 HB1 HIS 110 -3.650 7.029 8.126 891 HD1 HIS 110 HD1 HIS 110 -5.215 5.425 9.948 892 HD2 HIS 110 HD2 HIS 110 -4.060 9.269 11.020 893 HE1 HIS 110 HE1 HIS 110 -6.804 6.121 11.767 894 HE2 HIS 110 HE2 HIS 110 -6.014 8.405 12.477 895 H MET 111 HN MET 111 -2.236 4.486 7.332 896 HA MET 111 HA MET 111 -0.062 5.756 5.931 897 1HB MET 111 HB2 MET 111 0.225 2.889 6.847 898 2HB MET 111 HB1 MET 111 1.312 3.724 5.748 899 1HG MET 111 HG2 MET 111 1.858 5.312 7.551 900 2HG MET 111 HG1 MET 111 0.835 4.386 8.643 901 1HE MET 111 HE1 MET 111 4.751 2.983 6.720 902 2HE MET 111 HE2 MET 111 3.650 4.225 6.123 903 3HE MET 111 HE3 MET 111 3.255 2.520 5.911 904 H MET 112 HN MET 112 -0.470 5.678 3.836 905 HA MET 112 HA MET 112 -2.500 3.832 2.822 906 1HB MET 112 HB2 MET 112 -1.411 6.449 1.801 907 2HB MET 112 HB1 MET 112 -2.374 5.393 0.786 908 1HG MET 112 HG2 MET 112 -3.812 7.055 1.651 909 2HG MET 112 HG1 MET 112 -4.194 5.550 2.484 910 1HE MET 112 HE1 MET 112 -5.579 7.155 3.983 911 2HE MET 112 HE2 MET 112 -4.920 8.747 3.606 912 3HE MET 112 HE3 MET 112 -4.899 8.156 5.268 913 H ARG 113 HN ARG 113 -2.150 2.801 0.758 914 HA ARG 113 HA ARG 113 0.607 2.651 -0.187 915 1HB ARG 113 HB2 ARG 113 0.406 0.854 1.493 916 2HB ARG 113 HB1 ARG 113 -0.988 0.209 0.636 917 1HG ARG 113 HG2 ARG 113 0.410 -0.298 -1.288 918 2HG ARG 113 HG1 ARG 113 1.812 0.385 -0.461 919 1HD ARG 113 HD2 ARG 113 0.193 -1.987 0.462 920 2HD ARG 113 HD1 ARG 113 1.774 -2.059 -0.313 921 HE ARG 113 HE ARG 113 1.949 -0.430 1.970 922 1HH1 ARG 113 HH11 ARG 113 1.493 -3.776 1.096 923 2HH1 ARG 113 HH12 ARG 113 2.198 -4.387 2.554 924 1HH2 ARG 113 HH21 ARG 113 2.880 -1.237 3.901 925 2HH2 ARG 113 HH22 ARG 113 2.984 -2.949 4.144 926 H LEU 114 HN LEU 114 0.686 2.519 -2.373 927 HA LEU 114 HA LEU 114 -1.871 2.028 -3.755 928 1HB LEU 114 HB2 LEU 114 -0.943 4.344 -3.847 929 2HB LEU 114 HB1 LEU 114 0.450 3.704 -4.693 930 HG LEU 114 HG LEU 114 -2.381 3.553 -5.731 931 1HD1 LEU 114 HD11 LEU 114 -1.292 5.870 -5.484 932 2HD1 LEU 114 HD12 LEU 114 -1.970 5.424 -7.050 933 3HD1 LEU 114 HD13 LEU 114 -0.227 5.347 -6.788 934 1HD2 LEU 114 HD21 LEU 114 0.282 2.695 -6.774 935 2HD2 LEU 114 HD22 LEU 114 -0.970 3.222 -7.899 936 3HD2 LEU 114 HD23 LEU 114 -1.268 1.856 -6.824 937 H TYR 115 HN TYR 115 -1.955 0.205 -4.854 938 HA TYR 115 HA TYR 115 0.535 -0.999 -5.823 939 1HB TYR 115 HB2 TYR 115 -2.219 -2.156 -5.381 940 2HB TYR 115 HB1 TYR 115 -0.922 -3.036 -6.180 941 HD1 TYR 115 HD1 TYR 115 1.366 -3.041 -4.782 942 HD2 TYR 115 HD2 TYR 115 -2.520 -2.538 -3.121 943 HE1 TYR 115 HE1 TYR 115 2.201 -3.823 -2.607 944 HE2 TYR 115 HE2 TYR 115 -1.690 -3.318 -0.939 945 HH TYR 115 HH TYR 115 0.387 -4.911 -0.221 946 H SER 116 HN SER 116 1.052 -0.763 -7.893 947 HA SER 116 HA SER 116 -1.118 -0.244 -9.820 948 1HB SER 116 HB2 SER 116 0.533 1.031 -11.147 949 2HB SER 116 HB1 SER 116 0.324 1.711 -9.534 950 HG SER 116 HG SER 116 2.557 1.408 -10.355 951 H ARG 117 HN ARG 117 -1.355 -1.610 -11.468 952 HA ARG 117 HA ARG 117 0.096 -4.017 -11.631 953 1HB ARG 117 HB2 ARG 117 -1.826 -2.660 -13.509 954 2HB ARG 117 HB1 ARG 117 -1.062 -4.184 -13.920 955 1HG ARG 117 HG2 ARG 117 -3.360 -4.362 -12.959 956 2HG ARG 117 HG1 ARG 117 -2.125 -5.309 -12.135 957 1HD ARG 117 HD2 ARG 117 -2.020 -3.752 -10.336 958 2HD ARG 117 HD1 ARG 117 -2.999 -2.581 -11.211 959 HE ARG 117 HE ARG 117 -4.825 -3.604 -10.346 960 1HH1 ARG 117 HH11 ARG 117 -2.249 -5.958 -10.449 961 2HH1 ARG 117 HH12 ARG 117 -3.225 -7.234 -9.807 962 1HH2 ARG 117 HH21 ARG 117 -6.103 -5.279 -9.499 963 2HH2 ARG 117 HH22 ARG 117 -5.413 -6.850 -9.267 964 H SER 118 HN SER 118 0.236 -1.048 -13.560 965 HA SER 118 HA SER 118 2.870 -1.906 -14.541 966 1HB SER 118 HB2 SER 118 0.727 -0.546 -16.195 967 2HB SER 118 HB1 SER 118 2.364 -0.910 -16.740 968 HG SER 118 HG SER 118 0.221 -2.493 -16.753 969 HA PRO 119 HA PRO 119 4.599 1.881 -13.144 970 1HB PRO 119 HB2 PRO 119 5.800 2.671 -15.586 971 2HB PRO 119 HB1 PRO 119 6.558 1.775 -14.269 972 1HG PRO 119 HG2 PRO 119 5.378 0.778 -16.804 973 2HG PRO 119 HG1 PRO 119 6.726 0.127 -15.854 974 1HD PRO 119 HD2 PRO 119 4.324 -1.060 -15.865 975 2HD PRO 119 HD1 PRO 119 5.313 -0.994 -14.391 976 H GLU 120 HN GLU 120 3.103 2.004 -16.359 977 HA GLU 120 HA GLU 120 2.624 4.800 -16.331 978 1HB GLU 120 HB2 GLU 120 2.753 3.552 -18.418 979 2HB GLU 120 HB1 GLU 120 1.352 2.597 -17.959 980 1HG GLU 120 HG2 GLU 120 0.772 4.299 -19.591 981 2HG GLU 120 HG1 GLU 120 -0.058 4.569 -18.062 982 H VAL 121 HN VAL 121 1.711 4.813 -14.076 983 HA VAL 121 HA VAL 121 -0.868 3.739 -13.575 984 HB VAL 121 HB VAL 121 0.542 6.023 -12.182 985 1HG1 VAL 121 HG11 VAL 121 -0.968 5.444 -10.286 986 2HG1 VAL 121 HG12 VAL 121 -1.859 4.384 -11.378 987 3HG1 VAL 121 HG13 VAL 121 -1.805 6.120 -11.684 988 1HG2 VAL 121 HG21 VAL 121 0.524 3.052 -11.734 989 2HG2 VAL 121 HG22 VAL 121 0.969 4.192 -10.465 990 3HG2 VAL 121 HG23 VAL 121 1.909 4.121 -11.956 991 H SER 122 HN SER 122 -2.817 4.458 -14.114 992 HA SER 122 HA SER 122 -3.202 6.614 -15.883 993 1HB SER 122 HB2 SER 122 -4.733 4.694 -15.780 994 2HB SER 122 HB1 SER 122 -5.228 5.169 -14.156 995 HG SER 122 HG SER 122 -6.545 6.558 -15.004 996 HA PRO 123 HA PRO 123 -3.417 10.267 -13.409 997 1HB PRO 123 HB2 PRO 123 -5.795 11.322 -14.460 998 2HB PRO 123 HB1 PRO 123 -4.167 11.612 -15.081 999 1HG PRO 123 HG2 PRO 123 -6.236 9.678 -16.010 1000 2HG PRO 123 HG1 PRO 123 -5.072 10.620 -16.959 1001 1HD PRO 123 HD2 PRO 123 -4.691 8.017 -16.519 1002 2HD PRO 123 HD1 PRO 123 -3.324 9.152 -16.493 1003 H ALA 124 HN ALA 124 -6.380 8.366 -13.825 1004 HA ALA 124 HA ALA 124 -7.839 9.453 -11.686 1005 1HB ALA 124 HB1 ALA 124 -9.231 8.209 -12.976 1006 2HB ALA 124 HB2 ALA 124 -8.852 6.984 -11.764 1007 3HB ALA 124 HB3 ALA 124 -8.007 6.986 -13.313 1008 H ALA 125 HN ALA 125 -5.816 6.541 -11.842 1009 HA ALA 125 HA ALA 125 -6.164 5.631 -9.265 1010 1HB ALA 125 HB1 ALA 125 -3.424 5.460 -10.338 1011 2HB ALA 125 HB2 ALA 125 -4.710 4.802 -11.347 1012 3HB ALA 125 HB3 ALA 125 -4.481 4.200 -9.704 1013 H THR 126 HN THR 126 -3.713 7.940 -10.433 1014 HA THR 126 HA THR 126 -2.687 8.396 -7.790 1015 HB THR 126 HB THR 126 -1.315 10.134 -8.860 1016 HG1 THR 126 HG1 THR 126 -2.699 9.461 -11.241 1017 1HG2 THR 126 HG21 THR 126 0.098 8.599 -9.560 1018 2HG2 THR 126 HG22 THR 126 -0.915 8.230 -10.955 1019 3HG2 THR 126 HG23 THR 126 -1.191 7.404 -9.421 1020 H ALA 127 HN ALA 127 -4.641 10.299 -10.072 1021 HA ALA 127 HA ALA 127 -4.941 12.535 -8.378 1022 1HB ALA 127 HB1 ALA 127 -5.319 12.477 -10.861 1023 2HB ALA 127 HB2 ALA 127 -6.534 13.344 -9.921 1024 3HB ALA 127 HB3 ALA 127 -6.875 11.721 -10.528 1025 H ILE 128 HN ILE 128 -7.175 9.831 -9.063 1026 HA ILE 128 HA ILE 128 -9.175 10.683 -7.296 1027 HB ILE 128 HB ILE 128 -8.548 7.852 -8.146 1028 1HG1 ILE 128 HG12 ILE 128 -10.575 9.843 -9.195 1029 2HG1 ILE 128 HG11 ILE 128 -9.082 9.388 -10.009 1030 1HG2 ILE 128 HG21 ILE 128 -11.065 8.971 -6.919 1031 2HG2 ILE 128 HG22 ILE 128 -9.890 7.956 -6.085 1032 3HG2 ILE 128 HG23 ILE 128 -10.807 7.306 -7.443 1033 1HD1 ILE 128 HD11 ILE 128 -11.618 7.895 -9.713 1034 2HD1 ILE 128 HD12 ILE 128 -10.116 6.971 -9.739 1035 3HD1 ILE 128 HD13 ILE 128 -10.525 8.026 -11.092 1036 H PHE 129 HN PHE 129 -6.276 8.734 -6.774 1037 HA PHE 129 HA PHE 129 -6.895 7.928 -4.131 1038 1HB PHE 129 HB2 PHE 129 -5.098 6.797 -5.246 1039 2HB PHE 129 HB1 PHE 129 -4.251 8.310 -5.555 1040 HD1 PHE 129 HD1 PHE 129 -2.311 8.492 -4.343 1041 HD2 PHE 129 HD2 PHE 129 -5.697 6.658 -2.525 1042 HE1 PHE 129 HE1 PHE 129 -1.033 8.205 -2.260 1043 HE2 PHE 129 HE2 PHE 129 -4.423 6.369 -0.439 1044 HZ PHE 129 HZ PHE 129 -2.089 7.146 -0.304 1045 H ARG 130 HN ARG 130 -5.106 10.674 -5.459 1046 HA ARG 130 HA ARG 130 -4.539 11.904 -2.967 1047 1HB ARG 130 HB2 ARG 130 -3.238 12.427 -4.963 1048 2HB ARG 130 HB1 ARG 130 -4.668 13.046 -5.767 1049 1HG ARG 130 HG2 ARG 130 -3.697 14.282 -3.219 1050 2HG ARG 130 HG1 ARG 130 -2.971 14.706 -4.770 1051 1HD ARG 130 HD2 ARG 130 -5.298 15.219 -5.589 1052 2HD ARG 130 HD1 ARG 130 -5.843 15.047 -3.923 1053 HE ARG 130 HE ARG 130 -3.724 16.861 -3.959 1054 1HH1 ARG 130 HH11 ARG 130 -7.010 16.610 -5.109 1055 2HH1 ARG 130 HH12 ARG 130 -7.294 18.317 -5.049 1056 1HH2 ARG 130 HH21 ARG 130 -4.096 19.107 -3.880 1057 2HH2 ARG 130 HH22 ARG 130 -5.639 19.735 -4.352 1058 H LYS 131 HN LYS 131 -7.059 12.335 -5.401 1059 HA LYS 131 HA LYS 131 -8.435 14.462 -4.176 1060 1HB LYS 131 HB2 LYS 131 -8.767 13.709 -6.533 1061 2HB LYS 131 HB1 LYS 131 -9.572 12.270 -5.924 1062 1HG LYS 131 HG2 LYS 131 -11.323 13.642 -4.939 1063 2HG LYS 131 HG1 LYS 131 -10.508 15.100 -5.504 1064 1HD LYS 131 HD2 LYS 131 -12.325 14.538 -7.004 1065 2HD LYS 131 HD1 LYS 131 -10.779 14.331 -7.828 1066 1HE LYS 131 HE2 LYS 131 -10.891 11.915 -7.408 1067 2HE LYS 131 HE1 LYS 131 -12.445 12.133 -6.604 1068 1HZ LYS 131 HZ1 LYS 131 -12.429 11.429 -9.051 1069 2HZ LYS 131 HZ2 LYS 131 -12.046 13.042 -9.383 1070 3HZ LYS 131 HZ3 LYS 131 -13.490 12.664 -8.588 1071 H LEU 132 HN LEU 132 -8.827 10.955 -4.001 1072 HA LEU 132 HA LEU 132 -11.020 10.949 -2.219 1073 1HB LEU 132 HB2 LEU 132 -10.321 9.029 -3.645 1074 2HB LEU 132 HB1 LEU 132 -8.918 8.816 -2.617 1075 HG LEU 132 HG LEU 132 -11.737 8.633 -1.567 1076 1HD1 LEU 132 HD11 LEU 132 -11.638 6.922 -3.183 1077 2HD1 LEU 132 HD12 LEU 132 -11.275 6.137 -1.645 1078 3HD1 LEU 132 HD13 LEU 132 -9.972 6.519 -2.771 1079 1HD2 LEU 132 HD21 LEU 132 -10.561 8.716 0.343 1080 2HD2 LEU 132 HD22 LEU 132 -9.035 8.354 -0.461 1081 3HD2 LEU 132 HD23 LEU 132 -10.140 7.046 -0.039 1082 H ALA 133 HN ALA 133 -7.541 11.032 -1.799 1083 HA ALA 133 HA ALA 133 -7.333 10.456 0.917 1084 1HB ALA 133 HB1 ALA 133 -5.432 12.425 0.485 1085 2HB ALA 133 HB2 ALA 133 -5.680 11.720 -1.112 1086 3HB ALA 133 HB3 ALA 133 -5.214 10.692 0.241 1087 H GLY 134 HN GLY 134 -8.048 13.495 -0.743 1088 1HA GLY 134 HA2 GLY 134 -8.090 15.137 1.557 1089 2HA GLY 134 HA1 GLY 134 -8.869 15.501 0.023 1090 H GLU 135 HN GLU 135 -10.653 13.374 -0.139 1091 HA GLU 135 HA GLU 135 -12.851 14.296 1.276 1092 1HB GLU 135 HB2 GLU 135 -12.396 11.486 0.252 1093 2HB GLU 135 HB1 GLU 135 -13.954 12.201 0.643 1094 1HG GLU 135 HG2 GLU 135 -12.091 13.117 -1.537 1095 2HG GLU 135 HG1 GLU 135 -13.561 12.168 -1.752 1096 H ARG 136 HN ARG 136 -10.493 11.833 2.108 1097 HA ARG 136 HA ARG 136 -11.826 10.888 4.435 1098 1HB ARG 136 HB2 ARG 136 -8.904 10.750 3.673 1099 2HB ARG 136 HB1 ARG 136 -9.652 9.843 4.982 1100 1HG ARG 136 HG2 ARG 136 -10.287 9.591 2.051 1101 2HG ARG 136 HG1 ARG 136 -9.364 8.447 3.029 1102 1HD ARG 136 HD2 ARG 136 -11.321 8.030 4.414 1103 2HD ARG 136 HD1 ARG 136 -12.244 9.212 3.487 1104 HE ARG 136 HE ARG 136 -11.259 7.285 1.718 1105 1HH1 ARG 136 HH11 ARG 136 -13.527 7.546 4.355 1106 2HH1 ARG 136 HH12 ARG 136 -14.555 6.284 3.765 1107 1HH2 ARG 136 HH21 ARG 136 -12.617 5.622 0.934 1108 2HH2 ARG 136 HH22 ARG 136 -14.039 5.192 1.824 1109 H ASN 137 HN ASN 137 -9.273 13.278 3.867 1110 HA ASN 137 HA ASN 137 -10.018 14.835 6.104 1111 1HB ASN 137 HB2 ASN 137 -8.925 12.961 7.308 1112 2HB ASN 137 HB1 ASN 137 -7.441 13.283 6.415 1113 1HD2 ASN 137 HD21 ASN 137 -6.023 14.263 7.623 1114 2HD2 ASN 137 HD22 ASN 137 -6.334 15.497 8.791 1115 H TYR 138 HN TYR 138 -7.190 13.927 4.115 1116 HA TYR 138 HA TYR 138 -7.078 16.284 2.647 1117 1HB TYR 138 HB2 TYR 138 -6.491 17.063 5.104 1118 2HB TYR 138 HB1 TYR 138 -4.901 16.433 4.692 1119 HD1 TYR 138 HD1 TYR 138 -7.406 18.282 2.640 1120 HD2 TYR 138 HD2 TYR 138 -3.506 18.268 4.344 1121 HE1 TYR 138 HE1 TYR 138 -6.895 20.385 1.469 1122 HE2 TYR 138 HE2 TYR 138 -2.987 20.369 3.178 1123 HH TYR 138 HH TYR 138 -3.873 21.542 1.010 1124 H THR 139 HN THR 139 -4.555 16.634 1.920 1125 HA THR 139 HA THR 139 -3.673 13.921 1.230 1126 HB THR 139 HB THR 139 -4.065 15.003 -0.785 1127 HG1 THR 139 HG1 THR 139 -1.354 15.658 -0.355 1128 1HG2 THR 139 HG21 THR 139 -2.645 17.373 -0.938 1129 2HG2 THR 139 HG22 THR 139 -3.421 17.441 0.641 1130 3HG2 THR 139 HG23 THR 139 -4.397 17.203 -0.803 1131 H ASP 140 HN ASP 140 -1.965 17.079 1.601 1132 HA ASP 140 HA ASP 140 0.495 15.916 2.242 1133 1HB ASP 140 HB2 ASP 140 -0.550 18.646 3.050 1134 2HB ASP 140 HB1 ASP 140 1.136 18.140 3.119 1135 H GLU 141 HN GLU 141 -2.221 16.830 4.274 1136 HA GLU 141 HA GLU 141 -1.120 16.597 6.802 1137 1HB GLU 141 HB2 GLU 141 -3.521 17.217 6.213 1138 2HB GLU 141 HB1 GLU 141 -3.837 15.501 6.022 1139 1HG GLU 141 HG2 GLU 141 -4.588 16.177 8.171 1140 2HG GLU 141 HG1 GLU 141 -3.151 15.175 8.386 1141 H MET 142 HN MET 142 -2.168 14.173 4.521 1142 HA MET 142 HA MET 142 -0.754 12.092 6.030 1143 1HB MET 142 HB2 MET 142 -2.528 10.477 5.377 1144 2HB MET 142 HB1 MET 142 -3.101 11.719 6.481 1145 1HG MET 142 HG2 MET 142 -4.071 12.929 4.553 1146 2HG MET 142 HG1 MET 142 -3.567 11.599 3.512 1147 1HE MET 142 HE1 MET 142 -5.442 12.560 6.673 1148 2HE MET 142 HE2 MET 142 -5.085 10.933 7.253 1149 3HE MET 142 HE3 MET 142 -6.737 11.373 6.823 1150 H VAL 143 HN VAL 143 0.814 12.995 4.307 1151 HA VAL 143 HA VAL 143 0.369 11.600 1.738 1152 HB VAL 143 HB VAL 143 0.520 14.073 1.531 1153 1HG1 VAL 143 HG11 VAL 143 2.592 15.227 1.961 1154 2HG1 VAL 143 HG12 VAL 143 3.381 13.724 2.436 1155 3HG1 VAL 143 HG13 VAL 143 2.095 14.402 3.437 1156 1HG2 VAL 143 HG21 VAL 143 1.541 12.220 -0.106 1157 2HG2 VAL 143 HG22 VAL 143 3.018 13.112 0.254 1158 3HG2 VAL 143 HG23 VAL 143 1.634 13.945 -0.455 1159 H ALA 144 HN ALA 144 2.289 10.896 0.597 1160 HA ALA 144 HA ALA 144 4.834 10.645 1.728 1161 1HB ALA 144 HB1 ALA 144 4.762 8.795 2.955 1162 2HB ALA 144 HB2 ALA 144 4.051 7.894 1.621 1163 3HB ALA 144 HB3 ALA 144 3.012 8.756 2.756 1164 H MET 145 HN MET 145 6.303 9.943 0.118 1165 HA MET 145 HA MET 145 5.091 8.853 -2.328 1166 1HB MET 145 HB2 MET 145 7.008 11.184 -2.275 1167 2HB MET 145 HB1 MET 145 6.389 10.401 -3.722 1168 1HG MET 145 HG2 MET 145 4.141 11.114 -3.174 1169 2HG MET 145 HG1 MET 145 4.714 11.831 -1.670 1170 1HE MET 145 HE1 MET 145 6.839 12.451 -5.247 1171 2HE MET 145 HE2 MET 145 5.419 13.241 -5.934 1172 3HE MET 145 HE3 MET 145 5.307 11.582 -5.346 1173 H LEU 146 HN LEU 146 6.269 7.412 -3.460 1174 HA LEU 146 HA LEU 146 8.084 5.756 -2.455 1175 1HB LEU 146 HB2 LEU 146 7.167 5.547 -4.722 1176 2HB LEU 146 HB1 LEU 146 8.202 6.856 -5.269 1177 HG LEU 146 HG LEU 146 10.175 5.415 -4.580 1178 1HD1 LEU 146 HD11 LEU 146 8.747 2.932 -4.899 1179 2HD1 LEU 146 HD12 LEU 146 8.174 3.825 -3.491 1180 3HD1 LEU 146 HD13 LEU 146 9.885 3.430 -3.647 1181 1HD2 LEU 146 HD21 LEU 146 9.150 3.756 -6.653 1182 2HD2 LEU 146 HD22 LEU 146 10.323 5.066 -6.763 1183 3HD2 LEU 146 HD23 LEU 146 8.602 5.409 -6.937 1184 HA PRO 147 HA PRO 147 11.619 8.210 -1.379 1185 1HB PRO 147 HB2 PRO 147 13.374 6.105 -1.061 1186 2HB PRO 147 HB1 PRO 147 12.252 6.679 0.174 1187 1HG PRO 147 HG2 PRO 147 11.995 4.364 -1.693 1188 2HG PRO 147 HG1 PRO 147 11.509 4.503 0.003 1189 1HD PRO 147 HD2 PRO 147 9.735 4.659 -2.018 1190 2HD PRO 147 HD1 PRO 147 9.540 5.581 -0.510 1191 H ARG 148 HN ARG 148 13.292 9.120 -2.476 1192 HA ARG 148 HA ARG 148 14.673 7.768 -4.593 1193 1HB ARG 148 HB2 ARG 148 13.911 9.177 -6.433 1194 2HB ARG 148 HB1 ARG 148 12.554 8.310 -5.726 1195 1HG ARG 148 HG2 ARG 148 12.126 10.427 -4.370 1196 2HG ARG 148 HG1 ARG 148 13.246 11.216 -5.480 1197 1HD ARG 148 HD2 ARG 148 10.713 9.773 -6.246 1198 2HD ARG 148 HD1 ARG 148 10.935 11.521 -6.192 1199 HE ARG 148 HE ARG 148 12.874 10.436 -7.890 1200 1HH1 ARG 148 HH11 ARG 148 9.419 10.887 -7.742 1201 2HH1 ARG 148 HH12 ARG 148 9.225 10.951 -9.462 1202 1HH2 ARG 148 HH21 ARG 148 12.628 10.521 -10.153 1203 2HH2 ARG 148 HH22 ARG 148 11.051 10.742 -10.833 1204 H GLN 149 HN GLN 149 15.999 8.685 -2.598 1205 HA GLN 149 HA GLN 149 17.247 11.164 -3.564 1206 1HB GLN 149 HB2 GLN 149 15.576 11.316 -1.485 1207 2HB GLN 149 HB1 GLN 149 17.012 10.801 -0.613 1208 1HG GLN 149 HG2 GLN 149 18.240 12.722 -1.527 1209 2HG GLN 149 HG1 GLN 149 16.776 13.240 -2.363 1210 1HE2 GLN 149 HE21 GLN 149 18.609 13.764 0.286 1211 2HE2 GLN 149 HE22 GLN 149 17.418 14.422 1.350 1212 H GLU 150 HN GLU 150 18.892 11.021 -0.935 1213 HA GLU 150 HA GLU 150 21.214 9.888 -1.835 1214 1HB GLU 150 HB2 GLU 150 20.251 9.856 1.041 1215 2HB GLU 150 HB1 GLU 150 21.923 9.738 0.510 1216 1HG GLU 150 HG2 GLU 150 21.870 11.983 -0.328 1217 2HG GLU 150 HG1 GLU 150 20.146 12.113 0.020 1218 H GLU 151 HN GLU 151 20.988 8.034 0.876 1219 HA GLU 151 HA GLU 151 20.884 5.627 -0.665 1220 1HB GLU 151 HB2 GLU 151 21.114 4.536 1.649 1221 2HB GLU 151 HB1 GLU 151 22.439 5.549 1.100 1222 1HG GLU 151 HG2 GLU 151 21.647 7.375 2.488 1223 2HG GLU 151 HG1 GLU 151 20.277 6.397 3.017 1224 H CYS 152 HN CYS 152 19.362 4.883 2.215 1225 HA CYS 152 HA CYS 152 16.837 4.445 0.877 1226 1HB CYS 152 HB2 CYS 152 17.742 3.821 3.698 1227 2HB CYS 152 HB1 CYS 152 16.217 3.296 2.984 1228 H THR 153 HN THR 153 16.385 6.761 0.567 1229 HA THR 153 HA THR 153 14.760 7.781 2.732 1230 HB THR 153 HB THR 153 16.918 8.644 3.392 1231 HG1 THR 153 HG1 THR 153 15.476 10.723 2.119 1232 1HG2 THR 153 HG21 THR 153 17.291 9.074 0.559 1233 2HG2 THR 153 HG22 THR 153 18.480 8.992 1.857 1234 3HG2 THR 153 HG23 THR 153 17.658 10.514 1.507 1235 H VAL 154 HN VAL 154 13.212 9.214 2.115 1236 HA VAL 154 HA VAL 154 12.577 9.319 -0.675 1237 HB VAL 154 HB VAL 154 10.541 10.465 -0.017 1238 1HG1 VAL 154 HG11 VAL 154 9.769 8.757 1.772 1239 2HG1 VAL 154 HG12 VAL 154 11.370 8.054 1.543 1240 3HG1 VAL 154 HG13 VAL 154 10.256 8.176 0.180 1241 1HG2 VAL 154 HG21 VAL 154 10.066 11.091 2.269 1242 2HG2 VAL 154 HG22 VAL 154 11.532 11.911 1.729 1243 3HG2 VAL 154 HG23 VAL 154 11.642 10.508 2.793 1244 H ASP 155 HN ASP 155 12.430 11.067 -2.015 1245 HA ASP 155 HA ASP 155 14.358 13.066 -1.842 1246 1HB ASP 155 HB2 ASP 155 13.320 12.375 -3.954 1247 2HB ASP 155 HB1 ASP 155 11.785 13.068 -3.441 1248 H GLU 156 HN GLU 156 14.387 15.133 -1.114 1249 HA GLU 156 HA GLU 156 12.138 16.687 -0.468 1250 1HB GLU 156 HB2 GLU 156 11.733 15.171 1.334 1251 2HB GLU 156 HB1 GLU 156 13.421 15.203 1.822 1252 1HG GLU 156 HG2 GLU 156 13.192 17.534 2.493 1253 2HG GLU 156 HG1 GLU 156 11.503 17.517 1.987 1254 H VAL 157 HN VAL 157 12.738 18.766 -0.296 1255 HA VAL 157 HA VAL 157 14.054 20.621 -0.213 1256 HB VAL 157 HB VAL 157 15.829 18.929 1.557 1257 1HG1 VAL 157 HG11 VAL 157 16.211 21.372 2.487 1258 2HG1 VAL 157 HG12 VAL 157 15.795 21.810 0.829 1259 3HG1 VAL 157 HG13 VAL 157 17.159 20.736 1.143 1260 1HG2 VAL 157 HG21 VAL 157 13.243 19.478 2.065 1261 2HG2 VAL 157 HG22 VAL 157 14.001 20.926 2.728 1262 3HG2 VAL 157 HG23 VAL 157 14.475 19.334 3.319 Start of MODEL 2 1 1H MET 1 HT1 MET 1 -19.974 -5.669 -18.777 2 2H MET 1 HT2 MET 1 -20.522 -6.621 -20.062 3 3H MET 1 HT3 MET 1 -19.218 -7.143 -19.119 4 HA MET 1 HA MET 1 -21.756 -6.607 -17.776 5 1HB MET 1 HB2 MET 1 -22.645 -8.782 -18.335 6 2HB MET 1 HB1 MET 1 -22.325 -7.903 -19.822 7 1HG MET 1 HG2 MET 1 -20.470 -9.962 -18.653 8 2HG MET 1 HG1 MET 1 -21.698 -10.311 -19.866 9 1HE MET 1 HE1 MET 1 -19.681 -11.455 -20.690 10 2HE MET 1 HE2 MET 1 -18.102 -10.669 -20.689 11 3HE MET 1 HE3 MET 1 -19.019 -10.803 -22.189 12 H THR 2 HN THR 2 -21.662 -7.304 -15.717 13 HA THR 2 HA THR 2 -19.221 -8.030 -14.556 14 HB THR 2 HB THR 2 -20.983 -6.941 -13.279 15 HG1 THR 2 HG1 THR 2 -20.538 -9.533 -12.228 16 1HG2 THR 2 HG21 THR 2 -22.963 -8.080 -12.531 17 2HG2 THR 2 HG22 THR 2 -22.511 -9.527 -13.432 18 3HG2 THR 2 HG23 THR 2 -22.931 -8.047 -14.294 19 H VAL 3 HN VAL 3 -18.270 -9.936 -14.085 20 HA VAL 3 HA VAL 3 -19.729 -12.416 -14.112 21 HB VAL 3 HB VAL 3 -18.376 -13.493 -15.866 22 1HG1 VAL 3 HG11 VAL 3 -19.612 -12.692 -17.712 23 2HG1 VAL 3 HG12 VAL 3 -19.750 -11.078 -17.014 24 3HG1 VAL 3 HG13 VAL 3 -20.629 -12.428 -16.297 25 1HG2 VAL 3 HG21 VAL 3 -16.406 -12.349 -16.129 26 2HG2 VAL 3 HG22 VAL 3 -17.183 -10.769 -16.035 27 3HG2 VAL 3 HG23 VAL 3 -17.317 -11.732 -17.507 28 HA PRO 4 HA PRO 4 -16.642 -13.353 -11.066 29 1HB PRO 4 HB2 PRO 4 -17.034 -16.159 -11.962 30 2HB PRO 4 HB1 PRO 4 -17.156 -15.468 -10.341 31 1HG PRO 4 HG2 PRO 4 -19.342 -16.149 -11.704 32 2HG PRO 4 HG1 PRO 4 -19.312 -14.695 -10.688 33 1HD PRO 4 HD2 PRO 4 -19.141 -14.938 -13.661 34 2HD PRO 4 HD1 PRO 4 -19.952 -13.707 -12.672 35 H ASP 5 HN ASP 5 -14.470 -13.684 -11.021 36 HA ASP 5 HA ASP 5 -13.037 -15.286 -12.840 37 1HB ASP 5 HB2 ASP 5 -11.891 -13.547 -14.142 38 2HB ASP 5 HB1 ASP 5 -13.624 -13.535 -14.450 39 H ARG 6 HN ARG 6 -11.126 -15.768 -11.956 40 HA ARG 6 HA ARG 6 -10.399 -14.707 -9.441 41 1HB ARG 6 HB2 ARG 6 -8.807 -16.428 -11.352 42 2HB ARG 6 HB1 ARG 6 -8.373 -16.116 -9.677 43 1HG ARG 6 HG2 ARG 6 -10.449 -17.192 -8.945 44 2HG ARG 6 HG1 ARG 6 -10.862 -17.520 -10.627 45 1HD ARG 6 HD2 ARG 6 -8.842 -18.896 -10.845 46 2HD ARG 6 HD1 ARG 6 -8.446 -18.571 -9.157 47 HE ARG 6 HE ARG 6 -11.031 -19.631 -9.265 48 1HH1 ARG 6 HH11 ARG 6 -7.741 -20.648 -9.846 49 2HH1 ARG 6 HH12 ARG 6 -8.057 -22.305 -9.456 50 1HH2 ARG 6 HH21 ARG 6 -11.444 -21.804 -8.754 51 2HH2 ARG 6 HH22 ARG 6 -10.159 -22.962 -8.836 52 H SER 7 HN SER 7 -9.449 -13.963 -12.711 53 HA SER 7 HA SER 7 -7.050 -12.654 -12.409 54 1HB SER 7 HB2 SER 7 -7.696 -11.315 -14.388 55 2HB SER 7 HB1 SER 7 -8.105 -13.017 -14.591 56 HG SER 7 HG SER 7 -10.253 -12.483 -14.001 57 H GLU 8 HN GLU 8 -10.251 -11.554 -11.528 58 HA GLU 8 HA GLU 8 -10.014 -8.856 -11.291 59 1HB GLU 8 HB2 GLU 8 -11.629 -8.952 -9.476 60 2HB GLU 8 HB1 GLU 8 -12.042 -10.129 -10.718 61 1HG GLU 8 HG2 GLU 8 -10.956 -11.879 -9.333 62 2HG GLU 8 HG1 GLU 8 -10.730 -10.675 -8.069 63 H ILE 9 HN ILE 9 -8.460 -11.279 -9.340 64 HA ILE 9 HA ILE 9 -6.850 -9.199 -8.073 65 HB ILE 9 HB ILE 9 -8.171 -11.436 -6.520 66 1HG1 ILE 9 HG12 ILE 9 -9.646 -9.495 -7.073 67 2HG1 ILE 9 HG11 ILE 9 -9.376 -9.701 -5.347 68 1HG2 ILE 9 HG21 ILE 9 -6.168 -9.345 -5.683 69 2HG2 ILE 9 HG22 ILE 9 -5.971 -11.096 -5.642 70 3HG2 ILE 9 HG23 ILE 9 -7.108 -10.310 -4.553 71 1HD1 ILE 9 HD11 ILE 9 -7.566 -7.949 -5.566 72 2HD1 ILE 9 HD12 ILE 9 -9.231 -7.400 -5.759 73 3HD1 ILE 9 HD13 ILE 9 -8.210 -7.632 -7.176 74 H ALA 10 HN ALA 10 -5.757 -10.373 -10.069 75 HA ALA 10 HA ALA 10 -3.796 -12.183 -8.925 76 1HB ALA 10 HB1 ALA 10 -5.916 -13.306 -10.245 77 2HB ALA 10 HB2 ALA 10 -4.341 -14.059 -9.998 78 3HB ALA 10 HB3 ALA 10 -4.685 -13.203 -11.501 79 H GLY 11 HN GLY 11 -1.815 -11.618 -9.608 80 1HA GLY 11 HA2 GLY 11 -0.737 -11.297 -12.003 81 2HA GLY 11 HA1 GLY 11 -1.608 -9.778 -11.874 82 H LYS 12 HN LYS 12 -0.110 -8.255 -11.575 83 HA LYS 12 HA LYS 12 1.820 -8.636 -9.386 84 1HB LYS 12 HB2 LYS 12 2.970 -8.840 -11.534 85 2HB LYS 12 HB1 LYS 12 2.328 -7.281 -12.037 86 1HG LYS 12 HG2 LYS 12 3.588 -6.183 -10.258 87 2HG LYS 12 HG1 LYS 12 4.224 -7.748 -9.746 88 1HD LYS 12 HD2 LYS 12 5.291 -8.028 -11.931 89 2HD LYS 12 HD1 LYS 12 4.656 -6.464 -12.443 90 1HE LYS 12 HE2 LYS 12 5.920 -5.377 -10.640 91 2HE LYS 12 HE1 LYS 12 6.567 -6.943 -10.160 92 1HZ LYS 12 HZ1 LYS 12 7.189 -5.329 -12.537 93 2HZ LYS 12 HZ2 LYS 12 7.357 -7.012 -12.619 94 3HZ LYS 12 HZ3 LYS 12 8.236 -6.130 -11.476 95 H TRP 13 HN TRP 13 1.985 -7.032 -7.935 96 HA TRP 13 HA TRP 13 0.407 -4.589 -8.401 97 1HB TRP 13 HB2 TRP 13 0.974 -6.249 -5.986 98 2HB TRP 13 HB1 TRP 13 0.674 -4.528 -5.769 99 HD1 TRP 13 HD1 TRP 13 -1.210 -6.674 -8.345 100 HE1 TRP 13 HE1 TRP 13 -3.699 -6.711 -7.685 101 HE3 TRP 13 HE3 TRP 13 -0.890 -4.262 -3.853 102 HZ2 TRP 13 HZ2 TRP 13 -5.307 -5.839 -5.541 103 HZ3 TRP 13 HZ3 TRP 13 -2.948 -3.905 -2.555 104 HH2 TRP 13 HH2 TRP 13 -5.112 -4.678 -3.385 105 H TYR 14 HN TYR 14 1.477 -2.692 -8.595 106 HA TYR 14 HA TYR 14 4.271 -2.590 -7.662 107 1HB TYR 14 HB2 TYR 14 2.794 -0.849 -9.638 108 2HB TYR 14 HB1 TYR 14 4.448 -0.566 -9.121 109 HD1 TYR 14 HD1 TYR 14 2.540 -3.578 -10.279 110 HD2 TYR 14 HD2 TYR 14 5.951 -1.085 -10.770 111 HE1 TYR 14 HE1 TYR 14 3.339 -5.040 -12.083 112 HE2 TYR 14 HE2 TYR 14 6.761 -2.540 -12.578 113 HH TYR 14 HH TYR 14 5.337 -4.293 -14.303 114 H VAL 15 HN VAL 15 4.686 -1.497 -5.820 115 HA VAL 15 HA VAL 15 2.694 0.469 -4.929 116 HB VAL 15 HB VAL 15 2.770 -0.802 -3.078 117 1HG1 VAL 15 HG11 VAL 15 4.810 -2.119 -2.371 118 2HG1 VAL 15 HG12 VAL 15 5.511 -1.658 -3.917 119 3HG1 VAL 15 HG13 VAL 15 4.032 -2.609 -3.875 120 1HG2 VAL 15 HG21 VAL 15 3.714 1.323 -2.333 121 2HG2 VAL 15 HG22 VAL 15 5.342 0.718 -2.641 122 3HG2 VAL 15 HG23 VAL 15 4.350 -0.018 -1.382 123 H VAL 16 HN VAL 16 3.123 2.437 -5.369 124 HA VAL 16 HA VAL 16 5.878 3.474 -5.186 125 HB VAL 16 HB VAL 16 3.838 3.755 -7.352 126 1HG1 VAL 16 HG11 VAL 16 5.777 5.911 -6.569 127 2HG1 VAL 16 HG12 VAL 16 4.051 6.050 -6.866 128 3HG1 VAL 16 HG13 VAL 16 5.154 5.751 -8.207 129 1HG2 VAL 16 HG21 VAL 16 6.707 3.081 -7.084 130 2HG2 VAL 16 HG22 VAL 16 6.201 3.886 -8.570 131 3HG2 VAL 16 HG23 VAL 16 5.459 2.357 -8.097 132 H ALA 17 HN ALA 17 2.437 4.396 -5.258 133 HA ALA 17 HA ALA 17 2.989 6.851 -3.818 134 1HB ALA 17 HB1 ALA 17 0.934 5.944 -5.519 135 2HB ALA 17 HB2 ALA 17 1.107 7.533 -4.778 136 3HB ALA 17 HB3 ALA 17 0.193 6.271 -3.952 137 H LEU 18 HN LEU 18 3.367 6.713 -1.692 138 HA LEU 18 HA LEU 18 1.639 4.921 -0.121 139 1HB LEU 18 HB2 LEU 18 4.517 5.649 0.437 140 2HB LEU 18 HB1 LEU 18 3.497 4.708 1.500 141 HG LEU 18 HG LEU 18 5.042 3.278 0.298 142 1HD1 LEU 18 HD11 LEU 18 3.567 1.627 0.067 143 2HD1 LEU 18 HD12 LEU 18 2.628 2.498 -1.144 144 3HD1 LEU 18 HD13 LEU 18 2.374 2.821 0.569 145 1HD2 LEU 18 HD21 LEU 18 4.853 4.980 -1.755 146 2HD2 LEU 18 HD22 LEU 18 3.765 3.712 -2.321 147 3HD2 LEU 18 HD23 LEU 18 5.437 3.324 -1.915 148 H ALA 19 HN ALA 19 2.016 5.630 2.336 149 HA ALA 19 HA ALA 19 2.286 8.362 2.937 150 1HB ALA 19 HB1 ALA 19 -0.467 8.108 3.508 151 2HB ALA 19 HB2 ALA 19 -0.247 7.639 1.820 152 3HB ALA 19 HB3 ALA 19 0.307 9.214 2.371 153 H SER 20 HN SER 20 2.818 8.371 5.083 154 HA SER 20 HA SER 20 1.353 6.724 6.928 155 1HB SER 20 HB2 SER 20 3.353 5.396 7.656 156 2HB SER 20 HB1 SER 20 2.711 4.957 6.074 157 HG SER 20 HG SER 20 4.370 6.471 5.248 158 H ASN 21 HN ASN 21 1.770 7.075 9.056 159 HA ASN 21 HA ASN 21 3.932 8.581 10.052 160 1HB ASN 21 HB2 ASN 21 1.361 10.035 9.530 161 2HB ASN 21 HB1 ASN 21 2.467 10.555 10.796 162 1HD2 ASN 21 HD21 ASN 21 1.730 10.634 7.511 163 2HD2 ASN 21 HD22 ASN 21 3.138 11.462 6.956 164 H THR 22 HN THR 22 3.812 8.920 12.306 165 HA THR 22 HA THR 22 1.610 8.025 13.888 166 HB THR 22 HB THR 22 4.055 6.247 13.740 167 HG1 THR 22 HG1 THR 22 2.831 5.686 12.046 168 1HG2 THR 22 HG21 THR 22 2.876 6.476 15.995 169 2HG2 THR 22 HG22 THR 22 3.109 4.853 15.343 170 3HG2 THR 22 HG23 THR 22 1.534 5.633 15.224 171 H GLU 23 HN GLU 23 5.051 8.633 13.643 172 HA GLU 23 HA GLU 23 4.989 10.473 15.845 173 1HB GLU 23 HB2 GLU 23 6.701 7.980 16.033 174 2HB GLU 23 HB1 GLU 23 6.776 9.351 17.129 175 1HG GLU 23 HG2 GLU 23 4.467 8.911 17.826 176 2HG GLU 23 HG1 GLU 23 4.415 7.521 16.745 177 H PHE 24 HN PHE 24 6.152 12.130 15.147 178 HA PHE 24 HA PHE 24 7.688 12.122 12.827 179 1HB PHE 24 HB2 PHE 24 6.707 14.152 13.772 180 2HB PHE 24 HB1 PHE 24 7.800 14.056 15.149 181 HD1 PHE 24 HD1 PHE 24 9.158 15.916 15.011 182 HD2 PHE 24 HD2 PHE 24 8.469 13.587 11.517 183 HE1 PHE 24 HE1 PHE 24 10.813 17.265 13.791 184 HE2 PHE 24 HE2 PHE 24 10.124 14.932 10.289 185 HZ PHE 24 HZ PHE 24 11.299 16.774 11.427 186 H PHE 25 HN PHE 25 8.712 11.841 16.200 187 HA PHE 25 HA PHE 25 11.449 12.070 15.869 188 1HB PHE 25 HB2 PHE 25 10.359 11.987 18.057 189 2HB PHE 25 HB1 PHE 25 9.954 10.293 17.805 190 HD1 PHE 25 HD1 PHE 25 11.132 9.127 19.415 191 HD2 PHE 25 HD2 PHE 25 13.126 12.112 17.131 192 HE1 PHE 25 HE1 PHE 25 13.274 8.464 20.428 193 HE2 PHE 25 HE2 PHE 25 15.273 11.455 18.139 194 HZ PHE 25 HZ PHE 25 15.348 9.629 19.789 195 H LEU 26 HN LEU 26 9.517 9.070 15.774 196 HA LEU 26 HA LEU 26 11.838 7.556 14.937 197 1HB LEU 26 HB2 LEU 26 8.970 6.711 15.324 198 2HB LEU 26 HB1 LEU 26 10.306 5.626 14.986 199 HG LEU 26 HG LEU 26 9.980 7.320 17.464 200 1HD1 LEU 26 HD11 LEU 26 10.086 4.812 18.358 201 2HD1 LEU 26 HD12 LEU 26 9.355 4.511 16.781 202 3HD1 LEU 26 HD13 LEU 26 8.572 5.605 17.921 203 1HD2 LEU 26 HD21 LEU 26 11.947 5.842 18.205 204 2HD2 LEU 26 HD22 LEU 26 12.284 7.207 17.140 205 3HD2 LEU 26 HD23 LEU 26 12.208 5.573 16.483 206 H ARG 27 HN ARG 27 8.701 8.457 13.526 207 HA ARG 27 HA ARG 27 8.982 7.084 11.121 208 1HB ARG 27 HB2 ARG 27 7.476 9.625 11.714 209 2HB ARG 27 HB1 ARG 27 7.323 8.715 10.218 210 1HG ARG 27 HG2 ARG 27 6.658 7.720 12.980 211 2HG ARG 27 HG1 ARG 27 5.508 8.192 11.727 212 1HD ARG 27 HD2 ARG 27 7.474 5.910 11.571 213 2HD ARG 27 HD1 ARG 27 5.737 5.768 11.836 214 HE ARG 27 HE ARG 27 6.142 7.185 9.463 215 1HH1 ARG 27 HH11 ARG 27 6.644 3.975 10.738 216 2HH1 ARG 27 HH12 ARG 27 6.484 3.203 9.197 217 1HH2 ARG 27 HH21 ARG 27 5.932 6.171 7.437 218 2HH2 ARG 27 HH22 ARG 27 6.079 4.449 7.324 219 H GLU 28 HN GLU 28 10.116 10.322 11.994 220 HA GLU 28 HA GLU 28 10.740 11.444 9.612 221 1HB GLU 28 HB2 GLU 28 11.240 12.525 11.735 222 2HB GLU 28 HB1 GLU 28 12.530 11.371 12.046 223 1HG GLU 28 HG2 GLU 28 13.757 12.221 10.115 224 2HG GLU 28 HG1 GLU 28 12.461 13.374 9.800 225 H LYS 29 HN LYS 29 12.824 9.089 11.285 226 HA LYS 29 HA LYS 29 14.616 8.926 9.026 227 1HB LYS 29 HB2 LYS 29 15.491 8.742 11.304 228 2HB LYS 29 HB1 LYS 29 14.501 7.316 11.583 229 1HG LYS 29 HG2 LYS 29 16.805 6.703 11.139 230 2HG LYS 29 HG1 LYS 29 15.741 6.110 9.862 231 1HD LYS 29 HD2 LYS 29 16.385 7.994 8.445 232 2HD LYS 29 HD1 LYS 29 17.434 8.606 9.726 233 1HE LYS 29 HE2 LYS 29 17.723 5.954 8.316 234 2HE LYS 29 HE1 LYS 29 18.703 7.389 8.021 235 1HZ LYS 29 HZ1 LYS 29 19.114 7.171 10.588 236 2HZ LYS 29 HZ2 LYS 29 20.028 6.278 9.480 237 3HZ LYS 29 HZ3 LYS 29 18.740 5.547 10.297 238 H ASP 30 HN ASP 30 11.972 7.086 10.378 239 HA ASP 30 HA ASP 30 12.373 4.683 8.982 240 1HB ASP 30 HB2 ASP 30 10.842 5.024 10.946 241 2HB ASP 30 HB1 ASP 30 9.712 5.811 9.849 242 H LYS 31 HN LYS 31 11.420 7.742 7.788 243 HA LYS 31 HA LYS 31 9.628 7.008 5.764 244 1HB LYS 31 HB2 LYS 31 11.663 9.247 5.694 245 2HB LYS 31 HB1 LYS 31 10.255 9.105 4.656 246 1HG LYS 31 HG2 LYS 31 8.825 9.240 6.690 247 2HG LYS 31 HG1 LYS 31 10.286 9.578 7.620 248 1HD LYS 31 HD2 LYS 31 10.718 11.545 6.235 249 2HD LYS 31 HD1 LYS 31 9.255 11.213 5.305 250 1HE LYS 31 HE2 LYS 31 7.908 11.497 7.323 251 2HE LYS 31 HE1 LYS 31 9.369 11.808 8.259 252 1HZ LYS 31 HZ1 LYS 31 8.728 13.470 5.913 253 2HZ LYS 31 HZ2 LYS 31 9.677 13.850 7.260 254 3HZ LYS 31 HZ3 LYS 31 7.993 13.784 7.404 255 H MET 32 HN MET 32 10.983 8.032 3.393 256 HA MET 32 HA MET 32 12.039 7.169 1.566 257 1HB MET 32 HB2 MET 32 14.016 6.224 3.650 258 2HB MET 32 HB1 MET 32 14.320 6.300 1.922 259 1HG MET 32 HG2 MET 32 14.096 8.716 1.966 260 2HG MET 32 HG1 MET 32 13.722 8.665 3.688 261 1HE MET 32 HE1 MET 32 16.459 10.446 2.369 262 2HE MET 32 HE2 MET 32 17.105 10.279 4.001 263 3HE MET 32 HE3 MET 32 15.375 10.519 3.759 264 H LYS 33 HN LYS 33 10.853 5.581 0.648 265 HA LYS 33 HA LYS 33 11.606 2.878 1.062 266 1HB LYS 33 HB2 LYS 33 10.245 3.163 3.083 267 2HB LYS 33 HB1 LYS 33 8.889 3.689 2.096 268 1HG LYS 33 HG2 LYS 33 8.770 1.507 1.046 269 2HG LYS 33 HG1 LYS 33 10.176 0.974 1.966 270 1HD LYS 33 HD2 LYS 33 8.192 0.119 3.020 271 2HD LYS 33 HD1 LYS 33 8.892 1.361 4.056 272 1HE LYS 33 HE2 LYS 33 6.664 1.910 2.108 273 2HE LYS 33 HE1 LYS 33 6.379 1.416 3.775 274 1HZ LYS 33 HZ1 LYS 33 7.064 3.981 2.747 275 2HZ LYS 33 HZ2 LYS 33 8.154 3.499 3.947 276 3HZ LYS 33 HZ3 LYS 33 6.498 3.556 4.284 277 H MET 34 HN MET 34 11.142 1.678 -0.644 278 HA MET 34 HA MET 34 8.997 2.544 -2.480 279 1HB MET 34 HB2 MET 34 10.442 1.981 -4.405 280 2HB MET 34 HB1 MET 34 11.078 3.324 -3.470 281 1HG MET 34 HG2 MET 34 12.629 1.768 -2.352 282 2HG MET 34 HG1 MET 34 12.022 0.474 -3.384 283 1HE MET 34 HE1 MET 34 12.183 2.370 -6.613 284 2HE MET 34 HE2 MET 34 11.630 0.917 -5.780 285 3HE MET 34 HE3 MET 34 13.143 0.893 -6.686 286 H ALA 35 HN ALA 35 8.241 0.683 -3.912 287 HA ALA 35 HA ALA 35 9.167 -1.913 -3.050 288 1HB ALA 35 HB1 ALA 35 6.490 -0.874 -2.194 289 2HB ALA 35 HB2 ALA 35 7.814 -1.449 -1.184 290 3HB ALA 35 HB3 ALA 35 6.913 -2.587 -2.186 291 H MET 36 HN MET 36 8.377 -3.660 -4.111 292 HA MET 36 HA MET 36 6.699 -3.210 -6.489 293 1HB MET 36 HB2 MET 36 9.102 -5.051 -6.276 294 2HB MET 36 HB1 MET 36 8.055 -4.890 -7.678 295 1HG MET 36 HG2 MET 36 8.771 -2.590 -7.973 296 2HG MET 36 HG1 MET 36 9.790 -2.713 -6.539 297 1HE MET 36 HE1 MET 36 11.600 -1.711 -7.996 298 2HE MET 36 HE2 MET 36 10.957 -1.873 -9.631 299 3HE MET 36 HE3 MET 36 12.522 -2.577 -9.225 300 H ALA 37 HN ALA 37 5.155 -4.933 -6.835 301 HA ALA 37 HA ALA 37 5.268 -7.115 -4.874 302 1HB ALA 37 HB1 ALA 37 3.896 -5.054 -4.123 303 2HB ALA 37 HB2 ALA 37 3.243 -6.674 -3.882 304 3HB ALA 37 HB3 ALA 37 2.677 -5.688 -5.228 305 H ARG 38 HN ARG 38 3.926 -8.889 -5.223 306 HA ARG 38 HA ARG 38 2.736 -9.162 -7.895 307 1HB ARG 38 HB2 ARG 38 4.422 -11.263 -6.505 308 2HB ARG 38 HB1 ARG 38 3.595 -11.461 -8.041 309 1HG ARG 38 HG2 ARG 38 5.794 -11.079 -8.658 310 2HG ARG 38 HG1 ARG 38 5.040 -9.498 -8.851 311 1HD ARG 38 HD2 ARG 38 5.938 -8.801 -6.686 312 2HD ARG 38 HD1 ARG 38 6.658 -10.391 -6.461 313 HE ARG 38 HE ARG 38 7.603 -9.320 -8.871 314 1HH1 ARG 38 HH11 ARG 38 7.853 -8.752 -5.438 315 2HH1 ARG 38 HH12 ARG 38 9.428 -8.039 -5.540 316 1HH2 ARG 38 HH21 ARG 38 9.691 -8.374 -9.005 317 2HH2 ARG 38 HH22 ARG 38 10.468 -7.824 -7.558 318 H ILE 39 HN ILE 39 0.673 -10.012 -7.805 319 HA ILE 39 HA ILE 39 -0.291 -10.841 -5.170 320 HB ILE 39 HB ILE 39 -1.457 -9.371 -7.383 321 1HG1 ILE 39 HG12 ILE 39 -1.928 -9.730 -4.444 322 2HG1 ILE 39 HG11 ILE 39 -1.405 -8.289 -5.306 323 1HG2 ILE 39 HG21 ILE 39 -3.225 -11.485 -6.143 324 2HG2 ILE 39 HG22 ILE 39 -2.618 -11.505 -7.799 325 3HG2 ILE 39 HG23 ILE 39 -3.713 -10.227 -7.281 326 1HD1 ILE 39 HD11 ILE 39 -3.584 -7.812 -4.660 327 2HD1 ILE 39 HD12 ILE 39 -4.151 -9.437 -5.036 328 3HD1 ILE 39 HD13 ILE 39 -3.759 -8.320 -6.341 329 H SER 40 HN SER 40 -1.297 -12.706 -4.724 330 HA SER 40 HA SER 40 -1.838 -14.650 -6.815 331 1HB SER 40 HB2 SER 40 0.352 -15.375 -6.339 332 2HB SER 40 HB1 SER 40 0.177 -15.061 -4.613 333 HG SER 40 HG SER 40 -1.084 -16.848 -4.414 334 H PHE 41 HN PHE 41 -3.545 -15.960 -6.343 335 HA PHE 41 HA PHE 41 -5.156 -15.238 -4.059 336 1HB PHE 41 HB2 PHE 41 -5.915 -15.781 -6.492 337 2HB PHE 41 HB1 PHE 41 -5.817 -17.459 -5.973 338 HD1 PHE 41 HD1 PHE 41 -7.481 -14.230 -5.344 339 HD2 PHE 41 HD2 PHE 41 -7.500 -18.424 -4.615 340 HE1 PHE 41 HE1 PHE 41 -9.732 -14.047 -4.371 341 HE2 PHE 41 HE2 PHE 41 -9.755 -18.246 -3.642 342 HZ PHE 41 HZ PHE 41 -10.873 -16.054 -3.521 343 H LEU 42 HN LEU 42 -5.108 -16.226 -2.121 344 HA LEU 42 HA LEU 42 -3.856 -18.864 -1.927 345 1HB LEU 42 HB2 LEU 42 -4.695 -16.974 0.271 346 2HB LEU 42 HB1 LEU 42 -3.849 -18.488 0.499 347 HG LEU 42 HG LEU 42 -2.773 -16.026 -0.875 348 1HD1 LEU 42 HD11 LEU 42 -2.615 -15.576 1.376 349 2HD1 LEU 42 HD12 LEU 42 -1.076 -16.380 1.068 350 3HD1 LEU 42 HD13 LEU 42 -2.403 -17.272 1.812 351 1HD2 LEU 42 HD21 LEU 42 -1.856 -18.840 -0.832 352 2HD2 LEU 42 HD22 LEU 42 -0.631 -17.600 -0.569 353 3HD2 LEU 42 HD23 LEU 42 -1.604 -17.579 -2.039 354 H GLY 43 HN GLY 43 -5.054 -20.616 -1.919 355 1HA GLY 43 HA2 GLY 43 -7.889 -20.571 -1.811 356 2HA GLY 43 HA1 GLY 43 -6.877 -22.004 -1.828 357 H GLU 44 HN GLU 44 -7.526 -19.350 0.464 358 HA GLU 44 HA GLU 44 -8.626 -21.172 2.398 359 1HB GLU 44 HB2 GLU 44 -5.962 -19.831 2.899 360 2HB GLU 44 HB1 GLU 44 -6.964 -20.506 4.174 361 1HG GLU 44 HG2 GLU 44 -5.783 -22.049 1.875 362 2HG GLU 44 HG1 GLU 44 -5.159 -22.010 3.522 363 H ASP 45 HN ASP 45 -9.757 -19.055 1.084 364 HA ASP 45 HA ASP 45 -10.908 -17.114 1.382 365 1HB ASP 45 HB2 ASP 45 -11.828 -18.347 3.318 366 2HB ASP 45 HB1 ASP 45 -10.504 -17.759 4.319 367 H GLU 46 HN GLU 46 -8.172 -16.901 0.884 368 HA GLU 46 HA GLU 46 -7.673 -14.276 2.001 369 1HB GLU 46 HB2 GLU 46 -5.822 -16.603 2.517 370 2HB GLU 46 HB1 GLU 46 -5.350 -14.923 2.717 371 1HG GLU 46 HG2 GLU 46 -6.998 -14.616 4.448 372 2HG GLU 46 HG1 GLU 46 -7.614 -16.247 4.191 373 H LEU 47 HN LEU 47 -6.286 -13.038 0.826 374 HA LEU 47 HA LEU 47 -5.143 -14.224 -1.612 375 1HB LEU 47 HB2 LEU 47 -6.501 -11.524 -1.394 376 2HB LEU 47 HB1 LEU 47 -5.763 -12.191 -2.839 377 HG LEU 47 HG LEU 47 -7.468 -14.042 -2.762 378 1HD1 LEU 47 HD11 LEU 47 -8.553 -14.282 -0.825 379 2HD1 LEU 47 HD12 LEU 47 -9.561 -12.947 -1.380 380 3HD1 LEU 47 HD13 LEU 47 -8.195 -12.634 -0.309 381 1HD2 LEU 47 HD21 LEU 47 -7.979 -12.496 -4.374 382 2HD2 LEU 47 HD22 LEU 47 -8.133 -11.174 -3.217 383 3HD2 LEU 47 HD23 LEU 47 -9.406 -12.385 -3.345 384 H LYS 48 HN LYS 48 -2.996 -14.077 -1.411 385 HA LYS 48 HA LYS 48 -1.878 -11.920 0.202 386 1HB LYS 48 HB2 LYS 48 0.126 -13.258 0.373 387 2HB LYS 48 HB1 LYS 48 -1.280 -14.212 0.800 388 1HG LYS 48 HG2 LYS 48 -0.032 -15.674 -0.465 389 2HG LYS 48 HG1 LYS 48 -1.182 -15.039 -1.643 390 1HD LYS 48 HD2 LYS 48 0.442 -13.656 -2.635 391 2HD LYS 48 HD1 LYS 48 1.538 -13.822 -1.264 392 1HE LYS 48 HE2 LYS 48 1.934 -16.138 -1.814 393 2HE LYS 48 HE1 LYS 48 0.749 -16.066 -3.115 394 1HZ LYS 48 HZ1 LYS 48 2.200 -14.300 -4.121 395 2HZ LYS 48 HZ2 LYS 48 2.864 -15.856 -4.104 396 3HZ LYS 48 HZ3 LYS 48 3.378 -14.706 -2.975 397 H VAL 49 HN VAL 49 -0.089 -10.716 -0.382 398 HA VAL 49 HA VAL 49 0.660 -10.650 -3.211 399 HB VAL 49 HB VAL 49 -1.083 -8.936 -2.968 400 1HG1 VAL 49 HG11 VAL 49 -1.274 -7.540 -1.238 401 2HG1 VAL 49 HG12 VAL 49 0.444 -7.152 -1.238 402 3HG1 VAL 49 HG13 VAL 49 -0.126 -8.609 -0.431 403 1HG2 VAL 49 HG21 VAL 49 1.560 -7.514 -3.133 404 2HG2 VAL 49 HG22 VAL 49 0.058 -7.135 -3.970 405 3HG2 VAL 49 HG23 VAL 49 0.971 -8.575 -4.413 406 H SER 50 HN SER 50 2.764 -11.157 -3.047 407 HA SER 50 HA SER 50 4.376 -10.340 -0.802 408 1HB SER 50 HB2 SER 50 5.139 -11.719 -3.391 409 2HB SER 50 HB1 SER 50 6.197 -11.516 -1.996 410 HG SER 50 HG SER 50 4.959 -12.910 -0.844 411 H TYR 51 HN TYR 51 6.035 -8.794 -0.822 412 HA TYR 51 HA TYR 51 6.556 -7.379 -3.297 413 1HB TYR 51 HB2 TYR 51 6.093 -5.146 -2.273 414 2HB TYR 51 HB1 TYR 51 4.661 -6.123 -2.545 415 HD1 TYR 51 HD1 TYR 51 3.061 -5.815 -0.932 416 HD2 TYR 51 HD2 TYR 51 7.145 -5.780 0.256 417 HE1 TYR 51 HE1 TYR 51 2.378 -5.468 1.405 418 HE2 TYR 51 HE2 TYR 51 6.474 -5.450 2.590 419 HH TYR 51 HH TYR 51 3.947 -4.313 3.634 420 H ALA 52 HN ALA 52 8.483 -6.358 -3.405 421 HA ALA 52 HA ALA 52 10.343 -6.826 -1.185 422 1HB ALA 52 HB1 ALA 52 12.059 -6.136 -2.953 423 2HB ALA 52 HB2 ALA 52 10.737 -6.231 -4.114 424 3HB ALA 52 HB3 ALA 52 11.224 -7.667 -3.214 425 H VAL 53 HN VAL 53 11.250 -5.079 -0.056 426 HA VAL 53 HA VAL 53 10.691 -2.404 -1.124 427 HB VAL 53 HB VAL 53 9.983 -3.141 1.705 428 1HG1 VAL 53 HG11 VAL 53 9.495 -0.987 2.037 429 2HG1 VAL 53 HG12 VAL 53 8.748 -0.810 0.449 430 3HG1 VAL 53 HG13 VAL 53 10.499 -0.695 0.618 431 1HG2 VAL 53 HG21 VAL 53 7.595 -2.653 0.627 432 2HG2 VAL 53 HG22 VAL 53 8.295 -4.269 0.696 433 3HG2 VAL 53 HG23 VAL 53 8.399 -3.326 -0.788 434 HA PRO 54 HA PRO 54 14.768 -1.831 0.785 435 1HB PRO 54 HB2 PRO 54 15.121 0.469 -0.869 436 2HB PRO 54 HB1 PRO 54 15.849 -1.124 -1.075 437 1HG PRO 54 HG2 PRO 54 14.016 -0.010 -2.803 438 2HG PRO 54 HG1 PRO 54 14.325 -1.748 -2.647 439 1HD PRO 54 HD2 PRO 54 12.133 -0.098 -1.437 440 2HD PRO 54 HD1 PRO 54 12.051 -1.717 -2.167 441 H LYS 55 HN LYS 55 15.337 -0.524 2.471 442 HA LYS 55 HA LYS 55 13.988 2.040 2.825 443 1HB LYS 55 HB2 LYS 55 13.304 1.467 5.126 444 2HB LYS 55 HB1 LYS 55 12.495 0.481 3.917 445 1HG LYS 55 HG2 LYS 55 14.034 -1.356 4.379 446 2HG LYS 55 HG1 LYS 55 14.853 -0.365 5.588 447 1HD LYS 55 HD2 LYS 55 13.278 -1.902 6.640 448 2HD LYS 55 HD1 LYS 55 12.778 -0.227 6.879 449 1HE LYS 55 HE2 LYS 55 10.874 -1.644 6.309 450 2HE LYS 55 HE1 LYS 55 11.169 -0.438 5.058 451 1HZ LYS 55 HZ1 LYS 55 12.111 -3.250 4.921 452 2HZ LYS 55 HZ2 LYS 55 12.208 -2.088 3.696 453 3HZ LYS 55 HZ3 LYS 55 10.700 -2.680 4.181 454 HA PRO 56 HA PRO 56 17.486 4.039 4.549 455 1HB PRO 56 HB2 PRO 56 16.025 3.814 7.156 456 2HB PRO 56 HB1 PRO 56 16.896 5.193 6.476 457 1HG PRO 56 HG2 PRO 56 14.203 4.950 6.330 458 2HG PRO 56 HG1 PRO 56 15.166 5.780 5.099 459 1HD PRO 56 HD2 PRO 56 13.691 3.280 4.891 460 2HD PRO 56 HD1 PRO 56 14.449 4.238 3.607 461 H ASN 57 HN ASN 57 16.212 1.423 6.630 462 HA ASN 57 HA ASN 57 18.443 0.904 8.160 463 1HB ASN 57 HB2 ASN 57 16.544 -1.134 6.968 464 2HB ASN 57 HB1 ASN 57 17.628 -1.424 8.325 465 1HD2 ASN 57 HD21 ASN 57 16.655 -1.365 10.203 466 2HD2 ASN 57 HD22 ASN 57 15.304 -0.377 10.628 467 H GLY 58 HN GLY 58 20.300 1.322 6.894 468 1HA GLY 58 HA2 GLY 58 22.075 0.775 5.541 469 2HA GLY 58 HA1 GLY 58 21.594 -0.898 5.793 470 H CYS 59 HN CYS 59 19.416 1.410 4.388 471 HA CYS 59 HA CYS 59 18.278 1.381 2.413 472 1HB CYS 59 HB2 CYS 59 20.553 2.425 1.861 473 2HB CYS 59 HB1 CYS 59 20.969 0.873 1.145 474 H ARG 60 HN ARG 60 18.235 -1.059 3.723 475 HA ARG 60 HA ARG 60 18.670 -3.104 1.671 476 1HB ARG 60 HB2 ARG 60 17.903 -3.379 4.581 477 2HB ARG 60 HB1 ARG 60 18.164 -4.722 3.479 478 1HG ARG 60 HG2 ARG 60 20.504 -3.904 3.167 479 2HG ARG 60 HG1 ARG 60 20.199 -2.736 4.455 480 1HD ARG 60 HD2 ARG 60 20.020 -5.739 4.688 481 2HD ARG 60 HD1 ARG 60 21.308 -4.721 5.331 482 HE ARG 60 HE ARG 60 18.796 -5.245 6.539 483 1HH1 ARG 60 HH11 ARG 60 21.212 -2.764 6.143 484 2HH1 ARG 60 HH12 ARG 60 20.755 -1.913 7.579 485 1HH2 ARG 60 HH21 ARG 60 18.194 -4.132 8.433 486 2HH2 ARG 60 HH22 ARG 60 19.044 -2.692 8.883 487 H LYS 61 HN LYS 61 17.056 -4.447 0.900 488 HA LYS 61 HA LYS 61 14.350 -3.383 1.194 489 1HB LYS 61 HB2 LYS 61 13.828 -4.616 -0.867 490 2HB LYS 61 HB1 LYS 61 15.161 -3.492 -1.089 491 1HG LYS 61 HG2 LYS 61 16.748 -5.351 -0.870 492 2HG LYS 61 HG1 LYS 61 15.392 -6.468 -0.694 493 1HD LYS 61 HD2 LYS 61 16.244 -6.466 -2.985 494 2HD LYS 61 HD1 LYS 61 14.590 -5.857 -2.918 495 1HE LYS 61 HE2 LYS 61 15.442 -3.559 -2.996 496 2HE LYS 61 HE1 LYS 61 17.091 -4.177 -3.073 497 1HZ LYS 61 HZ1 LYS 61 16.249 -3.575 -5.259 498 2HZ LYS 61 HZ2 LYS 61 14.972 -4.672 -5.094 499 3HZ LYS 61 HZ3 LYS 61 16.565 -5.235 -5.173 500 H TRP 62 HN TRP 62 12.647 -4.586 1.920 501 HA TRP 62 HA TRP 62 13.321 -7.294 2.875 502 1HB TRP 62 HB2 TRP 62 11.354 -5.315 4.034 503 2HB TRP 62 HB1 TRP 62 11.576 -6.964 4.607 504 HD1 TRP 62 HD1 TRP 62 14.230 -4.241 3.821 505 HE1 TRP 62 HE1 TRP 62 15.711 -3.964 5.908 506 HE3 TRP 62 HE3 TRP 62 11.863 -7.532 6.936 507 HZ2 TRP 62 HZ2 TRP 62 15.856 -5.006 8.528 508 HZ3 TRP 62 HZ3 TRP 62 12.737 -7.835 9.216 509 HH2 TRP 62 HH2 TRP 62 14.693 -6.598 9.994 510 H GLU 63 HN GLU 63 12.122 -8.965 2.233 511 HA GLU 63 HA GLU 63 9.778 -8.399 0.550 512 1HB GLU 63 HB2 GLU 63 11.500 -10.885 0.699 513 2HB GLU 63 HB1 GLU 63 10.120 -10.667 -0.369 514 1HG GLU 63 HG2 GLU 63 11.272 -8.831 -1.489 515 2HG GLU 63 HG1 GLU 63 12.655 -9.045 -0.416 516 H THR 64 HN THR 64 7.792 -9.084 1.178 517 HA THR 64 HA THR 64 7.535 -11.223 3.111 518 HB THR 64 HB THR 64 6.593 -8.432 3.792 519 HG1 THR 64 HG1 THR 64 8.517 -10.077 5.069 520 1HG2 THR 64 HG21 THR 64 5.827 -9.297 5.879 521 2HG2 THR 64 HG22 THR 64 6.408 -10.913 5.478 522 3HG2 THR 64 HG23 THR 64 5.059 -10.213 4.583 523 H THR 65 HN THR 65 5.608 -12.239 3.038 524 HA THR 65 HA THR 65 3.797 -11.427 0.901 525 HB THR 65 HB THR 65 4.079 -13.981 2.490 526 HG1 THR 65 HG1 THR 65 4.709 -14.752 0.378 527 1HG2 THR 65 HG21 THR 65 2.048 -13.202 0.459 528 2HG2 THR 65 HG22 THR 65 1.854 -14.133 1.943 529 3HG2 THR 65 HG23 THR 65 2.624 -14.867 0.536 530 H PHE 66 HN PHE 66 2.055 -10.236 1.404 531 HA PHE 66 HA PHE 66 0.928 -10.507 4.111 532 1HB PHE 66 HB2 PHE 66 0.851 -8.289 2.087 533 2HB PHE 66 HB1 PHE 66 -0.343 -8.369 3.376 534 HD1 PHE 66 HD1 PHE 66 3.348 -8.955 3.253 535 HD2 PHE 66 HD2 PHE 66 0.101 -6.818 4.984 536 HE1 PHE 66 HE1 PHE 66 4.910 -7.822 4.782 537 HE2 PHE 66 HE2 PHE 66 1.656 -5.682 6.513 538 HZ PHE 66 HZ PHE 66 4.064 -6.184 6.414 539 H LYS 67 HN LYS 67 -0.754 -11.825 4.278 540 HA LYS 67 HA LYS 67 -2.594 -12.066 1.991 541 1HB LYS 67 HB2 LYS 67 -3.176 -14.264 2.786 542 2HB LYS 67 HB1 LYS 67 -1.426 -14.152 2.689 543 1HG LYS 67 HG2 LYS 67 -1.412 -13.667 5.145 544 2HG LYS 67 HG1 LYS 67 -3.134 -14.055 5.157 545 1HD LYS 67 HD2 LYS 67 -1.920 -16.018 5.807 546 2HD LYS 67 HD1 LYS 67 -2.568 -16.281 4.187 547 1HE LYS 67 HE2 LYS 67 -0.391 -15.703 3.227 548 2HE LYS 67 HE1 LYS 67 0.254 -15.448 4.848 549 1HZ LYS 67 HZ1 LYS 67 0.893 -17.604 4.189 550 2HZ LYS 67 HZ2 LYS 67 -0.659 -17.995 3.643 551 3HZ LYS 67 HZ3 LYS 67 -0.365 -17.819 5.300 552 H LYS 68 HN LYS 68 -4.777 -11.734 2.284 553 HA LYS 68 HA LYS 68 -5.911 -11.414 4.908 554 1HB LYS 68 HB2 LYS 68 -6.562 -8.967 4.325 555 2HB LYS 68 HB1 LYS 68 -4.965 -9.298 4.985 556 1HG LYS 68 HG2 LYS 68 -4.947 -7.711 3.083 557 2HG LYS 68 HG1 LYS 68 -3.964 -9.146 2.813 558 1HD LYS 68 HD2 LYS 68 -5.776 -10.127 1.483 559 2HD LYS 68 HD1 LYS 68 -6.748 -8.678 1.741 560 1HE LYS 68 HE2 LYS 68 -4.081 -8.804 0.336 561 2HE LYS 68 HE1 LYS 68 -5.654 -8.653 -0.447 562 1HZ LYS 68 HZ1 LYS 68 -5.962 -6.536 0.691 563 2HZ LYS 68 HZ2 LYS 68 -4.573 -6.514 -0.272 564 3HZ LYS 68 HZ3 LYS 68 -4.435 -6.679 1.406 565 H THR 69 HN THR 69 -8.157 -10.226 4.652 566 HA THR 69 HA THR 69 -9.519 -11.596 2.429 567 HB THR 69 HB THR 69 -10.351 -12.150 4.651 568 HG1 THR 69 HG1 THR 69 -12.193 -12.210 3.674 569 1HG2 THR 69 HG21 THR 69 -9.751 -10.111 5.848 570 2HG2 THR 69 HG22 THR 69 -11.453 -10.516 6.063 571 3HG2 THR 69 HG23 THR 69 -10.987 -9.225 4.956 572 H SER 70 HN SER 70 -10.994 -10.510 1.089 573 HA SER 70 HA SER 70 -11.131 -7.594 1.361 574 1HB SER 70 HB2 SER 70 -10.762 -7.313 -1.069 575 2HB SER 70 HB1 SER 70 -9.353 -8.009 -0.270 576 HG SER 70 HG SER 70 -10.486 -8.968 -2.346 577 H ASP 71 HN ASP 71 -13.160 -6.924 1.278 578 HA ASP 71 HA ASP 71 -15.110 -8.508 -0.261 579 1HB ASP 71 HB2 ASP 71 -15.373 -9.084 2.094 580 2HB ASP 71 HB1 ASP 71 -15.502 -7.381 2.522 581 H ASP 72 HN ASP 72 -17.164 -7.301 -0.658 582 HA ASP 72 HA ASP 72 -18.400 -5.410 -1.144 583 1HB ASP 72 HB2 ASP 72 -17.175 -4.084 0.552 584 2HB ASP 72 HB1 ASP 72 -15.887 -3.809 -0.616 585 H GLY 73 HN GLY 73 -18.629 -4.058 -3.065 586 1HA GLY 73 HA2 GLY 73 -17.846 -5.184 -5.412 587 2HA GLY 73 HA1 GLY 73 -18.151 -3.455 -5.259 588 H GLU 74 HN GLU 74 -16.118 -2.644 -3.667 589 HA GLU 74 HA GLU 74 -13.831 -2.866 -5.449 590 1HB GLU 74 HB2 GLU 74 -14.223 -1.137 -2.997 591 2HB GLU 74 HB1 GLU 74 -12.926 -0.990 -4.178 592 1HG GLU 74 HG2 GLU 74 -14.545 -0.421 -5.905 593 2HG GLU 74 HG1 GLU 74 -15.856 -0.590 -4.739 594 H VAL 75 HN VAL 75 -12.257 -2.162 -2.694 595 HA VAL 75 HA VAL 75 -12.281 -4.861 -1.603 596 HB VAL 75 HB VAL 75 -9.896 -3.719 -3.026 597 1HG1 VAL 75 HG11 VAL 75 -9.925 -5.383 -0.596 598 2HG1 VAL 75 HG12 VAL 75 -8.649 -4.370 -1.269 599 3HG1 VAL 75 HG13 VAL 75 -8.916 -5.988 -1.910 600 1HG2 VAL 75 HG21 VAL 75 -10.979 -5.118 -4.484 601 2HG2 VAL 75 HG22 VAL 75 -11.578 -6.173 -3.209 602 3HG2 VAL 75 HG23 VAL 75 -9.887 -6.256 -3.698 603 H TYR 76 HN TYR 76 -12.055 -4.895 0.455 604 HA TYR 76 HA TYR 76 -10.498 -2.857 1.875 605 1HB TYR 76 HB2 TYR 76 -13.250 -3.836 2.724 606 2HB TYR 76 HB1 TYR 76 -12.208 -2.778 3.665 607 HD1 TYR 76 HD1 TYR 76 -13.498 -2.817 0.138 608 HD2 TYR 76 HD2 TYR 76 -12.929 -0.603 3.727 609 HE1 TYR 76 HE1 TYR 76 -14.516 -0.848 -0.922 610 HE2 TYR 76 HE2 TYR 76 -13.955 1.368 2.678 611 HH TYR 76 HH TYR 76 -14.369 2.268 0.465 612 H TYR 77 HN TYR 77 -8.931 -4.014 2.949 613 HA TYR 77 HA TYR 77 -9.640 -6.789 3.549 614 1HB TYR 77 HB2 TYR 77 -7.494 -7.505 3.085 615 2HB TYR 77 HB1 TYR 77 -7.782 -6.266 1.875 616 HD1 TYR 77 HD1 TYR 77 -6.258 -6.699 5.260 617 HD2 TYR 77 HD2 TYR 77 -6.147 -4.656 1.528 618 HE1 TYR 77 HE1 TYR 77 -4.149 -5.622 5.917 619 HE2 TYR 77 HE2 TYR 77 -4.039 -3.568 2.182 620 HH TYR 77 HH TYR 77 -2.053 -4.355 4.012 621 H SER 78 HN SER 78 -9.174 -7.826 5.317 622 HA SER 78 HA SER 78 -8.432 -6.212 7.663 623 1HB SER 78 HB2 SER 78 -10.169 -8.695 7.509 624 2HB SER 78 HB1 SER 78 -9.758 -7.827 8.988 625 HG SER 78 HG SER 78 -11.656 -7.269 7.118 626 H GLU 79 HN GLU 79 -6.910 -7.046 9.085 627 HA GLU 79 HA GLU 79 -5.852 -9.672 8.957 628 1HB GLU 79 HB2 GLU 79 -5.024 -8.431 6.805 629 2HB GLU 79 HB1 GLU 79 -3.918 -7.630 7.908 630 1HG GLU 79 HG2 GLU 79 -3.110 -9.898 8.602 631 2HG GLU 79 HG1 GLU 79 -4.098 -10.568 7.308 632 H GLU 80 HN GLU 80 -3.640 -9.727 10.191 633 HA GLU 80 HA GLU 80 -2.559 -9.407 12.150 634 1HB GLU 80 HB2 GLU 80 -3.037 -6.630 11.173 635 2HB GLU 80 HB1 GLU 80 -2.435 -6.838 12.808 636 1HG GLU 80 HG2 GLU 80 -0.583 -6.484 11.347 637 2HG GLU 80 HG1 GLU 80 -0.547 -8.156 11.902 638 H ALA 81 HN ALA 81 -2.842 -7.886 14.333 639 HA ALA 81 HA ALA 81 -5.012 -9.014 15.670 640 1HB ALA 81 HB1 ALA 81 -4.493 -7.015 17.319 641 2HB ALA 81 HB2 ALA 81 -3.063 -6.863 16.299 642 3HB ALA 81 HB3 ALA 81 -3.390 -8.379 17.140 643 H LYS 82 HN LYS 82 -4.644 -5.486 15.275 644 HA LYS 82 HA LYS 82 -7.524 -5.360 14.672 645 1HB LYS 82 HB2 LYS 82 -5.931 -3.444 16.383 646 2HB LYS 82 HB1 LYS 82 -7.615 -3.236 15.932 647 1HG LYS 82 HG2 LYS 82 -6.684 -5.649 17.447 648 2HG LYS 82 HG1 LYS 82 -7.087 -4.139 18.262 649 1HD LYS 82 HD2 LYS 82 -9.088 -5.283 18.372 650 2HD LYS 82 HD1 LYS 82 -9.310 -4.318 16.914 651 1HE LYS 82 HE2 LYS 82 -10.068 -6.586 16.539 652 2HE LYS 82 HE1 LYS 82 -8.647 -6.260 15.555 653 1HZ LYS 82 HZ1 LYS 82 -9.028 -8.243 17.546 654 2HZ LYS 82 HZ2 LYS 82 -7.690 -7.281 17.929 655 3HZ LYS 82 HZ3 LYS 82 -7.761 -8.075 16.437 656 H LYS 83 HN LYS 83 -5.949 -5.512 12.521 657 HA LYS 83 HA LYS 83 -5.437 -2.736 11.708 658 1HB LYS 83 HB2 LYS 83 -3.546 -4.252 11.417 659 2HB LYS 83 HB1 LYS 83 -4.531 -5.316 10.425 660 1HG LYS 83 HG2 LYS 83 -4.750 -3.594 8.737 661 2HG LYS 83 HG1 LYS 83 -3.832 -2.472 9.741 662 1HD LYS 83 HD2 LYS 83 -2.420 -3.435 8.006 663 2HD LYS 83 HD1 LYS 83 -1.883 -3.954 9.604 664 1HE LYS 83 HE2 LYS 83 -3.026 -6.081 9.309 665 2HE LYS 83 HE1 LYS 83 -3.613 -5.562 7.732 666 1HZ LYS 83 HZ1 LYS 83 -1.648 -7.003 7.595 667 2HZ LYS 83 HZ2 LYS 83 -0.748 -5.855 8.451 668 3HZ LYS 83 HZ3 LYS 83 -1.366 -5.475 6.924 669 H LYS 84 HN LYS 84 -7.055 -1.782 10.720 670 HA LYS 84 HA LYS 84 -8.749 -3.359 8.892 671 1HB LYS 84 HB2 LYS 84 -9.430 -0.825 10.407 672 2HB LYS 84 HB1 LYS 84 -10.503 -1.663 9.293 673 1HG LYS 84 HG2 LYS 84 -10.505 -3.618 10.761 674 2HG LYS 84 HG1 LYS 84 -9.427 -2.777 11.878 675 1HD LYS 84 HD2 LYS 84 -11.136 -1.057 12.226 676 2HD LYS 84 HD1 LYS 84 -12.211 -1.897 11.107 677 1HE LYS 84 HE2 LYS 84 -12.788 -2.402 13.423 678 2HE LYS 84 HE1 LYS 84 -12.230 -3.845 12.579 679 1HZ LYS 84 HZ1 LYS 84 -10.197 -3.797 13.700 680 2HZ LYS 84 HZ2 LYS 84 -11.334 -3.442 14.900 681 3HZ LYS 84 HZ3 LYS 84 -10.403 -2.202 14.225 682 H VAL 85 HN VAL 85 -8.814 -2.725 6.763 683 HA VAL 85 HA VAL 85 -7.801 -0.064 6.087 684 HB VAL 85 HB VAL 85 -6.124 -0.814 4.604 685 1HG1 VAL 85 HG11 VAL 85 -6.015 -2.412 7.158 686 2HG1 VAL 85 HG12 VAL 85 -5.374 -0.794 6.884 687 3HG1 VAL 85 HG13 VAL 85 -4.647 -2.178 6.073 688 1HG2 VAL 85 HG21 VAL 85 -6.307 -2.702 3.462 689 2HG2 VAL 85 HG22 VAL 85 -7.687 -3.179 4.447 690 3HG2 VAL 85 HG23 VAL 85 -6.061 -3.625 4.939 691 H GLU 86 HN GLU 86 -8.403 0.720 4.070 692 HA GLU 86 HA GLU 86 -10.391 -0.907 2.629 693 1HB GLU 86 HB2 GLU 86 -11.545 1.221 2.086 694 2HB GLU 86 HB1 GLU 86 -11.530 0.863 3.807 695 1HG GLU 86 HG2 GLU 86 -9.688 2.441 4.115 696 2HG GLU 86 HG1 GLU 86 -9.711 2.800 2.389 697 H VAL 87 HN VAL 87 -9.629 -1.473 0.692 698 HA VAL 87 HA VAL 87 -7.624 0.168 -0.626 699 HB VAL 87 HB VAL 87 -8.829 -2.445 -1.555 700 1HG1 VAL 87 HG11 VAL 87 -6.697 -0.661 -2.610 701 2HG1 VAL 87 HG12 VAL 87 -7.901 -1.617 -3.474 702 3HG1 VAL 87 HG13 VAL 87 -6.490 -2.405 -2.768 703 1HG2 VAL 87 HG21 VAL 87 -7.350 -2.165 0.671 704 2HG2 VAL 87 HG22 VAL 87 -6.067 -2.330 -0.525 705 3HG2 VAL 87 HG23 VAL 87 -7.283 -3.591 -0.361 706 H LEU 88 HN LEU 88 -8.353 1.877 -1.640 707 HA LEU 88 HA LEU 88 -10.984 2.028 -2.787 708 1HB LEU 88 HB2 LEU 88 -8.734 4.017 -3.024 709 2HB LEU 88 HB1 LEU 88 -10.445 4.325 -3.225 710 HG LEU 88 HG LEU 88 -9.193 3.488 -0.611 711 1HD1 LEU 88 HD11 LEU 88 -10.099 6.262 -1.297 712 2HD1 LEU 88 HD12 LEU 88 -8.442 5.734 -1.585 713 3HD1 LEU 88 HD13 LEU 88 -9.098 5.724 0.050 714 1HD2 LEU 88 HD21 LEU 88 -11.933 4.250 -1.501 715 2HD2 LEU 88 HD22 LEU 88 -11.411 4.672 0.130 716 3HD2 LEU 88 HD23 LEU 88 -11.422 2.985 -0.384 717 H ASP 89 HN ASP 89 -10.566 3.636 -5.014 718 HA ASP 89 HA ASP 89 -10.294 3.552 -7.261 719 1HB ASP 89 HB2 ASP 89 -7.865 3.457 -6.433 720 2HB ASP 89 HB1 ASP 89 -7.935 1.746 -6.825 721 H THR 90 HN THR 90 -8.883 0.846 -8.335 722 HA THR 90 HA THR 90 -10.946 -1.080 -7.818 723 HB THR 90 HB THR 90 -10.796 0.134 -10.578 724 HG1 THR 90 HG1 THR 90 -11.962 1.507 -9.337 725 1HG2 THR 90 HG21 THR 90 -12.403 -2.132 -9.456 726 2HG2 THR 90 HG22 THR 90 -11.381 -2.108 -10.894 727 3HG2 THR 90 HG23 THR 90 -12.911 -1.230 -10.884 728 H ASP 91 HN ASP 91 -9.432 -2.601 -7.382 729 HA ASP 91 HA ASP 91 -7.225 -3.123 -9.178 730 1HB ASP 91 HB2 ASP 91 -6.761 -5.003 -7.575 731 2HB ASP 91 HB1 ASP 91 -6.800 -3.407 -6.832 732 H TYR 92 HN TYR 92 -10.154 -3.587 -9.975 733 HA TYR 92 HA TYR 92 -10.014 -6.452 -10.544 734 1HB TYR 92 HB2 TYR 92 -12.340 -4.530 -10.777 735 2HB TYR 92 HB1 TYR 92 -12.408 -6.257 -11.126 736 HD1 TYR 92 HD1 TYR 92 -11.219 -4.033 -8.364 737 HD2 TYR 92 HD2 TYR 92 -13.280 -7.590 -9.456 738 HE1 TYR 92 HE1 TYR 92 -11.648 -4.502 -5.996 739 HE2 TYR 92 HE2 TYR 92 -13.719 -8.068 -7.085 740 HH TYR 92 HH TYR 92 -12.702 -7.497 -4.880 741 H LYS 93 HN LYS 93 -9.700 -3.376 -12.047 742 HA LYS 93 HA LYS 93 -9.909 -4.617 -14.699 743 1HB LYS 93 HB2 LYS 93 -9.975 -1.708 -13.897 744 2HB LYS 93 HB1 LYS 93 -9.934 -2.266 -15.560 745 1HG LYS 93 HG2 LYS 93 -12.184 -1.782 -15.100 746 2HG LYS 93 HG1 LYS 93 -12.058 -3.541 -15.058 747 1HD LYS 93 HD2 LYS 93 -11.894 -3.423 -12.588 748 2HD LYS 93 HD1 LYS 93 -12.132 -1.678 -12.688 749 1HE LYS 93 HE2 LYS 93 -14.070 -3.798 -13.605 750 2HE LYS 93 HE1 LYS 93 -14.217 -2.818 -12.148 751 1HZ LYS 93 HZ1 LYS 93 -13.982 -0.920 -13.990 752 2HZ LYS 93 HZ2 LYS 93 -15.471 -1.551 -13.496 753 3HZ LYS 93 HZ3 LYS 93 -14.744 -2.114 -14.915 754 H SER 94 HN SER 94 -7.754 -2.525 -12.750 755 HA SER 94 HA SER 94 -5.422 -3.726 -13.753 756 1HB SER 94 HB2 SER 94 -4.612 -1.821 -15.185 757 2HB SER 94 HB1 SER 94 -5.944 -2.744 -15.875 758 HG SER 94 HG SER 94 -7.247 -1.068 -15.638 759 H TYR 95 HN TYR 95 -6.491 -0.420 -12.942 760 HA TYR 95 HA TYR 95 -4.177 -0.170 -11.172 761 1HB TYR 95 HB2 TYR 95 -4.878 2.268 -11.143 762 2HB TYR 95 HB1 TYR 95 -4.305 1.635 -12.684 763 HD1 TYR 95 HD1 TYR 95 -7.440 2.312 -10.780 764 HD2 TYR 95 HD2 TYR 95 -5.608 1.882 -14.592 765 HE1 TYR 95 HE1 TYR 95 -9.522 3.054 -11.857 766 HE2 TYR 95 HE2 TYR 95 -7.681 2.625 -15.681 767 HH TYR 95 HH TYR 95 -9.996 4.245 -14.322 768 H ALA 96 HN ALA 96 -4.303 0.322 -9.030 769 HA ALA 96 HA ALA 96 -6.900 0.708 -7.788 770 1HB ALA 96 HB1 ALA 96 -7.133 -1.309 -6.885 771 2HB ALA 96 HB2 ALA 96 -5.483 -1.289 -6.273 772 3HB ALA 96 HB3 ALA 96 -5.804 -1.851 -7.912 773 H VAL 97 HN VAL 97 -6.765 1.476 -5.612 774 HA VAL 97 HA VAL 97 -4.079 2.299 -4.761 775 HB VAL 97 HB VAL 97 -4.752 4.507 -4.249 776 1HG1 VAL 97 HG11 VAL 97 -5.683 3.570 -6.932 777 2HG1 VAL 97 HG12 VAL 97 -4.261 4.526 -6.510 778 3HG1 VAL 97 HG13 VAL 97 -5.865 5.261 -6.474 779 1HG2 VAL 97 HG21 VAL 97 -7.517 3.445 -4.506 780 2HG2 VAL 97 HG22 VAL 97 -7.232 5.147 -4.869 781 3HG2 VAL 97 HG23 VAL 97 -6.823 4.500 -3.280 782 H ILE 98 HN ILE 98 -3.671 1.657 -2.738 783 HA ILE 98 HA ILE 98 -5.973 0.925 -1.076 784 HB ILE 98 HB ILE 98 -4.923 -1.071 -1.375 785 1HG1 ILE 98 HG12 ILE 98 -3.612 -1.655 0.643 786 2HG1 ILE 98 HG11 ILE 98 -3.478 0.055 1.032 787 1HG2 ILE 98 HG21 ILE 98 -2.188 0.134 -1.119 788 2HG2 ILE 98 HG22 ILE 98 -3.021 -0.104 -2.653 789 3HG2 ILE 98 HG23 ILE 98 -2.606 -1.491 -1.648 790 1HD1 ILE 98 HD11 ILE 98 -5.325 -0.185 2.223 791 2HD1 ILE 98 HD12 ILE 98 -5.608 -1.798 1.574 792 3HD1 ILE 98 HD13 ILE 98 -6.200 -0.383 0.705 793 H TYR 99 HN TYR 99 -6.211 1.537 0.948 794 HA TYR 99 HA TYR 99 -4.172 3.251 2.204 795 1HB TYR 99 HB2 TYR 99 -5.858 4.806 1.602 796 2HB TYR 99 HB1 TYR 99 -7.152 3.678 1.977 797 HD1 TYR 99 HD1 TYR 99 -4.331 4.260 4.290 798 HD2 TYR 99 HD2 TYR 99 -8.367 5.229 3.351 799 HE1 TYR 99 HE1 TYR 99 -4.589 5.299 6.501 800 HE2 TYR 99 HE2 TYR 99 -8.634 6.269 5.561 801 HH TYR 99 HH TYR 99 -5.985 6.926 7.621 802 H ALA 100 HN ALA 100 -3.568 2.489 4.189 803 HA ALA 100 HA ALA 100 -5.443 0.663 5.539 804 1HB ALA 100 HB1 ALA 100 -4.023 -0.895 4.664 805 2HB ALA 100 HB2 ALA 100 -3.229 -0.570 6.205 806 3HB ALA 100 HB3 ALA 100 -2.626 0.179 4.726 807 H THR 101 HN THR 101 -5.706 0.895 7.639 808 HA THR 101 HA THR 101 -3.794 2.554 9.144 809 HB THR 101 HB THR 101 -5.696 3.260 10.569 810 HG1 THR 101 HG1 THR 101 -7.212 1.802 8.674 811 1HG2 THR 101 HG21 THR 101 -6.446 4.949 9.248 812 2HG2 THR 101 HG22 THR 101 -6.648 3.910 7.837 813 3HG2 THR 101 HG23 THR 101 -5.036 4.442 8.318 814 H ARG 102 HN ARG 102 -2.657 1.190 10.382 815 HA ARG 102 HA ARG 102 -3.879 -1.278 11.318 816 1HB ARG 102 HB2 ARG 102 -1.045 -0.423 11.836 817 2HB ARG 102 HB1 ARG 102 -1.702 -2.051 11.770 818 1HG ARG 102 HG2 ARG 102 -2.089 -1.755 9.347 819 2HG ARG 102 HG1 ARG 102 -1.314 -0.176 9.449 820 1HD ARG 102 HD2 ARG 102 0.744 -1.230 10.231 821 2HD ARG 102 HD1 ARG 102 -0.029 -2.812 10.153 822 HE ARG 102 HE ARG 102 -0.227 -1.601 7.638 823 1HH1 ARG 102 HH11 ARG 102 2.205 -2.920 9.762 824 2HH1 ARG 102 HH12 ARG 102 3.263 -3.379 8.470 825 1HH2 ARG 102 HH21 ARG 102 1.162 -2.202 5.937 826 2HH2 ARG 102 HH22 ARG 102 2.671 -2.971 6.298 827 H VAL 103 HN VAL 103 -3.951 -1.952 13.472 828 HA VAL 103 HA VAL 103 -3.330 0.045 15.516 829 HB VAL 103 HB VAL 103 -5.984 -1.394 15.444 830 1HG1 VAL 103 HG11 VAL 103 -6.369 0.504 17.232 831 2HG1 VAL 103 HG12 VAL 103 -4.619 0.371 17.406 832 3HG1 VAL 103 HG13 VAL 103 -5.642 -1.041 17.674 833 1HG2 VAL 103 HG21 VAL 103 -6.699 1.155 15.275 834 2HG2 VAL 103 HG22 VAL 103 -6.373 0.180 13.842 835 3HG2 VAL 103 HG23 VAL 103 -5.138 1.275 14.462 836 H LYS 104 HN LYS 104 -2.347 -0.816 17.220 837 HA LYS 104 HA LYS 104 -2.854 -3.505 18.108 838 1HB LYS 104 HB2 LYS 104 -0.512 -4.273 17.832 839 2HB LYS 104 HB1 LYS 104 -1.329 -4.012 16.299 840 1HG LYS 104 HG2 LYS 104 -0.196 -1.861 16.055 841 2HG LYS 104 HG1 LYS 104 0.624 -2.121 17.596 842 1HD LYS 104 HD2 LYS 104 1.727 -4.094 16.698 843 2HD LYS 104 HD1 LYS 104 0.867 -3.900 15.169 844 1HE LYS 104 HE2 LYS 104 2.833 -1.942 16.356 845 2HE LYS 104 HE1 LYS 104 3.162 -3.057 15.032 846 1HZ LYS 104 HZ1 LYS 104 1.676 -0.560 15.027 847 2HZ LYS 104 HZ2 LYS 104 1.029 -1.802 14.078 848 3HZ LYS 104 HZ3 LYS 104 2.611 -1.268 13.807 849 H ASP 105 HN ASP 105 -2.481 -3.675 20.244 850 HA ASP 105 HA ASP 105 -1.925 -3.094 22.375 851 1HB ASP 105 HB2 ASP 105 0.404 -3.280 21.284 852 2HB ASP 105 HB1 ASP 105 0.385 -1.520 21.231 853 H GLY 106 HN GLY 106 -0.403 -0.320 22.666 854 1HA GLY 106 HA2 GLY 106 -2.878 1.273 22.549 855 2HA GLY 106 HA1 GLY 106 -1.574 1.531 23.704 856 H ARG 107 HN ARG 107 -1.405 0.981 20.216 857 HA ARG 107 HA ARG 107 -0.597 3.745 19.773 858 1HB ARG 107 HB2 ARG 107 1.463 3.110 18.630 859 2HB ARG 107 HB1 ARG 107 1.496 2.567 20.300 860 1HG ARG 107 HG2 ARG 107 0.765 0.307 19.457 861 2HG ARG 107 HG1 ARG 107 1.062 0.919 17.829 862 1HD ARG 107 HD2 ARG 107 3.386 1.388 18.428 863 2HD ARG 107 HD1 ARG 107 3.094 0.778 20.056 864 HE ARG 107 HE ARG 107 2.414 -1.177 18.127 865 1HH1 ARG 107 HH11 ARG 107 5.164 0.339 19.644 866 2HH1 ARG 107 HH12 ARG 107 6.213 -1.014 19.387 867 1HH2 ARG 107 HH21 ARG 107 3.790 -2.963 17.784 868 2HH2 ARG 107 HH22 ARG 107 5.433 -2.890 18.328 869 H THR 108 HN THR 108 -1.200 4.498 17.843 870 HA THR 108 HA THR 108 -2.304 2.572 15.908 871 HB THR 108 HB THR 108 -3.270 5.367 16.551 872 HG1 THR 108 HG1 THR 108 -3.819 3.662 18.054 873 1HG2 THR 108 HG21 THR 108 -3.898 3.545 14.327 874 2HG2 THR 108 HG22 THR 108 -4.008 5.302 14.430 875 3HG2 THR 108 HG23 THR 108 -5.273 4.297 15.137 876 H LEU 109 HN LEU 109 -1.760 2.793 13.802 877 HA LEU 109 HA LEU 109 -0.287 5.164 12.951 878 1HB LEU 109 HB2 LEU 109 1.480 3.871 11.908 879 2HB LEU 109 HB1 LEU 109 1.445 3.580 13.633 880 HG LEU 109 HG LEU 109 1.912 1.514 12.547 881 1HD1 LEU 109 HD11 LEU 109 0.055 1.716 14.398 882 2HD1 LEU 109 HD12 LEU 109 0.433 0.175 13.629 883 3HD1 LEU 109 HD13 LEU 109 -0.968 1.105 13.101 884 1HD2 LEU 109 HD21 LEU 109 1.058 0.810 10.604 885 2HD2 LEU 109 HD22 LEU 109 0.510 2.477 10.425 886 3HD2 LEU 109 HD23 LEU 109 -0.589 1.250 11.052 887 H HIS 110 HN HIS 110 -0.545 5.674 10.793 888 HA HIS 110 HA HIS 110 -2.329 3.850 9.309 889 1HB HIS 110 HB2 HIS 110 -3.298 5.869 8.209 890 2HB HIS 110 HB1 HIS 110 -3.632 5.759 9.932 891 HD1 HIS 110 HD1 HIS 110 -4.097 8.423 9.239 892 HD2 HIS 110 HD2 HIS 110 -0.163 7.155 9.655 893 HE1 HIS 110 HE1 HIS 110 -2.754 10.513 9.607 894 HE2 HIS 110 HE2 HIS 110 -0.411 9.700 10.033 895 H MET 111 HN MET 111 -1.948 3.519 7.135 896 HA MET 111 HA MET 111 0.176 4.983 5.843 897 1HB MET 111 HB2 MET 111 0.456 2.000 6.072 898 2HB MET 111 HB1 MET 111 1.622 3.150 5.434 899 1HG MET 111 HG2 MET 111 1.863 4.099 7.701 900 2HG MET 111 HG1 MET 111 0.778 2.850 8.303 901 1HE MET 111 HE1 MET 111 2.834 -0.399 7.407 902 2HE MET 111 HE2 MET 111 1.628 0.428 6.422 903 3HE MET 111 HE3 MET 111 1.354 0.206 8.150 904 H MET 112 HN MET 112 -0.159 5.159 3.736 905 HA MET 112 HA MET 112 -2.238 3.492 2.510 906 1HB MET 112 HB2 MET 112 -1.233 6.255 1.921 907 2HB MET 112 HB1 MET 112 -2.068 5.336 0.687 908 1HG MET 112 HG2 MET 112 -3.891 6.310 1.498 909 2HG MET 112 HG1 MET 112 -3.780 5.093 2.762 910 1HE MET 112 HE1 MET 112 -2.756 5.356 4.937 911 2HE MET 112 HE2 MET 112 -2.649 6.866 5.842 912 3HE MET 112 HE3 MET 112 -1.316 6.368 4.803 913 H ARG 113 HN ARG 113 -1.944 2.906 0.254 914 HA ARG 113 HA ARG 113 0.741 2.874 -0.819 915 1HB ARG 113 HB2 ARG 113 0.848 0.891 0.570 916 2HB ARG 113 HB1 ARG 113 -0.692 0.319 -0.053 917 1HG ARG 113 HG2 ARG 113 0.320 0.099 -2.286 918 2HG ARG 113 HG1 ARG 113 1.868 0.598 -1.609 919 1HD ARG 113 HD2 ARG 113 0.300 -1.820 -0.725 920 2HD ARG 113 HD1 ARG 113 1.636 -1.857 -1.871 921 HE ARG 113 HE ARG 113 3.118 -1.581 -0.130 922 1HH1 ARG 113 HH11 ARG 113 -0.149 -1.198 1.043 923 2HH1 ARG 113 HH12 ARG 113 0.326 -1.154 2.707 924 1HH2 ARG 113 HH21 ARG 113 3.738 -1.524 2.050 925 2HH2 ARG 113 HH22 ARG 113 2.533 -1.339 3.280 926 H LEU 114 HN LEU 114 0.736 2.739 -3.047 927 HA LEU 114 HA LEU 114 -1.931 2.526 -4.272 928 1HB LEU 114 HB2 LEU 114 -0.851 4.732 -4.452 929 2HB LEU 114 HB1 LEU 114 0.498 3.998 -5.294 930 HG LEU 114 HG LEU 114 -2.341 4.008 -6.326 931 1HD1 LEU 114 HD11 LEU 114 -1.897 5.883 -7.574 932 2HD1 LEU 114 HD12 LEU 114 -0.150 5.658 -7.493 933 3HD1 LEU 114 HD13 LEU 114 -1.029 6.255 -6.085 934 1HD2 LEU 114 HD21 LEU 114 -0.841 3.649 -8.488 935 2HD2 LEU 114 HD22 LEU 114 -1.406 2.301 -7.501 936 3HD2 LEU 114 HD23 LEU 114 0.236 2.913 -7.302 937 H TYR 115 HN TYR 115 -2.322 0.851 -5.490 938 HA TYR 115 HA TYR 115 -0.107 -0.811 -6.418 939 1HB TYR 115 HB2 TYR 115 -1.569 -2.241 -5.377 940 2HB TYR 115 HB1 TYR 115 -2.976 -1.265 -5.775 941 HD1 TYR 115 HD1 TYR 115 -4.428 -2.880 -6.640 942 HD2 TYR 115 HD2 TYR 115 -0.466 -2.636 -8.165 943 HE1 TYR 115 HE1 TYR 115 -5.037 -4.433 -8.444 944 HE2 TYR 115 HE2 TYR 115 -1.062 -4.194 -9.971 945 HH TYR 115 HH TYR 115 -2.711 -5.908 -10.462 946 H SER 116 HN SER 116 0.552 -0.748 -8.444 947 HA SER 116 HA SER 116 -1.357 0.086 -10.523 948 1HB SER 116 HB2 SER 116 0.479 1.234 -11.712 949 2HB SER 116 HB1 SER 116 0.197 1.941 -10.121 950 HG SER 116 HG SER 116 2.437 0.866 -11.108 951 H ARG 117 HN ARG 117 -1.750 -1.578 -11.775 952 HA ARG 117 HA ARG 117 -0.428 -3.981 -11.810 953 1HB ARG 117 HB2 ARG 117 -1.695 -4.536 -13.789 954 2HB ARG 117 HB1 ARG 117 -2.693 -3.639 -12.660 955 1HG ARG 117 HG2 ARG 117 -1.438 -2.589 -15.186 956 2HG ARG 117 HG1 ARG 117 -3.144 -2.915 -14.911 957 1HD ARG 117 HD2 ARG 117 -2.952 -1.209 -12.997 958 2HD ARG 117 HD1 ARG 117 -1.447 -0.721 -13.750 959 HE ARG 117 HE ARG 117 -3.968 0.129 -14.489 960 1HH1 ARG 117 HH11 ARG 117 -1.159 -1.193 -16.111 961 2HH1 ARG 117 HH12 ARG 117 -1.536 -0.430 -17.615 962 1HH2 ARG 117 HH21 ARG 117 -4.422 1.143 -16.438 963 2HH2 ARG 117 HH22 ARG 117 -3.379 0.905 -17.801 964 H SER 118 HN SER 118 -0.094 -1.499 -14.381 965 HA SER 118 HA SER 118 2.556 -2.608 -14.959 966 1HB SER 118 HB2 SER 118 0.454 -1.921 -17.030 967 2HB SER 118 HB1 SER 118 2.104 -2.429 -17.378 968 HG SER 118 HG SER 118 1.635 -4.441 -16.774 969 HA PRO 119 HA PRO 119 4.393 1.372 -15.186 970 1HB PRO 119 HB2 PRO 119 4.662 0.912 -18.134 971 2HB PRO 119 HB1 PRO 119 5.859 1.511 -16.978 972 1HG PRO 119 HG2 PRO 119 5.916 -1.020 -17.818 973 2HG PRO 119 HG1 PRO 119 6.305 -0.602 -16.140 974 1HD PRO 119 HD2 PRO 119 3.903 -1.931 -17.245 975 2HD PRO 119 HD1 PRO 119 4.611 -2.045 -15.624 976 H GLU 120 HN GLU 120 2.088 0.619 -17.768 977 HA GLU 120 HA GLU 120 1.485 3.310 -18.443 978 1HB GLU 120 HB2 GLU 120 1.032 1.460 -19.976 979 2HB GLU 120 HB1 GLU 120 -0.129 0.786 -18.844 980 1HG GLU 120 HG2 GLU 120 -1.556 2.739 -19.130 981 2HG GLU 120 HG1 GLU 120 -0.387 3.434 -20.250 982 H VAL 121 HN VAL 121 1.404 3.764 -15.942 983 HA VAL 121 HA VAL 121 -0.901 3.079 -14.487 984 HB VAL 121 HB VAL 121 0.792 5.564 -14.178 985 1HG1 VAL 121 HG11 VAL 121 -1.308 5.749 -12.988 986 2HG1 VAL 121 HG12 VAL 121 0.008 5.502 -11.841 987 3HG1 VAL 121 HG13 VAL 121 -1.063 4.164 -12.254 988 1HG2 VAL 121 HG21 VAL 121 1.881 4.168 -12.358 989 2HG2 VAL 121 HG22 VAL 121 2.270 3.732 -14.021 990 3HG2 VAL 121 HG23 VAL 121 1.107 2.772 -13.107 991 H SER 122 HN SER 122 -2.918 3.572 -14.945 992 HA SER 122 HA SER 122 -3.693 5.557 -16.811 993 1HB SER 122 HB2 SER 122 -5.037 3.542 -16.406 994 2HB SER 122 HB1 SER 122 -5.339 4.073 -14.752 995 HG SER 122 HG SER 122 -7.042 4.933 -15.654 996 HA PRO 123 HA PRO 123 -3.934 9.322 -14.511 997 1HB PRO 123 HB2 PRO 123 -6.572 10.037 -15.172 998 2HB PRO 123 HB1 PRO 123 -5.118 10.489 -16.067 999 1HG PRO 123 HG2 PRO 123 -7.053 8.282 -16.583 1000 2HG PRO 123 HG1 PRO 123 -6.173 9.299 -17.738 1001 1HD PRO 123 HD2 PRO 123 -5.415 6.784 -17.281 1002 2HD PRO 123 HD1 PRO 123 -4.210 8.067 -17.512 1003 H ALA 124 HN ALA 124 -6.729 7.142 -14.406 1004 HA ALA 124 HA ALA 124 -7.860 8.100 -12.023 1005 1HB ALA 124 HB1 ALA 124 -8.147 5.217 -12.449 1006 2HB ALA 124 HB2 ALA 124 -8.563 6.199 -13.853 1007 3HB ALA 124 HB3 ALA 124 -9.377 6.473 -12.313 1008 H ALA 125 HN ALA 125 -5.512 5.510 -12.616 1009 HA ALA 125 HA ALA 125 -5.277 4.443 -10.100 1010 1HB ALA 125 HB1 ALA 125 -4.050 3.894 -12.328 1011 2HB ALA 125 HB2 ALA 125 -3.265 3.537 -10.789 1012 3HB ALA 125 HB3 ALA 125 -2.811 4.978 -11.696 1013 H THR 126 HN THR 126 -3.207 7.032 -11.399 1014 HA THR 126 HA THR 126 -2.157 7.678 -8.822 1015 HB THR 126 HB THR 126 -2.050 9.208 -11.417 1016 HG1 THR 126 HG1 THR 126 -1.065 7.048 -11.268 1017 1HG2 THR 126 HG21 THR 126 -0.474 9.548 -8.882 1018 2HG2 THR 126 HG22 THR 126 -1.504 10.736 -9.684 1019 3HG2 THR 126 HG23 THR 126 0.000 10.216 -10.443 1020 H ALA 127 HN ALA 127 -4.498 9.265 -10.983 1021 HA ALA 127 HA ALA 127 -4.950 11.510 -9.351 1022 1HB ALA 127 HB1 ALA 127 -5.566 11.276 -11.774 1023 2HB ALA 127 HB2 ALA 127 -6.789 12.023 -10.745 1024 3HB ALA 127 HB3 ALA 127 -6.962 10.340 -11.248 1025 H ILE 128 HN ILE 128 -6.693 8.403 -9.529 1026 HA ILE 128 HA ILE 128 -8.752 9.112 -7.776 1027 HB ILE 128 HB ILE 128 -7.571 6.393 -8.340 1028 1HG1 ILE 128 HG12 ILE 128 -10.162 7.694 -9.219 1029 2HG1 ILE 128 HG11 ILE 128 -8.719 7.559 -10.212 1030 1HG2 ILE 128 HG21 ILE 128 -8.607 5.700 -6.485 1031 2HG2 ILE 128 HG22 ILE 128 -10.106 5.946 -7.383 1032 3HG2 ILE 128 HG23 ILE 128 -9.500 7.210 -6.313 1033 1HD1 ILE 128 HD11 ILE 128 -8.939 5.240 -10.405 1034 2HD1 ILE 128 HD12 ILE 128 -10.571 5.877 -10.606 1035 3HD1 ILE 128 HD13 ILE 128 -10.090 5.153 -9.072 1036 H PHE 129 HN PHE 129 -5.597 7.569 -7.070 1037 HA PHE 129 HA PHE 129 -6.030 7.333 -4.291 1038 1HB PHE 129 HB2 PHE 129 -4.153 6.202 -5.430 1039 2HB PHE 129 HB1 PHE 129 -3.406 7.762 -5.746 1040 HD1 PHE 129 HD1 PHE 129 -1.485 7.935 -4.476 1041 HD2 PHE 129 HD2 PHE 129 -5.001 6.315 -2.705 1042 HE1 PHE 129 HE1 PHE 129 -0.338 7.832 -2.300 1043 HE2 PHE 129 HE2 PHE 129 -3.861 6.208 -0.529 1044 HZ PHE 129 HZ PHE 129 -1.528 6.970 -0.323 1045 H ARG 130 HN ARG 130 -4.475 9.860 -6.216 1046 HA ARG 130 HA ARG 130 -3.897 11.596 -4.065 1047 1HB ARG 130 HB2 ARG 130 -2.745 11.769 -6.206 1048 2HB ARG 130 HB1 ARG 130 -4.257 12.152 -7.014 1049 1HG ARG 130 HG2 ARG 130 -4.407 14.242 -5.777 1050 2HG ARG 130 HG1 ARG 130 -2.902 13.862 -4.936 1051 1HD ARG 130 HD2 ARG 130 -2.560 15.417 -6.818 1052 2HD ARG 130 HD1 ARG 130 -1.686 13.900 -7.036 1053 HE ARG 130 HE ARG 130 -4.198 13.706 -8.281 1054 1HH1 ARG 130 HH11 ARG 130 -1.139 15.346 -8.660 1055 2HH1 ARG 130 HH12 ARG 130 -1.282 15.475 -10.381 1056 1HH2 ARG 130 HH21 ARG 130 -4.383 13.873 -10.540 1057 2HH2 ARG 130 HH22 ARG 130 -3.123 14.640 -11.447 1058 H LYS 131 HN LYS 131 -6.593 11.378 -6.326 1059 HA LYS 131 HA LYS 131 -7.984 13.683 -5.533 1060 1HB LYS 131 HB2 LYS 131 -8.447 12.351 -7.600 1061 2HB LYS 131 HB1 LYS 131 -9.163 11.105 -6.586 1062 1HG LYS 131 HG2 LYS 131 -10.889 12.638 -5.860 1063 2HG LYS 131 HG1 LYS 131 -10.143 13.946 -6.778 1064 1HD LYS 131 HD2 LYS 131 -12.030 13.051 -8.003 1065 2HD LYS 131 HD1 LYS 131 -10.530 12.684 -8.856 1066 1HE LYS 131 HE2 LYS 131 -11.974 10.751 -8.882 1067 2HE LYS 131 HE1 LYS 131 -10.560 10.421 -7.883 1068 1HZ LYS 131 HZ1 LYS 131 -13.046 9.914 -7.110 1069 2HZ LYS 131 HZ2 LYS 131 -12.888 11.483 -6.500 1070 3HZ LYS 131 HZ3 LYS 131 -11.802 10.277 -6.022 1071 H LEU 132 HN LEU 132 -8.384 10.282 -4.553 1072 HA LEU 132 HA LEU 132 -10.341 10.797 -2.575 1073 1HB LEU 132 HB2 LEU 132 -8.390 8.509 -2.838 1074 2HB LEU 132 HB1 LEU 132 -9.722 8.548 -1.700 1075 HG LEU 132 HG LEU 132 -10.014 8.606 -4.707 1076 1HD1 LEU 132 HD11 LEU 132 -10.975 6.332 -3.085 1077 2HD1 LEU 132 HD12 LEU 132 -9.231 6.465 -3.311 1078 3HD1 LEU 132 HD13 LEU 132 -10.296 6.362 -4.712 1079 1HD2 LEU 132 HD21 LEU 132 -11.829 9.761 -3.546 1080 2HD2 LEU 132 HD22 LEU 132 -12.078 8.348 -2.521 1081 3HD2 LEU 132 HD23 LEU 132 -12.387 8.246 -4.254 1082 H ALA 133 HN ALA 133 -6.825 10.551 -2.516 1083 HA ALA 133 HA ALA 133 -6.459 10.784 0.267 1084 1HB ALA 133 HB1 ALA 133 -4.570 10.075 -0.898 1085 2HB ALA 133 HB2 ALA 133 -4.172 11.739 -0.475 1086 3HB ALA 133 HB3 ALA 133 -4.715 11.348 -2.108 1087 H GLY 134 HN GLY 134 -6.731 13.169 -2.324 1088 1HA GLY 134 HA2 GLY 134 -6.103 15.471 -0.869 1089 2HA GLY 134 HA1 GLY 134 -7.152 15.425 -2.279 1090 H GLU 135 HN GLU 135 -9.128 13.695 -1.145 1091 HA GLU 135 HA GLU 135 -10.888 15.517 -0.030 1092 1HB GLU 135 HB2 GLU 135 -10.917 12.540 0.486 1093 2HB GLU 135 HB1 GLU 135 -12.292 13.635 0.543 1094 1HG GLU 135 HG2 GLU 135 -11.986 14.049 -1.885 1095 2HG GLU 135 HG1 GLU 135 -10.719 12.825 -1.888 1096 H ARG 136 HN ARG 136 -8.687 13.250 1.545 1097 HA ARG 136 HA ARG 136 -9.483 14.155 4.189 1098 1HB ARG 136 HB2 ARG 136 -7.379 12.152 3.357 1099 2HB ARG 136 HB1 ARG 136 -7.886 12.472 5.010 1100 1HG ARG 136 HG2 ARG 136 -9.633 11.369 2.821 1101 2HG ARG 136 HG1 ARG 136 -8.899 10.441 4.128 1102 1HD ARG 136 HD2 ARG 136 -10.159 11.744 5.768 1103 2HD ARG 136 HD1 ARG 136 -10.883 12.687 4.465 1104 HE ARG 136 HE ARG 136 -11.733 10.151 5.384 1105 1HH1 ARG 136 HH11 ARG 136 -11.391 12.038 2.468 1106 2HH1 ARG 136 HH12 ARG 136 -12.621 11.171 1.615 1107 1HH2 ARG 136 HH21 ARG 136 -13.356 9.012 4.260 1108 2HH2 ARG 136 HH22 ARG 136 -13.738 9.457 2.630 1109 H ASN 137 HN ASN 137 -8.235 16.081 2.405 1110 HA ASN 137 HA ASN 137 -6.679 17.734 2.448 1111 1HB ASN 137 HB2 ASN 137 -7.490 17.920 4.786 1112 2HB ASN 137 HB1 ASN 137 -6.245 16.788 5.289 1113 1HD2 ASN 137 HD21 ASN 137 -5.158 18.854 2.824 1114 2HD2 ASN 137 HD22 ASN 137 -4.314 19.978 3.820 1115 H TYR 138 HN TYR 138 -4.824 17.644 1.364 1116 HA TYR 138 HA TYR 138 -3.105 15.368 1.443 1117 1HB TYR 138 HB2 TYR 138 -3.369 16.587 -0.623 1118 2HB TYR 138 HB1 TYR 138 -2.814 18.075 0.131 1119 HD1 TYR 138 HD1 TYR 138 -1.221 14.767 0.618 1120 HD2 TYR 138 HD2 TYR 138 -1.016 18.537 -1.347 1121 HE1 TYR 138 HE1 TYR 138 1.079 14.267 -0.096 1122 HE2 TYR 138 HE2 TYR 138 1.282 18.045 -2.064 1123 HH TYR 138 HH TYR 138 3.167 15.762 -0.746 1124 H THR 139 HN THR 139 -3.027 15.869 3.966 1125 HA THR 139 HA THR 139 -0.893 17.720 4.653 1126 HB THR 139 HB THR 139 -2.844 17.672 6.094 1127 HG1 THR 139 HG1 THR 139 -1.469 18.046 7.610 1128 1HG2 THR 139 HG21 THR 139 -3.315 15.703 7.517 1129 2HG2 THR 139 HG22 THR 139 -2.204 14.764 6.520 1130 3HG2 THR 139 HG23 THR 139 -3.666 15.446 5.809 1131 H ASP 140 HN ASP 140 1.089 17.160 5.481 1132 HA ASP 140 HA ASP 140 2.288 14.774 4.652 1133 1HB ASP 140 HB2 ASP 140 3.152 16.614 6.895 1134 2HB ASP 140 HB1 ASP 140 4.169 15.417 6.099 1135 H GLU 141 HN GLU 141 0.362 15.513 7.424 1136 HA GLU 141 HA GLU 141 1.178 13.713 9.329 1137 1HB GLU 141 HB2 GLU 141 -0.690 15.296 9.620 1138 2HB GLU 141 HB1 GLU 141 -1.670 14.323 8.540 1139 1HG GLU 141 HG2 GLU 141 -1.508 12.439 10.104 1140 2HG GLU 141 HG1 GLU 141 -0.583 13.459 11.204 1141 H MET 142 HN MET 142 -0.138 13.033 6.211 1142 HA MET 142 HA MET 142 0.169 10.188 6.681 1143 1HB MET 142 HB2 MET 142 -2.020 9.646 5.642 1144 2HB MET 142 HB1 MET 142 -2.181 10.431 7.206 1145 1HG MET 142 HG2 MET 142 -2.599 12.573 6.001 1146 2HG MET 142 HG1 MET 142 -2.596 11.658 4.493 1147 1HE MET 142 HE1 MET 142 -4.063 8.899 5.465 1148 2HE MET 142 HE2 MET 142 -4.312 9.734 3.931 1149 3HE MET 142 HE3 MET 142 -5.695 9.306 4.936 1150 H VAL 143 HN VAL 143 1.983 11.289 5.335 1151 HA VAL 143 HA VAL 143 1.301 10.861 2.510 1152 HB VAL 143 HB VAL 143 2.908 13.178 3.581 1153 1HG1 VAL 143 HG11 VAL 143 3.034 13.798 1.105 1154 2HG1 VAL 143 HG12 VAL 143 2.597 12.119 0.786 1155 3HG1 VAL 143 HG13 VAL 143 4.079 12.490 1.664 1156 1HG2 VAL 143 HG21 VAL 143 0.671 13.567 1.691 1157 2HG2 VAL 143 HG22 VAL 143 1.156 14.529 3.086 1158 3HG2 VAL 143 HG23 VAL 143 0.233 13.044 3.316 1159 H ALA 144 HN ALA 144 2.904 10.179 1.155 1160 HA ALA 144 HA ALA 144 5.620 9.827 1.844 1161 1HB ALA 144 HB1 ALA 144 4.093 7.926 3.056 1162 2HB ALA 144 HB2 ALA 144 5.785 7.725 2.609 1163 3HB ALA 144 HB3 ALA 144 4.514 7.129 1.542 1164 H MET 145 HN MET 145 6.750 9.666 -0.038 1165 HA MET 145 HA MET 145 5.259 8.822 -2.439 1166 1HB MET 145 HB2 MET 145 6.388 10.573 -3.704 1167 2HB MET 145 HB1 MET 145 5.477 11.259 -2.367 1168 1HG MET 145 HG2 MET 145 7.604 11.359 -1.068 1169 2HG MET 145 HG1 MET 145 8.454 10.862 -2.530 1170 1HE MET 145 HE1 MET 145 6.146 13.297 -0.860 1171 2HE MET 145 HE2 MET 145 5.341 13.596 -2.400 1172 3HE MET 145 HE3 MET 145 6.374 14.836 -1.690 1173 H LEU 146 HN LEU 146 6.297 7.629 -3.948 1174 HA LEU 146 HA LEU 146 8.394 5.962 -3.291 1175 1HB LEU 146 HB2 LEU 146 6.884 5.552 -5.142 1176 2HB LEU 146 HB1 LEU 146 7.495 6.957 -5.993 1177 HG LEU 146 HG LEU 146 9.738 5.788 -6.084 1178 1HD1 LEU 146 HD11 LEU 146 8.583 4.072 -4.289 1179 2HD1 LEU 146 HD12 LEU 146 10.060 3.771 -5.204 1180 3HD1 LEU 146 HD13 LEU 146 8.515 3.162 -5.799 1181 1HD2 LEU 146 HD21 LEU 146 8.999 5.509 -8.169 1182 2HD2 LEU 146 HD22 LEU 146 7.337 5.299 -7.624 1183 3HD2 LEU 146 HD23 LEU 146 8.428 3.916 -7.675 1184 HA PRO 147 HA PRO 147 11.987 8.607 -3.286 1185 1HB PRO 147 HB2 PRO 147 13.802 6.605 -3.970 1186 2HB PRO 147 HB1 PRO 147 13.287 7.017 -2.332 1187 1HG PRO 147 HG2 PRO 147 12.313 4.851 -4.138 1188 2HG PRO 147 HG1 PRO 147 12.575 4.820 -2.384 1189 1HD PRO 147 HD2 PRO 147 10.116 5.024 -3.401 1190 2HD PRO 147 HD1 PRO 147 10.576 5.924 -1.942 1191 H ARG 148 HN ARG 148 13.458 9.547 -4.704 1192 HA ARG 148 HA ARG 148 12.665 9.525 -7.452 1193 1HB ARG 148 HB2 ARG 148 15.042 10.894 -6.185 1194 2HB ARG 148 HB1 ARG 148 14.329 11.266 -7.749 1195 1HG ARG 148 HG2 ARG 148 12.240 11.915 -6.597 1196 2HG ARG 148 HG1 ARG 148 13.048 11.644 -5.052 1197 1HD ARG 148 HD2 ARG 148 13.827 13.642 -7.173 1198 2HD ARG 148 HD1 ARG 148 13.098 14.000 -5.609 1199 HE ARG 148 HE ARG 148 15.848 13.600 -6.138 1200 1HH1 ARG 148 HH11 ARG 148 13.401 12.983 -3.725 1201 2HH1 ARG 148 HH12 ARG 148 14.537 12.890 -2.422 1202 1HH2 ARG 148 HH21 ARG 148 17.337 13.480 -4.423 1203 2HH2 ARG 148 HH22 ARG 148 16.769 13.171 -2.816 1204 H GLN 149 HN GLN 149 14.389 7.291 -5.887 1205 HA GLN 149 HA GLN 149 15.791 6.500 -8.298 1206 1HB GLN 149 HB2 GLN 149 17.453 7.823 -6.998 1207 2HB GLN 149 HB1 GLN 149 17.241 6.710 -5.654 1208 1HG GLN 149 HG2 GLN 149 19.227 6.106 -6.825 1209 2HG GLN 149 HG1 GLN 149 18.011 4.868 -7.110 1210 1HE2 GLN 149 HE21 GLN 149 17.262 7.627 -8.881 1211 2HE2 GLN 149 HE22 GLN 149 17.947 7.147 -10.388 1212 H GLU 150 HN GLU 150 16.298 4.281 -8.363 1213 HA GLU 150 HA GLU 150 14.411 2.623 -7.092 1214 1HB GLU 150 HB2 GLU 150 16.902 1.923 -8.644 1215 2HB GLU 150 HB1 GLU 150 15.661 0.768 -8.175 1216 1HG GLU 150 HG2 GLU 150 14.016 2.091 -9.477 1217 2HG GLU 150 HG1 GLU 150 15.339 3.120 -10.025 1218 H GLU 151 HN GLU 151 17.142 3.925 -5.719 1219 HA GLU 151 HA GLU 151 17.798 1.566 -4.139 1220 1HB GLU 151 HB2 GLU 151 19.058 4.311 -4.232 1221 2HB GLU 151 HB1 GLU 151 19.596 3.011 -3.180 1222 1HG GLU 151 HG2 GLU 151 19.563 2.917 -6.186 1223 2HG GLU 151 HG1 GLU 151 20.977 3.235 -5.183 1224 H CYS 152 HN CYS 152 17.819 4.880 -2.956 1225 HA CYS 152 HA CYS 152 15.526 4.728 -1.313 1226 1HB CYS 152 HB2 CYS 152 16.752 4.591 0.887 1227 2HB CYS 152 HB1 CYS 152 16.742 3.089 -0.031 1228 H THR 153 HN THR 153 15.252 6.829 -2.133 1229 HA THR 153 HA THR 153 16.545 8.909 -0.643 1230 HB THR 153 HB THR 153 18.292 8.505 -2.287 1231 HG1 THR 153 HG1 THR 153 17.719 10.707 -1.695 1232 1HG2 THR 153 HG21 THR 153 16.503 7.688 -4.034 1233 2HG2 THR 153 HG22 THR 153 18.034 8.398 -4.547 1234 3HG2 THR 153 HG23 THR 153 16.567 9.377 -4.536 1235 H VAL 154 HN VAL 154 14.130 8.956 -0.281 1236 HA VAL 154 HA VAL 154 12.525 10.020 -2.427 1237 HB VAL 154 HB VAL 154 11.554 8.494 -0.738 1238 1HG1 VAL 154 HG11 VAL 154 10.869 9.710 1.446 1239 2HG1 VAL 154 HG12 VAL 154 12.255 10.744 1.101 1240 3HG1 VAL 154 HG13 VAL 154 12.475 9.010 1.311 1241 1HG2 VAL 154 HG21 VAL 154 10.360 11.245 -0.982 1242 2HG2 VAL 154 HG22 VAL 154 9.490 9.845 -0.358 1243 3HG2 VAL 154 HG23 VAL 154 10.075 9.849 -2.021 1244 H ASP 155 HN ASP 155 11.555 12.074 -2.501 1245 HA ASP 155 HA ASP 155 13.219 14.219 -1.699 1246 1HB ASP 155 HB2 ASP 155 11.718 14.244 -3.704 1247 2HB ASP 155 HB1 ASP 155 10.337 14.374 -2.618 1248 H GLU 156 HN GLU 156 13.154 13.356 0.634 1249 HA GLU 156 HA GLU 156 11.935 15.240 2.277 1250 1HB GLU 156 HB2 GLU 156 10.258 13.817 3.446 1251 2HB GLU 156 HB1 GLU 156 9.816 14.196 1.788 1252 1HG GLU 156 HG2 GLU 156 10.590 11.983 1.085 1253 2HG GLU 156 HG1 GLU 156 11.003 11.606 2.758 1254 H VAL 157 HN VAL 157 12.884 15.227 4.237 1255 HA VAL 157 HA VAL 157 14.510 14.743 5.762 1256 HB VAL 157 HB VAL 157 12.609 13.385 6.582 1257 1HG1 VAL 157 HG11 VAL 157 12.822 10.879 6.272 1258 2HG1 VAL 157 HG12 VAL 157 13.913 11.238 4.933 1259 3HG1 VAL 157 HG13 VAL 157 12.241 11.798 4.884 1260 1HG2 VAL 157 HG21 VAL 157 14.001 13.076 8.285 1261 2HG2 VAL 157 HG22 VAL 157 15.395 13.039 7.206 1262 3HG2 VAL 157 HG23 VAL 157 14.501 11.557 7.543 Start of MODEL 3 1 1H MET 1 HT1 MET 1 -25.543 -19.488 -9.979 2 2H MET 1 HT2 MET 1 -25.517 -18.168 -11.035 3 3H MET 1 HT3 MET 1 -24.536 -18.167 -9.658 4 HA MET 1 HA MET 1 -23.298 -20.064 -10.527 5 1HB MET 1 HB2 MET 1 -23.673 -20.715 -12.870 6 2HB MET 1 HB1 MET 1 -25.103 -20.988 -11.884 7 1HG MET 1 HG2 MET 1 -26.093 -18.930 -12.749 8 2HG MET 1 HG1 MET 1 -24.659 -18.659 -13.738 9 1HE MET 1 HE1 MET 1 -26.198 -18.631 -16.172 10 2HE MET 1 HE2 MET 1 -27.365 -18.472 -14.860 11 3HE MET 1 HE3 MET 1 -27.646 -19.638 -16.153 12 H THR 2 HN THR 2 -24.411 -17.221 -12.345 13 HA THR 2 HA THR 2 -22.010 -16.669 -13.674 14 HB THR 2 HB THR 2 -24.110 -15.605 -14.301 15 HG1 THR 2 HG1 THR 2 -22.999 -13.984 -14.995 16 1HG2 THR 2 HG21 THR 2 -25.484 -14.667 -12.855 17 2HG2 THR 2 HG22 THR 2 -24.255 -13.472 -12.440 18 3HG2 THR 2 HG23 THR 2 -24.339 -14.995 -11.555 19 H VAL 3 HN VAL 3 -20.170 -15.651 -13.114 20 HA VAL 3 HA VAL 3 -19.975 -14.027 -10.746 21 HB VAL 3 HB VAL 3 -18.213 -15.365 -9.661 22 1HG1 VAL 3 HG11 VAL 3 -19.641 -16.968 -8.608 23 2HG1 VAL 3 HG12 VAL 3 -20.732 -16.982 -9.994 24 3HG1 VAL 3 HG13 VAL 3 -20.606 -15.541 -8.986 25 1HG2 VAL 3 HG21 VAL 3 -18.769 -17.192 -11.951 26 2HG2 VAL 3 HG22 VAL 3 -18.277 -17.881 -10.404 27 3HG2 VAL 3 HG23 VAL 3 -17.228 -16.727 -11.227 28 HA PRO 4 HA PRO 4 -16.974 -11.995 -13.303 29 1HB PRO 4 HB2 PRO 4 -15.680 -11.427 -10.661 30 2HB PRO 4 HB1 PRO 4 -16.081 -10.317 -11.977 31 1HG PRO 4 HG2 PRO 4 -17.583 -10.384 -9.804 32 2HG PRO 4 HG1 PRO 4 -18.343 -10.270 -11.405 33 1HD PRO 4 HD2 PRO 4 -18.077 -12.640 -9.596 34 2HD PRO 4 HD1 PRO 4 -19.448 -12.144 -10.611 35 H ASP 5 HN ASP 5 -14.364 -12.160 -11.221 36 HA ASP 5 HA ASP 5 -13.488 -14.816 -11.601 37 1HB ASP 5 HB2 ASP 5 -13.344 -14.136 -13.947 38 2HB ASP 5 HB1 ASP 5 -12.344 -12.757 -13.500 39 H ARG 6 HN ARG 6 -12.031 -15.195 -10.070 40 HA ARG 6 HA ARG 6 -11.030 -13.114 -8.428 41 1HB ARG 6 HB2 ARG 6 -10.349 -16.049 -8.597 42 2HB ARG 6 HB1 ARG 6 -9.639 -14.968 -7.408 43 1HG ARG 6 HG2 ARG 6 -11.460 -16.181 -6.414 44 2HG ARG 6 HG1 ARG 6 -11.892 -14.476 -6.544 45 1HD ARG 6 HD2 ARG 6 -13.746 -15.965 -7.169 46 2HD ARG 6 HD1 ARG 6 -13.239 -14.934 -8.504 47 HE ARG 6 HE ARG 6 -11.873 -17.385 -8.660 48 1HH1 ARG 6 HH11 ARG 6 -15.083 -16.074 -9.062 49 2HH1 ARG 6 HH12 ARG 6 -15.565 -17.277 -10.210 50 1HH2 ARG 6 HH21 ARG 6 -12.507 -18.969 -10.169 51 2HH2 ARG 6 HH22 ARG 6 -14.104 -18.921 -10.838 52 H SER 7 HN SER 7 -9.742 -14.920 -11.120 53 HA SER 7 HA SER 7 -7.037 -14.427 -10.915 54 1HB SER 7 HB2 SER 7 -8.732 -14.472 -13.424 55 2HB SER 7 HB1 SER 7 -6.974 -14.618 -13.385 56 HG SER 7 HG SER 7 -8.860 -16.506 -12.957 57 H GLU 8 HN GLU 8 -9.609 -12.255 -11.907 58 HA GLU 8 HA GLU 8 -8.301 -10.253 -13.222 59 1HB GLU 8 HB2 GLU 8 -9.978 -8.724 -12.412 60 2HB GLU 8 HB1 GLU 8 -10.737 -10.289 -12.671 61 1HG GLU 8 HG2 GLU 8 -10.424 -10.708 -10.202 62 2HG GLU 8 HG1 GLU 8 -9.973 -9.012 -10.063 63 H ILE 9 HN ILE 9 -8.471 -10.712 -9.719 64 HA ILE 9 HA ILE 9 -6.810 -8.470 -9.114 65 HB ILE 9 HB ILE 9 -7.923 -10.743 -7.509 66 1HG1 ILE 9 HG12 ILE 9 -9.321 -8.773 -8.043 67 2HG1 ILE 9 HG11 ILE 9 -9.049 -8.953 -6.312 68 1HG2 ILE 9 HG21 ILE 9 -6.820 -9.270 -5.560 69 2HG2 ILE 9 HG22 ILE 9 -5.592 -9.069 -6.810 70 3HG2 ILE 9 HG23 ILE 9 -6.036 -10.685 -6.263 71 1HD1 ILE 9 HD11 ILE 9 -7.992 -6.996 -6.163 72 2HD1 ILE 9 HD12 ILE 9 -8.732 -6.653 -7.726 73 3HD1 ILE 9 HD13 ILE 9 -7.081 -7.262 -7.649 74 H ALA 10 HN ALA 10 -6.286 -11.949 -9.432 75 HA ALA 10 HA ALA 10 -3.694 -12.106 -8.432 76 1HB ALA 10 HB1 ALA 10 -4.212 -13.791 -10.777 77 2HB ALA 10 HB2 ALA 10 -5.453 -13.869 -9.526 78 3HB ALA 10 HB3 ALA 10 -3.776 -14.240 -9.127 79 H GLY 11 HN GLY 11 -1.805 -11.270 -9.097 80 1HA GLY 11 HA2 GLY 11 -0.750 -11.264 -11.625 81 2HA GLY 11 HA1 GLY 11 -1.689 -9.783 -11.563 82 H LYS 12 HN LYS 12 -0.055 -8.311 -11.626 83 HA LYS 12 HA LYS 12 1.851 -8.381 -9.379 84 1HB LYS 12 HB2 LYS 12 3.032 -8.788 -11.468 85 2HB LYS 12 HB1 LYS 12 2.310 -7.353 -12.182 86 1HG LYS 12 HG2 LYS 12 3.501 -5.935 -10.628 87 2HG LYS 12 HG1 LYS 12 4.166 -7.348 -9.813 88 1HD LYS 12 HD2 LYS 12 5.839 -6.422 -11.273 89 2HD LYS 12 HD1 LYS 12 5.309 -7.972 -11.923 90 1HE LYS 12 HE2 LYS 12 4.204 -5.327 -12.845 91 2HE LYS 12 HE1 LYS 12 5.595 -6.105 -13.598 92 1HZ LYS 12 HZ1 LYS 12 4.135 -7.171 -14.859 93 2HZ LYS 12 HZ2 LYS 12 2.820 -6.661 -13.927 94 3HZ LYS 12 HZ3 LYS 12 3.673 -8.055 -13.492 95 H TRP 13 HN TRP 13 1.698 -6.762 -8.016 96 HA TRP 13 HA TRP 13 0.290 -4.306 -8.825 97 1HB TRP 13 HB2 TRP 13 0.794 -5.491 -6.082 98 2HB TRP 13 HB1 TRP 13 -0.011 -3.958 -6.372 99 HD1 TRP 13 HD1 TRP 13 -0.916 -6.820 -8.693 100 HE1 TRP 13 HE1 TRP 13 -3.300 -7.615 -8.159 101 HE3 TRP 13 HE3 TRP 13 -1.697 -4.200 -4.373 102 HZ2 TRP 13 HZ2 TRP 13 -5.251 -7.196 -6.172 103 HZ3 TRP 13 HZ3 TRP 13 -3.851 -4.458 -3.214 104 HH2 TRP 13 HH2 TRP 13 -5.592 -5.927 -4.097 105 H TYR 14 HN TYR 14 1.397 -2.377 -8.834 106 HA TYR 14 HA TYR 14 4.182 -2.465 -7.868 107 1HB TYR 14 HB2 TYR 14 4.030 -2.123 -10.269 108 2HB TYR 14 HB1 TYR 14 2.939 -0.762 -10.036 109 HD1 TYR 14 HD1 TYR 14 4.226 0.917 -11.114 110 HD2 TYR 14 HD2 TYR 14 5.967 -1.427 -8.020 111 HE1 TYR 14 HE1 TYR 14 6.150 2.448 -11.044 112 HE2 TYR 14 HE2 TYR 14 7.894 0.096 -7.941 113 HH TYR 14 HH TYR 14 8.860 1.957 -10.110 114 H VAL 15 HN VAL 15 4.397 -1.514 -5.940 115 HA VAL 15 HA VAL 15 2.702 0.754 -5.263 116 HB VAL 15 HB VAL 15 2.673 -0.497 -3.376 117 1HG1 VAL 15 HG11 VAL 15 4.789 -1.700 -2.535 118 2HG1 VAL 15 HG12 VAL 15 5.390 -1.427 -4.164 119 3HG1 VAL 15 HG13 VAL 15 3.922 -2.360 -3.919 120 1HG2 VAL 15 HG21 VAL 15 5.214 1.074 -2.942 121 2HG2 VAL 15 HG22 VAL 15 4.211 0.377 -1.673 122 3HG2 VAL 15 HG23 VAL 15 3.569 1.660 -2.698 123 H VAL 16 HN VAL 16 3.293 2.748 -5.573 124 HA VAL 16 HA VAL 16 6.153 3.428 -5.504 125 HB VAL 16 HB VAL 16 4.914 3.152 -7.832 126 1HG1 VAL 16 HG11 VAL 16 3.160 4.820 -7.259 127 2HG1 VAL 16 HG12 VAL 16 4.030 5.161 -8.752 128 3HG1 VAL 16 HG13 VAL 16 4.406 6.066 -7.286 129 1HG2 VAL 16 HG21 VAL 16 7.100 4.872 -6.929 130 2HG2 VAL 16 HG22 VAL 16 6.444 5.261 -8.516 131 3HG2 VAL 16 HG23 VAL 16 7.061 3.643 -8.188 132 H ALA 17 HN ALA 17 2.850 4.823 -5.524 133 HA ALA 17 HA ALA 17 3.812 7.212 -4.174 134 1HB ALA 17 HB1 ALA 17 0.942 6.559 -4.777 135 2HB ALA 17 HB2 ALA 17 2.042 7.226 -5.985 136 3HB ALA 17 HB3 ALA 17 1.674 8.139 -4.522 137 H LEU 18 HN LEU 18 3.382 7.779 -2.067 138 HA LEU 18 HA LEU 18 1.803 5.947 -0.424 139 1HB LEU 18 HB2 LEU 18 4.640 6.759 0.221 140 2HB LEU 18 HB1 LEU 18 3.565 5.935 1.326 141 HG LEU 18 HG LEU 18 5.103 4.346 0.435 142 1HD1 LEU 18 HD11 LEU 18 3.049 3.320 0.766 143 2HD1 LEU 18 HD12 LEU 18 3.501 2.846 -0.872 144 3HD1 LEU 18 HD13 LEU 18 2.319 4.126 -0.619 145 1HD2 LEU 18 HD21 LEU 18 4.314 4.361 -2.343 146 2HD2 LEU 18 HD22 LEU 18 5.924 4.390 -1.624 147 3HD2 LEU 18 HD23 LEU 18 5.039 5.896 -1.863 148 H ALA 19 HN ALA 19 1.798 6.823 1.931 149 HA ALA 19 HA ALA 19 2.138 9.591 2.420 150 1HB ALA 19 HB1 ALA 19 -0.718 9.367 2.579 151 2HB ALA 19 HB2 ALA 19 -0.179 8.993 0.940 152 3HB ALA 19 HB3 ALA 19 0.258 10.529 1.684 153 H SER 20 HN SER 20 2.801 9.292 4.533 154 HA SER 20 HA SER 20 0.915 7.839 6.270 155 1HB SER 20 HB2 SER 20 2.579 6.228 5.667 156 2HB SER 20 HB1 SER 20 3.880 7.348 6.059 157 HG SER 20 HG SER 20 2.155 5.948 7.780 158 H ASN 21 HN ASN 21 1.237 8.012 8.522 159 HA ASN 21 HA ASN 21 2.720 10.333 9.514 160 1HB ASN 21 HB2 ASN 21 -0.224 9.796 9.910 161 2HB ASN 21 HB1 ASN 21 0.697 10.698 11.099 162 1HD2 ASN 21 HD21 ASN 21 2.250 11.671 8.499 163 2HD2 ASN 21 HD22 ASN 21 1.261 12.988 7.993 164 H THR 22 HN THR 22 3.870 9.784 11.290 165 HA THR 22 HA THR 22 3.031 8.152 13.391 166 HB THR 22 HB THR 22 3.027 6.322 11.780 167 HG1 THR 22 HG1 THR 22 4.199 4.936 12.964 168 1HG2 THR 22 HG21 THR 22 4.698 7.263 10.204 169 2HG2 THR 22 HG22 THR 22 4.948 5.563 10.603 170 3HG2 THR 22 HG23 THR 22 5.960 6.802 11.346 171 H GLU 23 HN GLU 23 5.673 6.831 13.813 172 HA GLU 23 HA GLU 23 6.986 8.965 15.101 173 1HB GLU 23 HB2 GLU 23 7.755 6.128 14.495 174 2HB GLU 23 HB1 GLU 23 8.944 7.237 15.161 175 1HG GLU 23 HG2 GLU 23 8.001 6.011 16.960 176 2HG GLU 23 HG1 GLU 23 7.394 7.661 17.059 177 H PHE 24 HN PHE 24 8.489 10.358 14.440 178 HA PHE 24 HA PHE 24 9.098 10.529 11.651 179 1HB PHE 24 HB2 PHE 24 8.696 12.535 12.995 180 2HB PHE 24 HB1 PHE 24 10.106 12.169 13.982 181 HD1 PHE 24 HD1 PHE 24 9.610 12.097 10.292 182 HD2 PHE 24 HD2 PHE 24 11.664 13.819 13.597 183 HE1 PHE 24 HE1 PHE 24 11.023 13.380 8.739 184 HE2 PHE 24 HE2 PHE 24 13.081 15.106 12.051 185 HZ PHE 24 HZ PHE 24 12.761 14.888 9.619 186 H PHE 25 HN PHE 25 10.793 9.364 14.477 187 HA PHE 25 HA PHE 25 13.328 9.297 13.061 188 1HB PHE 25 HB2 PHE 25 12.569 8.506 15.870 189 2HB PHE 25 HB1 PHE 25 14.197 8.358 15.217 190 HD1 PHE 25 HD1 PHE 25 11.555 11.013 15.223 191 HD2 PHE 25 HD2 PHE 25 15.617 9.978 15.960 192 HE1 PHE 25 HE1 PHE 25 12.029 13.340 15.854 193 HE2 PHE 25 HE2 PHE 25 16.097 12.304 16.597 194 HZ PHE 25 HZ PHE 25 14.302 13.990 16.544 195 H LEU 26 HN LEU 26 11.255 6.864 14.680 196 HA LEU 26 HA LEU 26 12.785 4.737 13.444 197 1HB LEU 26 HB2 LEU 26 10.372 4.625 15.247 198 2HB LEU 26 HB1 LEU 26 11.323 3.242 14.737 199 HG LEU 26 HG LEU 26 12.309 5.529 16.443 200 1HD1 LEU 26 HD11 LEU 26 12.018 4.228 18.282 201 2HD1 LEU 26 HD12 LEU 26 12.214 2.721 17.386 202 3HD1 LEU 26 HD13 LEU 26 10.691 3.608 17.300 203 1HD2 LEU 26 HD21 LEU 26 14.302 4.029 16.729 204 2HD2 LEU 26 HD22 LEU 26 14.132 4.753 15.129 205 3HD2 LEU 26 HD23 LEU 26 13.682 3.067 15.387 206 H ARG 27 HN ARG 27 9.259 5.138 13.690 207 HA ARG 27 HA ARG 27 8.597 3.426 11.637 208 1HB ARG 27 HB2 ARG 27 7.114 5.853 12.640 209 2HB ARG 27 HB1 ARG 27 6.412 4.644 11.578 210 1HG ARG 27 HG2 ARG 27 7.534 4.060 14.308 211 2HG ARG 27 HG1 ARG 27 5.830 4.356 13.971 212 1HD ARG 27 HD2 ARG 27 7.373 2.197 12.562 213 2HD ARG 27 HD1 ARG 27 6.617 1.924 14.129 214 HE ARG 27 HE ARG 27 4.556 1.916 13.114 215 1HH1 ARG 27 HH11 ARG 27 6.961 2.922 10.792 216 2HH1 ARG 27 HH12 ARG 27 5.844 2.964 9.472 217 1HH2 ARG 27 HH21 ARG 27 3.099 1.952 11.377 218 2HH2 ARG 27 HH22 ARG 27 3.656 2.411 9.802 219 H GLU 28 HN GLU 28 9.114 6.933 11.425 220 HA GLU 28 HA GLU 28 8.432 7.151 8.696 221 1HB GLU 28 HB2 GLU 28 8.486 9.079 10.197 222 2HB GLU 28 HB1 GLU 28 10.224 8.902 10.380 223 1HG GLU 28 HG2 GLU 28 9.676 10.700 8.847 224 2HG GLU 28 HG1 GLU 28 10.541 9.404 8.026 225 H LYS 29 HN LYS 29 11.566 6.748 10.314 226 HA LYS 29 HA LYS 29 13.085 6.831 7.911 227 1HB LYS 29 HB2 LYS 29 14.045 7.359 10.115 228 2HB LYS 29 HB1 LYS 29 13.821 5.686 10.610 229 1HG LYS 29 HG2 LYS 29 16.131 6.149 9.976 230 2HG LYS 29 HG1 LYS 29 15.391 4.946 8.919 231 1HD LYS 29 HD2 LYS 29 16.714 6.554 7.639 232 2HD LYS 29 HD1 LYS 29 15.003 6.668 7.225 233 1HE LYS 29 HE2 LYS 29 14.779 8.606 8.706 234 2HE LYS 29 HE1 LYS 29 16.490 8.489 9.116 235 1HZ LYS 29 HZ1 LYS 29 16.643 8.604 6.472 236 2HZ LYS 29 HZ2 LYS 29 16.664 9.981 7.455 237 3HZ LYS 29 HZ3 LYS 29 15.227 9.502 6.701 238 H ASP 30 HN ASP 30 11.694 4.217 9.829 239 HA ASP 30 HA ASP 30 12.989 2.071 8.589 240 1HB ASP 30 HB2 ASP 30 11.690 1.866 10.676 241 2HB ASP 30 HB1 ASP 30 10.204 2.118 9.765 242 H LYS 31 HN LYS 31 9.754 3.419 7.872 243 HA LYS 31 HA LYS 31 9.465 1.763 5.558 244 1HB LYS 31 HB2 LYS 31 7.834 4.025 6.695 245 2HB LYS 31 HB1 LYS 31 7.419 3.255 5.172 246 1HG LYS 31 HG2 LYS 31 6.142 2.341 7.041 247 2HG LYS 31 HG1 LYS 31 7.159 1.121 6.273 248 1HD LYS 31 HD2 LYS 31 8.816 1.382 8.052 249 2HD LYS 31 HD1 LYS 31 7.804 2.609 8.817 250 1HE LYS 31 HE2 LYS 31 6.023 0.932 9.085 251 2HE LYS 31 HE1 LYS 31 7.077 -0.282 8.364 252 1HZ LYS 31 HZ1 LYS 31 8.150 1.186 10.637 253 2HZ LYS 31 HZ2 LYS 31 8.316 -0.446 10.226 254 3HZ LYS 31 HZ3 LYS 31 6.898 0.097 10.971 255 H MET 32 HN MET 32 8.195 4.004 3.956 256 HA MET 32 HA MET 32 8.778 5.266 2.165 257 1HB MET 32 HB2 MET 32 11.065 6.120 3.952 258 2HB MET 32 HB1 MET 32 10.554 6.940 2.484 259 1HG MET 32 HG2 MET 32 8.315 7.271 3.576 260 2HG MET 32 HG1 MET 32 9.047 6.687 5.070 261 1HE MET 32 HE1 MET 32 11.309 8.838 6.360 262 2HE MET 32 HE2 MET 32 12.206 8.954 4.848 263 3HE MET 32 HE3 MET 32 11.536 7.405 5.360 264 H LYS 33 HN LYS 33 9.280 3.766 0.632 265 HA LYS 33 HA LYS 33 11.970 3.558 -0.214 266 1HB LYS 33 HB2 LYS 33 12.359 1.192 0.150 267 2HB LYS 33 HB1 LYS 33 12.085 1.995 1.687 268 1HG LYS 33 HG2 LYS 33 10.007 0.423 0.178 269 2HG LYS 33 HG1 LYS 33 10.983 -0.209 1.503 270 1HD LYS 33 HD2 LYS 33 10.053 1.612 2.947 271 2HD LYS 33 HD1 LYS 33 8.967 2.031 1.622 272 1HE LYS 33 HE2 LYS 33 9.105 -0.663 2.967 273 2HE LYS 33 HE1 LYS 33 7.900 0.579 3.305 274 1HZ LYS 33 HZ1 LYS 33 7.525 -1.367 1.551 275 2HZ LYS 33 HZ2 LYS 33 8.197 -0.208 0.519 276 3HZ LYS 33 HZ3 LYS 33 6.800 0.154 1.399 277 H MET 34 HN MET 34 12.205 1.927 -2.058 278 HA MET 34 HA MET 34 9.955 2.280 -3.842 279 1HB MET 34 HB2 MET 34 12.395 2.323 -4.533 280 2HB MET 34 HB1 MET 34 12.424 0.586 -4.283 281 1HG MET 34 HG2 MET 34 10.505 1.910 -6.172 282 2HG MET 34 HG1 MET 34 12.123 1.409 -6.657 283 1HE MET 34 HE1 MET 34 11.979 -2.171 -5.237 284 2HE MET 34 HE2 MET 34 12.966 -0.764 -5.632 285 3HE MET 34 HE3 MET 34 12.491 -1.892 -6.901 286 H ALA 35 HN ALA 35 8.475 0.608 -4.590 287 HA ALA 35 HA ALA 35 8.961 -2.028 -3.429 288 1HB ALA 35 HB1 ALA 35 6.536 -0.387 -2.771 289 2HB ALA 35 HB2 ALA 35 7.792 -0.943 -1.667 290 3HB ALA 35 HB3 ALA 35 6.704 -2.107 -2.423 291 H MET 36 HN MET 36 8.169 -3.688 -4.446 292 HA MET 36 HA MET 36 6.318 -3.314 -6.706 293 1HB MET 36 HB2 MET 36 8.582 -3.742 -7.581 294 2HB MET 36 HB1 MET 36 8.716 -5.168 -6.563 295 1HG MET 36 HG2 MET 36 6.835 -6.184 -7.785 296 2HG MET 36 HG1 MET 36 6.793 -4.775 -8.843 297 1HE MET 36 HE1 MET 36 8.883 -7.557 -7.374 298 2HE MET 36 HE2 MET 36 10.294 -6.520 -7.580 299 3HE MET 36 HE3 MET 36 10.090 -7.945 -8.600 300 H ALA 37 HN ALA 37 4.756 -5.070 -6.904 301 HA ALA 37 HA ALA 37 4.912 -7.099 -4.796 302 1HB ALA 37 HB1 ALA 37 3.542 -4.876 -4.264 303 2HB ALA 37 HB2 ALA 37 3.096 -6.461 -3.631 304 3HB ALA 37 HB3 ALA 37 2.276 -5.816 -5.049 305 H ARG 38 HN ARG 38 3.344 -8.773 -4.901 306 HA ARG 38 HA ARG 38 1.985 -9.199 -7.450 307 1HB ARG 38 HB2 ARG 38 2.934 -11.456 -7.669 308 2HB ARG 38 HB1 ARG 38 4.200 -10.236 -7.714 309 1HG ARG 38 HG2 ARG 38 4.767 -10.704 -5.400 310 2HG ARG 38 HG1 ARG 38 3.467 -11.893 -5.308 311 1HD ARG 38 HD2 ARG 38 5.857 -12.029 -7.141 312 2HD ARG 38 HD1 ARG 38 5.645 -12.955 -5.655 313 HE ARG 38 HE ARG 38 3.451 -13.440 -7.324 314 1HH1 ARG 38 HH11 ARG 38 6.880 -14.062 -7.202 315 2HH1 ARG 38 HH12 ARG 38 6.776 -15.523 -8.125 316 1HH2 ARG 38 HH21 ARG 38 3.310 -15.365 -8.539 317 2HH2 ARG 38 HH22 ARG 38 4.750 -16.263 -8.884 318 H ILE 39 HN ILE 39 -0.059 -9.834 -6.980 319 HA ILE 39 HA ILE 39 -0.570 -10.880 -4.293 320 HB ILE 39 HB ILE 39 -1.799 -8.873 -4.943 321 1HG1 ILE 39 HG12 ILE 39 -3.617 -11.280 -4.693 322 2HG1 ILE 39 HG11 ILE 39 -2.764 -10.524 -3.350 323 1HG2 ILE 39 HG21 ILE 39 -1.968 -9.216 -7.321 324 2HG2 ILE 39 HG22 ILE 39 -3.584 -9.031 -6.643 325 3HG2 ILE 39 HG23 ILE 39 -2.992 -10.633 -7.079 326 1HD1 ILE 39 HD11 ILE 39 -5.232 -9.928 -3.771 327 2HD1 ILE 39 HD12 ILE 39 -4.597 -8.917 -5.070 328 3HD1 ILE 39 HD13 ILE 39 -4.090 -8.635 -3.406 329 H SER 40 HN SER 40 -1.724 -12.693 -3.852 330 HA SER 40 HA SER 40 -2.728 -14.385 -5.989 331 1HB SER 40 HB2 SER 40 -0.363 -15.046 -5.825 332 2HB SER 40 HB1 SER 40 -0.559 -15.337 -4.097 333 HG SER 40 HG SER 40 -2.066 -16.971 -4.622 334 H PHE 41 HN PHE 41 -4.310 -15.833 -5.292 335 HA PHE 41 HA PHE 41 -5.528 -15.202 -2.761 336 1HB PHE 41 HB2 PHE 41 -6.330 -17.055 -5.004 337 2HB PHE 41 HB1 PHE 41 -7.298 -16.812 -3.554 338 HD1 PHE 41 HD1 PHE 41 -9.142 -15.536 -3.989 339 HD2 PHE 41 HD2 PHE 41 -5.470 -14.502 -5.878 340 HE1 PHE 41 HE1 PHE 41 -10.222 -13.580 -5.019 341 HE2 PHE 41 HE2 PHE 41 -6.542 -12.547 -6.905 342 HZ PHE 41 HZ PHE 41 -8.921 -12.082 -6.476 343 H LEU 42 HN LEU 42 -5.817 -16.512 -0.950 344 HA LEU 42 HA LEU 42 -4.402 -19.106 -0.980 345 1HB LEU 42 HB2 LEU 42 -4.449 -17.100 1.274 346 2HB LEU 42 HB1 LEU 42 -3.758 -18.702 1.370 347 HG LEU 42 HG LEU 42 -2.761 -16.447 -0.373 348 1HD1 LEU 42 HD11 LEU 42 -1.833 -15.801 1.562 349 2HD1 LEU 42 HD12 LEU 42 -0.754 -17.177 1.336 350 3HD1 LEU 42 HD13 LEU 42 -2.184 -17.337 2.354 351 1HD2 LEU 42 HD21 LEU 42 -1.919 -19.316 -0.083 352 2HD2 LEU 42 HD22 LEU 42 -0.789 -18.067 -0.604 353 3HD2 LEU 42 HD23 LEU 42 -2.235 -18.399 -1.557 354 H GLY 43 HN GLY 43 -5.609 -20.798 -0.410 355 1HA GLY 43 HA2 GLY 43 -7.571 -21.932 0.166 356 2HA GLY 43 HA1 GLY 43 -7.050 -21.359 1.739 357 H GLU 44 HN GLU 44 -8.333 -19.321 -0.843 358 HA GLU 44 HA GLU 44 -10.190 -18.017 -0.995 359 1HB GLU 44 HB2 GLU 44 -11.361 -20.125 0.817 360 2HB GLU 44 HB1 GLU 44 -12.291 -18.875 0.001 361 1HG GLU 44 HG2 GLU 44 -11.597 -19.764 -2.159 362 2HG GLU 44 HG1 GLU 44 -10.659 -21.014 -1.343 363 H ASP 45 HN ASP 45 -10.337 -19.159 2.380 364 HA ASP 45 HA ASP 45 -11.399 -16.906 3.519 365 1HB ASP 45 HB2 ASP 45 -10.446 -17.678 5.648 366 2HB ASP 45 HB1 ASP 45 -11.137 -19.010 4.726 367 H GLU 46 HN GLU 46 -8.142 -17.297 2.367 368 HA GLU 46 HA GLU 46 -7.605 -14.550 3.211 369 1HB GLU 46 HB2 GLU 46 -5.742 -16.861 3.766 370 2HB GLU 46 HB1 GLU 46 -5.347 -15.165 4.004 371 1HG GLU 46 HG2 GLU 46 -7.079 -14.964 5.684 372 2HG GLU 46 HG1 GLU 46 -7.560 -16.638 5.411 373 H LEU 47 HN LEU 47 -6.097 -13.433 2.030 374 HA LEU 47 HA LEU 47 -4.943 -14.738 -0.327 375 1HB LEU 47 HB2 LEU 47 -6.394 -12.078 -0.386 376 2HB LEU 47 HB1 LEU 47 -5.506 -12.776 -1.718 377 HG LEU 47 HG LEU 47 -7.128 -14.670 -1.742 378 1HD1 LEU 47 HD11 LEU 47 -8.057 -13.327 0.662 379 2HD1 LEU 47 HD12 LEU 47 -8.367 -14.964 0.086 380 3HD1 LEU 47 HD13 LEU 47 -9.354 -13.625 -0.495 381 1HD2 LEU 47 HD21 LEU 47 -9.035 -13.282 -2.636 382 2HD2 LEU 47 HD22 LEU 47 -7.452 -12.961 -3.345 383 3HD2 LEU 47 HD23 LEU 47 -8.120 -11.858 -2.142 384 H LYS 48 HN LYS 48 -2.988 -13.567 -1.116 385 HA LYS 48 HA LYS 48 -1.993 -11.569 0.779 386 1HB LYS 48 HB2 LYS 48 0.051 -12.761 1.217 387 2HB LYS 48 HB1 LYS 48 -1.314 -13.780 1.634 388 1HG LYS 48 HG2 LYS 48 0.103 -15.255 0.581 389 2HG LYS 48 HG1 LYS 48 -0.972 -14.779 -0.734 390 1HD LYS 48 HD2 LYS 48 0.671 -13.238 -1.585 391 2HD LYS 48 HD1 LYS 48 1.710 -13.510 -0.191 392 1HE LYS 48 HE2 LYS 48 0.950 -15.565 -2.261 393 2HE LYS 48 HE1 LYS 48 2.494 -14.720 -2.167 394 1HZ LYS 48 HZ1 LYS 48 2.908 -16.725 -1.121 395 2HZ LYS 48 HZ2 LYS 48 1.402 -16.773 -0.354 396 3HZ LYS 48 HZ3 LYS 48 2.591 -15.699 0.186 397 H VAL 49 HN VAL 49 -0.263 -10.296 0.090 398 HA VAL 49 HA VAL 49 0.434 -10.524 -2.757 399 HB VAL 49 HB VAL 49 -1.224 -8.715 -2.437 400 1HG1 VAL 49 HG11 VAL 49 0.879 -7.360 -0.757 401 2HG1 VAL 49 HG12 VAL 49 -0.590 -8.107 -0.133 402 3HG1 VAL 49 HG13 VAL 49 -0.698 -6.715 -1.209 403 1HG2 VAL 49 HG21 VAL 49 -0.263 -7.676 -4.138 404 2HG2 VAL 49 HG22 VAL 49 1.207 -8.595 -3.813 405 3HG2 VAL 49 HG23 VAL 49 0.985 -7.001 -3.093 406 H SER 50 HN SER 50 2.519 -11.067 -2.791 407 HA SER 50 HA SER 50 4.336 -10.247 -0.699 408 1HB SER 50 HB2 SER 50 4.832 -11.776 -3.269 409 2HB SER 50 HB1 SER 50 6.012 -11.550 -1.972 410 HG SER 50 HG SER 50 4.531 -13.548 -2.095 411 H TYR 51 HN TYR 51 5.876 -8.650 -0.829 412 HA TYR 51 HA TYR 51 6.255 -7.347 -3.416 413 1HB TYR 51 HB2 TYR 51 6.045 -5.099 -2.248 414 2HB TYR 51 HB1 TYR 51 4.551 -5.982 -2.517 415 HD1 TYR 51 HD1 TYR 51 7.178 -5.638 0.132 416 HD2 TYR 51 HD2 TYR 51 3.047 -6.068 -0.784 417 HE1 TYR 51 HE1 TYR 51 6.640 -5.481 2.522 418 HE2 TYR 51 HE2 TYR 51 2.496 -5.904 1.607 419 HH TYR 51 HH TYR 51 3.461 -5.040 3.669 420 H ALA 52 HN ALA 52 8.225 -6.606 -3.815 421 HA ALA 52 HA ALA 52 10.291 -7.021 -1.782 422 1HB ALA 52 HB1 ALA 52 11.846 -6.648 -3.743 423 2HB ALA 52 HB2 ALA 52 10.414 -6.616 -4.770 424 3HB ALA 52 HB3 ALA 52 10.810 -8.072 -3.859 425 H VAL 53 HN VAL 53 11.464 -5.317 -0.924 426 HA VAL 53 HA VAL 53 11.079 -2.679 -2.126 427 HB VAL 53 HB VAL 53 10.511 -1.632 -0.010 428 1HG1 VAL 53 HG11 VAL 53 8.529 -3.837 -0.173 429 2HG1 VAL 53 HG12 VAL 53 8.811 -2.866 -1.618 430 3HG1 VAL 53 HG13 VAL 53 8.282 -2.093 -0.124 431 1HG2 VAL 53 HG21 VAL 53 11.088 -2.666 1.876 432 2HG2 VAL 53 HG22 VAL 53 11.266 -4.215 1.055 433 3HG2 VAL 53 HG23 VAL 53 9.684 -3.706 1.645 434 HA PRO 54 HA PRO 54 15.334 -2.442 -0.688 435 1HB PRO 54 HB2 PRO 54 16.189 -0.871 -2.677 436 2HB PRO 54 HB1 PRO 54 15.792 -2.570 -2.954 437 1HG PRO 54 HG2 PRO 54 14.362 -0.163 -3.826 438 2HG PRO 54 HG1 PRO 54 14.235 -1.823 -4.428 439 1HD PRO 54 HD2 PRO 54 12.545 -0.433 -2.501 440 2HD PRO 54 HD1 PRO 54 12.276 -1.996 -3.299 441 H LYS 55 HN LYS 55 16.294 -1.079 0.659 442 HA LYS 55 HA LYS 55 17.039 1.242 1.045 443 1HB LYS 55 HB2 LYS 55 14.094 1.708 0.768 444 2HB LYS 55 HB1 LYS 55 15.086 2.795 1.724 445 1HG LYS 55 HG2 LYS 55 16.416 3.379 -0.153 446 2HG LYS 55 HG1 LYS 55 15.688 2.113 -1.141 447 1HD LYS 55 HD2 LYS 55 14.797 4.335 -1.675 448 2HD LYS 55 HD1 LYS 55 13.550 3.250 -1.063 449 1HE LYS 55 HE2 LYS 55 13.318 5.464 -0.081 450 2HE LYS 55 HE1 LYS 55 13.749 4.280 1.151 451 1HZ LYS 55 HZ1 LYS 55 15.641 5.336 1.586 452 2HZ LYS 55 HZ2 LYS 55 15.011 6.641 0.715 453 3HZ LYS 55 HZ3 LYS 55 16.033 5.530 -0.048 454 HA PRO 56 HA PRO 56 14.679 0.580 5.251 455 1HB PRO 56 HB2 PRO 56 13.412 -1.859 5.425 456 2HB PRO 56 HB1 PRO 56 12.600 -0.328 5.085 457 1HG PRO 56 HG2 PRO 56 13.467 -2.474 3.202 458 2HG PRO 56 HG1 PRO 56 11.993 -1.489 3.182 459 1HD PRO 56 HD2 PRO 56 14.067 -1.002 1.545 460 2HD PRO 56 HD1 PRO 56 13.057 0.304 2.188 461 H ASN 57 HN ASN 57 15.658 -0.398 6.998 462 HA ASN 57 HA ASN 57 17.121 -1.679 8.176 463 1HB ASN 57 HB2 ASN 57 17.007 -3.562 5.811 464 2HB ASN 57 HB1 ASN 57 17.711 -3.927 7.382 465 1HD2 ASN 57 HD21 ASN 57 16.461 -5.119 8.605 466 2HD2 ASN 57 HD22 ASN 57 14.734 -5.097 8.637 467 H GLY 58 HN GLY 58 18.192 0.456 7.052 468 1HA GLY 58 HA2 GLY 58 20.255 1.356 6.573 469 2HA GLY 58 HA1 GLY 58 20.927 -0.259 6.739 470 H CYS 59 HN CYS 59 18.593 1.185 4.462 471 HA CYS 59 HA CYS 59 18.537 1.244 2.189 472 1HB CYS 59 HB2 CYS 59 21.543 0.961 2.333 473 2HB CYS 59 HB1 CYS 59 20.604 1.626 1.001 474 H ARG 60 HN ARG 60 17.859 -1.148 3.175 475 HA ARG 60 HA ARG 60 19.146 -3.067 1.343 476 1HB ARG 60 HB2 ARG 60 18.070 -3.631 4.109 477 2HB ARG 60 HB1 ARG 60 18.673 -4.846 2.993 478 1HG ARG 60 HG2 ARG 60 20.289 -2.594 4.168 479 2HG ARG 60 HG1 ARG 60 20.316 -4.274 4.705 480 1HD ARG 60 HD2 ARG 60 21.108 -3.263 1.975 481 2HD ARG 60 HD1 ARG 60 22.211 -3.784 3.248 482 HE ARG 60 HE ARG 60 20.425 -5.874 2.691 483 1HH1 ARG 60 HH11 ARG 60 23.075 -4.160 1.201 484 2HH1 ARG 60 HH12 ARG 60 23.569 -5.509 0.234 485 1HH2 ARG 60 HH21 ARG 60 21.076 -7.653 1.417 486 2HH2 ARG 60 HH22 ARG 60 22.435 -7.490 0.356 487 H LYS 61 HN LYS 61 17.804 -4.748 0.507 488 HA LYS 61 HA LYS 61 15.033 -3.905 0.186 489 1HB LYS 61 HB2 LYS 61 16.350 -4.384 -1.833 490 2HB LYS 61 HB1 LYS 61 16.608 -6.029 -1.271 491 1HG LYS 61 HG2 LYS 61 14.236 -6.493 -1.442 492 2HG LYS 61 HG1 LYS 61 13.926 -4.824 -1.926 493 1HD LYS 61 HD2 LYS 61 13.956 -6.319 -3.861 494 2HD LYS 61 HD1 LYS 61 15.275 -5.148 -3.936 495 1HE LYS 61 HE2 LYS 61 16.029 -7.381 -4.579 496 2HE LYS 61 HE1 LYS 61 16.831 -6.831 -3.108 497 1HZ LYS 61 HZ1 LYS 61 15.940 -9.208 -3.180 498 2HZ LYS 61 HZ2 LYS 61 14.410 -8.516 -2.980 499 3HZ LYS 61 HZ3 LYS 61 15.602 -8.284 -1.803 500 H TRP 62 HN TRP 62 13.261 -5.101 0.827 501 HA TRP 62 HA TRP 62 13.745 -7.768 1.932 502 1HB TRP 62 HB2 TRP 62 12.481 -5.516 3.494 503 2HB TRP 62 HB1 TRP 62 12.339 -7.209 3.945 504 HD1 TRP 62 HD1 TRP 62 15.302 -4.805 3.159 505 HE1 TRP 62 HE1 TRP 62 17.150 -5.257 4.889 506 HE3 TRP 62 HE3 TRP 62 13.054 -8.572 5.790 507 HZ2 TRP 62 HZ2 TRP 62 17.598 -6.976 7.081 508 HZ3 TRP 62 HZ3 TRP 62 14.262 -9.565 7.690 509 HH2 TRP 62 HH2 TRP 62 16.488 -8.783 8.320 510 H GLU 63 HN GLU 63 12.073 -9.175 1.779 511 HA GLU 63 HA GLU 63 9.697 -8.210 0.349 512 1HB GLU 63 HB2 GLU 63 9.371 -10.583 -0.310 513 2HB GLU 63 HB1 GLU 63 10.890 -9.908 -0.882 514 1HG GLU 63 HG2 GLU 63 11.355 -12.094 -0.130 515 2HG GLU 63 HG1 GLU 63 12.000 -10.997 1.087 516 H THR 64 HN THR 64 7.620 -8.718 1.068 517 HA THR 64 HA THR 64 7.330 -10.285 3.497 518 HB THR 64 HB THR 64 6.566 -7.365 3.392 519 HG1 THR 64 HG1 THR 64 8.070 -7.163 5.027 520 1HG2 THR 64 HG21 THR 64 4.926 -8.866 4.606 521 2HG2 THR 64 HG22 THR 64 5.627 -7.538 5.532 522 3HG2 THR 64 HG23 THR 64 6.227 -9.181 5.753 523 H THR 65 HN THR 65 5.369 -11.196 3.752 524 HA THR 65 HA THR 65 3.505 -10.934 1.525 525 HB THR 65 HB THR 65 3.801 -12.953 3.751 526 HG1 THR 65 HG1 THR 65 4.027 -13.287 0.950 527 1HG2 THR 65 HG21 THR 65 1.417 -12.419 2.398 528 2HG2 THR 65 HG22 THR 65 1.813 -13.825 3.387 529 3HG2 THR 65 HG23 THR 65 2.094 -13.862 1.647 530 H PHE 66 HN PHE 66 1.739 -9.716 1.687 531 HA PHE 66 HA PHE 66 0.754 -8.976 4.359 532 1HB PHE 66 HB2 PHE 66 1.412 -7.212 2.618 533 2HB PHE 66 HB1 PHE 66 -0.027 -7.703 1.735 534 HD1 PHE 66 HD1 PHE 66 0.408 -7.341 5.407 535 HD2 PHE 66 HD2 PHE 66 -1.386 -5.829 1.856 536 HE1 PHE 66 HE1 PHE 66 -0.926 -5.772 6.753 537 HE2 PHE 66 HE2 PHE 66 -2.724 -4.259 3.196 538 HZ PHE 66 HZ PHE 66 -2.494 -4.228 5.647 539 H LYS 67 HN LYS 67 -0.552 -10.710 4.889 540 HA LYS 67 HA LYS 67 -2.679 -11.408 2.981 541 1HB LYS 67 HB2 LYS 67 -1.191 -13.242 3.552 542 2HB LYS 67 HB1 LYS 67 -1.507 -12.991 5.262 543 1HG LYS 67 HG2 LYS 67 -3.811 -13.652 4.972 544 2HG LYS 67 HG1 LYS 67 -3.574 -13.802 3.232 545 1HD LYS 67 HD2 LYS 67 -3.510 -15.991 4.246 546 2HD LYS 67 HD1 LYS 67 -1.907 -15.576 3.640 547 1HE LYS 67 HE2 LYS 67 -2.736 -15.166 6.504 548 2HE LYS 67 HE1 LYS 67 -2.000 -16.659 5.927 549 1HZ LYS 67 HZ1 LYS 67 -0.058 -15.689 6.320 550 2HZ LYS 67 HZ2 LYS 67 -0.768 -14.177 6.583 551 3HZ LYS 67 HZ3 LYS 67 -0.360 -14.657 5.013 552 H LYS 68 HN LYS 68 -4.746 -11.108 3.440 553 HA LYS 68 HA LYS 68 -5.787 -11.050 6.121 554 1HB LYS 68 HB2 LYS 68 -5.844 -8.528 4.450 555 2HB LYS 68 HB1 LYS 68 -6.774 -8.769 5.912 556 1HG LYS 68 HG2 LYS 68 -5.095 -8.042 7.133 557 2HG LYS 68 HG1 LYS 68 -4.047 -9.301 6.500 558 1HD LYS 68 HD2 LYS 68 -3.053 -7.151 6.062 559 2HD LYS 68 HD1 LYS 68 -3.580 -7.863 4.534 560 1HE LYS 68 HE2 LYS 68 -4.235 -5.572 4.514 561 2HE LYS 68 HE1 LYS 68 -5.687 -6.542 4.747 562 1HZ LYS 68 HZ1 LYS 68 -5.849 -4.799 6.272 563 2HZ LYS 68 HZ2 LYS 68 -4.234 -4.931 6.753 564 3HZ LYS 68 HZ3 LYS 68 -5.347 -6.124 7.197 565 H THR 69 HN THR 69 -8.211 -9.580 5.352 566 HA THR 69 HA THR 69 -9.353 -11.500 3.428 567 HB THR 69 HB THR 69 -10.260 -11.750 5.701 568 HG1 THR 69 HG1 THR 69 -12.137 -10.570 3.934 569 1HG2 THR 69 HG21 THR 69 -10.398 -8.876 5.630 570 2HG2 THR 69 HG22 THR 69 -10.567 -9.983 6.992 571 3HG2 THR 69 HG23 THR 69 -11.969 -9.587 5.999 572 H SER 70 HN SER 70 -11.069 -10.661 1.996 573 HA SER 70 HA SER 70 -10.907 -7.740 1.648 574 1HB SER 70 HB2 SER 70 -10.886 -8.092 -0.814 575 2HB SER 70 HB1 SER 70 -9.445 -8.710 -0.007 576 HG SER 70 HG SER 70 -10.032 -10.712 -0.458 577 H ASP 71 HN ASP 71 -12.709 -6.659 1.111 578 HA ASP 71 HA ASP 71 -15.221 -8.151 1.137 579 1HB ASP 71 HB2 ASP 71 -14.612 -5.202 1.337 580 2HB ASP 71 HB1 ASP 71 -16.250 -5.846 1.263 581 H ASP 72 HN ASP 72 -16.954 -7.618 -0.392 582 HA ASP 72 HA ASP 72 -15.995 -7.677 -3.088 583 1HB ASP 72 HB2 ASP 72 -18.373 -7.919 -3.694 584 2HB ASP 72 HB1 ASP 72 -17.914 -9.027 -2.406 585 H GLY 73 HN GLY 73 -18.068 -6.297 -4.448 586 1HA GLY 73 HA2 GLY 73 -18.567 -4.232 -5.326 587 2HA GLY 73 HA1 GLY 73 -18.326 -3.582 -3.711 588 H GLU 74 HN GLU 74 -15.997 -3.415 -3.050 589 HA GLU 74 HA GLU 74 -14.273 -2.603 -5.297 590 1HB GLU 74 HB2 GLU 74 -15.348 -0.747 -3.787 591 2HB GLU 74 HB1 GLU 74 -14.171 -1.277 -2.596 592 1HG GLU 74 HG2 GLU 74 -12.363 -0.771 -4.165 593 2HG GLU 74 HG1 GLU 74 -13.553 -0.237 -5.351 594 H VAL 75 HN VAL 75 -12.355 -2.023 -2.744 595 HA VAL 75 HA VAL 75 -11.978 -4.779 -1.939 596 HB VAL 75 HB VAL 75 -9.910 -3.328 -3.575 597 1HG1 VAL 75 HG11 VAL 75 -9.339 -4.830 -1.288 598 2HG1 VAL 75 HG12 VAL 75 -8.220 -4.387 -2.574 599 3HG1 VAL 75 HG13 VAL 75 -9.067 -5.930 -2.637 600 1HG2 VAL 75 HG21 VAL 75 -11.609 -5.740 -3.864 601 2HG2 VAL 75 HG22 VAL 75 -9.978 -5.816 -4.523 602 3HG2 VAL 75 HG23 VAL 75 -11.095 -4.567 -5.073 603 H TYR 76 HN TYR 76 -11.635 -4.835 0.092 604 HA TYR 76 HA TYR 76 -10.062 -2.748 1.426 605 1HB TYR 76 HB2 TYR 76 -12.293 -2.106 1.956 606 2HB TYR 76 HB1 TYR 76 -12.796 -3.775 2.201 607 HD1 TYR 76 HD1 TYR 76 -12.577 -4.818 4.314 608 HD2 TYR 76 HD2 TYR 76 -10.807 -1.008 3.655 609 HE1 TYR 76 HE1 TYR 76 -12.185 -4.593 6.726 610 HE2 TYR 76 HE2 TYR 76 -10.402 -0.774 6.069 611 HH TYR 76 HH TYR 76 -11.590 -1.840 8.247 612 H TYR 77 HN TYR 77 -8.428 -3.678 2.443 613 HA TYR 77 HA TYR 77 -8.663 -6.506 3.147 614 1HB TYR 77 HB2 TYR 77 -6.694 -5.113 1.750 615 2HB TYR 77 HB1 TYR 77 -5.975 -5.440 3.321 616 HD1 TYR 77 HD1 TYR 77 -8.429 -7.490 1.454 617 HD2 TYR 77 HD2 TYR 77 -4.418 -7.158 2.839 618 HE1 TYR 77 HE1 TYR 77 -8.012 -9.810 0.774 619 HE2 TYR 77 HE2 TYR 77 -3.993 -9.486 2.160 620 HH TYR 77 HH TYR 77 -6.424 -11.644 1.455 621 H SER 78 HN SER 78 -8.443 -7.239 5.169 622 HA SER 78 HA SER 78 -7.225 -5.741 7.270 623 1HB SER 78 HB2 SER 78 -9.303 -4.467 7.117 624 2HB SER 78 HB1 SER 78 -10.245 -5.951 7.259 625 HG SER 78 HG SER 78 -9.344 -6.219 9.348 626 H GLU 79 HN GLU 79 -6.802 -7.015 9.070 627 HA GLU 79 HA GLU 79 -8.200 -9.449 9.600 628 1HB GLU 79 HB2 GLU 79 -6.231 -9.651 7.651 629 2HB GLU 79 HB1 GLU 79 -5.451 -10.246 9.108 630 1HG GLU 79 HG2 GLU 79 -8.024 -11.253 7.919 631 2HG GLU 79 HG1 GLU 79 -6.456 -12.056 7.858 632 H GLU 80 HN GLU 80 -7.681 -10.370 11.561 633 HA GLU 80 HA GLU 80 -6.946 -10.494 13.707 634 1HB GLU 80 HB2 GLU 80 -4.486 -9.165 12.551 635 2HB GLU 80 HB1 GLU 80 -4.591 -9.821 14.177 636 1HG GLU 80 HG2 GLU 80 -4.951 -12.049 13.272 637 2HG GLU 80 HG1 GLU 80 -4.900 -11.401 11.633 638 H ALA 81 HN ALA 81 -5.558 -7.463 12.571 639 HA ALA 81 HA ALA 81 -7.293 -5.585 13.460 640 1HB ALA 81 HB1 ALA 81 -6.003 -4.943 15.673 641 2HB ALA 81 HB2 ALA 81 -5.670 -6.674 15.723 642 3HB ALA 81 HB3 ALA 81 -7.336 -6.098 15.712 643 H LYS 82 HN LYS 82 -3.910 -6.037 14.432 644 HA LYS 82 HA LYS 82 -2.774 -3.702 13.766 645 1HB LYS 82 HB2 LYS 82 -0.692 -4.930 13.263 646 2HB LYS 82 HB1 LYS 82 -1.486 -5.521 14.716 647 1HG LYS 82 HG2 LYS 82 -2.399 -7.404 13.446 648 2HG LYS 82 HG1 LYS 82 -1.578 -6.814 12.002 649 1HD LYS 82 HD2 LYS 82 0.583 -7.086 13.113 650 2HD LYS 82 HD1 LYS 82 -0.234 -7.659 14.568 651 1HE LYS 82 HE2 LYS 82 -1.119 -9.565 13.330 652 2HE LYS 82 HE1 LYS 82 -0.337 -8.985 11.860 653 1HZ LYS 82 HZ1 LYS 82 1.780 -9.107 13.347 654 2HZ LYS 82 HZ2 LYS 82 1.178 -10.505 12.610 655 3HZ LYS 82 HZ3 LYS 82 0.861 -10.207 14.245 656 H LYS 83 HN LYS 83 -3.940 -6.127 11.480 657 HA LYS 83 HA LYS 83 -2.898 -4.470 9.288 658 1HB LYS 83 HB2 LYS 83 -3.952 -7.301 9.283 659 2HB LYS 83 HB1 LYS 83 -3.465 -6.421 7.840 660 1HG LYS 83 HG2 LYS 83 -1.193 -6.206 8.767 661 2HG LYS 83 HG1 LYS 83 -1.697 -7.160 10.161 662 1HD LYS 83 HD2 LYS 83 -2.218 -9.041 8.679 663 2HD LYS 83 HD1 LYS 83 -1.699 -8.083 7.289 664 1HE LYS 83 HE2 LYS 83 0.551 -7.927 8.240 665 2HE LYS 83 HE1 LYS 83 0.031 -8.880 9.629 666 1HZ LYS 83 HZ1 LYS 83 -0.212 -9.924 6.877 667 2HZ LYS 83 HZ2 LYS 83 -0.193 -10.781 8.335 668 3HZ LYS 83 HZ3 LYS 83 1.230 -10.079 7.750 669 H LYS 84 HN LYS 84 -4.240 -2.973 8.621 670 HA LYS 84 HA LYS 84 -6.944 -3.680 7.848 671 1HB LYS 84 HB2 LYS 84 -7.255 -2.939 10.156 672 2HB LYS 84 HB1 LYS 84 -6.374 -1.456 9.823 673 1HG LYS 84 HG2 LYS 84 -8.110 -0.786 8.234 674 2HG LYS 84 HG1 LYS 84 -8.997 -2.265 8.591 675 1HD LYS 84 HD2 LYS 84 -8.275 -0.242 10.699 676 2HD LYS 84 HD1 LYS 84 -9.778 -0.170 9.781 677 1HE LYS 84 HE2 LYS 84 -10.258 -1.269 11.833 678 2HE LYS 84 HE1 LYS 84 -10.266 -2.497 10.570 679 1HZ LYS 84 HZ1 LYS 84 -8.924 -2.692 12.886 680 2HZ LYS 84 HZ2 LYS 84 -7.709 -2.120 11.859 681 3HZ LYS 84 HZ3 LYS 84 -8.532 -3.549 11.481 682 H VAL 85 HN VAL 85 -7.172 -2.901 5.849 683 HA VAL 85 HA VAL 85 -6.154 -0.256 5.174 684 HB VAL 85 HB VAL 85 -4.736 -0.917 3.426 685 1HG1 VAL 85 HG11 VAL 85 -3.869 -1.367 5.765 686 2HG1 VAL 85 HG12 VAL 85 -3.031 -2.184 4.449 687 3HG1 VAL 85 HG13 VAL 85 -4.183 -3.071 5.447 688 1HG2 VAL 85 HG21 VAL 85 -6.250 -3.459 3.540 689 2HG2 VAL 85 HG22 VAL 85 -4.563 -3.554 3.036 690 3HG2 VAL 85 HG23 VAL 85 -5.693 -2.533 2.147 691 H GLU 86 HN GLU 86 -7.203 0.695 3.420 692 HA GLU 86 HA GLU 86 -9.430 -0.869 2.287 693 1HB GLU 86 HB2 GLU 86 -10.191 1.018 3.650 694 2HB GLU 86 HB1 GLU 86 -9.219 2.122 2.687 695 1HG GLU 86 HG2 GLU 86 -10.568 1.635 0.727 696 2HG GLU 86 HG1 GLU 86 -11.521 0.478 1.654 697 H VAL 87 HN VAL 87 -9.195 -1.409 0.227 698 HA VAL 87 HA VAL 87 -7.256 0.020 -1.416 699 HB VAL 87 HB VAL 87 -8.808 -2.416 -2.260 700 1HG1 VAL 87 HG11 VAL 87 -6.825 -0.770 -3.473 701 2HG1 VAL 87 HG12 VAL 87 -7.641 -2.188 -4.130 702 3HG1 VAL 87 HG13 VAL 87 -6.149 -2.377 -3.211 703 1HG2 VAL 87 HG21 VAL 87 -6.191 -3.120 -1.399 704 2HG2 VAL 87 HG22 VAL 87 -7.742 -3.690 -0.786 705 3HG2 VAL 87 HG23 VAL 87 -6.994 -2.259 -0.087 706 H LEU 88 HN LEU 88 -7.979 1.749 -2.387 707 HA LEU 88 HA LEU 88 -10.708 1.842 -3.449 708 1HB LEU 88 HB2 LEU 88 -8.703 4.079 -3.130 709 2HB LEU 88 HB1 LEU 88 -10.396 4.251 -3.545 710 HG LEU 88 HG LEU 88 -9.360 3.225 -0.902 711 1HD1 LEU 88 HD11 LEU 88 -9.650 5.313 -0.008 712 2HD1 LEU 88 HD12 LEU 88 -10.809 5.803 -1.243 713 3HD1 LEU 88 HD13 LEU 88 -9.088 5.735 -1.625 714 1HD2 LEU 88 HD21 LEU 88 -11.463 2.256 -1.194 715 2HD2 LEU 88 HD22 LEU 88 -12.107 3.679 -2.015 716 3HD2 LEU 88 HD23 LEU 88 -11.797 3.727 -0.280 717 H ASP 89 HN ASP 89 -10.325 3.837 -5.373 718 HA ASP 89 HA ASP 89 -9.956 4.074 -7.593 719 1HB ASP 89 HB2 ASP 89 -7.623 4.369 -6.527 720 2HB ASP 89 HB1 ASP 89 -7.273 2.776 -7.187 721 H THR 90 HN THR 90 -7.906 1.960 -8.870 722 HA THR 90 HA THR 90 -9.928 -0.156 -9.166 723 HB THR 90 HB THR 90 -8.166 0.995 -11.336 724 HG1 THR 90 HG1 THR 90 -9.778 2.276 -11.636 725 1HG2 THR 90 HG21 THR 90 -9.630 -1.498 -11.194 726 2HG2 THR 90 HG22 THR 90 -8.459 -0.935 -12.387 727 3HG2 THR 90 HG23 THR 90 -10.157 -0.477 -12.531 728 H ASP 91 HN ASP 91 -9.126 -1.864 -8.138 729 HA ASP 91 HA ASP 91 -6.265 -2.454 -8.334 730 1HB ASP 91 HB2 ASP 91 -6.728 -4.124 -6.562 731 2HB ASP 91 HB1 ASP 91 -7.208 -2.494 -6.091 732 H TYR 92 HN TYR 92 -7.820 -2.808 -10.672 733 HA TYR 92 HA TYR 92 -7.831 -5.744 -10.879 734 1HB TYR 92 HB2 TYR 92 -9.563 -3.751 -12.349 735 2HB TYR 92 HB1 TYR 92 -9.520 -5.479 -12.688 736 HD1 TYR 92 HD1 TYR 92 -11.260 -6.691 -11.808 737 HD2 TYR 92 HD2 TYR 92 -9.873 -3.280 -9.676 738 HE1 TYR 92 HE1 TYR 92 -12.974 -7.074 -10.089 739 HE2 TYR 92 HE2 TYR 92 -11.583 -3.655 -7.948 740 HH TYR 92 HH TYR 92 -13.837 -4.790 -7.808 741 H LYS 93 HN LYS 93 -8.173 -3.612 -13.659 742 HA LYS 93 HA LYS 93 -5.434 -4.310 -14.447 743 1HB LYS 93 HB2 LYS 93 -6.483 -4.426 -16.848 744 2HB LYS 93 HB1 LYS 93 -6.510 -5.821 -15.780 745 1HG LYS 93 HG2 LYS 93 -8.637 -5.527 -16.908 746 2HG LYS 93 HG1 LYS 93 -8.810 -5.323 -15.166 747 1HD LYS 93 HD2 LYS 93 -8.820 -2.904 -15.434 748 2HD LYS 93 HD1 LYS 93 -8.582 -3.082 -17.174 749 1HE LYS 93 HE2 LYS 93 -10.721 -4.243 -17.353 750 2HE LYS 93 HE1 LYS 93 -10.954 -4.099 -15.612 751 1HZ LYS 93 HZ1 LYS 93 -12.066 -2.399 -17.165 752 2HZ LYS 93 HZ2 LYS 93 -10.532 -1.692 -17.257 753 3HZ LYS 93 HZ3 LYS 93 -11.307 -1.837 -15.761 754 H SER 94 HN SER 94 -4.920 -2.164 -13.752 755 HA SER 94 HA SER 94 -4.517 -0.366 -15.774 756 1HB SER 94 HB2 SER 94 -6.143 1.464 -15.224 757 2HB SER 94 HB1 SER 94 -6.897 0.037 -15.933 758 HG SER 94 HG SER 94 -8.075 0.725 -14.129 759 H TYR 95 HN TYR 95 -5.875 0.722 -12.704 760 HA TYR 95 HA TYR 95 -3.263 0.995 -11.470 761 1HB TYR 95 HB2 TYR 95 -3.204 3.015 -12.720 762 2HB TYR 95 HB1 TYR 95 -4.903 3.352 -12.397 763 HD1 TYR 95 HD1 TYR 95 -5.570 4.535 -10.476 764 HD2 TYR 95 HD2 TYR 95 -1.531 3.275 -10.877 765 HE1 TYR 95 HE1 TYR 95 -4.950 5.949 -8.568 766 HE2 TYR 95 HE2 TYR 95 -0.900 4.684 -8.973 767 HH TYR 95 HH TYR 95 -3.111 6.956 -7.540 768 H ALA 96 HN ALA 96 -3.410 1.040 -9.240 769 HA ALA 96 HA ALA 96 -6.101 1.354 -8.092 770 1HB ALA 96 HB1 ALA 96 -4.532 -0.602 -6.644 771 2HB ALA 96 HB2 ALA 96 -4.798 -1.083 -8.320 772 3HB ALA 96 HB3 ALA 96 -6.173 -0.717 -7.281 773 H VAL 97 HN VAL 97 -6.192 1.958 -5.907 774 HA VAL 97 HA VAL 97 -3.689 2.949 -4.744 775 HB VAL 97 HB VAL 97 -4.570 5.030 -4.149 776 1HG1 VAL 97 HG11 VAL 97 -4.168 5.572 -6.288 777 2HG1 VAL 97 HG12 VAL 97 -5.921 5.683 -6.405 778 3HG1 VAL 97 HG13 VAL 97 -5.097 4.212 -6.917 779 1HG2 VAL 97 HG21 VAL 97 -7.259 3.816 -4.650 780 2HG2 VAL 97 HG22 VAL 97 -7.050 5.567 -4.615 781 3HG2 VAL 97 HG23 VAL 97 -6.645 4.598 -3.199 782 H ILE 98 HN ILE 98 -3.452 2.310 -2.681 783 HA ILE 98 HA ILE 98 -5.826 1.629 -1.116 784 HB ILE 98 HB ILE 98 -5.131 -0.449 -2.220 785 1HG1 ILE 98 HG12 ILE 98 -6.045 -0.466 0.126 786 2HG1 ILE 98 HG11 ILE 98 -5.064 -1.864 -0.294 787 1HG2 ILE 98 HG21 ILE 98 -2.733 0.201 -2.450 788 2HG2 ILE 98 HG22 ILE 98 -2.996 -1.449 -1.882 789 3HG2 ILE 98 HG23 ILE 98 -2.524 -0.193 -0.742 790 1HD1 ILE 98 HD11 ILE 98 -4.058 -1.486 1.652 791 2HD1 ILE 98 HD12 ILE 98 -4.654 0.170 1.748 792 3HD1 ILE 98 HD13 ILE 98 -3.213 -0.194 0.801 793 H TYR 99 HN TYR 99 -5.659 2.583 0.798 794 HA TYR 99 HA TYR 99 -2.987 3.245 1.788 795 1HB TYR 99 HB2 TYR 99 -4.023 4.898 3.190 796 2HB TYR 99 HB1 TYR 99 -4.694 5.072 1.573 797 HD1 TYR 99 HD1 TYR 99 -7.005 5.167 1.303 798 HD2 TYR 99 HD2 TYR 99 -5.413 3.455 4.857 799 HE1 TYR 99 HE1 TYR 99 -9.275 4.997 2.234 800 HE2 TYR 99 HE2 TYR 99 -7.678 3.277 5.796 801 HH TYR 99 HH TYR 99 -10.070 4.799 5.137 802 H ALA 100 HN ALA 100 -2.144 2.260 3.511 803 HA ALA 100 HA ALA 100 -3.804 0.257 4.839 804 1HB ALA 100 HB1 ALA 100 -1.782 -0.591 3.813 805 2HB ALA 100 HB2 ALA 100 -1.691 -0.756 5.566 806 3HB ALA 100 HB3 ALA 100 -0.806 0.537 4.755 807 H THR 101 HN THR 101 -4.081 0.146 6.996 808 HA THR 101 HA THR 101 -2.842 2.189 8.689 809 HB THR 101 HB THR 101 -5.797 1.526 8.724 810 HG1 THR 101 HG1 THR 101 -4.459 3.842 7.778 811 1HG2 THR 101 HG21 THR 101 -6.096 3.188 10.321 812 2HG2 THR 101 HG22 THR 101 -4.486 3.859 10.061 813 3HG2 THR 101 HG23 THR 101 -4.672 2.307 10.878 814 H ARG 102 HN ARG 102 -2.037 1.314 10.502 815 HA ARG 102 HA ARG 102 -2.775 -1.450 11.096 816 1HB ARG 102 HB2 ARG 102 -0.359 0.182 11.852 817 2HB ARG 102 HB1 ARG 102 -0.674 -1.422 12.495 818 1HG ARG 102 HG2 ARG 102 0.886 -1.562 10.668 819 2HG ARG 102 HG1 ARG 102 -0.635 -2.327 10.213 820 1HD ARG 102 HD2 ARG 102 -1.273 -0.418 8.906 821 2HD ARG 102 HD1 ARG 102 0.120 0.497 9.481 822 HE ARG 102 HE ARG 102 0.066 -1.301 7.304 823 1HH1 ARG 102 HH11 ARG 102 2.095 -0.254 9.944 824 2HH1 ARG 102 HH12 ARG 102 3.567 -0.725 9.164 825 1HH2 ARG 102 HH21 ARG 102 2.000 -1.914 6.274 826 2HH2 ARG 102 HH22 ARG 102 3.514 -1.666 7.079 827 H VAL 103 HN VAL 103 -3.406 -2.169 13.058 828 HA VAL 103 HA VAL 103 -3.698 -0.269 15.252 829 HB VAL 103 HB VAL 103 -5.846 -0.115 14.151 830 1HG1 VAL 103 HG11 VAL 103 -7.297 -2.050 13.850 831 2HG1 VAL 103 HG12 VAL 103 -6.025 -3.109 14.455 832 3HG1 VAL 103 HG13 VAL 103 -5.797 -2.232 12.942 833 1HG2 VAL 103 HG21 VAL 103 -6.990 -1.673 16.211 834 2HG2 VAL 103 HG22 VAL 103 -6.700 0.067 16.191 835 3HG2 VAL 103 HG23 VAL 103 -5.472 -1.024 16.831 836 H LYS 104 HN LYS 104 -2.767 -1.158 16.940 837 HA LYS 104 HA LYS 104 -3.393 -3.841 17.790 838 1HB LYS 104 HB2 LYS 104 -1.666 -4.281 16.111 839 2HB LYS 104 HB1 LYS 104 -0.581 -3.157 16.914 840 1HG LYS 104 HG2 LYS 104 0.017 -5.432 17.449 841 2HG LYS 104 HG1 LYS 104 -0.565 -4.600 18.892 842 1HD LYS 104 HD2 LYS 104 -2.763 -5.649 18.596 843 2HD LYS 104 HD1 LYS 104 -2.160 -6.496 17.170 844 1HE LYS 104 HE2 LYS 104 -1.098 -6.785 19.979 845 2HE LYS 104 HE1 LYS 104 -2.146 -7.937 19.150 846 1HZ LYS 104 HZ1 LYS 104 -0.070 -8.826 18.806 847 2HZ LYS 104 HZ2 LYS 104 0.688 -7.322 18.658 848 3HZ LYS 104 HZ3 LYS 104 -0.265 -7.915 17.394 849 H ASP 105 HN ASP 105 -3.144 -4.067 19.966 850 HA ASP 105 HA ASP 105 -2.894 -3.400 22.136 851 1HB ASP 105 HB2 ASP 105 -0.265 -2.373 21.040 852 2HB ASP 105 HB1 ASP 105 -0.633 -2.601 22.747 853 H GLY 106 HN GLY 106 -4.294 -1.597 20.399 854 1HA GLY 106 HA2 GLY 106 -5.245 0.486 20.541 855 2HA GLY 106 HA1 GLY 106 -4.434 0.668 22.089 856 H ARG 107 HN ARG 107 -3.140 0.288 18.787 857 HA ARG 107 HA ARG 107 -1.962 2.974 19.021 858 1HB ARG 107 HB2 ARG 107 0.176 2.260 18.335 859 2HB ARG 107 HB1 ARG 107 -0.314 1.084 19.543 860 1HG ARG 107 HG2 ARG 107 -1.106 -0.333 17.553 861 2HG ARG 107 HG1 ARG 107 -0.137 0.764 16.573 862 1HD ARG 107 HD2 ARG 107 0.864 -0.885 18.891 863 2HD ARG 107 HD1 ARG 107 1.126 -1.237 17.184 864 HE ARG 107 HE ARG 107 2.076 1.337 17.683 865 1HH1 ARG 107 HH11 ARG 107 2.808 -1.954 18.587 866 2HH1 ARG 107 HH12 ARG 107 4.500 -1.652 18.802 867 1HH2 ARG 107 HH21 ARG 107 4.299 1.739 17.962 868 2HH2 ARG 107 HH22 ARG 107 5.348 0.448 18.447 869 H THR 108 HN THR 108 -2.136 4.192 17.210 870 HA THR 108 HA THR 108 -3.280 2.870 14.842 871 HB THR 108 HB THR 108 -4.785 4.481 15.856 872 HG1 THR 108 HG1 THR 108 -4.566 4.352 13.508 873 1HG2 THR 108 HG21 THR 108 -2.398 6.184 15.926 874 2HG2 THR 108 HG22 THR 108 -3.819 6.164 16.971 875 3HG2 THR 108 HG23 THR 108 -3.885 6.980 15.409 876 H LEU 109 HN LEU 109 -2.439 3.169 12.852 877 HA LEU 109 HA LEU 109 -0.186 5.017 12.511 878 1HB LEU 109 HB2 LEU 109 -0.187 2.129 11.619 879 2HB LEU 109 HB1 LEU 109 1.047 3.310 11.230 880 HG LEU 109 HG LEU 109 1.877 1.901 12.971 881 1HD1 LEU 109 HD11 LEU 109 1.834 4.620 13.107 882 2HD1 LEU 109 HD12 LEU 109 2.795 3.566 14.144 883 3HD1 LEU 109 HD13 LEU 109 1.234 4.167 14.703 884 1HD2 LEU 109 HD21 LEU 109 0.633 1.025 14.594 885 2HD2 LEU 109 HD22 LEU 109 -0.765 1.736 13.789 886 3HD2 LEU 109 HD23 LEU 109 0.039 2.608 15.094 887 H HIS 110 HN HIS 110 -0.331 6.152 10.634 888 HA HIS 110 HA HIS 110 -2.360 5.214 8.710 889 1HB HIS 110 HB2 HIS 110 -1.404 8.035 9.222 890 2HB HIS 110 HB1 HIS 110 -2.618 7.562 8.037 891 HD1 HIS 110 HD1 HIS 110 -4.639 6.023 9.347 892 HD2 HIS 110 HD2 HIS 110 -2.593 8.957 11.458 893 HE1 HIS 110 HE1 HIS 110 -6.106 6.582 11.310 894 HE2 HIS 110 HE2 HIS 110 -4.796 8.280 12.632 895 H MET 111 HN MET 111 -1.824 4.859 6.638 896 HA MET 111 HA MET 111 0.467 6.052 5.419 897 1HB MET 111 HB2 MET 111 1.732 4.001 5.020 898 2HB MET 111 HB1 MET 111 1.594 4.340 6.738 899 1HG MET 111 HG2 MET 111 -0.074 2.651 7.007 900 2HG MET 111 HG1 MET 111 -0.163 2.396 5.264 901 1HE MET 111 HE1 MET 111 3.090 3.095 7.260 902 2HE MET 111 HE2 MET 111 3.675 1.478 7.651 903 3HE MET 111 HE3 MET 111 2.225 2.104 8.436 904 H MET 112 HN MET 112 0.147 6.198 3.299 905 HA MET 112 HA MET 112 -2.063 4.708 2.105 906 1HB MET 112 HB2 MET 112 -0.610 7.215 1.318 907 2HB MET 112 HB1 MET 112 -1.688 6.387 0.212 908 1HG MET 112 HG2 MET 112 -3.532 6.682 1.780 909 2HG MET 112 HG1 MET 112 -2.446 7.504 2.899 910 1HE MET 112 HE1 MET 112 -5.337 8.951 1.340 911 2HE MET 112 HE2 MET 112 -4.556 10.448 1.849 912 3HE MET 112 HE3 MET 112 -4.470 9.018 2.877 913 H ARG 113 HN ARG 113 -1.835 3.530 0.205 914 HA ARG 113 HA ARG 113 0.884 3.154 -0.815 915 1HB ARG 113 HB2 ARG 113 0.116 1.385 0.908 916 2HB ARG 113 HB1 ARG 113 -0.922 0.797 -0.381 917 1HG ARG 113 HG2 ARG 113 0.921 0.240 -1.744 918 2HG ARG 113 HG1 ARG 113 2.042 1.128 -0.708 919 1HD ARG 113 HD2 ARG 113 1.424 -0.472 1.138 920 2HD ARG 113 HD1 ARG 113 0.573 -1.423 -0.078 921 HE ARG 113 HE ARG 113 3.095 -1.081 -1.082 922 1HH1 ARG 113 HH11 ARG 113 1.743 -2.420 1.842 923 2HH1 ARG 113 HH12 ARG 113 3.027 -3.560 2.060 924 1HH2 ARG 113 HH21 ARG 113 4.781 -2.573 -0.800 925 2HH2 ARG 113 HH22 ARG 113 4.755 -3.648 0.557 926 H LEU 114 HN LEU 114 1.011 2.986 -2.979 927 HA LEU 114 HA LEU 114 -1.529 2.942 -4.475 928 1HB LEU 114 HB2 LEU 114 -0.492 5.088 -4.599 929 2HB LEU 114 HB1 LEU 114 1.070 4.388 -4.951 930 HG LEU 114 HG LEU 114 -1.282 4.289 -6.848 931 1HD1 LEU 114 HD11 LEU 114 -0.319 6.597 -6.239 932 2HD1 LEU 114 HD12 LEU 114 -0.434 6.170 -7.945 933 3HD1 LEU 114 HD13 LEU 114 1.116 6.069 -7.117 934 1HD2 LEU 114 HD21 LEU 114 0.083 2.639 -7.647 935 2HD2 LEU 114 HD22 LEU 114 1.535 3.342 -6.935 936 3HD2 LEU 114 HD23 LEU 114 0.853 4.032 -8.405 937 H TYR 115 HN TYR 115 -1.820 1.068 -5.529 938 HA TYR 115 HA TYR 115 0.559 -0.305 -6.583 939 1HB TYR 115 HB2 TYR 115 -2.162 -1.391 -5.862 940 2HB TYR 115 HB1 TYR 115 -0.962 -2.314 -6.756 941 HD1 TYR 115 HD1 TYR 115 1.366 -2.580 -5.600 942 HD2 TYR 115 HD2 TYR 115 -2.203 -1.512 -3.563 943 HE1 TYR 115 HE1 TYR 115 2.348 -3.364 -3.486 944 HE2 TYR 115 HE2 TYR 115 -1.231 -2.282 -1.436 945 HH TYR 115 HH TYR 115 0.545 -3.880 -0.698 946 H SER 116 HN SER 116 0.898 0.181 -8.652 947 HA SER 116 HA SER 116 -1.411 0.638 -10.404 948 1HB SER 116 HB2 SER 116 0.241 1.601 -11.981 949 2HB SER 116 HB1 SER 116 0.281 2.404 -10.412 950 HG SER 116 HG SER 116 2.111 0.530 -11.477 951 H ARG 117 HN ARG 117 -1.972 -0.797 -11.967 952 HA ARG 117 HA ARG 117 -0.758 -3.357 -12.022 953 1HB ARG 117 HB2 ARG 117 -2.804 -2.026 -13.776 954 2HB ARG 117 HB1 ARG 117 -2.154 -3.605 -14.183 955 1HG ARG 117 HG2 ARG 117 -4.119 -4.086 -13.062 956 2HG ARG 117 HG1 ARG 117 -2.876 -4.305 -11.834 957 1HD ARG 117 HD2 ARG 117 -4.176 -1.640 -12.087 958 2HD ARG 117 HD1 ARG 117 -5.087 -2.951 -11.343 959 HE ARG 117 HE ARG 117 -3.043 -1.444 -10.142 960 1HH1 ARG 117 HH11 ARG 117 -4.133 -4.754 -10.399 961 2HH1 ARG 117 HH12 ARG 117 -3.568 -5.188 -8.823 962 1HH2 ARG 117 HH21 ARG 117 -2.332 -2.015 -8.070 963 2HH2 ARG 117 HH22 ARG 117 -2.543 -3.634 -7.499 964 H SER 118 HN SER 118 -0.545 -0.532 -14.090 965 HA SER 118 HA SER 118 1.860 -1.666 -15.314 966 1HB SER 118 HB2 SER 118 -0.399 -0.347 -16.840 967 2HB SER 118 HB1 SER 118 1.149 -0.837 -17.531 968 HG SER 118 HG SER 118 0.098 -2.637 -17.879 969 HA PRO 119 HA PRO 119 3.934 2.119 -14.517 970 1HB PRO 119 HB2 PRO 119 4.924 2.593 -17.117 971 2HB PRO 119 HB1 PRO 119 5.740 1.718 -15.821 972 1HG PRO 119 HG2 PRO 119 4.166 0.671 -18.119 973 2HG PRO 119 HG1 PRO 119 5.587 -0.024 -17.316 974 1HD PRO 119 HD2 PRO 119 3.145 -1.023 -16.904 975 2HD PRO 119 HD1 PRO 119 4.321 -0.911 -15.577 976 H GLU 120 HN GLU 120 1.707 1.932 -17.202 977 HA GLU 120 HA GLU 120 1.598 4.672 -17.867 978 1HB GLU 120 HB2 GLU 120 0.779 2.851 -19.319 979 2HB GLU 120 HB1 GLU 120 -0.524 2.548 -18.182 980 1HG GLU 120 HG2 GLU 120 -1.331 3.805 -20.076 981 2HG GLU 120 HG1 GLU 120 -1.427 4.776 -18.611 982 H VAL 121 HN VAL 121 1.622 5.119 -15.319 983 HA VAL 121 HA VAL 121 -0.953 5.075 -14.062 984 HB VAL 121 HB VAL 121 1.532 6.612 -13.279 985 1HG1 VAL 121 HG11 VAL 121 -0.578 7.500 -12.313 986 2HG1 VAL 121 HG12 VAL 121 0.530 6.852 -11.103 987 3HG1 VAL 121 HG13 VAL 121 -0.875 5.914 -11.603 988 1HG2 VAL 121 HG21 VAL 121 0.579 3.836 -12.726 989 2HG2 VAL 121 HG22 VAL 121 1.525 4.691 -11.507 990 3HG2 VAL 121 HG23 VAL 121 2.201 4.411 -13.111 991 H SER 122 HN SER 122 -2.517 6.251 -14.928 992 HA SER 122 HA SER 122 -2.184 8.630 -16.404 993 1HB SER 122 HB2 SER 122 -4.127 7.215 -16.732 994 2HB SER 122 HB1 SER 122 -4.625 7.454 -15.055 995 HG SER 122 HG SER 122 -5.165 8.965 -17.197 996 HA PRO 123 HA PRO 123 -1.885 11.961 -13.499 997 1HB PRO 123 HB2 PRO 123 -4.072 13.492 -14.397 998 2HB PRO 123 HB1 PRO 123 -2.401 13.639 -14.954 999 1HG PRO 123 HG2 PRO 123 -4.686 12.166 -16.178 1000 2HG PRO 123 HG1 PRO 123 -3.372 13.059 -16.967 1001 1HD PRO 123 HD2 PRO 123 -3.353 10.398 -16.917 1002 2HD PRO 123 HD1 PRO 123 -1.850 11.312 -16.669 1003 H ALA 124 HN ALA 124 -5.090 10.674 -14.258 1004 HA ALA 124 HA ALA 124 -6.385 11.524 -11.901 1005 1HB ALA 124 HB1 ALA 124 -7.449 9.024 -12.866 1006 2HB ALA 124 HB2 ALA 124 -7.118 10.119 -14.210 1007 3HB ALA 124 HB3 ALA 124 -8.170 10.634 -12.892 1008 H ALA 125 HN ALA 125 -4.543 8.645 -12.746 1009 HA ALA 125 HA ALA 125 -5.092 7.023 -10.587 1010 1HB ALA 125 HB1 ALA 125 -2.553 6.389 -10.884 1011 2HB ALA 125 HB2 ALA 125 -2.704 7.386 -12.325 1012 3HB ALA 125 HB3 ALA 125 -3.741 5.978 -12.116 1013 H THR 126 HN THR 126 -2.360 9.290 -10.850 1014 HA THR 126 HA THR 126 -1.752 9.097 -8.069 1015 HB THR 126 HB THR 126 -0.844 11.114 -10.120 1016 HG1 THR 126 HG1 THR 126 -0.228 8.931 -10.527 1017 1HG2 THR 126 HG21 THR 126 -0.520 11.269 -7.371 1018 2HG2 THR 126 HG22 THR 126 0.405 12.125 -8.605 1019 3HG2 THR 126 HG23 THR 126 0.995 10.591 -7.969 1020 H ALA 127 HN ALA 127 -3.365 11.574 -10.057 1021 HA ALA 127 HA ALA 127 -3.726 13.424 -7.950 1022 1HB ALA 127 HB1 ALA 127 -3.870 13.862 -10.450 1023 2HB ALA 127 HB2 ALA 127 -5.053 14.675 -9.423 1024 3HB ALA 127 HB3 ALA 127 -5.517 13.246 -10.349 1025 H ILE 128 HN ILE 128 -6.041 11.110 -9.412 1026 HA ILE 128 HA ILE 128 -8.206 11.707 -7.825 1027 HB ILE 128 HB ILE 128 -7.466 9.016 -8.953 1028 1HG1 ILE 128 HG12 ILE 128 -9.457 11.121 -9.842 1029 2HG1 ILE 128 HG11 ILE 128 -7.899 10.811 -10.596 1030 1HG2 ILE 128 HG21 ILE 128 -9.841 8.418 -8.572 1031 2HG2 ILE 128 HG22 ILE 128 -10.033 9.909 -7.650 1032 3HG2 ILE 128 HG23 ILE 128 -8.936 8.653 -7.078 1033 1HD1 ILE 128 HD11 ILE 128 -8.632 8.589 -11.230 1034 2HD1 ILE 128 HD12 ILE 128 -9.735 9.819 -11.849 1035 3HD1 ILE 128 HD13 ILE 128 -10.184 8.862 -10.437 1036 H PHE 129 HN PHE 129 -5.569 9.416 -7.106 1037 HA PHE 129 HA PHE 129 -6.651 8.509 -4.670 1038 1HB PHE 129 HB2 PHE 129 -4.740 7.409 -5.808 1039 2HB PHE 129 HB1 PHE 129 -3.721 8.782 -5.393 1040 HD1 PHE 129 HD1 PHE 129 -2.121 7.739 -4.008 1041 HD2 PHE 129 HD2 PHE 129 -6.272 7.197 -3.229 1042 HE1 PHE 129 HE1 PHE 129 -1.578 6.684 -1.850 1043 HE2 PHE 129 HE2 PHE 129 -5.734 6.144 -1.074 1044 HZ PHE 129 HZ PHE 129 -3.389 5.886 -0.382 1045 H ARG 130 HN ARG 130 -4.563 11.246 -5.451 1046 HA ARG 130 HA ARG 130 -4.162 12.097 -2.775 1047 1HB ARG 130 HB2 ARG 130 -2.640 12.763 -4.558 1048 2HB ARG 130 HB1 ARG 130 -3.939 13.616 -5.379 1049 1HG ARG 130 HG2 ARG 130 -4.083 15.216 -3.569 1050 2HG ARG 130 HG1 ARG 130 -2.865 14.327 -2.653 1051 1HD ARG 130 HD2 ARG 130 -2.444 15.663 -5.326 1052 2HD ARG 130 HD1 ARG 130 -1.908 16.289 -3.767 1053 HE ARG 130 HE ARG 130 -0.850 13.735 -4.038 1054 1HH1 ARG 130 HH11 ARG 130 -0.581 16.828 -5.623 1055 2HH1 ARG 130 HH12 ARG 130 1.057 16.570 -6.121 1056 1HH2 ARG 130 HH21 ARG 130 1.302 13.392 -4.692 1057 2HH2 ARG 130 HH22 ARG 130 2.127 14.621 -5.594 1058 H LYS 131 HN LYS 131 -6.297 13.351 -5.361 1059 HA LYS 131 HA LYS 131 -7.589 15.269 -3.758 1060 1HB LYS 131 HB2 LYS 131 -9.274 15.377 -5.495 1061 2HB LYS 131 HB1 LYS 131 -7.688 15.228 -6.236 1062 1HG LYS 131 HG2 LYS 131 -8.084 12.822 -6.534 1063 2HG LYS 131 HG1 LYS 131 -9.700 13.026 -5.871 1064 1HD LYS 131 HD2 LYS 131 -9.823 12.974 -8.281 1065 2HD LYS 131 HD1 LYS 131 -10.226 14.595 -7.711 1066 1HE LYS 131 HE2 LYS 131 -7.458 13.838 -8.614 1067 2HE LYS 131 HE1 LYS 131 -8.686 14.418 -9.735 1068 1HZ LYS 131 HZ1 LYS 131 -7.036 15.899 -7.966 1069 2HZ LYS 131 HZ2 LYS 131 -8.665 16.216 -7.643 1070 3HZ LYS 131 HZ3 LYS 131 -8.050 16.456 -9.200 1071 H LEU 132 HN LEU 132 -8.381 11.896 -4.532 1072 HA LEU 132 HA LEU 132 -10.812 11.705 -3.148 1073 1HB LEU 132 HB2 LEU 132 -10.037 9.938 -4.644 1074 2HB LEU 132 HB1 LEU 132 -8.680 9.604 -3.585 1075 HG LEU 132 HG LEU 132 -10.254 8.860 -1.830 1076 1HD1 LEU 132 HD11 LEU 132 -12.206 9.874 -3.779 1077 2HD1 LEU 132 HD12 LEU 132 -12.311 9.740 -2.023 1078 3HD1 LEU 132 HD13 LEU 132 -12.611 8.328 -3.035 1079 1HD2 LEU 132 HD21 LEU 132 -9.347 7.123 -3.117 1080 2HD2 LEU 132 HD22 LEU 132 -10.321 7.542 -4.527 1081 3HD2 LEU 132 HD23 LEU 132 -11.084 6.817 -3.112 1082 H ALA 133 HN ALA 133 -7.476 11.417 -2.117 1083 HA ALA 133 HA ALA 133 -7.946 10.601 0.547 1084 1HB ALA 133 HB1 ALA 133 -5.611 11.770 0.840 1085 2HB ALA 133 HB2 ALA 133 -5.654 11.827 -0.921 1086 3HB ALA 133 HB3 ALA 133 -5.755 10.278 -0.090 1087 H GLY 134 HN GLY 134 -7.708 13.738 -1.040 1088 1HA GLY 134 HA2 GLY 134 -7.720 15.341 1.284 1089 2HA GLY 134 HA1 GLY 134 -8.190 15.866 -0.324 1090 H GLU 135 HN GLU 135 -10.314 13.937 -0.626 1091 HA GLU 135 HA GLU 135 -12.490 15.370 0.273 1092 1HB GLU 135 HB2 GLU 135 -12.411 12.387 -0.206 1093 2HB GLU 135 HB1 GLU 135 -13.843 13.408 -0.243 1094 1HG GLU 135 HG2 GLU 135 -12.767 14.661 -2.140 1095 2HG GLU 135 HG1 GLU 135 -11.534 13.402 -2.167 1096 H ARG 136 HN ARG 136 -10.628 12.924 1.921 1097 HA ARG 136 HA ARG 136 -12.457 12.440 4.033 1098 1HB ARG 136 HB2 ARG 136 -9.460 12.069 3.930 1099 2HB ARG 136 HB1 ARG 136 -10.517 11.424 5.181 1100 1HG ARG 136 HG2 ARG 136 -11.695 10.102 3.488 1101 2HG ARG 136 HG1 ARG 136 -10.601 10.730 2.254 1102 1HD ARG 136 HD2 ARG 136 -8.708 9.706 3.379 1103 2HD ARG 136 HD1 ARG 136 -9.761 9.132 4.672 1104 HE ARG 136 HE ARG 136 -9.324 7.873 2.183 1105 1HH1 ARG 136 HH11 ARG 136 -11.818 8.507 4.540 1106 2HH1 ARG 136 HH12 ARG 136 -12.818 7.193 4.021 1107 1HH2 ARG 136 HH21 ARG 136 -10.639 6.142 1.499 1108 2HH2 ARG 136 HH22 ARG 136 -12.148 5.847 2.298 1109 H ASN 137 HN ASN 137 -9.497 14.471 3.889 1110 HA ASN 137 HA ASN 137 -10.643 16.548 5.394 1111 1HB ASN 137 HB2 ASN 137 -10.475 14.787 7.189 1112 2HB ASN 137 HB1 ASN 137 -8.729 14.846 6.993 1113 1HD2 ASN 137 HD21 ASN 137 -9.969 17.920 6.490 1114 2HD2 ASN 137 HD22 ASN 137 -9.728 18.549 8.076 1115 H TYR 138 HN TYR 138 -7.488 14.877 5.097 1116 HA TYR 138 HA TYR 138 -6.384 17.201 3.735 1117 1HB TYR 138 HB2 TYR 138 -5.518 16.335 6.472 1118 2HB TYR 138 HB1 TYR 138 -4.334 17.008 5.361 1119 HD1 TYR 138 HD1 TYR 138 -4.026 19.306 5.272 1120 HD2 TYR 138 HD2 TYR 138 -7.628 17.761 6.914 1121 HE1 TYR 138 HE1 TYR 138 -4.668 21.572 5.979 1122 HE2 TYR 138 HE2 TYR 138 -8.288 20.023 7.620 1123 HH TYR 138 HH TYR 138 -7.314 22.650 6.503 1124 H THR 139 HN THR 139 -5.022 16.527 2.150 1125 HA THR 139 HA THR 139 -4.216 13.735 2.128 1126 HB THR 139 HB THR 139 -4.953 14.747 0.021 1127 HG1 THR 139 HG1 THR 139 -3.388 13.099 -0.060 1128 1HG2 THR 139 HG21 THR 139 -4.002 17.046 0.520 1129 2HG2 THR 139 HG22 THR 139 -3.798 16.430 -1.120 1130 3HG2 THR 139 HG23 THR 139 -2.448 16.385 0.011 1131 H ASP 140 HN ASP 140 -2.645 16.942 2.184 1132 HA ASP 140 HA ASP 140 0.010 16.057 2.334 1133 1HB ASP 140 HB2 ASP 140 0.534 18.263 3.317 1134 2HB ASP 140 HB1 ASP 140 -0.539 18.416 1.931 1135 H GLU 141 HN GLU 141 -2.521 16.146 4.717 1136 HA GLU 141 HA GLU 141 -1.389 16.157 7.157 1137 1HB GLU 141 HB2 GLU 141 -3.737 15.660 6.858 1138 2HB GLU 141 HB1 GLU 141 -3.366 14.126 6.098 1139 1HG GLU 141 HG2 GLU 141 -4.086 13.656 8.284 1140 2HG GLU 141 HG1 GLU 141 -2.335 13.428 8.280 1141 H MET 142 HN MET 142 -1.192 13.566 4.815 1142 HA MET 142 HA MET 142 1.178 12.521 6.153 1143 1HB MET 142 HB2 MET 142 0.419 10.194 5.787 1144 2HB MET 142 HB1 MET 142 -0.561 11.054 6.967 1145 1HG MET 142 HG2 MET 142 -2.207 11.485 5.109 1146 2HG MET 142 HG1 MET 142 -1.260 10.366 4.130 1147 1HE MET 142 HE1 MET 142 -3.735 9.368 7.851 1148 2HE MET 142 HE2 MET 142 -3.239 10.965 7.291 1149 3HE MET 142 HE3 MET 142 -2.081 9.921 8.116 1150 H VAL 143 HN VAL 143 2.752 12.043 4.766 1151 HA VAL 143 HA VAL 143 2.111 11.589 1.953 1152 HB VAL 143 HB VAL 143 4.188 13.620 2.783 1153 1HG1 VAL 143 HG11 VAL 143 4.985 12.925 0.784 1154 2HG1 VAL 143 HG12 VAL 143 3.773 14.050 0.170 1155 3HG1 VAL 143 HG13 VAL 143 3.416 12.327 0.245 1156 1HG2 VAL 143 HG21 VAL 143 1.658 14.247 3.021 1157 2HG2 VAL 143 HG22 VAL 143 1.714 14.342 1.261 1158 3HG2 VAL 143 HG23 VAL 143 2.769 15.364 2.237 1159 H ALA 144 HN ALA 144 3.754 10.626 0.754 1160 HA ALA 144 HA ALA 144 6.302 9.914 1.712 1161 1HB ALA 144 HB1 ALA 144 5.790 7.392 1.810 1162 2HB ALA 144 HB2 ALA 144 4.114 7.879 2.063 1163 3HB ALA 144 HB3 ALA 144 5.358 8.374 3.210 1164 H MET 145 HN MET 145 7.389 9.895 -0.189 1165 HA MET 145 HA MET 145 5.977 8.828 -2.548 1166 1HB MET 145 HB2 MET 145 8.057 11.002 -2.467 1167 2HB MET 145 HB1 MET 145 7.214 10.433 -3.900 1168 1HG MET 145 HG2 MET 145 5.116 11.252 -3.030 1169 2HG MET 145 HG1 MET 145 5.896 11.718 -1.520 1170 1HE MET 145 HE1 MET 145 5.981 12.095 -5.324 1171 2HE MET 145 HE2 MET 145 7.710 12.346 -5.078 1172 3HE MET 145 HE3 MET 145 6.688 13.685 -5.602 1173 H LEU 146 HN LEU 146 7.009 7.606 -4.029 1174 HA LEU 146 HA LEU 146 8.850 5.724 -3.364 1175 1HB LEU 146 HB2 LEU 146 9.154 5.322 -5.705 1176 2HB LEU 146 HB1 LEU 146 7.491 5.814 -5.447 1177 HG LEU 146 HG LEU 146 9.671 7.646 -6.459 1178 1HD1 LEU 146 HD11 LEU 146 7.416 6.814 -8.186 1179 2HD1 LEU 146 HD12 LEU 146 8.710 5.644 -7.924 1180 3HD1 LEU 146 HD13 LEU 146 9.078 7.227 -8.607 1181 1HD2 LEU 146 HD21 LEU 146 6.723 7.985 -6.007 1182 2HD2 LEU 146 HD22 LEU 146 7.634 9.020 -7.108 1183 3HD2 LEU 146 HD23 LEU 146 8.054 8.969 -5.396 1184 HA PRO 147 HA PRO 147 12.778 7.772 -3.093 1185 1HB PRO 147 HB2 PRO 147 14.428 5.676 -3.481 1186 2HB PRO 147 HB1 PRO 147 13.478 5.864 -2.002 1187 1HG PRO 147 HG2 PRO 147 12.887 4.194 -4.423 1188 2HG PRO 147 HG1 PRO 147 12.798 3.739 -2.711 1189 1HD PRO 147 HD2 PRO 147 10.608 4.440 -4.118 1190 2HD PRO 147 HD1 PRO 147 10.785 4.832 -2.394 1191 H ARG 148 HN ARG 148 14.037 8.876 -4.491 1192 HA ARG 148 HA ARG 148 13.812 8.263 -7.328 1193 1HB ARG 148 HB2 ARG 148 15.113 10.603 -5.925 1194 2HB ARG 148 HB1 ARG 148 14.889 10.451 -7.662 1195 1HG ARG 148 HG2 ARG 148 12.466 10.457 -7.353 1196 2HG ARG 148 HG1 ARG 148 12.691 10.609 -5.608 1197 1HD ARG 148 HD2 ARG 148 12.213 12.775 -6.627 1198 2HD ARG 148 HD1 ARG 148 13.834 12.739 -5.933 1199 HE ARG 148 HE ARG 148 14.009 12.025 -8.633 1200 1HH1 ARG 148 HH11 ARG 148 13.255 14.808 -6.670 1201 2HH1 ARG 148 HH12 ARG 148 13.790 15.948 -7.859 1202 1HH2 ARG 148 HH21 ARG 148 14.714 13.519 -10.197 1203 2HH2 ARG 148 HH22 ARG 148 14.618 15.216 -9.863 1204 H GLN 149 HN GLN 149 15.745 7.044 -5.069 1205 HA GLN 149 HA GLN 149 17.843 6.431 -6.940 1206 1HB GLN 149 HB2 GLN 149 18.526 7.983 -4.436 1207 2HB GLN 149 HB1 GLN 149 19.689 7.259 -5.535 1208 1HG GLN 149 HG2 GLN 149 18.932 8.758 -7.313 1209 2HG GLN 149 HG1 GLN 149 17.782 9.491 -6.193 1210 1HE2 GLN 149 HE21 GLN 149 18.442 11.340 -5.387 1211 2HE2 GLN 149 HE22 GLN 149 20.077 11.787 -5.055 1212 H GLU 150 HN GLU 150 19.182 4.694 -6.232 1213 HA GLU 150 HA GLU 150 17.879 2.862 -4.533 1214 1HB GLU 150 HB2 GLU 150 19.937 1.484 -4.758 1215 2HB GLU 150 HB1 GLU 150 19.265 2.019 -6.289 1216 1HG GLU 150 HG2 GLU 150 20.976 3.815 -6.353 1217 2HG GLU 150 HG1 GLU 150 21.686 3.132 -4.889 1218 H GLU 151 HN GLU 151 19.839 5.520 -3.795 1219 HA GLU 151 HA GLU 151 20.868 4.475 -1.298 1220 1HB GLU 151 HB2 GLU 151 20.922 7.298 -2.384 1221 2HB GLU 151 HB1 GLU 151 21.785 6.724 -0.965 1222 1HG GLU 151 HG2 GLU 151 22.228 5.702 -3.758 1223 2HG GLU 151 HG1 GLU 151 23.206 6.939 -2.967 1224 H CYS 152 HN CYS 152 20.236 5.079 0.738 1225 HA CYS 152 HA CYS 152 17.529 5.518 1.251 1226 1HB CYS 152 HB2 CYS 152 19.969 5.921 2.984 1227 2HB CYS 152 HB1 CYS 152 18.321 6.051 3.591 1228 H THR 153 HN THR 153 16.785 7.324 0.085 1229 HA THR 153 HA THR 153 17.000 9.832 1.453 1230 HB THR 153 HB THR 153 19.070 9.963 0.166 1231 HG1 THR 153 HG1 THR 153 17.049 11.606 -0.955 1232 1HG2 THR 153 HG21 THR 153 17.877 8.520 -1.771 1233 2HG2 THR 153 HG22 THR 153 19.335 9.482 -2.003 1234 3HG2 THR 153 HG23 THR 153 17.762 10.144 -2.449 1235 H VAL 154 HN VAL 154 14.737 8.816 1.358 1236 HA VAL 154 HA VAL 154 13.232 8.986 -1.042 1237 HB VAL 154 HB VAL 154 12.691 7.572 0.979 1238 1HG1 VAL 154 HG11 VAL 154 12.729 9.975 2.327 1239 2HG1 VAL 154 HG12 VAL 154 12.101 8.446 2.938 1240 3HG1 VAL 154 HG13 VAL 154 11.010 9.609 2.187 1241 1HG2 VAL 154 HG21 VAL 154 10.409 7.524 0.483 1242 2HG2 VAL 154 HG22 VAL 154 11.174 8.133 -0.984 1243 3HG2 VAL 154 HG23 VAL 154 10.362 9.248 0.114 1244 H ASP 155 HN ASP 155 11.736 10.510 -1.731 1245 HA ASP 155 HA ASP 155 12.319 13.216 -1.301 1246 1HB ASP 155 HB2 ASP 155 11.196 12.398 -3.329 1247 2HB ASP 155 HB1 ASP 155 9.774 11.978 -2.380 1248 H GLU 156 HN GLU 156 11.504 14.765 0.029 1249 HA GLU 156 HA GLU 156 9.085 14.622 1.440 1250 1HB GLU 156 HB2 GLU 156 9.887 14.202 3.719 1251 2HB GLU 156 HB1 GLU 156 10.160 12.809 2.681 1252 1HG GLU 156 HG2 GLU 156 12.501 13.448 2.436 1253 2HG GLU 156 HG1 GLU 156 12.228 14.847 3.472 1254 H VAL 157 HN VAL 157 8.591 16.572 2.326 1255 HA VAL 157 HA VAL 157 8.762 18.775 2.877 1256 HB VAL 157 HB VAL 157 11.693 18.202 3.337 1257 1HG1 VAL 157 HG11 VAL 157 9.962 20.550 3.775 1258 2HG1 VAL 157 HG12 VAL 157 11.698 20.457 3.480 1259 3HG1 VAL 157 HG13 VAL 157 11.059 20.137 5.092 1260 1HG2 VAL 157 HG21 VAL 157 10.646 16.719 4.777 1261 2HG2 VAL 157 HG22 VAL 157 9.275 17.795 5.052 1262 3HG2 VAL 157 HG23 VAL 157 10.840 18.153 5.784 Start of MODEL 4 1 1H MET 1 HT1 MET 1 13.169 -9.419 20.831 2 2H MET 1 HT2 MET 1 12.634 -10.437 22.072 3 3H MET 1 HT3 MET 1 13.760 -9.220 22.404 4 HA MET 1 HA MET 1 11.734 -8.408 23.208 5 1HB MET 1 HB2 MET 1 12.242 -7.288 20.443 6 2HB MET 1 HB1 MET 1 11.339 -6.478 21.716 7 1HG MET 1 HG2 MET 1 13.345 -6.418 23.104 8 2HG MET 1 HG1 MET 1 14.251 -7.232 21.830 9 1HE MET 1 HE1 MET 1 15.701 -3.593 21.739 10 2HE MET 1 HE2 MET 1 16.076 -5.309 21.908 11 3HE MET 1 HE3 MET 1 15.171 -4.475 23.172 12 H THR 2 HN THR 2 11.361 -9.534 19.863 13 HA THR 2 HA THR 2 9.559 -10.247 18.674 14 HB THR 2 HB THR 2 8.069 -11.797 19.828 15 HG1 THR 2 HG1 THR 2 8.232 -11.996 22.106 16 1HG2 THR 2 HG21 THR 2 10.742 -12.159 19.637 17 2HG2 THR 2 HG22 THR 2 9.596 -13.382 20.187 18 3HG2 THR 2 HG23 THR 2 10.480 -12.410 21.363 19 H VAL 3 HN VAL 3 6.798 -10.453 20.059 20 HA VAL 3 HA VAL 3 6.087 -7.713 20.566 21 HB VAL 3 HB VAL 3 4.464 -7.524 18.723 22 1HG1 VAL 3 HG11 VAL 3 7.194 -8.058 17.579 23 2HG1 VAL 3 HG12 VAL 3 6.828 -6.646 18.570 24 3HG1 VAL 3 HG13 VAL 3 5.993 -6.888 17.035 25 1HG2 VAL 3 HG21 VAL 3 4.623 -9.068 16.804 26 2HG2 VAL 3 HG22 VAL 3 4.073 -9.869 18.277 27 3HG2 VAL 3 HG23 VAL 3 5.738 -10.071 17.730 28 HA PRO 4 HA PRO 4 3.092 -9.748 23.127 29 1HB PRO 4 HB2 PRO 4 1.448 -7.336 22.456 30 2HB PRO 4 HB1 PRO 4 1.812 -8.044 24.034 31 1HG PRO 4 HG2 PRO 4 3.063 -5.852 23.251 32 2HG PRO 4 HG1 PRO 4 3.964 -7.143 24.073 33 1HD PRO 4 HD2 PRO 4 3.875 -6.448 21.163 34 2HD PRO 4 HD1 PRO 4 5.253 -6.960 22.159 35 H ASP 5 HN ASP 5 0.335 -8.327 21.877 36 HA ASP 5 HA ASP 5 -0.770 -10.686 20.927 37 1HB ASP 5 HB2 ASP 5 -2.130 -8.784 21.609 38 2HB ASP 5 HB1 ASP 5 -1.504 -7.824 20.273 39 H ARG 6 HN ARG 6 -0.205 -11.853 19.202 40 HA ARG 6 HA ARG 6 1.383 -10.834 17.085 41 1HB ARG 6 HB2 ARG 6 1.028 -13.032 16.024 42 2HB ARG 6 HB1 ARG 6 1.513 -13.178 17.707 43 1HG ARG 6 HG2 ARG 6 -0.825 -13.588 18.332 44 2HG ARG 6 HG1 ARG 6 -1.284 -13.480 16.630 45 1HD ARG 6 HD2 ARG 6 0.175 -15.377 16.117 46 2HD ARG 6 HD1 ARG 6 0.640 -15.481 17.813 47 HE ARG 6 HE ARG 6 -2.149 -15.665 17.643 48 1HH1 ARG 6 HH11 ARG 6 0.697 -17.493 16.778 49 2HH1 ARG 6 HH12 ARG 6 -0.095 -19.028 16.907 50 1HH2 ARG 6 HH21 ARG 6 -3.194 -17.687 17.813 51 2HH2 ARG 6 HH22 ARG 6 -2.303 -19.138 17.494 52 H SER 7 HN SER 7 -2.051 -11.335 17.516 53 HA SER 7 HA SER 7 -3.001 -11.186 14.931 54 1HB SER 7 HB2 SER 7 -4.216 -9.972 17.426 55 2HB SER 7 HB1 SER 7 -5.079 -10.255 15.916 56 HG SER 7 HG SER 7 -3.784 -12.293 17.402 57 H GLU 8 HN GLU 8 -1.715 -8.636 16.944 58 HA GLU 8 HA GLU 8 -2.688 -6.341 15.835 59 1HB GLU 8 HB2 GLU 8 -0.681 -5.243 16.533 60 2HB GLU 8 HB1 GLU 8 -1.018 -6.517 17.697 61 1HG GLU 8 HG2 GLU 8 0.625 -7.953 16.521 62 2HG GLU 8 HG1 GLU 8 1.021 -6.584 15.488 63 H ILE 9 HN ILE 9 -0.380 -8.560 14.456 64 HA ILE 9 HA ILE 9 -0.518 -7.082 11.923 65 HB ILE 9 HB ILE 9 1.944 -8.249 13.217 66 1HG1 ILE 9 HG12 ILE 9 1.305 -5.903 13.755 67 2HG1 ILE 9 HG11 ILE 9 2.861 -6.032 12.941 68 1HG2 ILE 9 HG21 ILE 9 2.697 -7.135 10.767 69 2HG2 ILE 9 HG22 ILE 9 1.311 -8.161 10.410 70 3HG2 ILE 9 HG23 ILE 9 2.721 -8.838 11.219 71 1HD1 ILE 9 HD11 ILE 9 0.711 -5.684 11.050 72 2HD1 ILE 9 HD12 ILE 9 2.179 -4.733 11.282 73 3HD1 ILE 9 HD13 ILE 9 0.743 -4.392 12.248 74 H ALA 10 HN ALA 10 -2.307 -8.936 12.242 75 HA ALA 10 HA ALA 10 -1.593 -10.963 10.341 76 1HB ALA 10 HB1 ALA 10 -1.299 -12.749 11.643 77 2HB ALA 10 HB2 ALA 10 -2.710 -12.353 12.624 78 3HB ALA 10 HB3 ALA 10 -1.147 -11.626 12.994 79 H GLY 11 HN GLY 11 -3.307 -10.964 9.024 80 1HA GLY 11 HA2 GLY 11 -5.825 -11.790 9.540 81 2HA GLY 11 HA1 GLY 11 -5.898 -10.107 10.031 82 H LYS 12 HN LYS 12 -7.045 -9.088 8.525 83 HA LYS 12 HA LYS 12 -6.319 -9.539 5.705 84 1HB LYS 12 HB2 LYS 12 -8.642 -8.986 5.123 85 2HB LYS 12 HB1 LYS 12 -8.539 -10.385 6.180 86 1HG LYS 12 HG2 LYS 12 -9.173 -9.018 8.088 87 2HG LYS 12 HG1 LYS 12 -9.227 -7.588 7.059 88 1HD LYS 12 HD2 LYS 12 -11.470 -8.337 7.347 89 2HD LYS 12 HD1 LYS 12 -10.992 -8.744 5.700 90 1HE LYS 12 HE2 LYS 12 -10.866 -10.685 7.999 91 2HE LYS 12 HE1 LYS 12 -12.260 -10.530 6.932 92 1HZ LYS 12 HZ1 LYS 12 -9.747 -11.840 6.480 93 2HZ LYS 12 HZ2 LYS 12 -10.183 -10.808 5.212 94 3HZ LYS 12 HZ3 LYS 12 -11.230 -12.046 5.692 95 H TRP 13 HN TRP 13 -5.500 -7.893 4.672 96 HA TRP 13 HA TRP 13 -5.924 -5.151 5.674 97 1HB TRP 13 HB2 TRP 13 -3.652 -6.335 4.058 98 2HB TRP 13 HB1 TRP 13 -3.827 -4.623 4.404 99 HD1 TRP 13 HD1 TRP 13 -4.653 -6.900 7.296 100 HE1 TRP 13 HE1 TRP 13 -2.756 -6.786 9.028 101 HE3 TRP 13 HE3 TRP 13 -1.202 -4.323 4.548 102 HZ2 TRP 13 HZ2 TRP 13 -0.144 -5.753 9.203 103 HZ3 TRP 13 HZ3 TRP 13 0.976 -3.816 5.570 104 HH2 TRP 13 HH2 TRP 13 1.492 -4.517 7.852 105 H TYR 14 HN TYR 14 -6.853 -3.663 4.286 106 HA TYR 14 HA TYR 14 -7.358 -4.605 1.533 107 1HB TYR 14 HB2 TYR 14 -9.080 -2.866 3.299 108 2HB TYR 14 HB1 TYR 14 -9.381 -3.125 1.585 109 HD1 TYR 14 HD1 TYR 14 -11.153 -4.523 1.229 110 HD2 TYR 14 HD2 TYR 14 -8.525 -5.371 4.463 111 HE1 TYR 14 HE1 TYR 14 -12.460 -6.536 1.757 112 HE2 TYR 14 HE2 TYR 14 -9.821 -7.384 5.000 113 HH TYR 14 HH TYR 14 -12.679 -7.972 4.291 114 H VAL 15 HN VAL 15 -6.199 -3.558 0.070 115 HA VAL 15 HA VAL 15 -5.350 -0.815 0.596 116 HB VAL 15 HB VAL 15 -3.565 -2.207 -0.169 117 1HG1 VAL 15 HG11 VAL 15 -4.815 -3.968 -1.240 118 2HG1 VAL 15 HG12 VAL 15 -3.611 -3.330 -2.358 119 3HG1 VAL 15 HG13 VAL 15 -5.305 -2.877 -2.537 120 1HG2 VAL 15 HG21 VAL 15 -3.605 0.103 -1.016 121 2HG2 VAL 15 HG22 VAL 15 -4.453 -0.450 -2.460 122 3HG2 VAL 15 HG23 VAL 15 -2.807 -0.995 -2.139 123 H VAL 16 HN VAL 16 -6.764 0.663 0.104 124 HA VAL 16 HA VAL 16 -7.978 0.672 -2.556 125 HB VAL 16 HB VAL 16 -10.138 1.413 -1.627 126 1HG1 VAL 16 HG11 VAL 16 -10.824 -0.803 -0.721 127 2HG1 VAL 16 HG12 VAL 16 -9.122 -1.264 -0.677 128 3HG1 VAL 16 HG13 VAL 16 -9.898 -0.906 -2.218 129 1HG2 VAL 16 HG21 VAL 16 -10.604 1.135 0.751 130 2HG2 VAL 16 HG22 VAL 16 -9.313 2.309 0.498 131 3HG2 VAL 16 HG23 VAL 16 -8.926 0.675 1.036 132 H ALA 17 HN ALA 17 -7.114 2.480 0.352 133 HA ALA 17 HA ALA 17 -7.489 5.047 -0.991 134 1HB ALA 17 HB1 ALA 17 -6.173 5.272 1.550 135 2HB ALA 17 HB2 ALA 17 -7.535 4.162 1.690 136 3HB ALA 17 HB3 ALA 17 -7.791 5.801 1.091 137 H LEU 18 HN LEU 18 -5.848 5.913 -2.218 138 HA LEU 18 HA LEU 18 -3.070 5.377 -1.396 139 1HB LEU 18 HB2 LEU 18 -3.869 5.289 -4.289 140 2HB LEU 18 HB1 LEU 18 -2.350 4.802 -3.578 141 HG LEU 18 HG LEU 18 -3.397 2.818 -4.191 142 1HD1 LEU 18 HD11 LEU 18 -4.461 2.408 -1.584 143 2HD1 LEU 18 HD12 LEU 18 -3.008 3.399 -1.478 144 3HD1 LEU 18 HD13 LEU 18 -2.945 1.830 -2.277 145 1HD2 LEU 18 HD21 LEU 18 -5.849 2.601 -2.999 146 2HD2 LEU 18 HD22 LEU 18 -5.556 2.965 -4.697 147 3HD2 LEU 18 HD23 LEU 18 -5.830 4.275 -3.549 148 H ALA 19 HN ALA 19 -1.609 6.551 -3.161 149 HA ALA 19 HA ALA 19 -2.485 9.017 -4.235 150 1HB ALA 19 HB1 ALA 19 -2.079 10.536 -2.633 151 2HB ALA 19 HB2 ALA 19 -0.591 9.734 -2.129 152 3HB ALA 19 HB3 ALA 19 -2.145 9.171 -1.517 153 H SER 20 HN SER 20 -1.314 8.544 -6.084 154 HA SER 20 HA SER 20 1.554 7.966 -5.686 155 1HB SER 20 HB2 SER 20 0.383 6.141 -6.705 156 2HB SER 20 HB1 SER 20 -0.303 7.205 -7.931 157 HG SER 20 HG SER 20 1.402 6.415 -8.963 158 H ASN 21 HN ASN 21 3.143 9.000 -6.714 159 HA ASN 21 HA ASN 21 2.472 11.039 -8.731 160 1HB ASN 21 HB2 ASN 21 4.688 11.453 -6.717 161 2HB ASN 21 HB1 ASN 21 3.998 12.624 -7.832 162 1HD2 ASN 21 HD21 ASN 21 3.749 11.101 -4.790 163 2HD2 ASN 21 HD22 ASN 21 2.425 12.027 -4.178 164 H THR 22 HN THR 22 3.590 10.668 -10.571 165 HA THR 22 HA THR 22 6.312 9.931 -10.652 166 HB THR 22 HB THR 22 5.482 7.797 -9.811 167 HG1 THR 22 HG1 THR 22 6.227 7.703 -12.542 168 1HG2 THR 22 HG21 THR 22 3.178 8.039 -10.851 169 2HG2 THR 22 HG22 THR 22 3.916 6.437 -10.881 170 3HG2 THR 22 HG23 THR 22 3.914 7.434 -12.336 171 H GLU 23 HN GLU 23 3.208 9.650 -12.345 172 HA GLU 23 HA GLU 23 4.181 11.157 -14.565 173 1HB GLU 23 HB2 GLU 23 5.168 8.938 -15.049 174 2HB GLU 23 HB1 GLU 23 3.556 8.243 -15.038 175 1HG GLU 23 HG2 GLU 23 4.373 8.623 -17.296 176 2HG GLU 23 HG1 GLU 23 2.927 9.571 -16.953 177 H PHE 24 HN PHE 24 2.530 11.960 -15.817 178 HA PHE 24 HA PHE 24 -0.018 12.009 -14.619 179 1HB PHE 24 HB2 PHE 24 1.068 13.117 -17.185 180 2HB PHE 24 HB1 PHE 24 -0.633 13.282 -16.765 181 HD1 PHE 24 HD1 PHE 24 -1.022 15.468 -16.194 182 HD2 PHE 24 HD2 PHE 24 2.469 13.547 -14.697 183 HE1 PHE 24 HE1 PHE 24 -0.512 17.456 -14.839 184 HE2 PHE 24 HE2 PHE 24 2.983 15.531 -13.339 185 HZ PHE 24 HZ PHE 24 1.491 17.489 -13.409 186 H PHE 25 HN PHE 25 0.542 11.135 -18.047 187 HA PHE 25 HA PHE 25 -1.714 9.269 -17.758 188 1HB PHE 25 HB2 PHE 25 -2.048 9.619 -20.215 189 2HB PHE 25 HB1 PHE 25 -2.293 11.052 -19.226 190 HD1 PHE 25 HD1 PHE 25 -1.253 13.026 -19.805 191 HD2 PHE 25 HD2 PHE 25 0.313 9.351 -21.275 192 HE1 PHE 25 HE1 PHE 25 0.343 14.270 -21.206 193 HE2 PHE 25 HE2 PHE 25 1.913 10.590 -22.674 194 HZ PHE 25 HZ PHE 25 1.930 13.052 -22.641 195 H LEU 26 HN LEU 26 1.511 9.555 -19.203 196 HA LEU 26 HA LEU 26 1.600 7.278 -20.716 197 1HB LEU 26 HB2 LEU 26 3.757 8.464 -18.992 198 2HB LEU 26 HB1 LEU 26 4.044 7.174 -20.142 199 HG LEU 26 HG LEU 26 3.047 9.943 -20.815 200 1HD1 LEU 26 HD11 LEU 26 5.449 9.721 -20.093 201 2HD1 LEU 26 HD12 LEU 26 5.197 10.362 -21.716 202 3HD1 LEU 26 HD13 LEU 26 5.692 8.683 -21.499 203 1HD2 LEU 26 HD21 LEU 26 3.541 9.147 -23.164 204 2HD2 LEU 26 HD22 LEU 26 2.113 8.454 -22.395 205 3HD2 LEU 26 HD23 LEU 26 3.601 7.514 -22.500 206 H ARG 27 HN ARG 27 2.919 7.298 -17.386 207 HA ARG 27 HA ARG 27 2.901 4.461 -17.242 208 1HB ARG 27 HB2 ARG 27 3.131 6.455 -14.988 209 2HB ARG 27 HB1 ARG 27 3.541 4.749 -14.904 210 1HG ARG 27 HG2 ARG 27 5.263 5.125 -16.645 211 2HG ARG 27 HG1 ARG 27 4.906 6.851 -16.567 212 1HD ARG 27 HD2 ARG 27 5.506 6.854 -14.189 213 2HD ARG 27 HD1 ARG 27 5.887 5.136 -14.289 214 HE ARG 27 HE ARG 27 7.366 6.552 -16.224 215 1HH1 ARG 27 HH11 ARG 27 7.209 6.024 -12.780 216 2HH1 ARG 27 HH12 ARG 27 8.890 6.354 -12.526 217 1HH2 ARG 27 HH21 ARG 27 9.577 6.982 -15.895 218 2HH2 ARG 27 HH22 ARG 27 10.235 6.897 -14.296 219 H GLU 28 HN GLU 28 0.643 6.945 -16.251 220 HA GLU 28 HA GLU 28 -0.969 5.689 -14.448 221 1HB GLU 28 HB2 GLU 28 -1.357 7.972 -15.237 222 2HB GLU 28 HB1 GLU 28 -1.860 7.361 -16.807 223 1HG GLU 28 HG2 GLU 28 -3.787 6.288 -15.801 224 2HG GLU 28 HG1 GLU 28 -3.269 6.820 -14.201 225 H LYS 29 HN LYS 29 -0.813 5.128 -17.915 226 HA LYS 29 HA LYS 29 -3.064 3.387 -18.041 227 1HB LYS 29 HB2 LYS 29 -0.720 3.689 -19.928 228 2HB LYS 29 HB1 LYS 29 -2.201 2.809 -20.284 229 1HG LYS 29 HG2 LYS 29 -3.480 4.886 -20.040 230 2HG LYS 29 HG1 LYS 29 -1.981 5.758 -19.723 231 1HD LYS 29 HD2 LYS 29 -1.155 5.127 -21.946 232 2HD LYS 29 HD1 LYS 29 -2.669 4.274 -22.259 233 1HE LYS 29 HE2 LYS 29 -3.901 6.373 -22.006 234 2HE LYS 29 HE1 LYS 29 -2.389 7.224 -21.694 235 1HZ LYS 29 HZ1 LYS 29 -2.546 7.610 -23.896 236 2HZ LYS 29 HZ2 LYS 29 -3.477 6.233 -24.205 237 3HZ LYS 29 HZ3 LYS 29 -1.803 6.094 -24.006 238 H ASP 30 HN ASP 30 0.434 2.876 -17.734 239 HA ASP 30 HA ASP 30 0.254 0.032 -17.828 240 1HB ASP 30 HB2 ASP 30 2.350 1.206 -18.356 241 2HB ASP 30 HB1 ASP 30 2.448 1.787 -16.695 242 H LYS 31 HN LYS 31 0.765 2.334 -15.158 243 HA LYS 31 HA LYS 31 0.363 0.253 -13.207 244 1HB LYS 31 HB2 LYS 31 0.775 3.230 -12.927 245 2HB LYS 31 HB1 LYS 31 0.559 2.147 -11.561 246 1HG LYS 31 HG2 LYS 31 2.905 2.640 -11.922 247 2HG LYS 31 HG1 LYS 31 2.575 0.929 -12.197 248 1HD LYS 31 HD2 LYS 31 2.594 1.266 -14.586 249 2HD LYS 31 HD1 LYS 31 2.770 3.009 -14.374 250 1HE LYS 31 HE2 LYS 31 4.900 1.983 -14.942 251 2HE LYS 31 HE1 LYS 31 4.944 2.648 -13.309 252 1HZ LYS 31 HZ1 LYS 31 4.959 0.572 -12.366 253 2HZ LYS 31 HZ2 LYS 31 5.864 0.287 -13.766 254 3HZ LYS 31 HZ3 LYS 31 4.239 -0.179 -13.702 255 H MET 32 HN MET 32 -1.645 -0.501 -13.112 256 HA MET 32 HA MET 32 -3.732 1.209 -12.115 257 1HB MET 32 HB2 MET 32 -5.367 0.476 -13.887 258 2HB MET 32 HB1 MET 32 -4.154 1.630 -14.423 259 1HG MET 32 HG2 MET 32 -2.869 -0.179 -15.430 260 2HG MET 32 HG1 MET 32 -4.074 -1.343 -14.884 261 1HE MET 32 HE1 MET 32 -4.498 1.906 -18.024 262 2HE MET 32 HE2 MET 32 -3.704 2.011 -16.453 263 3HE MET 32 HE3 MET 32 -5.446 2.253 -16.578 264 H LYS 33 HN LYS 33 -4.601 0.095 -10.508 265 HA LYS 33 HA LYS 33 -5.688 -2.466 -10.735 266 1HB LYS 33 HB2 LYS 33 -4.054 -3.806 -9.494 267 2HB LYS 33 HB1 LYS 33 -3.374 -3.204 -10.998 268 1HG LYS 33 HG2 LYS 33 -2.207 -1.445 -9.795 269 2HG LYS 33 HG1 LYS 33 -2.921 -1.994 -8.278 270 1HD LYS 33 HD2 LYS 33 -0.631 -2.800 -8.519 271 2HD LYS 33 HD1 LYS 33 -1.776 -4.140 -8.512 272 1HE LYS 33 HE2 LYS 33 -1.660 -4.262 -10.947 273 2HE LYS 33 HE1 LYS 33 -0.538 -2.902 -10.967 274 1HZ LYS 33 HZ1 LYS 33 1.143 -4.171 -10.037 275 2HZ LYS 33 HZ2 LYS 33 0.403 -5.266 -11.092 276 3HZ LYS 33 HZ3 LYS 33 0.083 -5.344 -9.433 277 H MET 34 HN MET 34 -5.907 -3.541 -8.509 278 HA MET 34 HA MET 34 -5.943 -1.681 -6.262 279 1HB MET 34 HB2 MET 34 -8.425 -3.081 -7.280 280 2HB MET 34 HB1 MET 34 -8.299 -2.315 -5.703 281 1HG MET 34 HG2 MET 34 -8.124 -0.975 -8.385 282 2HG MET 34 HG1 MET 34 -9.425 -0.843 -7.205 283 1HE MET 34 HE1 MET 34 -7.054 -0.140 -4.310 284 2HE MET 34 HE2 MET 34 -8.689 -0.609 -4.778 285 3HE MET 34 HE3 MET 34 -8.323 1.080 -4.425 286 H ALA 35 HN ALA 35 -6.791 -3.105 -4.184 287 HA ALA 35 HA ALA 35 -6.349 -5.902 -4.583 288 1HB ALA 35 HB1 ALA 35 -4.054 -4.251 -4.258 289 2HB ALA 35 HB2 ALA 35 -4.159 -5.982 -4.574 290 3HB ALA 35 HB3 ALA 35 -4.168 -5.389 -2.914 291 H MET 36 HN MET 36 -6.261 -7.209 -2.818 292 HA MET 36 HA MET 36 -7.122 -6.147 -0.219 293 1HB MET 36 HB2 MET 36 -8.225 -8.630 -1.581 294 2HB MET 36 HB1 MET 36 -8.664 -8.049 0.018 295 1HG MET 36 HG2 MET 36 -9.692 -6.081 -0.946 296 2HG MET 36 HG1 MET 36 -9.193 -6.589 -2.560 297 1HE MET 36 HE1 MET 36 -12.099 -6.739 -3.529 298 2HE MET 36 HE2 MET 36 -11.805 -5.680 -2.149 299 3HE MET 36 HE3 MET 36 -13.126 -6.849 -2.100 300 H ALA 37 HN ALA 37 -5.998 -7.265 1.500 301 HA ALA 37 HA ALA 37 -4.336 -9.521 0.607 302 1HB ALA 37 HB1 ALA 37 -3.266 -7.091 0.686 303 2HB ALA 37 HB2 ALA 37 -2.353 -8.552 1.060 304 3HB ALA 37 HB3 ALA 37 -3.004 -7.564 2.365 305 H ARG 38 HN ARG 38 -3.151 -10.598 2.278 306 HA ARG 38 HA ARG 38 -4.396 -10.570 4.939 307 1HB ARG 38 HB2 ARG 38 -3.647 -13.057 3.374 308 2HB ARG 38 HB1 ARG 38 -4.316 -13.018 4.999 309 1HG ARG 38 HG2 ARG 38 -6.406 -12.130 4.140 310 2HG ARG 38 HG1 ARG 38 -5.735 -12.100 2.507 311 1HD ARG 38 HD2 ARG 38 -5.425 -14.531 2.598 312 2HD ARG 38 HD1 ARG 38 -6.117 -14.555 4.218 313 HE ARG 38 HE ARG 38 -7.540 -14.536 1.775 314 1HH1 ARG 38 HH11 ARG 38 -7.664 -13.288 5.032 315 2HH1 ARG 38 HH12 ARG 38 -9.384 -13.105 5.026 316 1HH2 ARG 38 HH21 ARG 38 -9.801 -14.303 1.772 317 2HH2 ARG 38 HH22 ARG 38 -10.598 -13.680 3.178 318 H ILE 39 HN ILE 39 -2.780 -10.126 6.365 319 HA ILE 39 HA ILE 39 -0.039 -10.613 5.487 320 HB ILE 39 HB ILE 39 -0.587 -8.374 6.309 321 1HG1 ILE 39 HG12 ILE 39 1.337 -9.831 8.138 322 2HG1 ILE 39 HG11 ILE 39 1.713 -9.320 6.496 323 1HG2 ILE 39 HG21 ILE 39 -1.014 -7.991 8.678 324 2HG2 ILE 39 HG22 ILE 39 -1.013 -9.730 8.966 325 3HG2 ILE 39 HG23 ILE 39 -2.269 -9.004 7.964 326 1HD1 ILE 39 HD11 ILE 39 2.580 -7.811 8.255 327 2HD1 ILE 39 HD12 ILE 39 0.914 -7.449 8.706 328 3HD1 ILE 39 HD13 ILE 39 1.507 -7.020 7.102 329 H SER 40 HN SER 40 1.482 -11.726 6.551 330 HA SER 40 HA SER 40 1.013 -13.061 9.055 331 1HB SER 40 HB2 SER 40 -0.144 -14.592 7.507 332 2HB SER 40 HB1 SER 40 1.319 -14.710 6.528 333 HG SER 40 HG SER 40 1.059 -15.498 9.244 334 H PHE 41 HN PHE 41 2.955 -13.962 9.925 335 HA PHE 41 HA PHE 41 5.330 -12.652 8.955 336 1HB PHE 41 HB2 PHE 41 5.038 -14.568 11.274 337 2HB PHE 41 HB1 PHE 41 6.401 -13.499 10.964 338 HD1 PHE 41 HD1 PHE 41 6.469 -11.425 11.966 339 HD2 PHE 41 HD2 PHE 41 2.725 -13.409 11.571 340 HE1 PHE 41 HE1 PHE 41 5.397 -9.667 13.311 341 HE2 PHE 41 HE2 PHE 41 1.647 -11.653 12.907 342 HZ PHE 41 HZ PHE 41 2.983 -9.780 13.782 343 H LEU 42 HN LEU 42 7.060 -13.506 7.919 344 HA LEU 42 HA LEU 42 6.892 -16.332 7.141 345 1HB LEU 42 HB2 LEU 42 7.029 -14.478 5.390 346 2HB LEU 42 HB1 LEU 42 8.681 -14.235 5.918 347 HG LEU 42 HG LEU 42 8.592 -15.590 3.895 348 1HD1 LEU 42 HD11 LEU 42 10.236 -15.993 5.894 349 2HD1 LEU 42 HD12 LEU 42 10.209 -17.083 4.509 350 3HD1 LEU 42 HD13 LEU 42 9.387 -17.535 6.001 351 1HD2 LEU 42 HD21 LEU 42 7.502 -17.658 3.741 352 2HD2 LEU 42 HD22 LEU 42 6.329 -16.583 4.499 353 3HD2 LEU 42 HD23 LEU 42 7.226 -17.741 5.481 354 H GLY 43 HN GLY 43 8.287 -17.761 7.924 355 1HA GLY 43 HA2 GLY 43 10.106 -17.124 9.983 356 2HA GLY 43 HA1 GLY 43 9.970 -18.676 9.179 357 H GLU 44 HN GLU 44 11.136 -15.409 8.337 358 HA GLU 44 HA GLU 44 13.804 -16.355 7.917 359 1HB GLU 44 HB2 GLU 44 12.187 -15.480 5.511 360 2HB GLU 44 HB1 GLU 44 13.926 -15.726 5.519 361 1HG GLU 44 HG2 GLU 44 13.536 -18.100 6.108 362 2HG GLU 44 HG1 GLU 44 11.804 -17.816 5.940 363 H ASP 45 HN ASP 45 12.717 -14.451 9.597 364 HA ASP 45 HA ASP 45 12.921 -12.287 10.273 365 1HB ASP 45 HB2 ASP 45 15.130 -12.252 8.196 366 2HB ASP 45 HB1 ASP 45 14.900 -11.049 9.461 367 H GLU 46 HN GLU 46 10.941 -12.835 8.346 368 HA GLU 46 HA GLU 46 10.567 -10.173 7.277 369 1HB GLU 46 HB2 GLU 46 10.803 -12.555 5.431 370 2HB GLU 46 HB1 GLU 46 10.161 -10.993 4.953 371 1HG GLU 46 HG2 GLU 46 12.317 -9.957 5.412 372 2HG GLU 46 HG1 GLU 46 12.961 -11.518 5.920 373 H LEU 47 HN LEU 47 8.463 -9.643 7.210 374 HA LEU 47 HA LEU 47 6.511 -11.808 7.606 375 1HB LEU 47 HB2 LEU 47 5.036 -10.198 8.607 376 2HB LEU 47 HB1 LEU 47 6.600 -10.081 9.389 377 HG LEU 47 HG LEU 47 7.025 -8.108 7.777 378 1HD1 LEU 47 HD11 LEU 47 5.418 -7.678 6.307 379 2HD1 LEU 47 HD12 LEU 47 4.387 -7.196 7.652 380 3HD1 LEU 47 HD13 LEU 47 4.342 -8.855 7.056 381 1HD2 LEU 47 HD21 LEU 47 5.696 -6.590 9.318 382 2HD2 LEU 47 HD22 LEU 47 6.839 -7.690 10.090 383 3HD2 LEU 47 HD23 LEU 47 5.115 -8.060 10.098 384 H LYS 48 HN LYS 48 5.147 -12.254 5.953 385 HA LYS 48 HA LYS 48 5.163 -10.349 3.724 386 1HB LYS 48 HB2 LYS 48 4.688 -12.267 2.260 387 2HB LYS 48 HB1 LYS 48 6.182 -12.455 3.160 388 1HG LYS 48 HG2 LYS 48 5.222 -14.554 3.263 389 2HG LYS 48 HG1 LYS 48 4.776 -13.835 4.811 390 1HD LYS 48 HD2 LYS 48 2.567 -13.345 4.008 391 2HD LYS 48 HD1 LYS 48 3.002 -13.843 2.374 392 1HE LYS 48 HE2 LYS 48 2.903 -15.618 4.810 393 2HE LYS 48 HE1 LYS 48 1.706 -15.567 3.516 394 1HZ LYS 48 HZ1 LYS 48 3.765 -16.078 2.038 395 2HZ LYS 48 HZ2 LYS 48 2.999 -17.329 2.880 396 3HZ LYS 48 HZ3 LYS 48 4.432 -16.661 3.480 397 H VAL 49 HN VAL 49 3.294 -10.109 2.391 398 HA VAL 49 HA VAL 49 0.741 -10.799 3.663 399 HB VAL 49 HB VAL 49 1.242 -8.494 4.324 400 1HG1 VAL 49 HG11 VAL 49 0.987 -7.226 1.741 401 2HG1 VAL 49 HG12 VAL 49 2.388 -8.295 1.797 402 3HG1 VAL 49 HG13 VAL 49 2.213 -7.008 2.988 403 1HG2 VAL 49 HG21 VAL 49 -0.820 -8.003 2.273 404 2HG2 VAL 49 HG22 VAL 49 -0.870 -7.767 4.019 405 3HG2 VAL 49 HG23 VAL 49 -1.101 -9.378 3.342 406 H SER 50 HN SER 50 -0.260 -12.044 2.201 407 HA SER 50 HA SER 50 0.226 -11.776 -0.634 408 1HB SER 50 HB2 SER 50 -1.681 -13.548 0.917 409 2HB SER 50 HB1 SER 50 -1.385 -13.664 -0.816 410 HG SER 50 HG SER 50 0.804 -14.133 -0.327 411 H TYR 51 HN TYR 51 -1.263 -11.008 -2.176 412 HA TYR 51 HA TYR 51 -3.829 -10.035 -1.195 413 1HB TYR 51 HB2 TYR 51 -3.428 -7.786 -2.251 414 2HB TYR 51 HB1 TYR 51 -2.476 -8.106 -0.812 415 HD1 TYR 51 HD1 TYR 51 -2.087 -8.721 -4.493 416 HD2 TYR 51 HD2 TYR 51 -0.342 -7.283 -0.891 417 HE1 TYR 51 HE1 TYR 51 -0.029 -8.194 -5.713 418 HE2 TYR 51 HE2 TYR 51 1.724 -6.739 -2.109 419 HH TYR 51 HH TYR 51 2.407 -6.249 -4.463 420 H ALA 52 HN ALA 52 -5.420 -9.795 -2.709 421 HA ALA 52 HA ALA 52 -4.905 -11.013 -5.315 422 1HB ALA 52 HB1 ALA 52 -7.383 -10.352 -3.754 423 2HB ALA 52 HB2 ALA 52 -6.868 -11.901 -4.419 424 3HB ALA 52 HB3 ALA 52 -7.477 -10.640 -5.490 425 H VAL 53 HN VAL 53 -4.724 -9.776 -7.166 426 HA VAL 53 HA VAL 53 -5.526 -6.952 -6.912 427 HB VAL 53 HB VAL 53 -3.018 -7.904 -8.282 428 1HG1 VAL 53 HG11 VAL 53 -4.474 -5.606 -8.713 429 2HG1 VAL 53 HG12 VAL 53 -2.768 -5.839 -9.094 430 3HG1 VAL 53 HG13 VAL 53 -3.238 -5.092 -7.567 431 1HG2 VAL 53 HG21 VAL 53 -3.498 -7.576 -5.533 432 2HG2 VAL 53 HG22 VAL 53 -2.572 -6.165 -6.044 433 3HG2 VAL 53 HG23 VAL 53 -1.945 -7.786 -6.340 434 HA PRO 54 HA PRO 54 -7.280 -7.862 -10.954 435 1HB PRO 54 HB2 PRO 54 -9.320 -6.056 -10.684 436 2HB PRO 54 HB1 PRO 54 -9.373 -7.699 -10.042 437 1HG PRO 54 HG2 PRO 54 -9.267 -5.213 -8.590 438 2HG PRO 54 HG1 PRO 54 -9.409 -6.856 -7.949 439 1HD PRO 54 HD2 PRO 54 -7.021 -5.140 -8.202 440 2HD PRO 54 HD1 PRO 54 -7.303 -6.536 -7.141 441 H LYS 55 HN LYS 55 -7.205 -6.760 -12.925 442 HA LYS 55 HA LYS 55 -6.570 -3.912 -12.922 443 1HB LYS 55 HB2 LYS 55 -4.599 -4.216 -14.361 444 2HB LYS 55 HB1 LYS 55 -4.376 -4.952 -12.781 445 1HG LYS 55 HG2 LYS 55 -4.867 -7.148 -13.734 446 2HG LYS 55 HG1 LYS 55 -5.090 -6.406 -15.319 447 1HD LYS 55 HD2 LYS 55 -2.766 -5.637 -15.286 448 2HD LYS 55 HD1 LYS 55 -2.544 -6.373 -13.697 449 1HE LYS 55 HE2 LYS 55 -3.022 -8.575 -14.655 450 2HE LYS 55 HE1 LYS 55 -3.242 -7.837 -16.241 451 1HZ LYS 55 HZ1 LYS 55 -0.790 -8.389 -14.776 452 2HZ LYS 55 HZ2 LYS 55 -0.828 -6.937 -15.642 453 3HZ LYS 55 HZ3 LYS 55 -1.084 -8.405 -16.442 454 HA PRO 56 HA PRO 56 -9.212 -3.683 -16.423 455 1HB PRO 56 HB2 PRO 56 -7.096 -1.907 -17.559 456 2HB PRO 56 HB1 PRO 56 -8.839 -1.637 -17.428 457 1HG PRO 56 HG2 PRO 56 -7.229 -0.436 -15.729 458 2HG PRO 56 HG1 PRO 56 -8.723 -1.190 -15.142 459 1HD PRO 56 HD2 PRO 56 -5.905 -2.197 -14.970 460 2HD PRO 56 HD1 PRO 56 -7.195 -2.247 -13.749 461 H ASN 57 HN ASN 57 -8.470 -3.157 -19.067 462 HA ASN 57 HA ASN 57 -7.941 -4.255 -20.989 463 1HB ASN 57 HB2 ASN 57 -5.612 -5.250 -19.328 464 2HB ASN 57 HB1 ASN 57 -5.730 -5.359 -21.081 465 1HD2 ASN 57 HD21 ASN 57 -4.368 -3.674 -18.666 466 2HD2 ASN 57 HD22 ASN 57 -4.146 -2.147 -19.443 467 H GLY 58 HN GLY 58 -9.736 -5.491 -19.104 468 1HA GLY 58 HA2 GLY 58 -10.643 -7.707 -20.094 469 2HA GLY 58 HA1 GLY 58 -9.150 -8.352 -19.430 470 H CYS 59 HN CYS 59 -9.567 -6.234 -17.193 471 HA CYS 59 HA CYS 59 -10.429 -6.172 -15.085 472 1HB CYS 59 HB2 CYS 59 -12.694 -7.807 -16.259 473 2HB CYS 59 HB1 CYS 59 -12.701 -7.055 -14.674 474 H ARG 60 HN ARG 60 -8.490 -8.067 -15.693 475 HA ARG 60 HA ARG 60 -9.279 -10.627 -14.626 476 1HB ARG 60 HB2 ARG 60 -6.644 -9.516 -15.572 477 2HB ARG 60 HB1 ARG 60 -6.768 -11.094 -14.824 478 1HG ARG 60 HG2 ARG 60 -6.811 -11.508 -17.118 479 2HG ARG 60 HG1 ARG 60 -8.486 -11.657 -16.593 480 1HD ARG 60 HD2 ARG 60 -8.882 -10.341 -18.377 481 2HD ARG 60 HD1 ARG 60 -8.429 -9.048 -17.275 482 HE ARG 60 HE ARG 60 -6.931 -10.014 -19.539 483 1HH1 ARG 60 HH11 ARG 60 -6.832 -8.127 -16.605 484 2HH1 ARG 60 HH12 ARG 60 -5.330 -7.369 -17.001 485 1HH2 ARG 60 HH21 ARG 60 -4.967 -9.005 -20.060 486 2HH2 ARG 60 HH22 ARG 60 -4.275 -7.859 -18.961 487 H LYS 61 HN LYS 61 -6.990 -11.325 -13.156 488 HA LYS 61 HA LYS 61 -6.665 -9.507 -10.948 489 1HB LYS 61 HB2 LYS 61 -8.828 -10.497 -10.386 490 2HB LYS 61 HB1 LYS 61 -8.154 -12.110 -10.572 491 1HG LYS 61 HG2 LYS 61 -6.656 -11.704 -8.685 492 2HG LYS 61 HG1 LYS 61 -7.337 -10.087 -8.496 493 1HD LYS 61 HD2 LYS 61 -8.340 -11.634 -6.906 494 2HD LYS 61 HD1 LYS 61 -9.542 -11.074 -8.069 495 1HE LYS 61 HE2 LYS 61 -9.758 -13.469 -7.665 496 2HE LYS 61 HE1 LYS 61 -9.290 -13.147 -9.334 497 1HZ LYS 61 HZ1 LYS 61 -7.376 -13.883 -7.188 498 2HZ LYS 61 HZ2 LYS 61 -7.051 -13.756 -8.843 499 3HZ LYS 61 HZ3 LYS 61 -8.054 -14.993 -8.272 500 H TRP 62 HN TRP 62 -4.963 -10.111 -9.548 501 HA TRP 62 HA TRP 62 -3.591 -12.625 -10.041 502 1HB TRP 62 HB2 TRP 62 -2.652 -11.164 -11.764 503 2HB TRP 62 HB1 TRP 62 -2.249 -9.962 -10.543 504 HD1 TRP 62 HD1 TRP 62 0.297 -9.969 -10.321 505 HE1 TRP 62 HE1 TRP 62 2.123 -11.763 -10.061 506 HE3 TRP 62 HE3 TRP 62 -2.601 -14.158 -10.793 507 HZ2 TRP 62 HZ2 TRP 62 2.313 -14.578 -10.057 508 HZ3 TRP 62 HZ3 TRP 62 -1.517 -16.362 -10.648 509 HH2 TRP 62 HH2 TRP 62 0.889 -16.566 -10.288 510 H GLU 63 HN GLU 63 -2.501 -13.356 -8.308 511 HA GLU 63 HA GLU 63 -2.470 -11.629 -5.939 512 1HB GLU 63 HB2 GLU 63 -3.781 -13.658 -5.671 513 2HB GLU 63 HB1 GLU 63 -2.412 -14.641 -6.170 514 1HG GLU 63 HG2 GLU 63 -2.241 -12.860 -3.770 515 2HG GLU 63 HG1 GLU 63 -2.968 -14.462 -3.669 516 H THR 64 HN THR 64 -0.629 -11.379 -4.697 517 HA THR 64 HA THR 64 1.821 -12.724 -5.497 518 HB THR 64 HB THR 64 1.522 -9.718 -5.606 519 HG1 THR 64 HG1 THR 64 1.776 -9.950 -7.749 520 1HG2 THR 64 HG21 THR 64 3.690 -10.088 -4.760 521 2HG2 THR 64 HG22 THR 64 3.873 -9.801 -6.490 522 3HG2 THR 64 HG23 THR 64 3.965 -11.443 -5.854 523 H THR 65 HN THR 65 3.294 -12.907 -3.872 524 HA THR 65 HA THR 65 2.410 -11.958 -1.247 525 HB THR 65 HB THR 65 4.337 -14.133 -2.072 526 HG1 THR 65 HG1 THR 65 2.671 -15.365 -1.878 527 1HG2 THR 65 HG21 THR 65 3.680 -13.107 0.660 528 2HG2 THR 65 HG22 THR 65 5.256 -13.461 -0.047 529 3HG2 THR 65 HG23 THR 65 4.170 -14.781 0.384 530 H PHE 66 HN PHE 66 3.354 -10.246 -0.376 531 HA PHE 66 HA PHE 66 6.076 -9.528 -1.245 532 1HB PHE 66 HB2 PHE 66 3.712 -7.930 -0.384 533 2HB PHE 66 HB1 PHE 66 5.309 -7.302 0.005 534 HD1 PHE 66 HD1 PHE 66 4.473 -9.231 -3.043 535 HD2 PHE 66 HD2 PHE 66 5.286 -5.401 -1.372 536 HE1 PHE 66 HE1 PHE 66 4.659 -8.284 -5.308 537 HE2 PHE 66 HE2 PHE 66 5.472 -4.449 -3.631 538 HZ PHE 66 HZ PHE 66 5.159 -5.890 -5.603 539 H LYS 67 HN LYS 67 7.721 -9.407 0.217 540 HA LYS 67 HA LYS 67 7.057 -9.638 3.066 541 1HB LYS 67 HB2 LYS 67 8.498 -11.458 3.445 542 2HB LYS 67 HB1 LYS 67 7.599 -11.893 2.002 543 1HG LYS 67 HG2 LYS 67 10.418 -10.840 2.093 544 2HG LYS 67 HG1 LYS 67 9.928 -12.505 1.785 545 1HD LYS 67 HD2 LYS 67 9.353 -10.105 0.052 546 2HD LYS 67 HD1 LYS 67 10.483 -11.410 -0.296 547 1HE LYS 67 HE2 LYS 67 8.608 -13.003 -0.326 548 2HE LYS 67 HE1 LYS 67 7.489 -11.671 -0.035 549 1HZ LYS 67 HZ1 LYS 67 7.392 -11.823 -2.295 550 2HZ LYS 67 HZ2 LYS 67 8.994 -12.338 -2.460 551 3HZ LYS 67 HZ3 LYS 67 8.658 -10.710 -2.151 552 H LYS 68 HN LYS 68 8.347 -8.473 4.424 553 HA LYS 68 HA LYS 68 10.964 -7.569 3.582 554 1HB LYS 68 HB2 LYS 68 8.968 -5.423 4.248 555 2HB LYS 68 HB1 LYS 68 10.554 -5.253 3.526 556 1HG LYS 68 HG2 LYS 68 9.720 -6.309 1.477 557 2HG LYS 68 HG1 LYS 68 8.114 -6.406 2.203 558 1HD LYS 68 HD2 LYS 68 8.276 -3.896 2.536 559 2HD LYS 68 HD1 LYS 68 9.687 -3.944 1.487 560 1HE LYS 68 HE2 LYS 68 8.305 -4.960 -0.282 561 2HE LYS 68 HE1 LYS 68 6.899 -4.839 0.771 562 1HZ LYS 68 HZ1 LYS 68 6.925 -3.003 -0.748 563 2HZ LYS 68 HZ2 LYS 68 8.500 -2.581 -0.301 564 3HZ LYS 68 HZ3 LYS 68 7.234 -2.417 0.809 565 H THR 69 HN THR 69 10.922 -5.288 5.449 566 HA THR 69 HA THR 69 10.951 -6.790 7.982 567 HB THR 69 HB THR 69 12.587 -4.410 7.086 568 HG1 THR 69 HG1 THR 69 14.120 -5.813 6.755 569 1HG2 THR 69 HG21 THR 69 12.637 -5.824 9.740 570 2HG2 THR 69 HG22 THR 69 12.168 -4.150 9.445 571 3HG2 THR 69 HG23 THR 69 13.835 -4.659 9.179 572 H SER 70 HN SER 70 10.217 -5.761 9.898 573 HA SER 70 HA SER 70 8.558 -3.362 9.485 574 1HB SER 70 HB2 SER 70 6.855 -4.331 10.986 575 2HB SER 70 HB1 SER 70 7.087 -5.303 9.533 576 HG SER 70 HG SER 70 8.543 -6.606 10.856 577 H ASP 71 HN ASP 71 8.570 -1.840 11.063 578 HA ASP 71 HA ASP 71 10.553 -2.151 13.176 579 1HB ASP 71 HB2 ASP 71 9.033 0.233 12.134 580 2HB ASP 71 HB1 ASP 71 10.069 0.314 13.556 581 H ASP 72 HN ASP 72 10.158 -1.490 15.366 582 HA ASP 72 HA ASP 72 7.642 -2.500 16.381 583 1HB ASP 72 HB2 ASP 72 9.772 -3.160 17.422 584 2HB ASP 72 HB1 ASP 72 10.094 -1.481 17.836 585 H GLY 73 HN GLY 73 6.523 -1.311 18.191 586 1HA GLY 73 HA2 GLY 73 5.623 0.610 19.159 587 2HA GLY 73 HA1 GLY 73 6.753 1.580 18.222 588 H GLU 74 HN GLU 74 6.301 1.239 15.743 589 HA GLU 74 HA GLU 74 3.408 1.498 15.260 590 1HB GLU 74 HB2 GLU 74 5.626 3.080 13.921 591 2HB GLU 74 HB1 GLU 74 3.912 3.200 13.549 592 1HG GLU 74 HG2 GLU 74 4.415 5.058 14.889 593 2HG GLU 74 HG1 GLU 74 3.565 3.925 15.937 594 H VAL 75 HN VAL 75 4.279 1.817 12.260 595 HA VAL 75 HA VAL 75 5.464 -0.820 11.932 596 HB VAL 75 HB VAL 75 3.262 -1.543 11.897 597 1HG1 VAL 75 HG11 VAL 75 1.541 -0.392 10.372 598 2HG1 VAL 75 HG12 VAL 75 2.634 0.986 10.446 599 3HG1 VAL 75 HG13 VAL 75 1.934 0.340 11.926 600 1HG2 VAL 75 HG21 VAL 75 3.511 -2.725 10.046 601 2HG2 VAL 75 HG22 VAL 75 4.722 -1.576 9.485 602 3HG2 VAL 75 HG23 VAL 75 3.027 -1.348 9.060 603 H TYR 76 HN TYR 76 7.053 -0.675 10.622 604 HA TYR 76 HA TYR 76 6.951 1.190 8.345 605 1HB TYR 76 HB2 TYR 76 8.375 2.068 10.186 606 2HB TYR 76 HB1 TYR 76 9.344 0.604 10.108 607 HD1 TYR 76 HD1 TYR 76 8.272 3.532 8.087 608 HD2 TYR 76 HD2 TYR 76 11.177 0.482 8.664 609 HE1 TYR 76 HE1 TYR 76 9.703 4.585 6.389 610 HE2 TYR 76 HE2 TYR 76 12.622 1.528 6.973 611 HH TYR 76 HH TYR 76 12.852 4.043 6.054 612 H TYR 77 HN TYR 77 6.989 0.024 6.548 613 HA TYR 77 HA TYR 77 8.333 -2.586 6.517 614 1HB TYR 77 HB2 TYR 77 5.820 -2.018 5.857 615 2HB TYR 77 HB1 TYR 77 6.563 -1.655 4.314 616 HD1 TYR 77 HD1 TYR 77 5.886 -3.333 2.888 617 HD2 TYR 77 HD2 TYR 77 7.351 -4.358 6.747 618 HE1 TYR 77 HE1 TYR 77 5.787 -5.711 2.285 619 HE2 TYR 77 HE2 TYR 77 7.260 -6.742 6.151 620 HH TYR 77 HH TYR 77 5.568 -8.012 3.929 621 H SER 78 HN SER 78 10.104 -2.966 5.208 622 HA SER 78 HA SER 78 10.663 -1.207 2.961 623 1HB SER 78 HB2 SER 78 12.573 -1.294 5.308 624 2HB SER 78 HB1 SER 78 12.840 -0.445 3.786 625 HG SER 78 HG SER 78 11.182 0.944 4.286 626 H GLU 79 HN GLU 79 12.076 -2.061 1.437 627 HA GLU 79 HA GLU 79 13.737 -4.341 2.045 628 1HB GLU 79 HB2 GLU 79 12.667 -5.960 0.670 629 2HB GLU 79 HB1 GLU 79 11.421 -5.294 1.714 630 1HG GLU 79 HG2 GLU 79 10.543 -3.956 -0.062 631 2HG GLU 79 HG1 GLU 79 11.894 -4.369 -1.110 632 H GLU 80 HN GLU 80 13.974 -5.355 -0.587 633 HA GLU 80 HA GLU 80 15.346 -5.080 -2.362 634 1HB GLU 80 HB2 GLU 80 13.240 -3.016 -2.589 635 2HB GLU 80 HB1 GLU 80 14.594 -2.886 -3.699 636 1HG GLU 80 HG2 GLU 80 12.763 -4.133 -4.687 637 2HG GLU 80 HG1 GLU 80 14.183 -5.157 -4.482 638 H ALA 81 HN ALA 81 16.478 -3.083 -3.720 639 HA ALA 81 HA ALA 81 18.738 -2.432 -2.258 640 1HB ALA 81 HB1 ALA 81 19.056 -0.653 -4.095 641 2HB ALA 81 HB2 ALA 81 17.581 -1.327 -4.788 642 3HB ALA 81 HB3 ALA 81 18.998 -2.352 -4.563 643 H LYS 82 HN LYS 82 16.734 0.212 -3.548 644 HA LYS 82 HA LYS 82 17.028 1.525 -0.927 645 1HB LYS 82 HB2 LYS 82 16.797 2.817 -3.649 646 2HB LYS 82 HB1 LYS 82 16.935 3.671 -2.119 647 1HG LYS 82 HG2 LYS 82 19.143 2.703 -1.768 648 2HG LYS 82 HG1 LYS 82 19.005 1.832 -3.297 649 1HD LYS 82 HD2 LYS 82 18.840 3.957 -4.495 650 2HD LYS 82 HD1 LYS 82 18.966 4.832 -2.968 651 1HE LYS 82 HE2 LYS 82 21.064 3.020 -4.159 652 2HE LYS 82 HE1 LYS 82 21.106 4.782 -4.141 653 1HZ LYS 82 HZ1 LYS 82 22.410 4.211 -2.344 654 2HZ LYS 82 HZ2 LYS 82 21.436 2.902 -1.897 655 3HZ LYS 82 HZ3 LYS 82 20.911 4.483 -1.605 656 H LYS 83 HN LYS 83 14.910 -0.234 -1.324 657 HA LYS 83 HA LYS 83 12.616 1.546 -1.772 658 1HB LYS 83 HB2 LYS 83 12.655 -1.471 -1.561 659 2HB LYS 83 HB1 LYS 83 11.256 -0.478 -1.942 660 1HG LYS 83 HG2 LYS 83 12.555 0.336 -3.957 661 2HG LYS 83 HG1 LYS 83 13.695 -0.966 -3.621 662 1HD LYS 83 HD2 LYS 83 11.852 -2.595 -3.789 663 2HD LYS 83 HD1 LYS 83 10.744 -1.279 -4.174 664 1HE LYS 83 HE2 LYS 83 12.049 -0.765 -6.177 665 2HE LYS 83 HE1 LYS 83 13.164 -2.074 -5.789 666 1HZ LYS 83 HZ1 LYS 83 11.813 -3.214 -7.159 667 2HZ LYS 83 HZ2 LYS 83 10.488 -2.191 -6.913 668 3HZ LYS 83 HZ3 LYS 83 10.857 -3.385 -5.773 669 H LYS 84 HN LYS 84 11.369 2.166 -0.137 670 HA LYS 84 HA LYS 84 11.259 0.679 2.336 671 1HB LYS 84 HB2 LYS 84 11.990 2.577 3.732 672 2HB LYS 84 HB1 LYS 84 13.279 1.987 2.694 673 1HG LYS 84 HG2 LYS 84 12.881 3.839 1.149 674 2HG LYS 84 HG1 LYS 84 11.590 4.430 2.197 675 1HD LYS 84 HD2 LYS 84 13.206 4.734 4.012 676 2HD LYS 84 HD1 LYS 84 14.495 4.141 2.964 677 1HE LYS 84 HE2 LYS 84 14.108 6.012 1.435 678 2HE LYS 84 HE1 LYS 84 12.818 6.602 2.482 679 1HZ LYS 84 HZ1 LYS 84 15.723 6.506 3.035 680 2HZ LYS 84 HZ2 LYS 84 14.586 6.696 4.273 681 3HZ LYS 84 HZ3 LYS 84 14.696 7.851 3.042 682 H VAL 85 HN VAL 85 9.442 1.164 3.552 683 HA VAL 85 HA VAL 85 7.756 3.376 2.653 684 HB VAL 85 HB VAL 85 5.855 2.071 2.228 685 1HG1 VAL 85 HG11 VAL 85 7.807 0.125 1.132 686 2HG1 VAL 85 HG12 VAL 85 7.952 1.812 0.650 687 3HG1 VAL 85 HG13 VAL 85 6.455 0.936 0.346 688 1HG2 VAL 85 HG21 VAL 85 6.403 0.510 4.263 689 2HG2 VAL 85 HG22 VAL 85 7.102 -0.517 3.014 690 3HG2 VAL 85 HG23 VAL 85 5.399 -0.070 2.936 691 H GLU 86 HN GLU 86 6.431 4.239 4.272 692 HA GLU 86 HA GLU 86 6.891 3.074 6.942 693 1HB GLU 86 HB2 GLU 86 7.841 5.324 6.619 694 2HB GLU 86 HB1 GLU 86 6.242 5.936 6.226 695 1HG GLU 86 HG2 GLU 86 6.801 4.613 8.855 696 2HG GLU 86 HG1 GLU 86 7.149 6.319 8.586 697 H VAL 87 HN VAL 87 5.242 2.121 7.875 698 HA VAL 87 HA VAL 87 2.556 2.661 6.896 699 HB VAL 87 HB VAL 87 3.404 0.567 8.887 700 1HG1 VAL 87 HG11 VAL 87 1.268 -0.505 8.247 701 2HG1 VAL 87 HG12 VAL 87 0.874 0.921 7.289 702 3HG1 VAL 87 HG13 VAL 87 1.052 1.055 9.038 703 1HG2 VAL 87 HG21 VAL 87 4.176 0.645 6.271 704 2HG2 VAL 87 HG22 VAL 87 2.703 -0.322 6.201 705 3HG2 VAL 87 HG23 VAL 87 4.031 -0.813 7.251 706 H LEU 88 HN LEU 88 1.479 4.183 7.744 707 HA LEU 88 HA LEU 88 1.733 4.892 10.582 708 1HB LEU 88 HB2 LEU 88 2.246 6.633 8.880 709 2HB LEU 88 HB1 LEU 88 0.616 6.479 8.261 710 HG LEU 88 HG LEU 88 0.914 7.178 11.137 711 1HD1 LEU 88 HD11 LEU 88 2.283 8.618 9.124 712 2HD1 LEU 88 HD12 LEU 88 2.052 9.055 10.816 713 3HD1 LEU 88 HD13 LEU 88 0.884 9.579 9.603 714 1HD2 LEU 88 HD21 LEU 88 -1.218 6.923 9.511 715 2HD2 LEU 88 HD22 LEU 88 -0.861 8.632 9.278 716 3HD2 LEU 88 HD23 LEU 88 -1.178 8.011 10.897 717 H ASP 89 HN ASP 89 -0.466 5.885 11.401 718 HA ASP 89 HA ASP 89 -2.691 5.667 11.862 719 1HB ASP 89 HB2 ASP 89 -2.797 5.376 9.241 720 2HB ASP 89 HB1 ASP 89 -3.115 3.702 9.655 721 H THR 90 HN THR 90 -1.262 2.610 10.704 722 HA THR 90 HA THR 90 -0.622 0.794 11.952 723 HB THR 90 HB THR 90 -1.012 2.350 14.014 724 HG1 THR 90 HG1 THR 90 -0.174 0.740 15.078 725 1HG2 THR 90 HG21 THR 90 -3.620 1.677 13.795 726 2HG2 THR 90 HG22 THR 90 -2.834 2.124 15.307 727 3HG2 THR 90 HG23 THR 90 -3.049 0.423 14.892 728 H ASP 91 HN ASP 91 -1.264 -1.132 11.409 729 HA ASP 91 HA ASP 91 -4.124 -1.656 10.998 730 1HB ASP 91 HB2 ASP 91 -3.363 -3.664 9.779 731 2HB ASP 91 HB1 ASP 91 -2.623 -2.211 9.116 732 H TYR 92 HN TYR 92 -2.892 -1.448 13.615 733 HA TYR 92 HA TYR 92 -2.801 -4.187 14.596 734 1HB TYR 92 HB2 TYR 92 -2.189 -1.554 15.956 735 2HB TYR 92 HB1 TYR 92 -1.993 -3.139 16.694 736 HD1 TYR 92 HD1 TYR 92 -1.032 -1.797 13.314 737 HD2 TYR 92 HD2 TYR 92 0.259 -3.565 16.964 738 HE1 TYR 92 HE1 TYR 92 1.251 -1.937 12.429 739 HE2 TYR 92 HE2 TYR 92 2.549 -3.705 16.083 740 HH TYR 92 HH TYR 92 3.387 -3.659 13.112 741 H LYS 93 HN LYS 93 -4.814 -1.319 14.723 742 HA LYS 93 HA LYS 93 -6.582 -2.732 16.598 743 1HB LYS 93 HB2 LYS 93 -7.537 -0.517 17.144 744 2HB LYS 93 HB1 LYS 93 -5.835 -0.676 17.546 745 1HG LYS 93 HG2 LYS 93 -5.297 0.532 15.435 746 2HG LYS 93 HG1 LYS 93 -7.029 0.816 15.226 747 1HD LYS 93 HD2 LYS 93 -7.085 1.933 17.423 748 2HD LYS 93 HD1 LYS 93 -5.344 1.697 17.569 749 1HE LYS 93 HE2 LYS 93 -5.010 3.051 15.547 750 2HE LYS 93 HE1 LYS 93 -6.752 3.308 15.448 751 1HZ LYS 93 HZ1 LYS 93 -5.359 5.108 16.548 752 2HZ LYS 93 HZ2 LYS 93 -5.219 4.053 17.862 753 3HZ LYS 93 HZ3 LYS 93 -6.745 4.596 17.373 754 H SER 94 HN SER 94 -6.711 -0.733 13.606 755 HA SER 94 HA SER 94 -8.838 -2.332 12.612 756 1HB SER 94 HB2 SER 94 -10.622 -0.595 12.650 757 2HB SER 94 HB1 SER 94 -10.180 -1.190 14.251 758 HG SER 94 HG SER 94 -10.232 1.293 13.481 759 H TYR 95 HN TYR 95 -7.202 0.810 12.390 760 HA TYR 95 HA TYR 95 -7.400 0.552 9.464 761 1HB TYR 95 HB2 TYR 95 -7.504 3.132 9.488 762 2HB TYR 95 HB1 TYR 95 -8.963 2.228 9.876 763 HD1 TYR 95 HD1 TYR 95 -5.998 3.662 11.662 764 HD2 TYR 95 HD2 TYR 95 -10.188 2.955 11.687 765 HE1 TYR 95 HE1 TYR 95 -6.177 4.866 13.793 766 HE2 TYR 95 HE2 TYR 95 -10.383 4.161 13.821 767 HH TYR 95 HH TYR 95 -8.117 6.170 15.015 768 H ALA 96 HN ALA 96 -5.595 0.867 8.323 769 HA ALA 96 HA ALA 96 -3.287 2.140 9.618 770 1HB ALA 96 HB1 ALA 96 -1.885 0.386 9.350 771 2HB ALA 96 HB2 ALA 96 -2.712 -0.193 7.904 772 3HB ALA 96 HB3 ALA 96 -3.393 -0.514 9.496 773 H VAL 97 HN VAL 97 -1.977 3.315 8.275 774 HA VAL 97 HA VAL 97 -2.628 3.305 5.414 775 HB VAL 97 HB VAL 97 -2.584 5.661 5.263 776 1HG1 VAL 97 HG11 VAL 97 -4.128 6.024 7.599 777 2HG1 VAL 97 HG12 VAL 97 -4.401 4.372 7.049 778 3HG1 VAL 97 HG13 VAL 97 -4.699 5.721 5.956 779 1HG2 VAL 97 HG21 VAL 97 -0.898 6.528 6.553 780 2HG2 VAL 97 HG22 VAL 97 -1.333 5.555 7.956 781 3HG2 VAL 97 HG23 VAL 97 -2.292 6.972 7.542 782 H ILE 98 HN ILE 98 -0.890 2.775 4.290 783 HA ILE 98 HA ILE 98 1.751 3.578 5.306 784 HB ILE 98 HB ILE 98 1.884 1.352 5.736 785 1HG1 ILE 98 HG12 ILE 98 3.147 0.189 4.034 786 2HG1 ILE 98 HG11 ILE 98 2.520 1.261 2.787 787 1HG2 ILE 98 HG21 ILE 98 0.291 0.582 3.310 788 2HG2 ILE 98 HG22 ILE 98 -0.437 0.916 4.883 789 3HG2 ILE 98 HG23 ILE 98 0.705 -0.411 4.706 790 1HD1 ILE 98 HD11 ILE 98 3.657 3.032 4.484 791 2HD1 ILE 98 HD12 ILE 98 4.439 2.339 3.072 792 3HD1 ILE 98 HD13 ILE 98 4.723 1.641 4.665 793 H TYR 99 HN TYR 99 2.851 4.831 3.951 794 HA TYR 99 HA TYR 99 2.095 4.828 1.125 795 1HB TYR 99 HB2 TYR 99 3.308 6.945 0.948 796 2HB TYR 99 HB1 TYR 99 2.118 7.018 2.241 797 HD1 TYR 99 HD1 TYR 99 5.748 6.274 1.718 798 HD2 TYR 99 HD2 TYR 99 2.756 7.869 4.288 799 HE1 TYR 99 HE1 TYR 99 7.495 7.003 3.289 800 HE2 TYR 99 HE2 TYR 99 4.493 8.606 5.863 801 HH TYR 99 HH TYR 99 7.760 8.734 5.077 802 H ALA 100 HN ALA 100 3.385 4.053 -0.412 803 HA ALA 100 HA ALA 100 5.906 2.863 0.450 804 1HB ALA 100 HB1 ALA 100 4.201 1.414 -0.586 805 2HB ALA 100 HB2 ALA 100 5.728 1.422 -1.469 806 3HB ALA 100 HB3 ALA 100 4.354 2.347 -2.075 807 H THR 101 HN THR 101 7.833 3.260 -0.445 808 HA THR 101 HA THR 101 8.044 5.100 -2.711 809 HB THR 101 HB THR 101 9.780 6.406 -1.598 810 HG1 THR 101 HG1 THR 101 10.300 6.023 0.552 811 1HG2 THR 101 HG21 THR 101 7.123 6.601 -0.957 812 2HG2 THR 101 HG22 THR 101 8.377 7.780 -0.567 813 3HG2 THR 101 HG23 THR 101 7.915 6.558 0.619 814 H ARG 102 HN ARG 102 9.660 4.513 -4.121 815 HA ARG 102 HA ARG 102 11.598 2.512 -3.190 816 1HB ARG 102 HB2 ARG 102 11.265 1.136 -5.144 817 2HB ARG 102 HB1 ARG 102 9.729 1.344 -4.313 818 1HG ARG 102 HG2 ARG 102 8.964 2.893 -5.947 819 2HG ARG 102 HG1 ARG 102 10.562 2.986 -6.692 820 1HD ARG 102 HD2 ARG 102 9.178 1.583 -8.053 821 2HD ARG 102 HD1 ARG 102 10.374 0.569 -7.248 822 HE ARG 102 HE ARG 102 8.664 -0.535 -6.224 823 1HH1 ARG 102 HH11 ARG 102 7.474 2.550 -7.338 824 2HH1 ARG 102 HH12 ARG 102 5.841 2.237 -6.856 825 1HH2 ARG 102 HH21 ARG 102 6.516 -0.952 -5.590 826 2HH2 ARG 102 HH22 ARG 102 5.296 0.248 -5.863 827 H VAL 103 HN VAL 103 13.564 2.481 -4.198 828 HA VAL 103 HA VAL 103 14.062 4.344 -6.385 829 HB VAL 103 HB VAL 103 15.677 4.417 -3.828 830 1HG1 VAL 103 HG11 VAL 103 17.268 5.050 -5.302 831 2HG1 VAL 103 HG12 VAL 103 16.427 6.598 -5.218 832 3HG1 VAL 103 HG13 VAL 103 16.096 5.485 -6.546 833 1HG2 VAL 103 HG21 VAL 103 14.791 6.873 -3.941 834 2HG2 VAL 103 HG22 VAL 103 13.785 5.600 -3.252 835 3HG2 VAL 103 HG23 VAL 103 13.498 6.154 -4.901 836 H LYS 104 HN LYS 104 15.653 3.690 -7.746 837 HA LYS 104 HA LYS 104 17.464 1.559 -6.960 838 1HB LYS 104 HB2 LYS 104 15.498 0.335 -7.740 839 2HB LYS 104 HB1 LYS 104 15.506 1.246 -9.243 840 1HG LYS 104 HG2 LYS 104 17.668 0.266 -9.827 841 2HG LYS 104 HG1 LYS 104 17.655 -0.651 -8.319 842 1HD LYS 104 HD2 LYS 104 15.618 -1.803 -9.035 843 2HD LYS 104 HD1 LYS 104 15.620 -0.879 -10.538 844 1HE LYS 104 HE2 LYS 104 17.773 -1.869 -11.144 845 2HE LYS 104 HE1 LYS 104 17.776 -2.788 -9.638 846 1HZ LYS 104 HZ1 LYS 104 15.710 -3.869 -10.393 847 2HZ LYS 104 HZ2 LYS 104 17.020 -4.182 -11.416 848 3HZ LYS 104 HZ3 LYS 104 15.840 -3.060 -11.874 849 H ASP 105 HN ASP 105 19.186 2.807 -7.311 850 HA ASP 105 HA ASP 105 20.436 4.490 -8.443 851 1HB ASP 105 HB2 ASP 105 21.986 3.158 -9.846 852 2HB ASP 105 HB1 ASP 105 21.641 2.407 -8.291 853 H GLY 106 HN GLY 106 18.041 5.168 -9.561 854 1HA GLY 106 HA2 GLY 106 18.759 6.211 -12.027 855 2HA GLY 106 HA1 GLY 106 17.961 4.688 -12.367 856 H ARG 107 HN ARG 107 15.910 4.739 -10.422 857 HA ARG 107 HA ARG 107 14.520 7.258 -11.003 858 1HB ARG 107 HB2 ARG 107 12.589 6.250 -11.915 859 2HB ARG 107 HB1 ARG 107 13.961 5.569 -12.771 860 1HG ARG 107 HG2 ARG 107 12.496 4.210 -10.519 861 2HG ARG 107 HG1 ARG 107 12.214 3.916 -12.234 862 1HD ARG 107 HD2 ARG 107 14.652 3.301 -12.409 863 2HD ARG 107 HD1 ARG 107 14.708 3.357 -10.647 864 HE ARG 107 HE ARG 107 13.770 1.289 -10.637 865 1HH1 ARG 107 HH11 ARG 107 12.917 2.842 -13.649 866 2HH1 ARG 107 HH12 ARG 107 12.022 1.482 -14.241 867 1HH2 ARG 107 HH21 ARG 107 12.601 -0.504 -11.421 868 2HH2 ARG 107 HH22 ARG 107 11.845 -0.418 -12.977 869 H THR 108 HN THR 108 12.872 7.849 -9.674 870 HA THR 108 HA THR 108 12.553 6.282 -7.201 871 HB THR 108 HB THR 108 13.856 8.310 -6.785 872 HG1 THR 108 HG1 THR 108 11.212 8.679 -5.840 873 1HG2 THR 108 HG21 THR 108 12.943 9.649 -8.681 874 2HG2 THR 108 HG22 THR 108 13.041 10.509 -7.145 875 3HG2 THR 108 HG23 THR 108 11.487 9.903 -7.720 876 H LEU 109 HN LEU 109 10.485 6.109 -6.355 877 HA LEU 109 HA LEU 109 8.307 7.377 -7.868 878 1HB LEU 109 HB2 LEU 109 8.391 4.478 -7.028 879 2HB LEU 109 HB1 LEU 109 7.027 5.282 -7.780 880 HG LEU 109 HG LEU 109 8.135 3.967 -9.440 881 1HD1 LEU 109 HD11 LEU 109 7.728 6.724 -9.656 882 2HD1 LEU 109 HD12 LEU 109 7.809 5.541 -10.960 883 3HD1 LEU 109 HD13 LEU 109 9.264 6.401 -10.460 884 1HD2 LEU 109 HD21 LEU 109 10.673 5.359 -9.553 885 2HD2 LEU 109 HD22 LEU 109 10.333 3.629 -9.531 886 3HD2 LEU 109 HD23 LEU 109 10.447 4.523 -8.016 887 H HIS 110 HN HIS 110 6.539 7.996 -6.682 888 HA HIS 110 HA HIS 110 6.621 7.380 -3.797 889 1HB HIS 110 HB2 HIS 110 7.289 9.749 -4.368 890 2HB HIS 110 HB1 HIS 110 5.660 9.988 -4.989 891 HD1 HIS 110 HD1 HIS 110 6.959 8.487 -1.743 892 HD2 HIS 110 HD2 HIS 110 4.304 11.371 -3.094 893 HE1 HIS 110 HE1 HIS 110 5.893 9.438 0.324 894 HE2 HIS 110 HE2 HIS 110 4.425 11.302 -0.519 895 H MET 111 HN MET 111 4.780 6.587 -2.948 896 HA MET 111 HA MET 111 2.223 7.159 -4.096 897 1HB MET 111 HB2 MET 111 1.654 4.793 -4.613 898 2HB MET 111 HB1 MET 111 2.859 5.488 -5.687 899 1HG MET 111 HG2 MET 111 3.574 3.784 -3.318 900 2HG MET 111 HG1 MET 111 3.264 3.123 -4.920 901 1HE MET 111 HE1 MET 111 5.988 2.668 -3.273 902 2HE MET 111 HE2 MET 111 7.160 2.842 -4.578 903 3HE MET 111 HE3 MET 111 5.654 1.968 -4.856 904 H MET 112 HN MET 112 0.573 6.820 -2.733 905 HA MET 112 HA MET 112 1.248 5.930 -0.036 906 1HB MET 112 HB2 MET 112 -0.922 7.622 -1.206 907 2HB MET 112 HB1 MET 112 -1.146 6.886 0.366 908 1HG MET 112 HG2 MET 112 -0.348 9.177 0.538 909 2HG MET 112 HG1 MET 112 0.802 8.032 1.221 910 1HE MET 112 HE1 MET 112 3.319 10.078 0.604 911 2HE MET 112 HE2 MET 112 1.697 10.421 1.202 912 3HE MET 112 HE3 MET 112 2.318 11.281 -0.207 913 H ARG 113 HN ARG 113 0.160 4.315 1.042 914 HA ARG 113 HA ARG 113 -1.891 2.826 -0.432 915 1HB ARG 113 HB2 ARG 113 0.451 1.787 -0.607 916 2HB ARG 113 HB1 ARG 113 0.280 1.414 1.102 917 1HG ARG 113 HG2 ARG 113 -1.660 0.050 0.650 918 2HG ARG 113 HG1 ARG 113 -1.594 0.484 -1.060 919 1HD ARG 113 HD2 ARG 113 0.688 -0.524 -1.149 920 2HD ARG 113 HD1 ARG 113 0.447 -1.087 0.505 921 HE ARG 113 HE ARG 113 -1.712 -1.989 -0.978 922 1HH1 ARG 113 HH11 ARG 113 1.746 -2.462 -0.880 923 2HH1 ARG 113 HH12 ARG 113 1.667 -4.063 -1.535 924 1HH2 ARG 113 HH21 ARG 113 -1.817 -4.079 -1.842 925 2HH2 ARG 113 HH22 ARG 113 -0.359 -4.983 -2.083 926 H LEU 114 HN LEU 114 -3.580 2.098 0.850 927 HA LEU 114 HA LEU 114 -3.254 2.508 3.752 928 1HB LEU 114 HB2 LEU 114 -4.554 4.329 2.624 929 2HB LEU 114 HB1 LEU 114 -5.749 3.131 2.171 930 HG LEU 114 HG LEU 114 -5.025 3.822 5.023 931 1HD1 LEU 114 HD11 LEU 114 -6.186 5.602 3.541 932 2HD1 LEU 114 HD12 LEU 114 -6.850 5.235 5.133 933 3HD1 LEU 114 HD13 LEU 114 -7.597 4.554 3.688 934 1HD2 LEU 114 HD21 LEU 114 -6.918 1.902 3.762 935 2HD2 LEU 114 HD22 LEU 114 -7.399 2.710 5.254 936 3HD2 LEU 114 HD23 LEU 114 -5.934 1.730 5.215 937 H TYR 115 HN TYR 115 -3.645 0.761 4.911 938 HA TYR 115 HA TYR 115 -5.220 -1.404 3.705 939 1HB TYR 115 HB2 TYR 115 -3.220 -1.454 5.972 940 2HB TYR 115 HB1 TYR 115 -4.159 -2.846 5.447 941 HD1 TYR 115 HD1 TYR 115 -1.062 -1.309 5.194 942 HD2 TYR 115 HD2 TYR 115 -3.970 -3.271 2.788 943 HE1 TYR 115 HE1 TYR 115 0.679 -1.861 3.546 944 HE2 TYR 115 HE2 TYR 115 -2.236 -3.826 1.135 945 HH TYR 115 HH TYR 115 0.577 -4.096 1.439 946 H SER 116 HN SER 116 -7.157 -1.906 4.498 947 HA SER 116 HA SER 116 -7.858 -0.935 7.188 948 1HB SER 116 HB2 SER 116 -8.998 0.417 5.486 949 2HB SER 116 HB1 SER 116 -9.654 -1.045 4.751 950 HG SER 116 HG SER 116 -10.806 -1.420 6.672 951 H ARG 117 HN ARG 117 -8.646 -2.413 8.558 952 HA ARG 117 HA ARG 117 -8.604 -5.163 7.927 953 1HB ARG 117 HB2 ARG 117 -9.158 -3.505 10.276 954 2HB ARG 117 HB1 ARG 117 -10.096 -4.990 10.242 955 1HG ARG 117 HG2 ARG 117 -7.883 -5.072 11.457 956 2HG ARG 117 HG1 ARG 117 -8.169 -6.335 10.259 957 1HD ARG 117 HD2 ARG 117 -5.882 -5.353 10.177 958 2HD ARG 117 HD1 ARG 117 -6.775 -5.227 8.662 959 HE ARG 117 HE ARG 117 -7.056 -2.906 10.311 960 1HH1 ARG 117 HH11 ARG 117 -5.005 -4.494 7.978 961 2HH1 ARG 117 HH12 ARG 117 -4.258 -3.025 7.448 962 1HH2 ARG 117 HH21 ARG 117 -6.077 -0.974 9.616 963 2HH2 ARG 117 HH22 ARG 117 -4.878 -1.026 8.368 964 H SER 118 HN SER 118 -11.252 -2.858 8.306 965 HA SER 118 HA SER 118 -13.038 -4.838 7.061 966 1HB SER 118 HB2 SER 118 -13.762 -2.865 9.242 967 2HB SER 118 HB1 SER 118 -14.890 -3.944 8.423 968 HG SER 118 HG SER 118 -14.080 -4.726 10.475 969 HA PRO 119 HA PRO 119 -14.163 -2.134 3.786 970 1HB PRO 119 HB2 PRO 119 -16.907 -2.194 4.991 971 2HB PRO 119 HB1 PRO 119 -16.419 -2.395 3.303 972 1HG PRO 119 HG2 PRO 119 -17.047 -4.504 4.822 973 2HG PRO 119 HG1 PRO 119 -15.751 -4.586 3.616 974 1HD PRO 119 HD2 PRO 119 -15.578 -4.518 6.567 975 2HD PRO 119 HD1 PRO 119 -14.425 -5.158 5.381 976 H GLU 120 HN GLU 120 -15.529 -1.357 6.963 977 HA GLU 120 HA GLU 120 -15.883 1.426 6.400 978 1HB GLU 120 HB2 GLU 120 -17.273 0.304 8.057 979 2HB GLU 120 HB1 GLU 120 -15.853 -0.085 9.017 980 1HG GLU 120 HG2 GLU 120 -15.463 2.310 9.383 981 2HG GLU 120 HG1 GLU 120 -16.923 2.673 8.462 982 H VAL 121 HN VAL 121 -14.675 3.173 7.121 983 HA VAL 121 HA VAL 121 -12.101 2.622 8.396 984 HB VAL 121 HB VAL 121 -12.389 4.205 5.834 985 1HG1 VAL 121 HG11 VAL 121 -10.789 5.310 7.240 986 2HG1 VAL 121 HG12 VAL 121 -9.911 4.424 5.993 987 3HG1 VAL 121 HG13 VAL 121 -10.006 3.779 7.632 988 1HG2 VAL 121 HG21 VAL 121 -11.100 2.512 4.790 989 2HG2 VAL 121 HG22 VAL 121 -12.372 1.683 5.689 990 3HG2 VAL 121 HG23 VAL 121 -10.731 1.744 6.333 991 H SER 122 HN SER 122 -11.825 3.938 10.048 992 HA SER 122 HA SER 122 -13.587 5.933 10.815 993 1HB SER 122 HB2 SER 122 -12.038 4.846 12.376 994 2HB SER 122 HB1 SER 122 -10.672 5.629 11.579 995 HG SER 122 HG SER 122 -12.181 6.577 13.537 996 HA PRO 123 HA PRO 123 -12.797 9.543 8.396 997 1HB PRO 123 HB2 PRO 123 -12.728 11.388 10.515 998 2HB PRO 123 HB1 PRO 123 -14.161 10.910 9.599 999 1HG PRO 123 HG2 PRO 123 -13.187 9.939 12.242 1000 2HG PRO 123 HG1 PRO 123 -14.850 10.187 11.679 1001 1HD PRO 123 HD2 PRO 123 -13.811 7.735 11.865 1002 2HD PRO 123 HD1 PRO 123 -14.883 8.172 10.516 1003 H ALA 124 HN ALA 124 -10.962 9.043 11.377 1004 HA ALA 124 HA ALA 124 -8.856 10.827 10.812 1005 1HB ALA 124 HB1 ALA 124 -8.573 10.282 12.963 1006 2HB ALA 124 HB2 ALA 124 -7.699 8.873 12.361 1007 3HB ALA 124 HB3 ALA 124 -9.409 8.741 12.776 1008 H ALA 125 HN ALA 125 -9.123 7.310 10.367 1009 HA ALA 125 HA ALA 125 -6.630 6.809 9.308 1010 1HB ALA 125 HB1 ALA 125 -8.127 5.023 9.856 1011 2HB ALA 125 HB2 ALA 125 -7.695 4.888 8.153 1012 3HB ALA 125 HB3 ALA 125 -9.269 5.533 8.616 1013 H THR 126 HN THR 126 -9.578 7.760 7.555 1014 HA THR 126 HA THR 126 -8.243 7.879 5.025 1015 HB THR 126 HB THR 126 -10.358 8.822 4.201 1016 HG1 THR 126 HG1 THR 126 -11.223 8.696 6.898 1017 1HG2 THR 126 HG21 THR 126 -11.311 6.833 4.138 1018 2HG2 THR 126 HG22 THR 126 -11.568 6.816 5.882 1019 3HG2 THR 126 HG23 THR 126 -10.028 6.277 5.213 1020 H ALA 127 HN ALA 127 -9.514 10.340 7.259 1021 HA ALA 127 HA ALA 127 -8.634 12.535 5.709 1022 1HB ALA 127 HB1 ALA 127 -9.403 13.912 7.405 1023 2HB ALA 127 HB2 ALA 127 -9.075 12.718 8.660 1024 3HB ALA 127 HB3 ALA 127 -10.424 12.481 7.549 1025 H ILE 128 HN ILE 128 -7.275 11.074 8.668 1026 HA ILE 128 HA ILE 128 -5.096 12.787 8.882 1027 HB ILE 128 HB ILE 128 -5.236 9.896 9.746 1028 1HG1 ILE 128 HG12 ILE 128 -5.681 12.453 11.312 1029 2HG1 ILE 128 HG11 ILE 128 -6.954 11.373 10.757 1030 1HG2 ILE 128 HG21 ILE 128 -3.080 10.071 10.251 1031 2HG2 ILE 128 HG22 ILE 128 -3.489 11.352 11.393 1032 3HG2 ILE 128 HG23 ILE 128 -3.053 11.755 9.733 1033 1HD1 ILE 128 HD11 ILE 128 -4.870 10.880 12.850 1034 2HD1 ILE 128 HD12 ILE 128 -5.793 9.570 12.114 1035 3HD1 ILE 128 HD13 ILE 128 -6.627 10.842 13.007 1036 H PHE 129 HN PHE 129 -5.411 9.733 7.093 1037 HA PHE 129 HA PHE 129 -2.703 9.668 6.262 1038 1HB PHE 129 HB2 PHE 129 -4.282 7.711 6.187 1039 2HB PHE 129 HB1 PHE 129 -5.075 8.472 4.813 1040 HD1 PHE 129 HD1 PHE 129 -1.429 8.455 5.449 1041 HD2 PHE 129 HD2 PHE 129 -4.635 6.828 3.167 1042 HE1 PHE 129 HE1 PHE 129 0.192 7.387 3.938 1043 HE2 PHE 129 HE2 PHE 129 -3.016 5.759 1.653 1044 HZ PHE 129 HZ PHE 129 -0.601 6.038 2.039 1045 H ARG 130 HN ARG 130 -5.672 10.923 4.810 1046 HA ARG 130 HA ARG 130 -4.534 11.794 2.384 1047 1HB ARG 130 HB2 ARG 130 -6.952 11.549 2.670 1048 2HB ARG 130 HB1 ARG 130 -6.955 12.825 3.877 1049 1HG ARG 130 HG2 ARG 130 -6.332 14.459 2.211 1050 2HG ARG 130 HG1 ARG 130 -6.197 13.196 0.984 1051 1HD ARG 130 HD2 ARG 130 -8.569 12.717 1.183 1052 2HD ARG 130 HD1 ARG 130 -8.718 13.895 2.485 1053 HE ARG 130 HE ARG 130 -7.685 15.195 0.235 1054 1HH1 ARG 130 HH11 ARG 130 -10.627 13.642 1.283 1055 2HH1 ARG 130 HH12 ARG 130 -11.649 14.626 0.290 1056 1HH2 ARG 130 HH21 ARG 130 -9.027 16.494 -1.072 1057 2HH2 ARG 130 HH22 ARG 130 -10.741 16.246 -1.047 1058 H LYS 131 HN LYS 131 -5.258 13.551 5.409 1059 HA LYS 131 HA LYS 131 -4.138 16.002 4.593 1060 1HB LYS 131 HB2 LYS 131 -4.292 16.704 6.847 1061 2HB LYS 131 HB1 LYS 131 -5.642 15.607 6.613 1062 1HG LYS 131 HG2 LYS 131 -4.305 13.814 7.675 1063 2HG LYS 131 HG1 LYS 131 -3.044 14.998 8.006 1064 1HD LYS 131 HD2 LYS 131 -4.777 16.344 9.238 1065 2HD LYS 131 HD1 LYS 131 -5.862 14.964 9.068 1066 1HE LYS 131 HE2 LYS 131 -4.209 13.562 10.256 1067 2HE LYS 131 HE1 LYS 131 -3.195 14.985 10.475 1068 1HZ LYS 131 HZ1 LYS 131 -5.917 14.565 11.578 1069 2HZ LYS 131 HZ2 LYS 131 -5.052 16.013 11.698 1070 3HZ LYS 131 HZ3 LYS 131 -4.467 14.615 12.448 1071 H LEU 132 HN LEU 132 -2.836 13.149 6.179 1072 HA LEU 132 HA LEU 132 -0.240 14.085 6.718 1073 1HB LEU 132 HB2 LEU 132 -1.019 12.001 7.666 1074 2HB LEU 132 HB1 LEU 132 -1.255 11.313 6.071 1075 HG LEU 132 HG LEU 132 1.228 11.485 5.723 1076 1HD1 LEU 132 HD11 LEU 132 2.652 12.214 7.312 1077 2HD1 LEU 132 HD12 LEU 132 1.647 11.631 8.638 1078 3HD1 LEU 132 HD13 LEU 132 1.246 13.144 7.826 1079 1HD2 LEU 132 HD21 LEU 132 -0.069 9.731 7.755 1080 2HD2 LEU 132 HD22 LEU 132 1.671 9.613 7.494 1081 3HD2 LEU 132 HD23 LEU 132 0.558 9.331 6.156 1082 H ALA 133 HN ALA 133 -1.693 12.569 3.887 1083 HA ALA 133 HA ALA 133 0.646 12.411 2.315 1084 1HB ALA 133 HB1 ALA 133 -1.004 11.096 1.434 1085 2HB ALA 133 HB2 ALA 133 -1.211 12.524 0.422 1086 3HB ALA 133 HB3 ALA 133 -2.280 12.256 1.799 1087 H GLY 134 HN GLY 134 -1.807 14.904 2.770 1088 1HA GLY 134 HA2 GLY 134 -0.874 16.632 0.712 1089 2HA GLY 134 HA1 GLY 134 -1.939 17.079 2.034 1090 H GLU 135 HN GLU 135 -0.410 16.681 4.244 1091 HA GLU 135 HA GLU 135 1.222 18.971 4.287 1092 1HB GLU 135 HB2 GLU 135 1.837 18.294 6.548 1093 2HB GLU 135 HB1 GLU 135 0.112 18.098 6.286 1094 1HG GLU 135 HG2 GLU 135 0.763 16.207 7.481 1095 2HG GLU 135 HG1 GLU 135 0.611 15.656 5.815 1096 H ARG 136 HN ARG 136 1.874 15.674 3.491 1097 HA ARG 136 HA ARG 136 4.675 15.669 3.904 1098 1HB ARG 136 HB2 ARG 136 3.234 13.633 3.631 1099 2HB ARG 136 HB1 ARG 136 3.096 14.024 1.925 1100 1HG ARG 136 HG2 ARG 136 5.786 13.668 3.170 1101 2HG ARG 136 HG1 ARG 136 4.824 12.268 2.701 1102 1HD ARG 136 HD2 ARG 136 4.679 13.166 0.410 1103 2HD ARG 136 HD1 ARG 136 5.704 14.517 0.891 1104 HE ARG 136 HE ARG 136 6.560 11.917 0.177 1105 1HH1 ARG 136 HH11 ARG 136 7.286 14.557 2.338 1106 2HH1 ARG 136 HH12 ARG 136 8.943 14.100 2.538 1107 1HH2 ARG 136 HH21 ARG 136 8.732 11.312 0.442 1108 2HH2 ARG 136 HH22 ARG 136 9.766 12.258 1.459 1109 H ASN 137 HN ASN 137 2.653 16.366 1.067 1110 HA ASN 137 HA ASN 137 4.663 18.096 -0.011 1111 1HB ASN 137 HB2 ASN 137 4.997 16.874 -2.125 1112 2HB ASN 137 HB1 ASN 137 5.585 15.954 -0.743 1113 1HD2 ASN 137 HD21 ASN 137 3.995 15.676 -3.562 1114 2HD2 ASN 137 HD22 ASN 137 3.048 14.267 -3.241 1115 H TYR 138 HN TYR 138 1.774 16.186 -0.820 1116 HA TYR 138 HA TYR 138 -0.112 18.082 -1.073 1117 1HB TYR 138 HB2 TYR 138 1.836 18.424 -3.220 1118 2HB TYR 138 HB1 TYR 138 0.210 18.167 -3.841 1119 HD1 TYR 138 HD1 TYR 138 -0.061 20.362 -4.736 1120 HD2 TYR 138 HD2 TYR 138 0.888 19.836 -0.622 1121 HE1 TYR 138 HE1 TYR 138 -0.599 22.723 -4.313 1122 HE2 TYR 138 HE2 TYR 138 0.356 22.197 -0.188 1123 HH TYR 138 HH TYR 138 -0.054 24.474 -2.668 1124 H THR 139 HN THR 139 -1.931 16.916 -1.259 1125 HA THR 139 HA THR 139 -1.823 14.262 -2.399 1126 HB THR 139 HB THR 139 -4.182 14.093 -1.714 1127 HG1 THR 139 HG1 THR 139 -3.860 16.803 -0.944 1128 1HG2 THR 139 HG21 THR 139 -3.420 15.264 0.754 1129 2HG2 THR 139 HG22 THR 139 -2.016 14.465 0.052 1130 3HG2 THR 139 HG23 THR 139 -3.504 13.556 0.314 1131 H ASP 140 HN ASP 140 -3.293 17.377 -3.148 1132 HA ASP 140 HA ASP 140 -4.792 16.628 -5.380 1133 1HB ASP 140 HB2 ASP 140 -3.368 19.252 -4.870 1134 2HB ASP 140 HB1 ASP 140 -4.636 19.004 -6.065 1135 H GLU 141 HN GLU 141 -1.399 17.179 -4.974 1136 HA GLU 141 HA GLU 141 -0.410 17.645 -7.471 1137 1HB GLU 141 HB2 GLU 141 1.039 17.537 -5.571 1138 2HB GLU 141 HB1 GLU 141 0.622 15.858 -5.264 1139 1HG GLU 141 HG2 GLU 141 2.814 15.956 -6.189 1140 2HG GLU 141 HG1 GLU 141 1.728 15.244 -7.376 1141 H MET 142 HN MET 142 -0.285 14.326 -6.230 1142 HA MET 142 HA MET 142 -1.618 13.289 -8.579 1143 1HB MET 142 HB2 MET 142 1.225 12.402 -8.007 1144 2HB MET 142 HB1 MET 142 0.184 11.833 -9.297 1145 1HG MET 142 HG2 MET 142 0.199 14.104 -10.262 1146 2HG MET 142 HG1 MET 142 1.346 14.586 -9.016 1147 1HE MET 142 HE1 MET 142 2.262 11.393 -12.221 1148 2HE MET 142 HE2 MET 142 0.690 12.161 -12.008 1149 3HE MET 142 HE3 MET 142 1.296 11.038 -10.790 1150 H VAL 143 HN VAL 143 -3.118 12.411 -7.253 1151 HA VAL 143 HA VAL 143 -2.268 10.674 -5.054 1152 HB VAL 143 HB VAL 143 -3.842 12.360 -4.394 1153 1HG1 VAL 143 HG11 VAL 143 -6.216 12.139 -5.599 1154 2HG1 VAL 143 HG12 VAL 143 -5.178 11.653 -6.938 1155 3HG1 VAL 143 HG13 VAL 143 -4.950 13.224 -6.167 1156 1HG2 VAL 143 HG21 VAL 143 -5.580 11.142 -3.388 1157 2HG2 VAL 143 HG22 VAL 143 -4.272 9.974 -3.568 1158 3HG2 VAL 143 HG23 VAL 143 -5.633 9.967 -4.697 1159 H ALA 144 HN ALA 144 -4.317 8.916 -4.808 1160 HA ALA 144 HA ALA 144 -5.051 7.638 -7.251 1161 1HB ALA 144 HB1 ALA 144 -3.887 5.450 -6.418 1162 2HB ALA 144 HB2 ALA 144 -2.812 6.565 -5.571 1163 3HB ALA 144 HB3 ALA 144 -2.958 6.644 -7.326 1164 H MET 145 HN MET 145 -7.130 7.129 -6.776 1165 HA MET 145 HA MET 145 -7.710 6.131 -4.059 1166 1HB MET 145 HB2 MET 145 -9.929 7.227 -4.246 1167 2HB MET 145 HB1 MET 145 -8.585 8.362 -4.224 1168 1HG MET 145 HG2 MET 145 -8.728 8.526 -6.679 1169 2HG MET 145 HG1 MET 145 -10.119 7.448 -6.647 1170 1HE MET 145 HE1 MET 145 -10.619 11.009 -7.783 1171 2HE MET 145 HE2 MET 145 -12.098 10.050 -7.703 1172 3HE MET 145 HE3 MET 145 -10.585 9.297 -8.205 1173 H LEU 146 HN LEU 146 -9.475 4.745 -3.773 1174 HA LEU 146 HA LEU 146 -9.682 2.524 -5.288 1175 1HB LEU 146 HB2 LEU 146 -10.670 2.814 -3.067 1176 2HB LEU 146 HB1 LEU 146 -11.918 3.837 -3.749 1177 HG LEU 146 HG LEU 146 -12.657 1.848 -5.118 1178 1HD1 LEU 146 HD11 LEU 146 -11.791 -0.240 -4.815 1179 2HD1 LEU 146 HD12 LEU 146 -11.244 0.103 -3.175 1180 3HD1 LEU 146 HD13 LEU 146 -10.337 0.722 -4.554 1181 1HD2 LEU 146 HD21 LEU 146 -12.894 1.043 -2.284 1182 2HD2 LEU 146 HD22 LEU 146 -14.143 1.288 -3.504 1183 3HD2 LEU 146 HD23 LEU 146 -13.420 2.676 -2.692 1184 HA PRO 147 HA PRO 147 -11.982 3.698 -8.920 1185 1HB PRO 147 HB2 PRO 147 -12.294 1.018 -9.753 1186 2HB PRO 147 HB1 PRO 147 -10.971 2.104 -10.153 1187 1HG PRO 147 HG2 PRO 147 -10.794 -0.212 -8.603 1188 2HG PRO 147 HG1 PRO 147 -9.570 1.063 -8.715 1189 1HD PRO 147 HD2 PRO 147 -11.658 0.610 -6.628 1190 2HD PRO 147 HD1 PRO 147 -9.999 1.215 -6.448 1191 H ARG 148 HN ARG 148 -13.802 1.894 -10.169 1192 HA ARG 148 HA ARG 148 -16.158 2.438 -8.584 1193 1HB ARG 148 HB2 ARG 148 -17.360 1.628 -10.667 1194 2HB ARG 148 HB1 ARG 148 -16.386 3.075 -10.844 1195 1HG ARG 148 HG2 ARG 148 -15.063 0.508 -11.470 1196 2HG ARG 148 HG1 ARG 148 -16.323 1.053 -12.577 1197 1HD ARG 148 HD2 ARG 148 -13.938 2.696 -11.718 1198 2HD ARG 148 HD1 ARG 148 -14.068 1.817 -13.240 1199 HE ARG 148 HE ARG 148 -16.277 3.522 -13.004 1200 1HH1 ARG 148 HH11 ARG 148 -12.818 3.701 -13.438 1201 2HH1 ARG 148 HH12 ARG 148 -12.878 5.199 -14.304 1202 1HH2 ARG 148 HH21 ARG 148 -16.356 5.497 -14.141 1203 2HH2 ARG 148 HH22 ARG 148 -14.885 6.219 -14.703 1204 H GLN 149 HN GLN 149 -17.040 -0.153 -10.435 1205 HA GLN 149 HA GLN 149 -17.316 -1.846 -8.161 1206 1HB GLN 149 HB2 GLN 149 -18.298 -3.459 -9.751 1207 2HB GLN 149 HB1 GLN 149 -19.015 -1.857 -9.879 1208 1HG GLN 149 HG2 GLN 149 -17.650 -1.400 -11.845 1209 2HG GLN 149 HG1 GLN 149 -16.922 -3.000 -11.714 1210 1HE2 GLN 149 HE21 GLN 149 -19.156 -1.271 -13.317 1211 2HE2 GLN 149 HE22 GLN 149 -20.238 -2.529 -13.798 1212 H GLU 150 HN GLU 150 -16.641 -4.161 -8.172 1213 HA GLU 150 HA GLU 150 -13.814 -4.324 -8.406 1214 1HB GLU 150 HB2 GLU 150 -14.098 -6.642 -7.608 1215 2HB GLU 150 HB1 GLU 150 -14.949 -5.466 -6.616 1216 1HG GLU 150 HG2 GLU 150 -17.048 -6.050 -7.714 1217 2HG GLU 150 HG1 GLU 150 -16.196 -7.228 -8.715 1218 H GLU 151 HN GLU 151 -14.460 -3.754 -10.914 1219 HA GLU 151 HA GLU 151 -14.106 -6.284 -12.377 1220 1HB GLU 151 HB2 GLU 151 -15.289 -3.681 -13.390 1221 2HB GLU 151 HB1 GLU 151 -15.040 -5.130 -14.355 1222 1HG GLU 151 HG2 GLU 151 -16.842 -4.942 -11.953 1223 2HG GLU 151 HG1 GLU 151 -17.370 -4.841 -13.631 1224 H CYS 152 HN CYS 152 -13.571 -3.599 -14.365 1225 HA CYS 152 HA CYS 152 -10.718 -4.030 -14.243 1226 1HB CYS 152 HB2 CYS 152 -12.479 -2.320 -15.999 1227 2HB CYS 152 HB1 CYS 152 -10.723 -2.232 -16.073 1228 H THR 153 HN THR 153 -9.635 -3.134 -12.662 1229 HA THR 153 HA THR 153 -10.507 -0.953 -11.109 1230 HB THR 153 HB THR 153 -8.151 -1.120 -10.165 1231 HG1 THR 153 HG1 THR 153 -7.343 -3.354 -10.916 1232 1HG2 THR 153 HG21 THR 153 -9.734 -2.272 -8.926 1233 2HG2 THR 153 HG22 THR 153 -8.555 -3.516 -9.341 1234 3HG2 THR 153 HG23 THR 153 -10.072 -3.407 -10.232 1235 H VAL 154 HN VAL 154 -9.539 1.028 -10.685 1236 HA VAL 154 HA VAL 154 -8.795 2.539 -13.006 1237 HB VAL 154 HB VAL 154 -10.269 3.468 -11.268 1238 1HG1 VAL 154 HG11 VAL 154 -8.389 2.414 -9.496 1239 2HG1 VAL 154 HG12 VAL 154 -9.806 3.383 -9.096 1240 3HG1 VAL 154 HG13 VAL 154 -8.245 4.164 -9.332 1241 1HG2 VAL 154 HG21 VAL 154 -8.615 4.867 -12.706 1242 2HG2 VAL 154 HG22 VAL 154 -7.801 5.143 -11.165 1243 3HG2 VAL 154 HG23 VAL 154 -9.481 5.631 -11.373 1244 H ASP 155 HN ASP 155 -6.905 4.056 -12.942 1245 HA ASP 155 HA ASP 155 -4.495 2.769 -12.874 1246 1HB ASP 155 HB2 ASP 155 -3.439 4.998 -12.894 1247 2HB ASP 155 HB1 ASP 155 -4.804 4.902 -14.002 1248 H GLU 156 HN GLU 156 -2.769 2.606 -11.485 1249 HA GLU 156 HA GLU 156 -2.526 3.790 -8.962 1250 1HB GLU 156 HB2 GLU 156 -4.460 2.436 -8.347 1251 2HB GLU 156 HB1 GLU 156 -3.649 0.985 -8.922 1252 1HG GLU 156 HG2 GLU 156 -1.873 1.421 -7.198 1253 2HG GLU 156 HG1 GLU 156 -2.922 2.683 -6.552 1254 H VAL 157 HN VAL 157 -0.529 3.350 -8.059 1255 HA VAL 157 HA VAL 157 1.513 2.381 -9.638 1256 HB VAL 157 HB VAL 157 2.883 2.201 -7.602 1257 1HG1 VAL 157 HG11 VAL 157 1.900 4.445 -8.719 1258 2HG1 VAL 157 HG12 VAL 157 3.080 4.432 -7.408 1259 3HG1 VAL 157 HG13 VAL 157 1.369 4.658 -7.052 1260 1HG2 VAL 157 HG21 VAL 157 1.045 3.212 -5.668 1261 2HG2 VAL 157 HG22 VAL 157 1.992 1.725 -5.625 1262 3HG2 VAL 157 HG23 VAL 157 0.387 1.726 -6.356 Start of MODEL 5 1 1H MET 1 HT1 MET 1 -26.292 -15.348 -15.606 2 2H MET 1 HT2 MET 1 -25.110 -16.114 -16.543 3 3H MET 1 HT3 MET 1 -25.095 -14.431 -16.375 4 HA MET 1 HA MET 1 -24.517 -14.557 -14.095 5 1HB MET 1 HB2 MET 1 -25.935 -16.490 -13.584 6 2HB MET 1 HB1 MET 1 -24.844 -17.541 -14.475 7 1HG MET 1 HG2 MET 1 -23.069 -17.065 -12.870 8 2HG MET 1 HG1 MET 1 -24.160 -16.007 -11.978 9 1HE MET 1 HE1 MET 1 -26.404 -16.725 -11.153 10 2HE MET 1 HE2 MET 1 -26.721 -18.290 -10.404 11 3HE MET 1 HE3 MET 1 -27.013 -18.062 -12.128 12 H THR 2 HN THR 2 -22.387 -14.293 -13.718 13 HA THR 2 HA THR 2 -20.393 -16.024 -14.855 14 HB THR 2 HB THR 2 -19.237 -14.238 -16.129 15 HG1 THR 2 HG1 THR 2 -21.549 -12.780 -15.427 16 1HG2 THR 2 HG21 THR 2 -20.588 -14.226 -18.077 17 2HG2 THR 2 HG22 THR 2 -22.048 -14.541 -17.140 18 3HG2 THR 2 HG23 THR 2 -20.809 -15.787 -17.287 19 H VAL 3 HN VAL 3 -18.637 -16.065 -13.587 20 HA VAL 3 HA VAL 3 -18.577 -14.448 -11.225 21 HB VAL 3 HB VAL 3 -16.547 -15.701 -10.642 22 1HG1 VAL 3 HG11 VAL 3 -18.627 -16.708 -10.046 23 2HG1 VAL 3 HG12 VAL 3 -17.575 -17.982 -10.661 24 3HG1 VAL 3 HG13 VAL 3 -18.859 -17.331 -11.680 25 1HG2 VAL 3 HG21 VAL 3 -15.624 -15.859 -12.931 26 2HG2 VAL 3 HG22 VAL 3 -16.868 -17.046 -13.325 27 3HG2 VAL 3 HG23 VAL 3 -15.655 -17.414 -12.098 28 HA PRO 4 HA PRO 4 -16.170 -11.013 -12.678 29 1HB PRO 4 HB2 PRO 4 -14.976 -11.097 -9.954 30 2HB PRO 4 HB1 PRO 4 -15.746 -9.753 -10.805 31 1HG PRO 4 HG2 PRO 4 -17.017 -11.017 -8.838 32 2HG PRO 4 HG1 PRO 4 -17.888 -10.482 -10.287 33 1HD PRO 4 HD2 PRO 4 -16.975 -13.225 -9.527 34 2HD PRO 4 HD1 PRO 4 -18.469 -12.716 -10.340 35 H ASP 5 HN ASP 5 -14.166 -10.677 -13.531 36 HA ASP 5 HA ASP 5 -12.419 -12.804 -13.936 37 1HB ASP 5 HB2 ASP 5 -12.477 -10.882 -15.425 38 2HB ASP 5 HB1 ASP 5 -11.909 -9.828 -14.135 39 H ARG 6 HN ARG 6 -11.262 -13.833 -12.428 40 HA ARG 6 HA ARG 6 -10.528 -12.677 -9.948 41 1HB ARG 6 HB2 ARG 6 -9.230 -14.743 -9.591 42 2HB ARG 6 HB1 ARG 6 -10.870 -15.070 -10.136 43 1HG ARG 6 HG2 ARG 6 -10.019 -15.429 -12.414 44 2HG ARG 6 HG1 ARG 6 -8.378 -15.156 -11.824 45 1HD ARG 6 HD2 ARG 6 -8.864 -17.542 -11.991 46 2HD ARG 6 HD1 ARG 6 -8.593 -17.064 -10.316 47 HE ARG 6 HE ARG 6 -10.700 -17.784 -9.853 48 1HH1 ARG 6 HH11 ARG 6 -10.528 -17.089 -13.270 49 2HH1 ARG 6 HH12 ARG 6 -12.165 -17.564 -13.575 50 1HH2 ARG 6 HH21 ARG 6 -12.852 -18.411 -10.255 51 2HH2 ARG 6 HH22 ARG 6 -13.484 -18.314 -11.865 52 H SER 7 HN SER 7 -8.839 -13.124 -12.995 53 HA SER 7 HA SER 7 -6.225 -12.682 -12.266 54 1HB SER 7 HB2 SER 7 -6.913 -13.220 -14.571 55 2HB SER 7 HB1 SER 7 -7.605 -11.607 -14.739 56 HG SER 7 HG SER 7 -5.576 -10.728 -14.608 57 H GLU 8 HN GLU 8 -8.839 -10.347 -12.563 58 HA GLU 8 HA GLU 8 -7.604 -7.938 -12.703 59 1HB GLU 8 HB2 GLU 8 -9.435 -6.988 -11.452 60 2HB GLU 8 HB1 GLU 8 -10.056 -8.297 -12.448 61 1HG GLU 8 HG2 GLU 8 -9.845 -9.768 -10.397 62 2HG GLU 8 HG1 GLU 8 -9.571 -8.285 -9.491 63 H ILE 9 HN ILE 9 -7.846 -9.976 -9.838 64 HA ILE 9 HA ILE 9 -6.207 -8.116 -8.308 65 HB ILE 9 HB ILE 9 -7.699 -10.618 -7.530 66 1HG1 ILE 9 HG12 ILE 9 -9.067 -8.623 -7.783 67 2HG1 ILE 9 HG11 ILE 9 -8.938 -9.043 -6.079 68 1HG2 ILE 9 HG21 ILE 9 -5.928 -8.933 -5.767 69 2HG2 ILE 9 HG22 ILE 9 -5.607 -10.590 -6.277 70 3HG2 ILE 9 HG23 ILE 9 -6.978 -10.240 -5.226 71 1HD1 ILE 9 HD11 ILE 9 -7.467 -6.850 -7.520 72 2HD1 ILE 9 HD12 ILE 9 -7.171 -7.323 -5.847 73 3HD1 ILE 9 HD13 ILE 9 -8.743 -6.677 -6.316 74 H ALA 10 HN ALA 10 -6.036 -11.314 -9.766 75 HA ALA 10 HA ALA 10 -3.608 -12.115 -8.540 76 1HB ALA 10 HB1 ALA 10 -4.078 -14.040 -9.542 77 2HB ALA 10 HB2 ALA 10 -3.960 -13.301 -11.139 78 3HB ALA 10 HB3 ALA 10 -5.488 -13.263 -10.259 79 H GLY 11 HN GLY 11 -1.535 -11.557 -8.949 80 1HA GLY 11 HA2 GLY 11 -0.126 -11.319 -11.165 81 2HA GLY 11 HA1 GLY 11 -1.039 -9.825 -11.268 82 H LYS 12 HN LYS 12 0.812 -8.560 -11.190 83 HA LYS 12 HA LYS 12 2.249 -8.554 -8.617 84 1HB LYS 12 HB2 LYS 12 4.089 -7.415 -9.858 85 2HB LYS 12 HB1 LYS 12 3.763 -9.050 -10.414 86 1HG LYS 12 HG2 LYS 12 2.589 -8.221 -12.337 87 2HG LYS 12 HG1 LYS 12 2.720 -6.564 -11.750 88 1HD LYS 12 HD2 LYS 12 4.369 -6.942 -13.475 89 2HD LYS 12 HD1 LYS 12 5.181 -6.734 -11.923 90 1HE LYS 12 HE2 LYS 12 4.528 -9.431 -13.090 91 2HE LYS 12 HE1 LYS 12 6.048 -8.595 -13.399 92 1HZ LYS 12 HZ1 LYS 12 6.779 -9.558 -11.554 93 2HZ LYS 12 HZ2 LYS 12 5.236 -10.081 -11.105 94 3HZ LYS 12 HZ3 LYS 12 5.760 -8.531 -10.677 95 H TRP 13 HN TRP 13 2.040 -6.827 -7.352 96 HA TRP 13 HA TRP 13 0.691 -4.451 -8.434 97 1HB TRP 13 HB2 TRP 13 0.929 -5.473 -5.594 98 2HB TRP 13 HB1 TRP 13 0.106 -3.988 -6.057 99 HD1 TRP 13 HD1 TRP 13 -0.402 -6.993 -8.318 100 HE1 TRP 13 HE1 TRP 13 -2.800 -7.857 -8.055 101 HE3 TRP 13 HE3 TRP 13 -1.827 -4.215 -4.267 102 HZ2 TRP 13 HZ2 TRP 13 -5.001 -7.435 -6.367 103 HZ3 TRP 13 HZ3 TRP 13 -4.110 -4.518 -3.389 104 HH2 TRP 13 HH2 TRP 13 -5.661 -6.095 -4.419 105 H TYR 14 HN TYR 14 1.755 -2.555 -8.561 106 HA TYR 14 HA TYR 14 4.414 -2.389 -7.325 107 1HB TYR 14 HB2 TYR 14 3.172 -0.797 -9.572 108 2HB TYR 14 HB1 TYR 14 4.752 -0.452 -8.881 109 HD1 TYR 14 HD1 TYR 14 6.478 -1.111 -10.231 110 HD2 TYR 14 HD2 TYR 14 2.990 -3.541 -10.064 111 HE1 TYR 14 HE1 TYR 14 7.518 -2.700 -11.790 112 HE2 TYR 14 HE2 TYR 14 4.023 -5.136 -11.620 113 HH TYR 14 HH TYR 14 6.894 -5.573 -12.178 114 H VAL 15 HN VAL 15 4.882 -0.941 -5.769 115 HA VAL 15 HA VAL 15 2.819 1.054 -5.134 116 HB VAL 15 HB VAL 15 2.526 -0.191 -3.277 117 1HG1 VAL 15 HG11 VAL 15 4.642 -1.382 -2.217 118 2HG1 VAL 15 HG12 VAL 15 5.219 -1.261 -3.878 119 3HG1 VAL 15 HG13 VAL 15 3.710 -2.104 -3.526 120 1HG2 VAL 15 HG21 VAL 15 3.479 1.967 -2.513 121 2HG2 VAL 15 HG22 VAL 15 5.062 1.201 -2.413 122 3HG2 VAL 15 HG23 VAL 15 3.749 0.651 -1.372 123 H VAL 16 HN VAL 16 3.388 3.062 -4.976 124 HA VAL 16 HA VAL 16 6.165 3.817 -4.512 125 HB VAL 16 HB VAL 16 6.191 5.362 -6.413 126 1HG1 VAL 16 HG11 VAL 16 5.447 2.746 -7.629 127 2HG1 VAL 16 HG12 VAL 16 6.805 2.804 -6.508 128 3HG1 VAL 16 HG13 VAL 16 6.823 3.795 -7.967 129 1HG2 VAL 16 HG21 VAL 16 3.766 5.733 -6.583 130 2HG2 VAL 16 HG22 VAL 16 3.568 4.090 -7.192 131 3HG2 VAL 16 HG23 VAL 16 4.473 5.276 -8.132 132 H ALA 17 HN ALA 17 2.803 4.922 -4.933 133 HA ALA 17 HA ALA 17 3.364 7.413 -3.534 134 1HB ALA 17 HB1 ALA 17 0.557 6.806 -4.036 135 2HB ALA 17 HB2 ALA 17 1.562 6.720 -5.482 136 3HB ALA 17 HB3 ALA 17 1.521 8.200 -4.523 137 H LEU 18 HN LEU 18 2.628 7.962 -1.473 138 HA LEU 18 HA LEU 18 0.967 6.128 0.027 139 1HB LEU 18 HB2 LEU 18 3.830 6.607 0.849 140 2HB LEU 18 HB1 LEU 18 2.622 5.826 1.846 141 HG LEU 18 HG LEU 18 2.444 4.148 -0.140 142 1HD1 LEU 18 HD11 LEU 18 4.502 5.863 -1.065 143 2HD1 LEU 18 HD12 LEU 18 3.853 4.410 -1.827 144 3HD1 LEU 18 HD13 LEU 18 5.216 4.288 -0.716 145 1HD2 LEU 18 HD21 LEU 18 4.477 2.931 0.844 146 2HD2 LEU 18 HD22 LEU 18 3.149 3.340 1.930 147 3HD2 LEU 18 HD23 LEU 18 4.613 4.323 1.918 148 H ALA 19 HN ALA 19 1.265 6.848 2.522 149 HA ALA 19 HA ALA 19 1.682 9.562 3.134 150 1HB ALA 19 HB1 ALA 19 -0.166 10.558 2.383 151 2HB ALA 19 HB2 ALA 19 -1.119 9.544 3.465 152 3HB ALA 19 HB3 ALA 19 -0.801 9.014 1.815 153 H SER 20 HN SER 20 2.228 9.359 5.301 154 HA SER 20 HA SER 20 0.381 7.853 6.983 155 1HB SER 20 HB2 SER 20 1.788 6.079 6.269 156 2HB SER 20 HB1 SER 20 3.243 7.019 6.563 157 HG SER 20 HG SER 20 1.516 5.778 8.397 158 H ASN 21 HN ASN 21 0.736 7.919 9.202 159 HA ASN 21 HA ASN 21 2.625 9.841 10.284 160 1HB ASN 21 HB2 ASN 21 -0.361 10.136 10.433 161 2HB ASN 21 HB1 ASN 21 0.634 10.687 11.770 162 1HD2 ASN 21 HD21 ASN 21 2.597 11.186 9.226 163 2HD2 ASN 21 HD22 ASN 21 2.122 12.782 8.784 164 H THR 22 HN THR 22 3.413 9.176 12.185 165 HA THR 22 HA THR 22 2.184 7.799 14.229 166 HB THR 22 HB THR 22 1.763 5.969 12.689 167 HG1 THR 22 HG1 THR 22 3.939 5.251 14.346 168 1HG2 THR 22 HG21 THR 22 4.714 5.621 12.298 169 2HG2 THR 22 HG22 THR 22 3.705 6.503 11.152 170 3HG2 THR 22 HG23 THR 22 3.390 4.800 11.474 171 H GLU 23 HN GLU 23 5.134 7.711 12.278 172 HA GLU 23 HA GLU 23 6.777 8.935 14.170 173 1HB GLU 23 HB2 GLU 23 6.418 6.835 15.445 174 2HB GLU 23 HB1 GLU 23 7.087 5.926 14.097 175 1HG GLU 23 HG2 GLU 23 8.755 6.187 15.804 176 2HG GLU 23 HG1 GLU 23 9.216 7.117 14.380 177 H PHE 24 HN PHE 24 8.529 9.658 13.102 178 HA PHE 24 HA PHE 24 8.915 8.796 10.374 179 1HB PHE 24 HB2 PHE 24 10.219 10.959 12.025 180 2HB PHE 24 HB1 PHE 24 10.641 10.631 10.349 181 HD1 PHE 24 HD1 PHE 24 7.417 10.976 12.229 182 HD2 PHE 24 HD2 PHE 24 9.807 12.198 8.926 183 HE1 PHE 24 HE1 PHE 24 5.606 12.455 11.471 184 HE2 PHE 24 HE2 PHE 24 8.001 13.682 8.165 185 HZ PHE 24 HZ PHE 24 5.897 13.813 9.437 186 H PHE 25 HN PHE 25 10.983 9.011 13.266 187 HA PHE 25 HA PHE 25 13.320 8.002 12.250 188 1HB PHE 25 HB2 PHE 25 13.088 8.903 14.517 189 2HB PHE 25 HB1 PHE 25 12.169 7.481 14.996 190 HD1 PHE 25 HD1 PHE 25 15.257 7.707 12.941 191 HD2 PHE 25 HD2 PHE 25 13.482 6.441 16.595 192 HE1 PHE 25 HE1 PHE 25 17.351 6.572 13.560 193 HE2 PHE 25 HE2 PHE 25 15.572 5.305 17.221 194 HZ PHE 25 HZ PHE 25 17.510 5.369 15.703 195 H LEU 26 HN LEU 26 10.623 6.101 13.584 196 HA LEU 26 HA LEU 26 11.853 3.590 13.311 197 1HB LEU 26 HB2 LEU 26 9.904 3.970 14.727 198 2HB LEU 26 HB1 LEU 26 8.923 4.301 13.312 199 HG LEU 26 HG LEU 26 9.212 1.987 12.555 200 1HD1 LEU 26 HD11 LEU 26 10.313 0.337 13.899 201 2HD1 LEU 26 HD12 LEU 26 10.651 1.523 15.160 202 3HD1 LEU 26 HD13 LEU 26 11.446 1.654 13.591 203 1HD2 LEU 26 HD21 LEU 26 8.018 0.893 14.526 204 2HD2 LEU 26 HD22 LEU 26 7.263 2.319 13.816 205 3HD2 LEU 26 HD23 LEU 26 8.161 2.457 15.328 206 H ARG 27 HN ARG 27 9.553 5.258 11.170 207 HA ARG 27 HA ARG 27 9.400 3.243 9.232 208 1HB ARG 27 HB2 ARG 27 9.021 6.224 8.933 209 2HB ARG 27 HB1 ARG 27 8.554 5.027 7.733 210 1HG ARG 27 HG2 ARG 27 6.982 4.040 9.303 211 2HG ARG 27 HG1 ARG 27 7.469 5.203 10.537 212 1HD ARG 27 HD2 ARG 27 6.170 5.842 7.890 213 2HD ARG 27 HD1 ARG 27 5.390 5.889 9.471 214 HE ARG 27 HE ARG 27 7.613 7.567 9.568 215 1HH1 ARG 27 HH11 ARG 27 4.538 7.381 7.936 216 2HH1 ARG 27 HH12 ARG 27 4.381 9.096 7.763 217 1HH2 ARG 27 HH21 ARG 27 7.410 9.827 9.344 218 2HH2 ARG 27 HH22 ARG 27 6.011 10.486 8.564 219 H GLU 28 HN GLU 28 11.610 6.000 9.509 220 HA GLU 28 HA GLU 28 12.796 5.875 7.012 221 1HB GLU 28 HB2 GLU 28 13.964 6.647 9.681 222 2HB GLU 28 HB1 GLU 28 14.840 6.827 8.167 223 1HG GLU 28 HG2 GLU 28 12.234 8.151 8.883 224 2HG GLU 28 HG1 GLU 28 13.820 8.918 8.829 225 H LYS 29 HN LYS 29 13.970 4.254 9.982 226 HA LYS 29 HA LYS 29 15.916 2.771 8.464 227 1HB LYS 29 HB2 LYS 29 16.534 1.752 10.595 228 2HB LYS 29 HB1 LYS 29 16.446 3.501 10.729 229 1HG LYS 29 HG2 LYS 29 14.274 3.322 11.815 230 2HG LYS 29 HG1 LYS 29 14.329 1.565 11.650 231 1HD LYS 29 HD2 LYS 29 16.379 1.528 13.024 232 2HD LYS 29 HD1 LYS 29 16.253 3.275 13.229 233 1HE LYS 29 HE2 LYS 29 14.171 1.274 14.103 234 2HE LYS 29 HE1 LYS 29 15.380 1.999 15.160 235 1HZ LYS 29 HZ1 LYS 29 12.935 2.990 14.804 236 2HZ LYS 29 HZ2 LYS 29 13.778 3.870 13.631 237 3HZ LYS 29 HZ3 LYS 29 14.269 3.931 15.248 238 H ASP 30 HN ASP 30 12.774 2.095 9.897 239 HA ASP 30 HA ASP 30 12.923 -0.722 9.594 240 1HB ASP 30 HB2 ASP 30 11.401 0.347 11.186 241 2HB ASP 30 HB1 ASP 30 10.492 1.053 9.853 242 H LYS 31 HN LYS 31 10.917 1.622 7.754 243 HA LYS 31 HA LYS 31 11.169 -0.187 5.443 244 1HB LYS 31 HB2 LYS 31 8.831 0.210 4.890 245 2HB LYS 31 HB1 LYS 31 8.968 -0.447 6.512 246 1HG LYS 31 HG2 LYS 31 8.752 1.862 7.406 247 2HG LYS 31 HG1 LYS 31 8.453 2.422 5.761 248 1HD LYS 31 HD2 LYS 31 6.785 0.410 7.272 249 2HD LYS 31 HD1 LYS 31 6.366 2.102 7.002 250 1HE LYS 31 HE2 LYS 31 5.163 0.908 5.378 251 2HE LYS 31 HE1 LYS 31 6.544 1.587 4.518 252 1HZ LYS 31 HZ1 LYS 31 5.776 -1.049 4.582 253 2HZ LYS 31 HZ2 LYS 31 7.150 -0.986 5.566 254 3HZ LYS 31 HZ3 LYS 31 7.229 -0.435 3.969 255 H MET 32 HN MET 32 9.265 1.775 4.041 256 HA MET 32 HA MET 32 9.362 3.602 2.719 257 1HB MET 32 HB2 MET 32 11.432 4.470 4.729 258 2HB MET 32 HB1 MET 32 10.940 5.469 3.369 259 1HG MET 32 HG2 MET 32 8.623 5.397 4.186 260 2HG MET 32 HG1 MET 32 9.164 4.463 5.579 261 1HE MET 32 HE1 MET 32 8.382 7.473 7.467 262 2HE MET 32 HE2 MET 32 7.619 6.250 6.452 263 3HE MET 32 HE3 MET 32 7.763 7.910 5.875 264 H LYS 33 HN LYS 33 10.027 2.267 1.035 265 HA LYS 33 HA LYS 33 12.499 3.041 -0.207 266 1HB LYS 33 HB2 LYS 33 12.086 0.118 0.471 267 2HB LYS 33 HB1 LYS 33 13.403 0.780 -0.483 268 1HG LYS 33 HG2 LYS 33 14.235 1.968 1.478 269 2HG LYS 33 HG1 LYS 33 12.905 1.314 2.438 270 1HD LYS 33 HD2 LYS 33 15.033 -0.307 1.043 271 2HD LYS 33 HD1 LYS 33 14.970 0.038 2.773 272 1HE LYS 33 HE2 LYS 33 12.840 -1.151 2.932 273 2HE LYS 33 HE1 LYS 33 12.890 -1.480 1.201 274 1HZ LYS 33 HZ1 LYS 33 14.806 -2.840 1.490 275 2HZ LYS 33 HZ2 LYS 33 13.647 -3.351 2.610 276 3HZ LYS 33 HZ3 LYS 33 14.955 -2.407 3.119 277 H MET 34 HN MET 34 12.672 1.520 -2.373 278 HA MET 34 HA MET 34 10.265 1.991 -3.787 279 1HB MET 34 HB2 MET 34 12.472 1.863 -4.905 280 2HB MET 34 HB1 MET 34 12.539 0.144 -4.537 281 1HG MET 34 HG2 MET 34 10.731 -0.329 -5.991 282 2HG MET 34 HG1 MET 34 10.348 1.381 -6.178 283 1HE MET 34 HE1 MET 34 13.061 -1.470 -7.275 284 2HE MET 34 HE2 MET 34 13.710 -0.394 -6.037 285 3HE MET 34 HE3 MET 34 14.339 -0.325 -7.683 286 H ALA 35 HN ALA 35 8.519 0.516 -4.325 287 HA ALA 35 HA ALA 35 8.810 -2.088 -2.979 288 1HB ALA 35 HB1 ALA 35 6.485 -0.209 -2.706 289 2HB ALA 35 HB2 ALA 35 7.630 -0.688 -1.454 290 3HB ALA 35 HB3 ALA 35 6.509 -1.873 -2.122 291 H MET 36 HN MET 36 8.011 -3.795 -3.875 292 HA MET 36 HA MET 36 6.292 -3.588 -6.256 293 1HB MET 36 HB2 MET 36 8.558 -5.558 -5.819 294 2HB MET 36 HB1 MET 36 7.484 -5.521 -7.211 295 1HG MET 36 HG2 MET 36 8.362 -3.343 -7.846 296 2HG MET 36 HG1 MET 36 9.420 -3.352 -6.436 297 1HE MET 36 HE1 MET 36 8.682 -6.604 -8.654 298 2HE MET 36 HE2 MET 36 9.779 -6.258 -9.992 299 3HE MET 36 HE3 MET 36 8.415 -5.188 -9.671 300 H ALA 37 HN ALA 37 4.968 -5.658 -6.535 301 HA ALA 37 HA ALA 37 4.821 -7.288 -4.137 302 1HB ALA 37 HB1 ALA 37 3.089 -5.048 -4.539 303 2HB ALA 37 HB2 ALA 37 3.220 -6.129 -3.154 304 3HB ALA 37 HB3 ALA 37 2.153 -6.541 -4.495 305 H ARG 38 HN ARG 38 3.544 -9.137 -4.278 306 HA ARG 38 HA ARG 38 2.457 -9.830 -6.912 307 1HB ARG 38 HB2 ARG 38 4.707 -10.771 -6.855 308 2HB ARG 38 HB1 ARG 38 4.386 -11.518 -5.297 309 1HG ARG 38 HG2 ARG 38 2.664 -12.922 -6.354 310 2HG ARG 38 HG1 ARG 38 3.062 -12.199 -7.914 311 1HD ARG 38 HD2 ARG 38 4.174 -14.341 -7.670 312 2HD ARG 38 HD1 ARG 38 5.360 -13.036 -7.703 313 HE ARG 38 HE ARG 38 4.725 -13.575 -5.034 314 1HH1 ARG 38 HH11 ARG 38 6.309 -15.114 -7.736 315 2HH1 ARG 38 HH12 ARG 38 7.364 -16.059 -6.741 316 1HH2 ARG 38 HH21 ARG 38 6.112 -14.820 -3.723 317 2HH2 ARG 38 HH22 ARG 38 7.252 -15.893 -4.463 318 H ILE 39 HN ILE 39 0.362 -10.264 -6.537 319 HA ILE 39 HA ILE 39 -0.379 -11.418 -3.945 320 HB ILE 39 HB ILE 39 -1.424 -9.293 -4.378 321 1HG1 ILE 39 HG12 ILE 39 -3.436 -11.529 -4.694 322 2HG1 ILE 39 HG11 ILE 39 -2.721 -11.020 -3.167 323 1HG2 ILE 39 HG21 ILE 39 -3.033 -9.045 -6.247 324 2HG2 ILE 39 HG22 ILE 39 -2.453 -10.580 -6.893 325 3HG2 ILE 39 HG23 ILE 39 -1.354 -9.206 -6.762 326 1HD1 ILE 39 HD11 ILE 39 -3.908 -9.041 -3.126 327 2HD1 ILE 39 HD12 ILE 39 -5.069 -10.174 -3.818 328 3HD1 ILE 39 HD13 ILE 39 -4.195 -9.058 -4.867 329 H SER 40 HN SER 40 -1.710 -13.112 -3.700 330 HA SER 40 HA SER 40 -2.896 -14.509 -5.921 331 1HB SER 40 HB2 SER 40 -0.581 -15.340 -6.031 332 2HB SER 40 HB1 SER 40 -0.665 -15.811 -4.334 333 HG SER 40 HG SER 40 -1.767 -17.531 -4.867 334 H PHE 41 HN PHE 41 -4.671 -15.633 -5.256 335 HA PHE 41 HA PHE 41 -5.541 -15.310 -2.566 336 1HB PHE 41 HB2 PHE 41 -7.558 -16.522 -3.290 337 2HB PHE 41 HB1 PHE 41 -7.128 -15.222 -4.393 338 HD1 PHE 41 HD1 PHE 41 -7.017 -15.639 -6.652 339 HD2 PHE 41 HD2 PHE 41 -6.712 -18.899 -3.934 340 HE1 PHE 41 HE1 PHE 41 -7.093 -17.212 -8.538 341 HE2 PHE 41 HE2 PHE 41 -6.782 -20.481 -5.819 342 HZ PHE 41 HZ PHE 41 -6.972 -19.637 -8.125 343 H LEU 42 HN LEU 42 -5.614 -16.684 -0.872 344 HA LEU 42 HA LEU 42 -4.365 -19.320 -1.249 345 1HB LEU 42 HB2 LEU 42 -3.220 -17.772 0.308 346 2HB LEU 42 HB1 LEU 42 -4.665 -17.727 1.297 347 HG LEU 42 HG LEU 42 -4.426 -20.121 1.784 348 1HD1 LEU 42 HD11 LEU 42 -2.093 -21.071 1.168 349 2HD1 LEU 42 HD12 LEU 42 -2.133 -19.864 -0.118 350 3HD1 LEU 42 HD13 LEU 42 -3.385 -21.104 -0.033 351 1HD2 LEU 42 HD21 LEU 42 -2.141 -19.896 2.978 352 2HD2 LEU 42 HD22 LEU 42 -3.452 -18.805 3.429 353 3HD2 LEU 42 HD23 LEU 42 -2.167 -18.245 2.359 354 H GLY 43 HN GLY 43 -5.421 -21.136 -0.775 355 1HA GLY 43 HA2 GLY 43 -8.235 -21.141 -0.532 356 2HA GLY 43 HA1 GLY 43 -7.189 -22.543 -0.398 357 H GLU 44 HN GLU 44 -7.910 -19.631 1.517 358 HA GLU 44 HA GLU 44 -8.838 -21.206 3.733 359 1HB GLU 44 HB2 GLU 44 -6.293 -19.588 4.028 360 2HB GLU 44 HB1 GLU 44 -7.175 -20.344 5.347 361 1HG GLU 44 HG2 GLU 44 -6.739 -22.546 4.349 362 2HG GLU 44 HG1 GLU 44 -5.807 -21.765 3.074 363 H ASP 45 HN ASP 45 -9.998 -19.290 2.070 364 HA ASP 45 HA ASP 45 -11.201 -17.356 2.097 365 1HB ASP 45 HB2 ASP 45 -10.930 -17.661 5.102 366 2HB ASP 45 HB1 ASP 45 -12.083 -16.618 4.277 367 H GLU 46 HN GLU 46 -8.407 -17.057 1.720 368 HA GLU 46 HA GLU 46 -8.161 -14.310 2.465 369 1HB GLU 46 HB2 GLU 46 -6.073 -14.575 3.794 370 2HB GLU 46 HB1 GLU 46 -7.511 -15.204 4.588 371 1HG GLU 46 HG2 GLU 46 -6.884 -17.473 3.881 372 2HG GLU 46 HG1 GLU 46 -5.418 -16.823 3.153 373 H LEU 47 HN LEU 47 -7.002 -13.239 1.045 374 HA LEU 47 HA LEU 47 -5.231 -14.751 -0.749 375 1HB LEU 47 HB2 LEU 47 -5.595 -13.074 -2.432 376 2HB LEU 47 HB1 LEU 47 -7.147 -13.645 -1.857 377 HG LEU 47 HG LEU 47 -5.868 -11.051 -0.987 378 1HD1 LEU 47 HD11 LEU 47 -8.237 -11.252 -2.795 379 2HD1 LEU 47 HD12 LEU 47 -6.609 -11.368 -3.462 380 3HD1 LEU 47 HD13 LEU 47 -7.098 -9.921 -2.581 381 1HD2 LEU 47 HD21 LEU 47 -8.524 -10.802 -0.556 382 2HD2 LEU 47 HD22 LEU 47 -7.370 -11.323 0.671 383 3HD2 LEU 47 HD23 LEU 47 -8.302 -12.521 -0.228 384 H LYS 48 HN LYS 48 -3.105 -14.103 -1.009 385 HA LYS 48 HA LYS 48 -2.271 -11.906 0.761 386 1HB LYS 48 HB2 LYS 48 -0.275 -13.109 1.298 387 2HB LYS 48 HB1 LYS 48 -1.643 -14.182 1.533 388 1HG LYS 48 HG2 LYS 48 -0.142 -15.563 0.494 389 2HG LYS 48 HG1 LYS 48 -1.089 -14.985 -0.876 390 1HD LYS 48 HD2 LYS 48 0.619 -13.352 -1.410 391 2HD LYS 48 HD1 LYS 48 1.534 -13.799 0.027 392 1HE LYS 48 HE2 LYS 48 1.853 -16.044 -0.878 393 2HE LYS 48 HE1 LYS 48 0.930 -15.599 -2.313 394 1HZ LYS 48 HZ1 LYS 48 3.395 -14.183 -1.478 395 2HZ LYS 48 HZ2 LYS 48 2.591 -14.073 -2.962 396 3HZ LYS 48 HZ3 LYS 48 3.406 -15.496 -2.545 397 H VAL 49 HN VAL 49 -0.520 -10.603 0.201 398 HA VAL 49 HA VAL 49 0.437 -10.752 -2.572 399 HB VAL 49 HB VAL 49 -1.383 -9.035 -2.404 400 1HG1 VAL 49 HG11 VAL 49 0.428 -7.228 -0.924 401 2HG1 VAL 49 HG12 VAL 49 -0.462 -8.429 0.007 402 3HG1 VAL 49 HG13 VAL 49 -1.332 -7.260 -0.986 403 1HG2 VAL 49 HG21 VAL 49 1.251 -7.682 -2.911 404 2HG2 VAL 49 HG22 VAL 49 -0.296 -7.426 -3.714 405 3HG2 VAL 49 HG23 VAL 49 0.605 -8.914 -3.996 406 H SER 50 HN SER 50 2.598 -10.948 -2.494 407 HA SER 50 HA SER 50 4.015 -10.134 -0.095 408 1HB SER 50 HB2 SER 50 4.471 -12.337 -1.110 409 2HB SER 50 HB1 SER 50 5.043 -11.536 -2.573 410 HG SER 50 HG SER 50 6.172 -11.371 0.027 411 H TYR 51 HN TYR 51 4.717 -8.115 0.088 412 HA TYR 51 HA TYR 51 5.373 -6.586 -2.301 413 1HB TYR 51 HB2 TYR 51 5.589 -5.589 0.532 414 2HB TYR 51 HB1 TYR 51 5.402 -4.647 -0.939 415 HD1 TYR 51 HD1 TYR 51 3.290 -3.910 -1.588 416 HD2 TYR 51 HD2 TYR 51 3.607 -7.077 1.235 417 HE1 TYR 51 HE1 TYR 51 0.872 -3.765 -1.164 418 HE2 TYR 51 HE2 TYR 51 1.192 -6.947 1.656 419 HH TYR 51 HH TYR 51 -0.940 -5.198 -0.314 420 H ALA 52 HN ALA 52 7.424 -6.564 -3.054 421 HA ALA 52 HA ALA 52 9.599 -7.118 -1.143 422 1HB ALA 52 HB1 ALA 52 9.476 -8.676 -3.031 423 2HB ALA 52 HB2 ALA 52 10.962 -7.728 -3.078 424 3HB ALA 52 HB3 ALA 52 9.624 -7.329 -4.156 425 H VAL 53 HN VAL 53 10.278 -5.199 -0.338 426 HA VAL 53 HA VAL 53 10.455 -2.917 -2.140 427 HB VAL 53 HB VAL 53 10.834 -1.562 -0.108 428 1HG1 VAL 53 HG11 VAL 53 8.415 -3.015 0.661 429 2HG1 VAL 53 HG12 VAL 53 8.499 -2.619 -1.056 430 3HG1 VAL 53 HG13 VAL 53 8.622 -1.339 0.152 431 1HG2 VAL 53 HG21 VAL 53 10.402 -2.630 2.097 432 2HG2 VAL 53 HG22 VAL 53 11.896 -3.167 1.335 433 3HG2 VAL 53 HG23 VAL 53 10.471 -4.201 1.306 434 HA PRO 54 HA PRO 54 14.947 -3.454 -2.017 435 1HB PRO 54 HB2 PRO 54 15.338 -3.086 -4.638 436 2HB PRO 54 HB1 PRO 54 14.629 -4.584 -4.025 437 1HG PRO 54 HG2 PRO 54 13.362 -2.420 -5.548 438 2HG PRO 54 HG1 PRO 54 12.804 -4.078 -5.284 439 1HD PRO 54 HD2 PRO 54 12.065 -1.634 -3.859 440 2HD PRO 54 HD1 PRO 54 11.300 -3.235 -3.805 441 H LYS 55 HN LYS 55 16.731 -1.991 -2.412 442 HA LYS 55 HA LYS 55 16.647 0.484 -3.630 443 1HB LYS 55 HB2 LYS 55 14.946 1.081 -1.938 444 2HB LYS 55 HB1 LYS 55 16.107 0.735 -0.667 445 1HG LYS 55 HG2 LYS 55 15.946 3.125 -1.069 446 2HG LYS 55 HG1 LYS 55 17.551 2.528 -1.495 447 1HD LYS 55 HD2 LYS 55 16.900 2.466 -3.855 448 2HD LYS 55 HD1 LYS 55 15.297 3.066 -3.429 449 1HE LYS 55 HE2 LYS 55 16.726 4.859 -4.272 450 2HE LYS 55 HE1 LYS 55 16.280 5.131 -2.591 451 1HZ LYS 55 HZ1 LYS 55 18.680 3.680 -2.658 452 2HZ LYS 55 HZ2 LYS 55 18.416 5.245 -2.076 453 3HZ LYS 55 HZ3 LYS 55 18.840 5.007 -3.695 454 HA PRO 56 HA PRO 56 20.878 -0.713 -2.493 455 1HB PRO 56 HB2 PRO 56 21.607 1.138 -4.650 456 2HB PRO 56 HB1 PRO 56 21.936 -0.590 -4.496 457 1HG PRO 56 HG2 PRO 56 20.177 0.370 -6.290 458 2HG PRO 56 HG1 PRO 56 19.944 -1.193 -5.485 459 1HD PRO 56 HD2 PRO 56 18.669 1.454 -4.888 460 2HD PRO 56 HD1 PRO 56 17.936 -0.164 -4.938 461 H ASN 57 HN ASN 57 22.656 0.345 -1.577 462 HA ASN 57 HA ASN 57 23.748 1.920 -0.353 463 1HB ASN 57 HB2 ASN 57 23.827 3.169 -2.467 464 2HB ASN 57 HB1 ASN 57 22.245 3.862 -2.123 465 1HD2 ASN 57 HD21 ASN 57 22.339 5.857 -1.421 466 2HD2 ASN 57 HD22 ASN 57 23.593 6.546 -0.454 467 H GLY 58 HN GLY 58 23.368 2.447 1.691 468 1HA GLY 58 HA2 GLY 58 22.294 3.160 3.593 469 2HA GLY 58 HA1 GLY 58 21.239 4.105 2.552 470 H CYS 59 HN CYS 59 19.665 2.608 1.248 471 HA CYS 59 HA CYS 59 18.069 1.256 3.195 472 1HB CYS 59 HB2 CYS 59 17.750 1.600 0.206 473 2HB CYS 59 HB1 CYS 59 16.544 0.859 1.250 474 H ARG 60 HN ARG 60 17.239 -0.747 0.920 475 HA ARG 60 HA ARG 60 19.303 -2.497 0.377 476 1HB ARG 60 HB2 ARG 60 19.508 -2.613 2.867 477 2HB ARG 60 HB1 ARG 60 17.890 -3.287 2.933 478 1HG ARG 60 HG2 ARG 60 18.645 -5.203 1.605 479 2HG ARG 60 HG1 ARG 60 20.270 -4.519 1.563 480 1HD ARG 60 HD2 ARG 60 20.370 -4.631 4.013 481 2HD ARG 60 HD1 ARG 60 18.758 -5.346 4.039 482 HE ARG 60 HE ARG 60 21.191 -6.704 3.579 483 1HH1 ARG 60 HH11 ARG 60 17.855 -6.633 2.554 484 2HH1 ARG 60 HH12 ARG 60 17.855 -8.280 2.020 485 1HH2 ARG 60 HH21 ARG 60 21.190 -8.869 2.881 486 2HH2 ARG 60 HH22 ARG 60 19.746 -9.551 2.209 487 H LYS 61 HN LYS 61 16.905 -4.388 1.867 488 HA LYS 61 HA LYS 61 14.907 -4.228 -0.162 489 1HB LYS 61 HB2 LYS 61 15.249 -6.456 -1.122 490 2HB LYS 61 HB1 LYS 61 16.633 -5.416 -1.425 491 1HG LYS 61 HG2 LYS 61 17.899 -6.499 0.301 492 2HG LYS 61 HG1 LYS 61 16.494 -7.446 0.791 493 1HD LYS 61 HD2 LYS 61 17.980 -8.818 -0.534 494 2HD LYS 61 HD1 LYS 61 16.488 -8.528 -1.428 495 1HE LYS 61 HE2 LYS 61 18.983 -6.891 -1.815 496 2HE LYS 61 HE1 LYS 61 18.634 -8.343 -2.750 497 1HZ LYS 61 HZ1 LYS 61 17.600 -5.703 -3.057 498 2HZ LYS 61 HZ2 LYS 61 16.353 -6.840 -2.926 499 3HZ LYS 61 HZ3 LYS 61 17.533 -7.014 -4.124 500 H TRP 62 HN TRP 62 13.002 -5.240 0.507 501 HA TRP 62 HA TRP 62 13.142 -7.179 2.670 502 1HB TRP 62 HB2 TRP 62 13.146 -5.039 3.867 503 2HB TRP 62 HB1 TRP 62 11.673 -4.564 3.034 504 HD1 TRP 62 HD1 TRP 62 12.385 -7.954 4.780 505 HE1 TRP 62 HE1 TRP 62 10.580 -8.312 6.581 506 HE3 TRP 62 HE3 TRP 62 9.899 -3.506 4.341 507 HZ2 TRP 62 HZ2 TRP 62 8.394 -6.897 7.672 508 HZ3 TRP 62 HZ3 TRP 62 7.962 -3.089 5.798 509 HH2 TRP 62 HH2 TRP 62 7.225 -4.751 7.428 510 H GLU 63 HN GLU 63 11.368 -8.487 2.867 511 HA GLU 63 HA GLU 63 9.139 -7.986 1.020 512 1HB GLU 63 HB2 GLU 63 10.510 -10.640 1.468 513 2HB GLU 63 HB1 GLU 63 9.054 -10.401 0.514 514 1HG GLU 63 HG2 GLU 63 10.922 -10.592 -0.957 515 2HG GLU 63 HG1 GLU 63 10.335 -8.931 -1.000 516 H THR 64 HN THR 64 7.119 -8.574 1.720 517 HA THR 64 HA THR 64 6.821 -10.078 4.181 518 HB THR 64 HB THR 64 5.884 -7.214 3.943 519 HG1 THR 64 HG1 THR 64 7.820 -7.014 4.770 520 1HG2 THR 64 HG21 THR 64 4.219 -8.680 5.077 521 2HG2 THR 64 HG22 THR 64 4.893 -7.407 6.095 522 3HG2 THR 64 HG23 THR 64 5.457 -9.068 6.268 523 H THR 65 HN THR 65 4.932 -11.166 4.291 524 HA THR 65 HA THR 65 3.184 -10.915 1.960 525 HB THR 65 HB THR 65 3.705 -13.168 3.888 526 HG1 THR 65 HG1 THR 65 3.956 -13.161 1.076 527 1HG2 THR 65 HG21 THR 65 2.224 -14.225 1.816 528 2HG2 THR 65 HG22 THR 65 1.352 -12.759 2.266 529 3HG2 THR 65 HG23 THR 65 1.693 -13.990 3.482 530 H PHE 66 HN PHE 66 1.422 -9.769 2.222 531 HA PHE 66 HA PHE 66 0.063 -9.680 4.815 532 1HB PHE 66 HB2 PHE 66 -0.269 -8.096 2.259 533 2HB PHE 66 HB1 PHE 66 -1.412 -7.986 3.588 534 HD1 PHE 66 HD1 PHE 66 2.317 -8.149 3.585 535 HD2 PHE 66 HD2 PHE 66 -1.170 -5.894 4.518 536 HE1 PHE 66 HE1 PHE 66 3.718 -6.428 4.641 537 HE2 PHE 66 HE2 PHE 66 0.227 -4.167 5.575 538 HZ PHE 66 HZ PHE 66 2.675 -4.433 5.637 539 H LYS 67 HN LYS 67 -1.698 -10.965 5.177 540 HA LYS 67 HA LYS 67 -3.210 -11.934 2.865 541 1HB LYS 67 HB2 LYS 67 -1.450 -13.571 3.220 542 2HB LYS 67 HB1 LYS 67 -1.886 -13.709 4.912 543 1HG LYS 67 HG2 LYS 67 -3.953 -14.760 4.379 544 2HG LYS 67 HG1 LYS 67 -3.741 -14.431 2.658 545 1HD LYS 67 HD2 LYS 67 -3.225 -16.783 3.329 546 2HD LYS 67 HD1 LYS 67 -1.894 -15.950 2.526 547 1HE LYS 67 HE2 LYS 67 -0.852 -15.508 4.684 548 2HE LYS 67 HE1 LYS 67 -2.198 -16.289 5.510 549 1HZ LYS 67 HZ1 LYS 67 -0.578 -17.741 3.509 550 2HZ LYS 67 HZ2 LYS 67 -1.560 -18.373 4.733 551 3HZ LYS 67 HZ3 LYS 67 -0.088 -17.638 5.126 552 H LYS 68 HN LYS 68 -5.310 -11.996 3.192 553 HA LYS 68 HA LYS 68 -6.668 -12.974 5.362 554 1HB LYS 68 HB2 LYS 68 -5.629 -10.969 6.530 555 2HB LYS 68 HB1 LYS 68 -6.697 -9.970 5.554 556 1HG LYS 68 HG2 LYS 68 -7.804 -10.278 7.621 557 2HG LYS 68 HG1 LYS 68 -8.612 -11.350 6.480 558 1HD LYS 68 HD2 LYS 68 -7.312 -13.239 7.305 559 2HD LYS 68 HD1 LYS 68 -6.459 -12.174 8.423 560 1HE LYS 68 HE2 LYS 68 -9.417 -12.758 8.432 561 2HE LYS 68 HE1 LYS 68 -8.227 -13.401 9.563 562 1HZ LYS 68 HZ1 LYS 68 -8.481 -11.606 10.804 563 2HZ LYS 68 HZ2 LYS 68 -9.638 -10.999 9.730 564 3HZ LYS 68 HZ3 LYS 68 -8.007 -10.605 9.525 565 H THR 69 HN THR 69 -8.515 -10.276 4.992 566 HA THR 69 HA THR 69 -9.718 -11.309 2.509 567 HB THR 69 HB THR 69 -11.088 -11.922 4.420 568 HG1 THR 69 HG1 THR 69 -12.937 -11.239 3.560 569 1HG2 THR 69 HG21 THR 69 -11.461 -9.003 5.020 570 2HG2 THR 69 HG22 THR 69 -10.361 -10.049 5.919 571 3HG2 THR 69 HG23 THR 69 -12.090 -10.390 5.911 572 H SER 70 HN SER 70 -11.077 -9.785 1.336 573 HA SER 70 HA SER 70 -10.480 -6.967 1.780 574 1HB SER 70 HB2 SER 70 -8.763 -7.774 0.190 575 2HB SER 70 HB1 SER 70 -10.045 -8.327 -0.887 576 HG SER 70 HG SER 70 -9.013 -6.086 -1.123 577 H ASP 71 HN ASP 71 -12.775 -7.289 2.494 578 HA ASP 71 HA ASP 71 -14.593 -7.089 0.183 579 1HB ASP 71 HB2 ASP 71 -16.334 -8.162 1.530 580 2HB ASP 71 HB1 ASP 71 -14.926 -9.206 1.370 581 H ASP 72 HN ASP 72 -16.157 -5.555 0.202 582 HA ASP 72 HA ASP 72 -17.298 -4.102 2.195 583 1HB ASP 72 HB2 ASP 72 -15.147 -3.310 2.971 584 2HB ASP 72 HB1 ASP 72 -14.684 -2.825 1.345 585 H GLY 73 HN GLY 73 -18.285 -1.983 1.343 586 1HA GLY 73 HA2 GLY 73 -19.585 -2.239 -1.019 587 2HA GLY 73 HA1 GLY 73 -19.093 -0.660 -0.409 588 H GLU 74 HN GLU 74 -16.367 -0.899 -0.583 589 HA GLU 74 HA GLU 74 -15.917 -0.987 -3.488 590 1HB GLU 74 HB2 GLU 74 -15.538 1.181 -2.194 591 2HB GLU 74 HB1 GLU 74 -14.184 0.374 -1.419 592 1HG GLU 74 HG2 GLU 74 -13.065 0.117 -3.525 593 2HG GLU 74 HG1 GLU 74 -14.467 0.753 -4.387 594 H VAL 75 HN VAL 75 -12.922 -0.948 -1.886 595 HA VAL 75 HA VAL 75 -12.956 -3.865 -1.574 596 HB VAL 75 HB VAL 75 -12.049 -3.675 -3.738 597 1HG1 VAL 75 HG11 VAL 75 -9.786 -2.158 -3.754 598 2HG1 VAL 75 HG12 VAL 75 -10.860 -1.223 -2.721 599 3HG1 VAL 75 HG13 VAL 75 -11.363 -1.648 -4.352 600 1HG2 VAL 75 HG21 VAL 75 -10.817 -5.269 -2.517 601 2HG2 VAL 75 HG22 VAL 75 -9.880 -4.028 -1.684 602 3HG2 VAL 75 HG23 VAL 75 -9.624 -4.323 -3.404 603 H TYR 76 HN TYR 76 -12.831 -3.850 0.573 604 HA TYR 76 HA TYR 76 -10.704 -2.302 1.887 605 1HB TYR 76 HB2 TYR 76 -12.928 -1.802 2.682 606 2HB TYR 76 HB1 TYR 76 -13.284 -3.509 2.893 607 HD1 TYR 76 HD1 TYR 76 -9.997 -2.455 3.938 608 HD2 TYR 76 HD2 TYR 76 -14.038 -2.873 5.172 609 HE1 TYR 76 HE1 TYR 76 -9.286 -2.284 6.285 610 HE2 TYR 76 HE2 TYR 76 -13.346 -2.708 7.523 611 HH TYR 76 HH TYR 76 -11.447 -1.762 8.817 612 H TYR 77 HN TYR 77 -8.927 -3.393 2.468 613 HA TYR 77 HA TYR 77 -9.137 -6.290 2.944 614 1HB TYR 77 HB2 TYR 77 -7.715 -5.752 1.069 615 2HB TYR 77 HB1 TYR 77 -6.808 -4.598 2.039 616 HD1 TYR 77 HD1 TYR 77 -4.876 -5.269 3.140 617 HD2 TYR 77 HD2 TYR 77 -7.630 -8.226 1.810 618 HE1 TYR 77 HE1 TYR 77 -3.270 -7.028 3.742 619 HE2 TYR 77 HE2 TYR 77 -6.032 -9.994 2.417 620 HH TYR 77 HH TYR 77 -3.620 -9.675 4.414 621 H SER 78 HN SER 78 -9.168 -6.799 5.044 622 HA SER 78 HA SER 78 -7.389 -5.325 6.881 623 1HB SER 78 HB2 SER 78 -10.003 -6.731 7.482 624 2HB SER 78 HB1 SER 78 -8.944 -6.013 8.696 625 HG SER 78 HG SER 78 -10.231 -4.367 8.301 626 H GLU 79 HN GLU 79 -6.227 -6.580 8.458 627 HA GLU 79 HA GLU 79 -6.415 -9.460 8.273 628 1HB GLU 79 HB2 GLU 79 -4.053 -9.803 7.707 629 2HB GLU 79 HB1 GLU 79 -4.932 -8.996 6.416 630 1HG GLU 79 HG2 GLU 79 -3.976 -6.866 7.054 631 2HG GLU 79 HG1 GLU 79 -3.151 -7.620 8.421 632 H GLU 80 HN GLU 80 -6.143 -10.387 10.124 633 HA GLU 80 HA GLU 80 -5.820 -10.665 12.361 634 1HB GLU 80 HB2 GLU 80 -3.465 -10.695 12.987 635 2HB GLU 80 HB1 GLU 80 -3.699 -11.390 11.390 636 1HG GLU 80 HG2 GLU 80 -2.894 -9.382 10.343 637 2HG GLU 80 HG1 GLU 80 -2.789 -8.569 11.904 638 H ALA 81 HN ALA 81 -5.408 -9.779 14.428 639 HA ALA 81 HA ALA 81 -6.024 -6.985 14.646 640 1HB ALA 81 HB1 ALA 81 -6.423 -9.090 16.313 641 2HB ALA 81 HB2 ALA 81 -6.423 -7.409 16.850 642 3HB ALA 81 HB3 ALA 81 -4.971 -8.393 17.029 643 H LYS 82 HN LYS 82 -4.172 -6.447 13.256 644 HA LYS 82 HA LYS 82 -1.946 -5.574 14.827 645 1HB LYS 82 HB2 LYS 82 -1.392 -7.944 14.092 646 2HB LYS 82 HB1 LYS 82 -1.345 -7.322 12.447 647 1HG LYS 82 HG2 LYS 82 0.450 -5.801 13.055 648 2HG LYS 82 HG1 LYS 82 0.380 -6.371 14.723 649 1HD LYS 82 HD2 LYS 82 0.980 -8.627 13.970 650 2HD LYS 82 HD1 LYS 82 1.069 -8.044 12.308 651 1HE LYS 82 HE2 LYS 82 3.288 -8.176 13.293 652 2HE LYS 82 HE1 LYS 82 2.855 -6.503 12.943 653 1HZ LYS 82 HZ1 LYS 82 2.303 -6.182 15.262 654 2HZ LYS 82 HZ2 LYS 82 3.895 -6.739 15.123 655 3HZ LYS 82 HZ3 LYS 82 2.667 -7.797 15.610 656 H LYS 83 HN LYS 83 -3.557 -5.827 11.658 657 HA LYS 83 HA LYS 83 -3.292 -3.027 11.300 658 1HB LYS 83 HB2 LYS 83 -1.825 -2.863 9.442 659 2HB LYS 83 HB1 LYS 83 -0.980 -3.760 10.692 660 1HG LYS 83 HG2 LYS 83 -2.393 -5.049 8.370 661 2HG LYS 83 HG1 LYS 83 -0.680 -4.635 8.379 662 1HD LYS 83 HD2 LYS 83 -2.043 -6.494 10.324 663 2HD LYS 83 HD1 LYS 83 -1.059 -6.991 8.948 664 1HE LYS 83 HE2 LYS 83 -0.130 -5.366 11.309 665 2HE LYS 83 HE1 LYS 83 0.232 -7.063 11.008 666 1HZ LYS 83 HZ1 LYS 83 1.061 -4.790 9.285 667 2HZ LYS 83 HZ2 LYS 83 1.417 -6.419 9.004 668 3HZ LYS 83 HZ3 LYS 83 2.066 -5.634 10.353 669 H LYS 84 HN LYS 84 -4.878 -2.288 10.144 670 HA LYS 84 HA LYS 84 -6.360 -4.113 8.374 671 1HB LYS 84 HB2 LYS 84 -7.223 -1.685 9.946 672 2HB LYS 84 HB1 LYS 84 -8.202 -2.350 8.645 673 1HG LYS 84 HG2 LYS 84 -8.394 -4.453 9.813 674 2HG LYS 84 HG1 LYS 84 -7.325 -3.872 11.090 675 1HD LYS 84 HD2 LYS 84 -8.949 -2.146 11.675 676 2HD LYS 84 HD1 LYS 84 -10.008 -2.691 10.372 677 1HE LYS 84 HE2 LYS 84 -9.160 -4.320 12.765 678 2HE LYS 84 HE1 LYS 84 -10.735 -3.561 12.539 679 1HZ LYS 84 HZ1 LYS 84 -11.040 -5.764 11.897 680 2HZ LYS 84 HZ2 LYS 84 -9.569 -5.843 11.067 681 3HZ LYS 84 HZ3 LYS 84 -10.853 -4.949 10.426 682 H VAL 85 HN VAL 85 -7.006 -3.319 6.279 683 HA VAL 85 HA VAL 85 -5.774 -0.791 5.442 684 HB VAL 85 HB VAL 85 -5.290 -3.406 4.015 685 1HG1 VAL 85 HG11 VAL 85 -4.145 -0.680 3.457 686 2HG1 VAL 85 HG12 VAL 85 -5.458 -1.424 2.551 687 3HG1 VAL 85 HG13 VAL 85 -3.855 -2.159 2.548 688 1HG2 VAL 85 HG21 VAL 85 -2.844 -2.631 4.670 689 2HG2 VAL 85 HG22 VAL 85 -3.832 -3.611 5.753 690 3HG2 VAL 85 HG23 VAL 85 -3.710 -1.870 6.003 691 H GLU 86 HN GLU 86 -7.061 0.356 4.116 692 HA GLU 86 HA GLU 86 -9.334 -1.031 2.869 693 1HB GLU 86 HB2 GLU 86 -8.957 1.882 3.568 694 2HB GLU 86 HB1 GLU 86 -10.358 1.238 2.722 695 1HG GLU 86 HG2 GLU 86 -10.894 -0.148 4.651 696 2HG GLU 86 HG1 GLU 86 -9.482 0.476 5.501 697 H VAL 87 HN VAL 87 -9.355 -1.304 0.736 698 HA VAL 87 HA VAL 87 -7.371 0.118 -0.863 699 HB VAL 87 HB VAL 87 -9.171 -2.088 -1.839 700 1HG1 VAL 87 HG11 VAL 87 -8.192 -1.028 -3.672 701 2HG1 VAL 87 HG12 VAL 87 -7.154 -2.420 -3.370 702 3HG1 VAL 87 HG13 VAL 87 -6.653 -0.816 -2.840 703 1HG2 VAL 87 HG21 VAL 87 -8.116 -3.520 -0.518 704 2HG2 VAL 87 HG22 VAL 87 -7.047 -2.254 0.085 705 3HG2 VAL 87 HG23 VAL 87 -6.625 -3.141 -1.380 706 H LEU 88 HN LEU 88 -7.827 1.738 -2.104 707 HA LEU 88 HA LEU 88 -10.630 2.361 -2.738 708 1HB LEU 88 HB2 LEU 88 -8.243 4.205 -2.551 709 2HB LEU 88 HB1 LEU 88 -9.875 4.703 -2.936 710 HG LEU 88 HG LEU 88 -10.609 4.019 -0.685 711 1HD1 LEU 88 HD11 LEU 88 -7.763 3.150 -0.487 712 2HD1 LEU 88 HD12 LEU 88 -9.228 2.345 0.075 713 3HD1 LEU 88 HD13 LEU 88 -8.594 3.735 0.953 714 1HD2 LEU 88 HD21 LEU 88 -8.380 5.999 -0.997 715 2HD2 LEU 88 HD22 LEU 88 -9.193 5.764 0.551 716 3HD2 LEU 88 HD23 LEU 88 -10.112 6.293 -0.858 717 H ASP 89 HN ASP 89 -10.081 4.334 -4.695 718 HA ASP 89 HA ASP 89 -9.872 4.551 -6.939 719 1HB ASP 89 HB2 ASP 89 -7.441 4.308 -6.179 720 2HB ASP 89 HB1 ASP 89 -7.537 2.659 -6.776 721 H THR 90 HN THR 90 -8.459 1.875 -8.226 722 HA THR 90 HA THR 90 -10.965 0.352 -8.343 723 HB THR 90 HB THR 90 -9.264 1.113 -10.726 724 HG1 THR 90 HG1 THR 90 -11.811 1.960 -9.840 725 1HG2 THR 90 HG21 THR 90 -10.204 -1.076 -11.073 726 2HG2 THR 90 HG22 THR 90 -11.051 0.107 -12.071 727 3HG2 THR 90 HG23 THR 90 -11.799 -0.498 -10.593 728 H ASP 91 HN ASP 91 -10.059 -1.221 -6.988 729 HA ASP 91 HA ASP 91 -7.586 -2.520 -7.748 730 1HB ASP 91 HB2 ASP 91 -8.197 -2.150 -5.368 731 2HB ASP 91 HB1 ASP 91 -9.559 -3.246 -5.570 732 H TYR 92 HN TYR 92 -9.980 -2.632 -9.542 733 HA TYR 92 HA TYR 92 -9.970 -5.524 -9.959 734 1HB TYR 92 HB2 TYR 92 -12.472 -3.830 -9.776 735 2HB TYR 92 HB1 TYR 92 -12.438 -5.421 -10.516 736 HD1 TYR 92 HD1 TYR 92 -11.246 -3.916 -7.289 737 HD2 TYR 92 HD2 TYR 92 -13.338 -7.074 -9.222 738 HE1 TYR 92 HE1 TYR 92 -11.696 -4.945 -5.107 739 HE2 TYR 92 HE2 TYR 92 -13.803 -8.108 -7.041 740 HH TYR 92 HH TYR 92 -13.415 -6.504 -4.129 741 H LYS 93 HN LYS 93 -8.666 -3.258 -11.327 742 HA LYS 93 HA LYS 93 -9.603 -3.895 -13.995 743 1HB LYS 93 HB2 LYS 93 -10.975 -1.955 -13.480 744 2HB LYS 93 HB1 LYS 93 -9.550 -1.036 -13.014 745 1HG LYS 93 HG2 LYS 93 -8.712 -1.159 -15.306 746 2HG LYS 93 HG1 LYS 93 -10.134 -2.090 -15.777 747 1HD LYS 93 HD2 LYS 93 -10.161 0.725 -14.690 748 2HD LYS 93 HD1 LYS 93 -10.330 0.282 -16.389 749 1HE LYS 93 HE2 LYS 93 -12.201 -0.482 -14.150 750 2HE LYS 93 HE1 LYS 93 -12.503 0.734 -15.390 751 1HZ LYS 93 HZ1 LYS 93 -12.221 -2.194 -15.788 752 2HZ LYS 93 HZ2 LYS 93 -12.297 -1.078 -17.056 753 3HZ LYS 93 HZ3 LYS 93 -13.615 -1.260 -16.011 754 H SER 94 HN SER 94 -7.674 -1.040 -13.233 755 HA SER 94 HA SER 94 -5.243 -2.486 -13.987 756 1HB SER 94 HB2 SER 94 -4.629 -0.721 -15.596 757 2HB SER 94 HB1 SER 94 -6.112 -1.551 -16.062 758 HG SER 94 HG SER 94 -6.111 0.828 -16.167 759 H TYR 95 HN TYR 95 -6.735 0.132 -12.262 760 HA TYR 95 HA TYR 95 -4.145 0.665 -11.002 761 1HB TYR 95 HB2 TYR 95 -5.080 3.142 -10.886 762 2HB TYR 95 HB1 TYR 95 -4.160 2.567 -12.272 763 HD1 TYR 95 HD1 TYR 95 -7.743 2.585 -11.149 764 HD2 TYR 95 HD2 TYR 95 -4.979 3.141 -14.328 765 HE1 TYR 95 HE1 TYR 95 -9.600 3.167 -12.649 766 HE2 TYR 95 HE2 TYR 95 -6.825 3.735 -15.839 767 HH TYR 95 HH TYR 95 -9.128 4.595 -15.687 768 H ALA 96 HN ALA 96 -4.184 0.704 -8.851 769 HA ALA 96 HA ALA 96 -6.709 1.212 -7.461 770 1HB ALA 96 HB1 ALA 96 -5.626 -1.373 -7.796 771 2HB ALA 96 HB2 ALA 96 -7.002 -0.888 -6.809 772 3HB ALA 96 HB3 ALA 96 -5.384 -0.922 -6.110 773 H VAL 97 HN VAL 97 -6.494 2.134 -5.460 774 HA VAL 97 HA VAL 97 -3.749 2.630 -4.522 775 HB VAL 97 HB VAL 97 -4.301 4.855 -3.898 776 1HG1 VAL 97 HG11 VAL 97 -3.859 5.290 -6.047 777 2HG1 VAL 97 HG12 VAL 97 -5.597 5.489 -6.246 778 3HG1 VAL 97 HG13 VAL 97 -4.842 3.939 -6.609 779 1HG2 VAL 97 HG21 VAL 97 -6.753 5.632 -4.564 780 2HG2 VAL 97 HG22 VAL 97 -6.391 4.961 -2.974 781 3HG2 VAL 97 HG23 VAL 97 -7.110 3.939 -4.219 782 H ILE 98 HN ILE 98 -3.427 1.658 -2.631 783 HA ILE 98 HA ILE 98 -5.748 1.303 -0.852 784 HB ILE 98 HB ILE 98 -5.096 -0.808 -1.839 785 1HG1 ILE 98 HG12 ILE 98 -4.149 -0.622 1.021 786 2HG1 ILE 98 HG11 ILE 98 -5.820 -0.839 0.511 787 1HG2 ILE 98 HG21 ILE 98 -2.992 -1.247 -2.380 788 2HG2 ILE 98 HG22 ILE 98 -2.550 -1.272 -0.675 789 3HG2 ILE 98 HG23 ILE 98 -2.472 0.238 -1.580 790 1HD1 ILE 98 HD11 ILE 98 -4.708 -2.928 -0.739 791 2HD1 ILE 98 HD12 ILE 98 -5.324 -3.005 0.913 792 3HD1 ILE 98 HD13 ILE 98 -3.599 -2.779 0.624 793 H TYR 99 HN TYR 99 -5.587 2.123 1.145 794 HA TYR 99 HA TYR 99 -2.909 2.867 2.090 795 1HB TYR 99 HB2 TYR 99 -3.881 4.578 3.438 796 2HB TYR 99 HB1 TYR 99 -4.584 4.720 1.836 797 HD1 TYR 99 HD1 TYR 99 -5.314 3.126 5.145 798 HD2 TYR 99 HD2 TYR 99 -6.841 5.059 1.678 799 HE1 TYR 99 HE1 TYR 99 -7.554 3.158 6.157 800 HE2 TYR 99 HE2 TYR 99 -9.086 5.092 2.677 801 HH TYR 99 HH TYR 99 -10.373 4.054 4.359 802 H ALA 100 HN ALA 100 -2.045 1.800 3.710 803 HA ALA 100 HA ALA 100 -3.695 -0.126 5.173 804 1HB ALA 100 HB1 ALA 100 -1.673 -0.931 3.992 805 2HB ALA 100 HB2 ALA 100 -1.642 -1.257 5.726 806 3HB ALA 100 HB3 ALA 100 -0.689 0.069 5.061 807 H THR 101 HN THR 101 -3.931 -0.149 7.338 808 HA THR 101 HA THR 101 -2.536 1.892 8.929 809 HB THR 101 HB THR 101 -4.634 2.310 10.176 810 HG1 THR 101 HG1 THR 101 -6.391 1.221 9.769 811 1HG2 THR 101 HG21 THR 101 -3.984 3.557 7.967 812 2HG2 THR 101 HG22 THR 101 -5.545 3.828 8.744 813 3HG2 THR 101 HG23 THR 101 -5.426 2.752 7.351 814 H ARG 102 HN ARG 102 -1.710 1.124 10.803 815 HA ARG 102 HA ARG 102 -1.965 -1.676 11.349 816 1HB ARG 102 HB2 ARG 102 -0.516 0.463 12.910 817 2HB ARG 102 HB1 ARG 102 -0.371 -1.269 13.171 818 1HG ARG 102 HG2 ARG 102 0.445 -1.472 10.814 819 2HG ARG 102 HG1 ARG 102 0.488 0.289 10.747 820 1HD ARG 102 HD2 ARG 102 2.065 0.333 12.607 821 2HD ARG 102 HD1 ARG 102 2.001 -1.425 12.714 822 HE ARG 102 HE ARG 102 3.607 0.091 10.955 823 1HH1 ARG 102 HH11 ARG 102 1.724 -2.844 11.098 824 2HH1 ARG 102 HH12 ARG 102 2.586 -3.607 9.805 825 1HH2 ARG 102 HH21 ARG 102 4.748 -0.917 9.260 826 2HH2 ARG 102 HH22 ARG 102 4.303 -2.516 8.763 827 H VAL 103 HN VAL 103 -2.811 -2.666 13.137 828 HA VAL 103 HA VAL 103 -4.266 -1.171 15.146 829 HB VAL 103 HB VAL 103 -6.366 -2.489 14.733 830 1HG1 VAL 103 HG11 VAL 103 -7.252 -0.972 13.166 831 2HG1 VAL 103 HG12 VAL 103 -5.695 -0.767 12.362 832 3HG1 VAL 103 HG13 VAL 103 -5.951 -0.097 13.974 833 1HG2 VAL 103 HG21 VAL 103 -4.782 -3.893 12.948 834 2HG2 VAL 103 HG22 VAL 103 -5.823 -2.920 11.912 835 3HG2 VAL 103 HG23 VAL 103 -6.536 -4.007 13.104 836 H LYS 104 HN LYS 104 -3.259 -2.112 16.844 837 HA LYS 104 HA LYS 104 -3.575 -5.004 17.174 838 1HB LYS 104 HB2 LYS 104 -1.339 -4.811 16.325 839 2HB LYS 104 HB1 LYS 104 -0.977 -3.488 17.419 840 1HG LYS 104 HG2 LYS 104 0.081 -5.527 18.171 841 2HG LYS 104 HG1 LYS 104 -1.154 -5.018 19.322 842 1HD LYS 104 HD2 LYS 104 -2.719 -6.639 18.309 843 2HD LYS 104 HD1 LYS 104 -1.426 -7.177 17.234 844 1HE LYS 104 HE2 LYS 104 -0.098 -7.864 19.160 845 2HE LYS 104 HE1 LYS 104 -1.367 -7.300 20.247 846 1HZ LYS 104 HZ1 LYS 104 -1.192 -9.803 19.507 847 2HZ LYS 104 HZ2 LYS 104 -2.101 -9.248 18.192 848 3HZ LYS 104 HZ3 LYS 104 -2.692 -9.064 19.766 849 H ASP 105 HN ASP 105 -5.157 -4.574 18.717 850 HA ASP 105 HA ASP 105 -5.973 -3.440 20.678 851 1HB ASP 105 HB2 ASP 105 -4.218 -5.769 21.482 852 2HB ASP 105 HB1 ASP 105 -5.524 -5.095 22.450 853 H GLY 106 HN GLY 106 -4.186 -1.542 20.204 854 1HA GLY 106 HA2 GLY 106 -3.369 -0.645 22.690 855 2HA GLY 106 HA1 GLY 106 -1.997 -1.515 22.032 856 H ARG 107 HN ARG 107 -2.139 -0.781 19.335 857 HA ARG 107 HA ARG 107 -2.062 2.153 19.413 858 1HB ARG 107 HB2 ARG 107 0.110 2.263 18.343 859 2HB ARG 107 HB1 ARG 107 0.227 1.403 19.869 860 1HG ARG 107 HG2 ARG 107 -0.074 -0.077 17.282 861 2HG ARG 107 HG1 ARG 107 1.501 0.493 17.837 862 1HD ARG 107 HD2 ARG 107 -0.357 -1.353 19.333 863 2HD ARG 107 HD1 ARG 107 1.127 -1.817 18.504 864 HE ARG 107 HE ARG 107 1.730 0.180 20.374 865 1HH1 ARG 107 HH11 ARG 107 0.711 -3.154 20.269 866 2HH1 ARG 107 HH12 ARG 107 1.437 -3.555 21.790 867 1HH2 ARG 107 HH21 ARG 107 2.687 -0.342 22.374 868 2HH2 ARG 107 HH22 ARG 107 2.559 -1.958 22.986 869 H THR 108 HN THR 108 -2.226 3.221 17.461 870 HA THR 108 HA THR 108 -3.120 1.581 15.186 871 HB THR 108 HB THR 108 -4.187 4.261 16.102 872 HG1 THR 108 HG1 THR 108 -5.202 2.847 17.342 873 1HG2 THR 108 HG21 THR 108 -5.980 3.216 14.302 874 2HG2 THR 108 HG22 THR 108 -4.414 2.908 13.551 875 3HG2 THR 108 HG23 THR 108 -4.864 4.550 14.012 876 H LEU 109 HN LEU 109 -2.543 2.290 13.122 877 HA LEU 109 HA LEU 109 -0.714 4.585 12.952 878 1HB LEU 109 HB2 LEU 109 0.588 2.474 13.186 879 2HB LEU 109 HB1 LEU 109 -0.193 1.868 11.742 880 HG LEU 109 HG LEU 109 1.564 4.317 11.789 881 1HD1 LEU 109 HD11 LEU 109 2.271 1.553 10.829 882 2HD1 LEU 109 HD12 LEU 109 2.752 2.203 12.396 883 3HD1 LEU 109 HD13 LEU 109 3.325 2.964 10.912 884 1HD2 LEU 109 HD21 LEU 109 1.584 3.309 9.257 885 2HD2 LEU 109 HD22 LEU 109 0.562 4.633 9.809 886 3HD2 LEU 109 HD23 LEU 109 -0.076 2.990 9.757 887 H HIS 110 HN HIS 110 -0.899 5.771 11.071 888 HA HIS 110 HA HIS 110 -2.887 4.759 9.132 889 1HB HIS 110 HB2 HIS 110 -2.144 7.642 9.670 890 2HB HIS 110 HB1 HIS 110 -3.427 7.062 8.611 891 HD1 HIS 110 HD1 HIS 110 -5.174 5.368 10.104 892 HD2 HIS 110 HD2 HIS 110 -3.173 8.464 12.021 893 HE1 HIS 110 HE1 HIS 110 -6.476 5.807 12.209 894 HE2 HIS 110 HE2 HIS 110 -5.292 7.737 13.315 895 H MET 111 HN MET 111 -2.241 4.428 7.074 896 HA MET 111 HA MET 111 -0.036 5.900 5.960 897 1HB MET 111 HB2 MET 111 1.177 4.211 7.214 898 2HB MET 111 HB1 MET 111 0.235 2.935 6.457 899 1HG MET 111 HG2 MET 111 1.206 3.453 4.305 900 2HG MET 111 HG1 MET 111 2.094 4.804 5.003 901 1HE MET 111 HE1 MET 111 4.007 2.232 3.474 902 2HE MET 111 HE2 MET 111 5.167 3.017 4.547 903 3HE MET 111 HE3 MET 111 3.902 3.968 3.768 904 H MET 112 HN MET 112 -0.116 6.024 3.789 905 HA MET 112 HA MET 112 -2.249 4.551 2.420 906 1HB MET 112 HB2 MET 112 -0.887 7.160 1.861 907 2HB MET 112 HB1 MET 112 -1.782 6.325 0.606 908 1HG MET 112 HG2 MET 112 -3.159 8.011 1.620 909 2HG MET 112 HG1 MET 112 -3.791 6.412 1.998 910 1HE MET 112 HE1 MET 112 -5.122 7.706 4.851 911 2HE MET 112 HE2 MET 112 -5.054 8.285 3.188 912 3HE MET 112 HE3 MET 112 -4.412 9.279 4.494 913 H ARG 113 HN ARG 113 -1.888 3.499 0.444 914 HA ARG 113 HA ARG 113 0.882 3.284 -0.475 915 1HB ARG 113 HB2 ARG 113 0.248 1.452 1.225 916 2HB ARG 113 HB1 ARG 113 -0.760 0.801 -0.059 917 1HG ARG 113 HG2 ARG 113 1.257 0.671 -1.498 918 2HG ARG 113 HG1 ARG 113 2.222 1.163 -0.103 919 1HD ARG 113 HD2 ARG 113 1.171 -0.803 1.120 920 2HD ARG 113 HD1 ARG 113 0.595 -1.340 -0.457 921 HE ARG 113 HE ARG 113 2.688 -2.124 -0.867 922 1HH1 ARG 113 HH11 ARG 113 2.916 0.360 1.571 923 2HH1 ARG 113 HH12 ARG 113 4.621 0.161 1.794 924 1HH2 ARG 113 HH21 ARG 113 4.933 -2.394 -0.570 925 2HH2 ARG 113 HH22 ARG 113 5.767 -1.400 0.577 926 H LEU 114 HN LEU 114 1.072 3.113 -2.651 927 HA LEU 114 HA LEU 114 -1.388 3.168 -4.216 928 1HB LEU 114 HB2 LEU 114 0.435 4.860 -4.544 929 2HB LEU 114 HB1 LEU 114 1.448 3.567 -5.156 930 HG LEU 114 HG LEU 114 -0.084 3.208 -7.024 931 1HD1 LEU 114 HD11 LEU 114 -1.957 4.713 -7.416 932 2HD1 LEU 114 HD12 LEU 114 -1.643 5.518 -5.879 933 3HD1 LEU 114 HD13 LEU 114 -2.161 3.833 -5.901 934 1HD2 LEU 114 HD21 LEU 114 0.735 4.915 -8.275 935 2HD2 LEU 114 HD22 LEU 114 1.716 5.172 -6.833 936 3HD2 LEU 114 HD23 LEU 114 0.270 6.146 -7.101 937 H TYR 115 HN TYR 115 -1.596 1.932 -6.191 938 HA TYR 115 HA TYR 115 0.074 -0.422 -6.482 939 1HB TYR 115 HB2 TYR 115 -1.431 -1.433 -5.005 940 2HB TYR 115 HB1 TYR 115 -2.806 -0.537 -5.637 941 HD1 TYR 115 HD1 TYR 115 -0.397 -2.304 -7.820 942 HD2 TYR 115 HD2 TYR 115 -4.208 -2.454 -5.937 943 HE1 TYR 115 HE1 TYR 115 -1.023 -4.201 -9.253 944 HE2 TYR 115 HE2 TYR 115 -4.837 -4.357 -7.358 945 HH TYR 115 HH TYR 115 -2.540 -5.936 -9.459 946 H SER 116 HN SER 116 0.447 -0.775 -8.545 947 HA SER 116 HA SER 116 -1.607 -0.141 -10.537 948 1HB SER 116 HB2 SER 116 -0.044 1.769 -10.523 949 2HB SER 116 HB1 SER 116 1.310 0.664 -10.769 950 HG SER 116 HG SER 116 -0.633 1.532 -12.558 951 H ARG 117 HN ARG 117 -1.907 -1.795 -11.903 952 HA ARG 117 HA ARG 117 -0.467 -4.202 -11.587 953 1HB ARG 117 HB2 ARG 117 -2.462 -3.345 -13.679 954 2HB ARG 117 HB1 ARG 117 -1.772 -4.959 -13.612 955 1HG ARG 117 HG2 ARG 117 -3.812 -5.179 -12.528 956 2HG ARG 117 HG1 ARG 117 -2.652 -5.032 -11.210 957 1HD ARG 117 HD2 ARG 117 -3.193 -2.643 -11.020 958 2HD ARG 117 HD1 ARG 117 -4.373 -2.819 -12.311 959 HE ARG 117 HE ARG 117 -4.800 -3.345 -9.599 960 1HH1 ARG 117 HH11 ARG 117 -5.528 -4.710 -12.728 961 2HH1 ARG 117 HH12 ARG 117 -6.924 -5.563 -12.163 962 1HH2 ARG 117 HH21 ARG 117 -6.634 -4.451 -8.864 963 2HH2 ARG 117 HH22 ARG 117 -7.556 -5.411 -9.972 964 H SER 118 HN SER 118 -0.336 -1.672 -14.049 965 HA SER 118 HA SER 118 2.110 -2.957 -15.071 966 1HB SER 118 HB2 SER 118 0.034 -1.456 -16.684 967 2HB SER 118 HB1 SER 118 1.553 -2.095 -17.313 968 HG SER 118 HG SER 118 0.769 -4.194 -16.575 969 HA PRO 119 HA PRO 119 4.523 0.614 -14.221 970 1HB PRO 119 HB2 PRO 119 5.505 0.976 -16.873 971 2HB PRO 119 HB1 PRO 119 6.311 0.167 -15.529 972 1HG PRO 119 HG2 PRO 119 4.770 -0.988 -17.780 973 2HG PRO 119 HG1 PRO 119 6.099 -1.693 -16.843 974 1HD PRO 119 HD2 PRO 119 3.565 -2.514 -16.523 975 2HD PRO 119 HD1 PRO 119 4.687 -2.413 -15.149 976 H GLU 120 HN GLU 120 2.547 0.624 -17.143 977 HA GLU 120 HA GLU 120 2.517 3.423 -17.547 978 1HB GLU 120 HB2 GLU 120 1.928 1.869 -19.323 979 2HB GLU 120 HB1 GLU 120 0.555 1.286 -18.396 980 1HG GLU 120 HG2 GLU 120 -0.501 3.479 -18.576 981 2HG GLU 120 HG1 GLU 120 0.879 4.068 -19.502 982 H VAL 121 HN VAL 121 2.206 3.868 -15.134 983 HA VAL 121 HA VAL 121 -0.292 3.439 -13.907 984 HB VAL 121 HB VAL 121 1.685 5.666 -13.375 985 1HG1 VAL 121 HG11 VAL 121 0.627 5.886 -11.213 986 2HG1 VAL 121 HG12 VAL 121 -0.488 4.573 -11.588 987 3HG1 VAL 121 HG13 VAL 121 -0.584 6.093 -12.478 988 1HG2 VAL 121 HG21 VAL 121 2.137 4.026 -11.372 989 2HG2 VAL 121 HG22 VAL 121 2.920 3.780 -12.933 990 3HG2 VAL 121 HG23 VAL 121 1.505 2.824 -12.496 991 H SER 122 HN SER 122 -2.113 4.049 -14.873 992 HA SER 122 HA SER 122 -2.432 6.214 -16.622 993 1HB SER 122 HB2 SER 122 -3.997 4.308 -16.509 994 2HB SER 122 HB1 SER 122 -4.519 4.844 -14.914 995 HG SER 122 HG SER 122 -5.535 6.540 -15.789 996 HA PRO 123 HA PRO 123 -2.671 9.905 -14.218 997 1HB PRO 123 HB2 PRO 123 -5.166 10.820 -15.175 998 2HB PRO 123 HB1 PRO 123 -3.578 11.233 -15.827 999 1HG PRO 123 HG2 PRO 123 -5.537 9.195 -16.756 1000 2HG PRO 123 HG1 PRO 123 -4.415 10.190 -17.701 1001 1HD PRO 123 HD2 PRO 123 -3.923 7.603 -17.275 1002 2HD PRO 123 HD1 PRO 123 -2.608 8.795 -17.251 1003 H ALA 124 HN ALA 124 -5.626 7.971 -14.543 1004 HA ALA 124 HA ALA 124 -7.007 8.932 -12.312 1005 1HB ALA 124 HB1 ALA 124 -8.538 7.346 -12.779 1006 2HB ALA 124 HB2 ALA 124 -7.333 6.062 -12.893 1007 3HB ALA 124 HB3 ALA 124 -7.595 7.153 -14.255 1008 H ALA 125 HN ALA 125 -4.826 6.149 -12.613 1009 HA ALA 125 HA ALA 125 -5.017 5.121 -10.075 1010 1HB ALA 125 HB1 ALA 125 -3.491 4.555 -12.199 1011 2HB ALA 125 HB2 ALA 125 -3.185 3.907 -10.587 1012 3HB ALA 125 HB3 ALA 125 -2.282 5.309 -11.157 1013 H THR 126 HN THR 126 -2.486 7.406 -11.123 1014 HA THR 126 HA THR 126 -1.685 8.003 -8.458 1015 HB THR 126 HB THR 126 -0.133 8.201 -10.325 1016 HG1 THR 126 HG1 THR 126 0.844 9.813 -9.395 1017 1HG2 THR 126 HG21 THR 126 -1.603 10.659 -11.232 1018 2HG2 THR 126 HG22 THR 126 -1.820 9.079 -11.985 1019 3HG2 THR 126 HG23 THR 126 -0.234 9.849 -12.000 1020 H ALA 127 HN ALA 127 -3.590 9.787 -10.863 1021 HA ALA 127 HA ALA 127 -3.963 12.083 -9.287 1022 1HB ALA 127 HB1 ALA 127 -4.279 11.880 -11.781 1023 2HB ALA 127 HB2 ALA 127 -5.480 12.835 -10.910 1024 3HB ALA 127 HB3 ALA 127 -5.861 11.191 -11.427 1025 H ILE 128 HN ILE 128 -5.944 9.158 -9.617 1026 HA ILE 128 HA ILE 128 -8.172 10.132 -8.224 1027 HB ILE 128 HB ILE 128 -7.170 7.312 -8.554 1028 1HG1 ILE 128 HG12 ILE 128 -9.561 8.761 -9.716 1029 2HG1 ILE 128 HG11 ILE 128 -8.035 8.525 -10.551 1030 1HG2 ILE 128 HG21 ILE 128 -8.427 6.775 -6.779 1031 2HG2 ILE 128 HG22 ILE 128 -9.800 7.053 -7.851 1032 3HG2 ILE 128 HG23 ILE 128 -9.251 8.334 -6.771 1033 1HD1 ILE 128 HD11 ILE 128 -8.353 6.162 -10.596 1034 2HD1 ILE 128 HD12 ILE 128 -9.815 6.938 -11.206 1035 3HD1 ILE 128 HD13 ILE 128 -9.780 6.286 -9.568 1036 H PHE 129 HN PHE 129 -5.375 8.242 -6.987 1037 HA PHE 129 HA PHE 129 -6.176 8.198 -4.303 1038 1HB PHE 129 HB2 PHE 129 -4.261 6.901 -4.997 1039 2HB PHE 129 HB1 PHE 129 -3.401 8.348 -5.503 1040 HD1 PHE 129 HD1 PHE 129 -5.239 7.450 -2.386 1041 HD2 PHE 129 HD2 PHE 129 -1.562 8.658 -4.157 1042 HE1 PHE 129 HE1 PHE 129 -4.229 7.641 -0.152 1043 HE2 PHE 129 HE2 PHE 129 -0.544 8.849 -1.925 1044 HZ PHE 129 HZ PHE 129 -1.879 8.344 0.081 1045 H ARG 130 HN ARG 130 -4.237 10.552 -6.074 1046 HA ARG 130 HA ARG 130 -3.903 12.380 -3.944 1047 1HB ARG 130 HB2 ARG 130 -2.420 12.430 -5.857 1048 2HB ARG 130 HB1 ARG 130 -3.766 12.736 -6.944 1049 1HG ARG 130 HG2 ARG 130 -4.108 14.922 -5.925 1050 2HG ARG 130 HG1 ARG 130 -2.771 14.620 -4.811 1051 1HD ARG 130 HD2 ARG 130 -1.218 14.487 -6.672 1052 2HD ARG 130 HD1 ARG 130 -2.545 14.672 -7.818 1053 HE ARG 130 HE ARG 130 -2.563 16.873 -6.099 1054 1HH1 ARG 130 HH11 ARG 130 -0.552 15.474 -8.581 1055 2HH1 ARG 130 HH12 ARG 130 0.098 16.996 -9.089 1056 1HH2 ARG 130 HH21 ARG 130 -1.712 18.880 -6.767 1057 2HH2 ARG 130 HH22 ARG 130 -0.560 18.930 -8.060 1058 H LYS 131 HN LYS 131 -6.326 11.953 -6.444 1059 HA LYS 131 HA LYS 131 -7.706 14.370 -6.186 1060 1HB LYS 131 HB2 LYS 131 -8.060 12.670 -8.000 1061 2HB LYS 131 HB1 LYS 131 -8.916 11.675 -6.832 1062 1HG LYS 131 HG2 LYS 131 -10.654 13.291 -6.613 1063 2HG LYS 131 HG1 LYS 131 -9.744 14.475 -7.551 1064 1HD LYS 131 HD2 LYS 131 -11.500 13.478 -8.904 1065 2HD LYS 131 HD1 LYS 131 -9.912 13.032 -9.526 1066 1HE LYS 131 HE2 LYS 131 -10.090 10.868 -8.375 1067 2HE LYS 131 HE1 LYS 131 -11.698 11.317 -7.805 1068 1HZ LYS 131 HZ1 LYS 131 -11.670 9.893 -9.829 1069 2HZ LYS 131 HZ2 LYS 131 -10.960 11.175 -10.675 1070 3HZ LYS 131 HZ3 LYS 131 -12.510 11.350 -10.021 1071 H LEU 132 HN LEU 132 -7.977 11.312 -4.446 1072 HA LEU 132 HA LEU 132 -10.216 11.928 -2.873 1073 1HB LEU 132 HB2 LEU 132 -7.804 10.235 -2.199 1074 2HB LEU 132 HB1 LEU 132 -9.291 10.261 -1.272 1075 HG LEU 132 HG LEU 132 -9.045 9.351 -4.142 1076 1HD1 LEU 132 HD11 LEU 132 -8.167 7.538 -3.144 1077 2HD1 LEU 132 HD12 LEU 132 -9.846 7.192 -2.731 1078 3HD1 LEU 132 HD13 LEU 132 -8.792 7.978 -1.555 1079 1HD2 LEU 132 HD21 LEU 132 -11.236 9.918 -4.109 1080 2HD2 LEU 132 HD22 LEU 132 -11.339 9.858 -2.349 1081 3HD2 LEU 132 HD23 LEU 132 -11.387 8.364 -3.287 1082 H ALA 133 HN ALA 133 -6.774 12.549 -2.456 1083 HA ALA 133 HA ALA 133 -7.055 13.865 0.076 1084 1HB ALA 133 HB1 ALA 133 -4.675 14.687 -0.560 1085 2HB ALA 133 HB2 ALA 133 -4.819 13.535 -1.888 1086 3HB ALA 133 HB3 ALA 133 -4.937 12.977 -0.220 1087 H GLY 134 HN GLY 134 -6.952 14.848 -3.300 1088 1HA GLY 134 HA2 GLY 134 -6.710 17.641 -2.835 1089 2HA GLY 134 HA1 GLY 134 -7.246 16.884 -4.325 1090 H GLU 135 HN GLU 135 -9.546 15.614 -3.615 1091 HA GLU 135 HA GLU 135 -11.452 17.625 -3.648 1092 1HB GLU 135 HB2 GLU 135 -13.106 15.864 -3.107 1093 2HB GLU 135 HB1 GLU 135 -11.989 15.386 -4.374 1094 1HG GLU 135 HG2 GLU 135 -12.140 13.491 -3.080 1095 2HG GLU 135 HG1 GLU 135 -10.667 14.252 -2.482 1096 H ARG 136 HN ARG 136 -10.104 15.844 -0.907 1097 HA ARG 136 HA ARG 136 -11.629 17.475 0.985 1098 1HB ARG 136 HB2 ARG 136 -10.020 14.975 1.193 1099 2HB ARG 136 HB1 ARG 136 -10.081 16.016 2.608 1100 1HG ARG 136 HG2 ARG 136 -12.507 15.870 2.629 1101 2HG ARG 136 HG1 ARG 136 -12.467 14.853 1.192 1102 1HD ARG 136 HD2 ARG 136 -12.733 13.513 3.214 1103 2HD ARG 136 HD1 ARG 136 -11.208 13.159 2.404 1104 HE ARG 136 HE ARG 136 -10.140 13.817 4.298 1105 1HH1 ARG 136 HH11 ARG 136 -13.300 15.302 4.283 1106 2HH1 ARG 136 HH12 ARG 136 -13.077 16.080 5.814 1107 1HH2 ARG 136 HH21 ARG 136 -9.851 14.831 6.315 1108 2HH2 ARG 136 HH22 ARG 136 -11.120 15.812 6.968 1109 H ASN 137 HN ASN 137 -9.463 18.500 -0.817 1110 HA ASN 137 HA ASN 137 -7.739 19.965 -0.753 1111 1HB ASN 137 HB2 ASN 137 -9.178 21.186 0.819 1112 2HB ASN 137 HB1 ASN 137 -8.553 20.226 2.155 1113 1HD2 ASN 137 HD21 ASN 137 -7.176 21.298 3.339 1114 2HD2 ASN 137 HD22 ASN 137 -6.030 22.464 2.782 1115 H TYR 138 HN TYR 138 -5.572 19.583 -0.751 1116 HA TYR 138 HA TYR 138 -4.483 17.244 0.271 1117 1HB TYR 138 HB2 TYR 138 -3.394 18.700 -1.452 1118 2HB TYR 138 HB1 TYR 138 -2.966 19.829 -0.170 1119 HD1 TYR 138 HD1 TYR 138 -0.992 19.539 1.050 1120 HD2 TYR 138 HD2 TYR 138 -2.489 16.309 -1.281 1121 HE1 TYR 138 HE1 TYR 138 1.083 18.287 1.460 1122 HE2 TYR 138 HE2 TYR 138 -0.419 15.047 -0.873 1123 HH TYR 138 HH TYR 138 2.307 16.214 -0.038 1124 H THR 139 HN THR 139 -4.250 16.606 2.293 1125 HA THR 139 HA THR 139 -4.206 18.589 4.420 1126 HB THR 139 HB THR 139 -5.793 16.771 4.637 1127 HG1 THR 139 HG1 THR 139 -4.484 17.575 6.512 1128 1HG2 THR 139 HG21 THR 139 -4.979 14.460 5.089 1129 2HG2 THR 139 HG22 THR 139 -3.402 14.959 4.478 1130 3HG2 THR 139 HG23 THR 139 -4.810 14.991 3.417 1131 H ASP 140 HN ASP 140 -2.495 19.093 5.607 1132 HA ASP 140 HA ASP 140 0.097 18.089 4.976 1133 1HB ASP 140 HB2 ASP 140 -0.194 20.373 5.837 1134 2HB ASP 140 HB1 ASP 140 -0.842 19.741 7.347 1135 H GLU 141 HN GLU 141 -2.465 17.050 6.927 1136 HA GLU 141 HA GLU 141 -1.582 15.874 9.142 1137 1HB GLU 141 HB2 GLU 141 -3.860 15.653 8.435 1138 2HB GLU 141 HB1 GLU 141 -3.399 14.698 7.037 1139 1HG GLU 141 HG2 GLU 141 -2.625 12.915 8.586 1140 2HG GLU 141 HG1 GLU 141 -3.268 13.865 9.925 1141 H MET 142 HN MET 142 -1.932 13.487 6.563 1142 HA MET 142 HA MET 142 0.792 12.577 7.195 1143 1HB MET 142 HB2 MET 142 -0.043 10.257 6.734 1144 2HB MET 142 HB1 MET 142 -0.653 11.009 8.204 1145 1HG MET 142 HG2 MET 142 -2.718 11.608 6.919 1146 2HG MET 142 HG1 MET 142 -2.091 10.613 5.602 1147 1HE MET 142 HE1 MET 142 -4.822 8.440 6.633 1148 2HE MET 142 HE2 MET 142 -4.609 10.144 6.230 1149 3HE MET 142 HE3 MET 142 -5.067 9.675 7.867 1150 H VAL 143 HN VAL 143 2.130 12.571 5.633 1151 HA VAL 143 HA VAL 143 1.230 11.982 2.898 1152 HB VAL 143 HB VAL 143 3.381 14.004 3.586 1153 1HG1 VAL 143 HG11 VAL 143 3.511 14.430 1.226 1154 2HG1 VAL 143 HG12 VAL 143 2.147 13.356 0.911 1155 3HG1 VAL 143 HG13 VAL 143 3.674 12.695 1.487 1156 1HG2 VAL 143 HG21 VAL 143 0.945 14.695 4.027 1157 2HG2 VAL 143 HG22 VAL 143 0.763 14.671 2.272 1158 3HG2 VAL 143 HG23 VAL 143 1.933 15.755 3.025 1159 H ALA 144 HN ALA 144 2.866 10.869 1.621 1160 HA ALA 144 HA ALA 144 5.374 10.182 2.804 1161 1HB ALA 144 HB1 ALA 144 5.017 8.129 3.681 1162 2HB ALA 144 HB2 ALA 144 3.722 7.744 2.548 1163 3HB ALA 144 HB3 ALA 144 3.401 8.784 3.935 1164 H MET 145 HN MET 145 6.763 9.223 1.364 1165 HA MET 145 HA MET 145 5.623 8.460 -1.225 1166 1HB MET 145 HB2 MET 145 8.242 9.914 -1.046 1167 2HB MET 145 HB1 MET 145 7.240 9.637 -2.450 1168 1HG MET 145 HG2 MET 145 7.047 11.929 -1.875 1169 2HG MET 145 HG1 MET 145 5.530 11.149 -1.445 1170 1HE MET 145 HE1 MET 145 6.447 14.121 -0.203 1171 2HE MET 145 HE2 MET 145 5.695 13.809 1.361 1172 3HE MET 145 HE3 MET 145 4.911 13.258 -0.118 1173 H LEU 146 HN LEU 146 6.394 6.702 -2.106 1174 HA LEU 146 HA LEU 146 7.130 4.514 -1.079 1175 1HB LEU 146 HB2 LEU 146 7.021 4.994 -3.501 1176 2HB LEU 146 HB1 LEU 146 8.690 5.490 -3.454 1177 HG LEU 146 HG LEU 146 9.363 3.238 -2.811 1178 1HD1 LEU 146 HD11 LEU 146 7.472 1.472 -3.149 1179 2HD1 LEU 146 HD12 LEU 146 6.409 2.811 -2.731 1180 3HD1 LEU 146 HD13 LEU 146 7.650 2.284 -1.596 1181 1HD2 LEU 146 HD21 LEU 146 7.969 3.909 -5.302 1182 2HD2 LEU 146 HD22 LEU 146 8.138 2.181 -5.010 1183 3HD2 LEU 146 HD23 LEU 146 9.568 3.211 -5.051 1184 HA PRO 147 HA PRO 147 11.812 4.909 -0.408 1185 1HB PRO 147 HB2 PRO 147 12.729 7.597 -0.975 1186 2HB PRO 147 HB1 PRO 147 13.220 6.080 -1.728 1187 1HG PRO 147 HG2 PRO 147 11.789 7.999 -3.024 1188 2HG PRO 147 HG1 PRO 147 11.691 6.275 -3.418 1189 1HD PRO 147 HD2 PRO 147 9.826 7.956 -1.780 1190 2HD PRO 147 HD1 PRO 147 9.453 6.714 -2.988 1191 H ARG 148 HN ARG 148 13.385 5.985 1.127 1192 HA ARG 148 HA ARG 148 11.859 7.195 3.303 1193 1HB ARG 148 HB2 ARG 148 13.786 6.545 4.725 1194 2HB ARG 148 HB1 ARG 148 13.043 5.187 3.901 1195 1HG ARG 148 HG2 ARG 148 14.839 5.170 2.265 1196 2HG ARG 148 HG1 ARG 148 15.585 6.563 3.055 1197 1HD ARG 148 HD2 ARG 148 16.729 4.615 3.825 1198 2HD ARG 148 HD1 ARG 148 15.714 5.192 5.143 1199 HE ARG 148 HE ARG 148 14.248 3.287 3.741 1200 1HH1 ARG 148 HH11 ARG 148 17.152 3.443 5.673 1201 2HH1 ARG 148 HH12 ARG 148 17.012 1.814 6.243 1202 1HH2 ARG 148 HH21 ARG 148 14.064 1.133 4.500 1203 2HH2 ARG 148 HH22 ARG 148 15.266 0.506 5.579 1204 H GLN 149 HN GLN 149 14.824 8.026 4.251 1205 HA GLN 149 HA GLN 149 14.869 10.522 2.688 1206 1HB GLN 149 HB2 GLN 149 15.195 10.317 5.682 1207 2HB GLN 149 HB1 GLN 149 15.235 11.795 4.733 1208 1HG GLN 149 HG2 GLN 149 12.915 11.540 4.147 1209 2HG GLN 149 HG1 GLN 149 12.848 9.975 4.951 1210 1HE2 GLN 149 HE21 GLN 149 14.805 11.773 6.851 1211 2HE2 GLN 149 HE22 GLN 149 13.643 12.419 7.948 1212 H GLU 150 HN GLU 150 17.006 11.579 4.483 1213 HA GLU 150 HA GLU 150 19.247 11.442 3.163 1214 1HB GLU 150 HB2 GLU 150 19.021 11.157 6.152 1215 2HB GLU 150 HB1 GLU 150 20.565 11.387 5.344 1216 1HG GLU 150 HG2 GLU 150 19.830 13.506 6.117 1217 2HG GLU 150 HG1 GLU 150 19.655 13.495 4.364 1218 H GLU 151 HN GLU 151 19.194 9.533 1.944 1219 HA GLU 151 HA GLU 151 21.129 7.782 2.029 1220 1HB GLU 151 HB2 GLU 151 20.267 5.681 3.113 1221 2HB GLU 151 HB1 GLU 151 20.712 6.954 4.236 1222 1HG GLU 151 HG2 GLU 151 18.304 7.552 4.413 1223 2HG GLU 151 HG1 GLU 151 17.931 6.155 3.407 1224 H CYS 152 HN CYS 152 17.750 8.224 1.633 1225 HA CYS 152 HA CYS 152 17.791 7.230 -1.055 1226 1HB CYS 152 HB2 CYS 152 15.879 5.937 0.909 1227 2HB CYS 152 HB1 CYS 152 15.998 5.600 -0.808 1228 H THR 153 HN THR 153 17.109 9.189 -1.769 1229 HA THR 153 HA THR 153 15.400 10.956 -0.515 1230 HB THR 153 HB THR 153 15.139 12.026 -2.723 1231 HG1 THR 153 HG1 THR 153 15.163 10.709 -4.349 1232 1HG2 THR 153 HG21 THR 153 17.846 11.111 -1.861 1233 2HG2 THR 153 HG22 THR 153 17.119 12.714 -1.760 1234 3HG2 THR 153 HG23 THR 153 17.648 12.082 -3.319 1235 H VAL 154 HN VAL 154 13.313 11.228 -0.281 1236 HA VAL 154 HA VAL 154 11.484 9.141 -1.040 1237 HB VAL 154 HB VAL 154 11.622 10.485 1.176 1238 1HG1 VAL 154 HG11 VAL 154 11.284 12.670 -0.219 1239 2HG1 VAL 154 HG12 VAL 154 10.609 12.508 1.401 1240 3HG1 VAL 154 HG13 VAL 154 9.577 12.283 -0.010 1241 1HG2 VAL 154 HG21 VAL 154 8.811 10.405 0.720 1242 2HG2 VAL 154 HG22 VAL 154 9.824 9.294 1.636 1243 3HG2 VAL 154 HG23 VAL 154 9.578 9.043 -0.091 1244 H ASP 155 HN ASP 155 11.993 9.749 -3.401 1245 HA ASP 155 HA ASP 155 11.258 11.969 -4.772 1246 1HB ASP 155 HB2 ASP 155 12.251 9.843 -5.689 1247 2HB ASP 155 HB1 ASP 155 10.622 9.181 -5.739 1248 H GLU 156 HN GLU 156 9.445 12.482 -6.143 1249 HA GLU 156 HA GLU 156 7.267 12.777 -6.713 1250 1HB GLU 156 HB2 GLU 156 5.818 11.078 -6.497 1251 2HB GLU 156 HB1 GLU 156 7.182 10.203 -5.825 1252 1HG GLU 156 HG2 GLU 156 6.432 10.905 -3.563 1253 2HG GLU 156 HG1 GLU 156 5.008 11.619 -4.308 1254 H VAL 157 HN VAL 157 5.912 14.352 -6.149 1255 HA VAL 157 HA VAL 157 5.236 16.199 -4.997 1256 HB VAL 157 HB VAL 157 3.972 15.779 -2.974 1257 1HG1 VAL 157 HG11 VAL 157 3.663 13.597 -5.029 1258 2HG1 VAL 157 HG12 VAL 157 2.905 15.188 -5.049 1259 3HG1 VAL 157 HG13 VAL 157 2.458 14.014 -3.812 1260 1HG2 VAL 157 HG21 VAL 157 3.973 13.704 -1.804 1261 2HG2 VAL 157 HG22 VAL 157 5.648 14.234 -1.950 1262 3HG2 VAL 157 HG23 VAL 157 5.033 12.962 -3.001 Start of MODEL 6 1 1H MET 1 HT1 MET 1 -24.541 -6.321 -16.211 2 2H MET 1 HT2 MET 1 -23.612 -7.511 -15.448 3 3H MET 1 HT3 MET 1 -23.223 -7.012 -17.016 4 HA MET 1 HA MET 1 -22.918 -4.707 -16.021 5 1HB MET 1 HB2 MET 1 -22.750 -6.459 -13.560 6 2HB MET 1 HB1 MET 1 -22.309 -4.758 -13.626 7 1HG MET 1 HG2 MET 1 -24.614 -4.178 -14.178 8 2HG MET 1 HG1 MET 1 -25.058 -5.883 -14.115 9 1HE MET 1 HE1 MET 1 -24.480 -6.726 -10.334 10 2HE MET 1 HE2 MET 1 -23.245 -6.838 -11.588 11 3HE MET 1 HE3 MET 1 -24.897 -7.355 -11.928 12 H THR 2 HN THR 2 -21.514 -7.867 -15.187 13 HA THR 2 HA THR 2 -19.210 -7.517 -16.738 14 HB THR 2 HB THR 2 -18.597 -5.804 -15.119 15 HG1 THR 2 HG1 THR 2 -17.005 -7.380 -15.943 16 1HG2 THR 2 HG21 THR 2 -18.721 -5.962 -12.896 17 2HG2 THR 2 HG22 THR 2 -18.168 -7.637 -12.882 18 3HG2 THR 2 HG23 THR 2 -19.859 -7.270 -13.222 19 H VAL 3 HN VAL 3 -18.307 -9.456 -17.067 20 HA VAL 3 HA VAL 3 -19.366 -11.740 -15.702 21 HB VAL 3 HB VAL 3 -17.932 -13.065 -17.188 22 1HG1 VAL 3 HG11 VAL 3 -18.936 -12.369 -19.313 23 2HG1 VAL 3 HG12 VAL 3 -19.383 -10.823 -18.591 24 3HG1 VAL 3 HG13 VAL 3 -20.104 -12.318 -17.993 25 1HG2 VAL 3 HG21 VAL 3 -16.623 -10.453 -17.571 26 2HG2 VAL 3 HG22 VAL 3 -16.836 -11.422 -19.029 27 3HG2 VAL 3 HG23 VAL 3 -15.954 -12.083 -17.652 28 HA PRO 4 HA PRO 4 -16.437 -12.094 -12.384 29 1HB PRO 4 HB2 PRO 4 -16.749 -15.018 -12.825 30 2HB PRO 4 HB1 PRO 4 -16.963 -14.073 -11.347 31 1HG PRO 4 HG2 PRO 4 -19.069 -15.009 -12.683 32 2HG PRO 4 HG1 PRO 4 -19.106 -13.405 -11.926 33 1HD PRO 4 HD2 PRO 4 -18.772 -14.140 -14.804 34 2HD PRO 4 HD1 PRO 4 -19.652 -12.779 -14.079 35 H ASP 5 HN ASP 5 -14.259 -12.427 -12.145 36 HA ASP 5 HA ASP 5 -12.798 -14.153 -13.940 37 1HB ASP 5 HB2 ASP 5 -12.369 -11.157 -14.026 38 2HB ASP 5 HB1 ASP 5 -11.340 -12.351 -14.811 39 H ARG 6 HN ARG 6 -11.198 -15.050 -12.806 40 HA ARG 6 HA ARG 6 -10.584 -14.250 -10.165 41 1HB ARG 6 HB2 ARG 6 -10.371 -16.574 -10.929 42 2HB ARG 6 HB1 ARG 6 -9.060 -16.107 -12.004 43 1HG ARG 6 HG2 ARG 6 -7.687 -15.491 -10.102 44 2HG ARG 6 HG1 ARG 6 -9.008 -15.880 -9.002 45 1HD ARG 6 HD2 ARG 6 -7.377 -17.682 -9.063 46 2HD ARG 6 HD1 ARG 6 -8.919 -18.218 -9.724 47 HE ARG 6 HE ARG 6 -6.410 -17.969 -11.124 48 1HH1 ARG 6 HH11 ARG 6 -9.874 -18.297 -11.419 49 2HH1 ARG 6 HH12 ARG 6 -9.812 -18.743 -13.089 50 1HH2 ARG 6 HH21 ARG 6 -6.331 -18.574 -13.314 51 2HH2 ARG 6 HH22 ARG 6 -7.803 -18.908 -14.163 52 H SER 7 HN SER 7 -9.105 -13.630 -13.271 53 HA SER 7 HA SER 7 -6.602 -12.701 -12.590 54 1HB SER 7 HB2 SER 7 -6.728 -11.323 -14.640 55 2HB SER 7 HB1 SER 7 -7.348 -12.950 -14.908 56 HG SER 7 HG SER 7 -9.363 -12.186 -15.041 57 H GLU 8 HN GLU 8 -9.700 -11.122 -12.213 58 HA GLU 8 HA GLU 8 -9.095 -8.482 -11.932 59 1HB GLU 8 HB2 GLU 8 -10.989 -8.278 -10.458 60 2HB GLU 8 HB1 GLU 8 -11.359 -9.496 -11.674 61 1HG GLU 8 HG2 GLU 8 -10.713 -11.240 -10.012 62 2HG GLU 8 HG1 GLU 8 -10.569 -9.960 -8.814 63 H ILE 9 HN ILE 9 -8.288 -11.078 -9.765 64 HA ILE 9 HA ILE 9 -6.626 -9.233 -8.228 65 HB ILE 9 HB ILE 9 -8.547 -11.217 -7.008 66 1HG1 ILE 9 HG12 ILE 9 -9.497 -9.014 -7.604 67 2HG1 ILE 9 HG11 ILE 9 -9.457 -9.261 -5.861 68 1HG2 ILE 9 HG21 ILE 9 -7.226 -9.712 -5.012 69 2HG2 ILE 9 HG22 ILE 9 -5.987 -10.394 -6.062 70 3HG2 ILE 9 HG23 ILE 9 -7.159 -11.449 -5.286 71 1HD1 ILE 9 HD11 ILE 9 -8.781 -7.037 -6.274 72 2HD1 ILE 9 HD12 ILE 9 -7.642 -7.541 -7.522 73 3HD1 ILE 9 HD13 ILE 9 -7.329 -7.935 -5.832 74 H ALA 10 HN ALA 10 -5.458 -10.596 -10.097 75 HA ALA 10 HA ALA 10 -3.749 -12.415 -8.685 76 1HB ALA 10 HB1 ALA 10 -4.552 -14.382 -9.335 77 2HB ALA 10 HB2 ALA 10 -4.534 -13.875 -11.025 78 3HB ALA 10 HB3 ALA 10 -5.945 -13.547 -10.021 79 H GLY 11 HN GLY 11 -1.935 -11.346 -9.248 80 1HA GLY 11 HA2 GLY 11 -0.664 -11.730 -11.650 81 2HA GLY 11 HA1 GLY 11 -1.552 -10.232 -11.868 82 H LYS 12 HN LYS 12 0.166 -8.878 -12.009 83 HA LYS 12 HA LYS 12 2.012 -8.798 -9.728 84 1HB LYS 12 HB2 LYS 12 3.659 -7.855 -11.108 85 2HB LYS 12 HB1 LYS 12 2.919 -9.111 -12.085 86 1HG LYS 12 HG2 LYS 12 2.351 -6.158 -12.287 87 2HG LYS 12 HG1 LYS 12 3.369 -7.094 -13.378 88 1HD LYS 12 HD2 LYS 12 0.399 -7.398 -12.957 89 2HD LYS 12 HD1 LYS 12 1.210 -6.767 -14.388 90 1HE LYS 12 HE2 LYS 12 2.249 -8.943 -14.771 91 2HE LYS 12 HE1 LYS 12 1.459 -9.581 -13.331 92 1HZ LYS 12 HZ1 LYS 12 -0.671 -9.265 -14.349 93 2HZ LYS 12 HZ2 LYS 12 0.303 -10.152 -15.410 94 3HZ LYS 12 HZ3 LYS 12 0.021 -8.509 -15.696 95 H TRP 13 HN TRP 13 1.996 -7.193 -8.375 96 HA TRP 13 HA TRP 13 0.532 -4.713 -9.025 97 1HB TRP 13 HB2 TRP 13 0.911 -6.157 -6.393 98 2HB TRP 13 HB1 TRP 13 0.287 -4.524 -6.507 99 HD1 TRP 13 HD1 TRP 13 -0.932 -7.055 -9.077 100 HE1 TRP 13 HE1 TRP 13 -3.397 -7.605 -8.585 101 HE3 TRP 13 HE3 TRP 13 -1.405 -4.689 -4.574 102 HZ2 TRP 13 HZ2 TRP 13 -5.287 -7.109 -6.553 103 HZ3 TRP 13 HZ3 TRP 13 -3.572 -4.778 -3.417 104 HH2 TRP 13 HH2 TRP 13 -5.472 -5.963 -4.387 105 H TYR 14 HN TYR 14 1.692 -2.813 -8.878 106 HA TYR 14 HA TYR 14 4.370 -2.988 -7.641 107 1HB TYR 14 HB2 TYR 14 3.481 -1.474 -10.093 108 2HB TYR 14 HB1 TYR 14 4.989 -1.123 -9.258 109 HD1 TYR 14 HD1 TYR 14 3.263 -4.280 -10.307 110 HD2 TYR 14 HD2 TYR 14 6.800 -1.920 -10.415 111 HE1 TYR 14 HE1 TYR 14 4.395 -6.044 -11.590 112 HE2 TYR 14 HE2 TYR 14 7.939 -3.675 -11.704 113 HH TYR 14 HH TYR 14 6.527 -5.972 -13.338 114 H VAL 15 HN VAL 15 4.274 -1.984 -5.721 115 HA VAL 15 HA VAL 15 2.542 0.304 -5.351 116 HB VAL 15 HB VAL 15 3.714 -1.639 -3.606 117 1HG1 VAL 15 HG11 VAL 15 5.438 -0.029 -3.068 118 2HG1 VAL 15 HG12 VAL 15 4.319 -0.169 -1.714 119 3HG1 VAL 15 HG13 VAL 15 4.225 1.223 -2.791 120 1HG2 VAL 15 HG21 VAL 15 1.964 -0.969 -2.135 121 2HG2 VAL 15 HG22 VAL 15 1.335 -0.886 -3.780 122 3HG2 VAL 15 HG23 VAL 15 1.805 0.590 -2.941 123 H VAL 16 HN VAL 16 3.094 2.328 -5.570 124 HA VAL 16 HA VAL 16 5.878 3.134 -5.190 125 HB VAL 16 HB VAL 16 5.800 4.560 -7.211 126 1HG1 VAL 16 HG11 VAL 16 6.978 2.495 -7.365 127 2HG1 VAL 16 HG12 VAL 16 6.035 2.668 -8.844 128 3HG1 VAL 16 HG13 VAL 16 5.480 1.586 -7.567 129 1HG2 VAL 16 HG21 VAL 16 4.101 4.523 -8.765 130 2HG2 VAL 16 HG22 VAL 16 3.191 4.392 -7.265 131 3HG2 VAL 16 HG23 VAL 16 3.502 2.954 -8.234 132 H ALA 17 HN ALA 17 2.499 4.158 -5.582 133 HA ALA 17 HA ALA 17 3.043 6.794 -4.506 134 1HB ALA 17 HB1 ALA 17 0.240 6.004 -4.546 135 2HB ALA 17 HB2 ALA 17 1.038 5.733 -6.095 136 3HB ALA 17 HB3 ALA 17 1.046 7.339 -5.366 137 H LEU 18 HN LEU 18 2.912 7.363 -2.363 138 HA LEU 18 HA LEU 18 1.610 5.476 -0.519 139 1HB LEU 18 HB2 LEU 18 4.266 6.804 -0.002 140 2HB LEU 18 HB1 LEU 18 3.403 5.775 1.118 141 HG LEU 18 HG LEU 18 5.231 4.550 0.178 142 1HD1 LEU 18 HD11 LEU 18 3.359 3.168 0.574 143 2HD1 LEU 18 HD12 LEU 18 4.002 2.705 -1.003 144 3HD1 LEU 18 HD13 LEU 18 2.563 3.715 -0.899 145 1HD2 LEU 18 HD21 LEU 18 5.917 4.675 -1.933 146 2HD2 LEU 18 HD22 LEU 18 4.839 6.066 -2.059 147 3HD2 LEU 18 HD23 LEU 18 4.285 4.471 -2.567 148 H ALA 19 HN ALA 19 1.508 6.401 1.739 149 HA ALA 19 HA ALA 19 1.491 9.214 2.149 150 1HB ALA 19 HB1 ALA 19 -1.211 8.816 2.640 151 2HB ALA 19 HB2 ALA 19 -0.929 8.027 1.085 152 3HB ALA 19 HB3 ALA 19 -0.510 9.721 1.302 153 H SER 20 HN SER 20 2.240 9.233 4.213 154 HA SER 20 HA SER 20 0.919 7.426 6.142 155 1HB SER 20 HB2 SER 20 3.131 6.976 7.165 156 2HB SER 20 HB1 SER 20 3.003 6.380 5.509 157 HG SER 20 HG SER 20 4.932 7.450 5.665 158 H ASN 21 HN ASN 21 1.373 7.890 8.387 159 HA ASN 21 HA ASN 21 2.377 10.401 9.245 160 1HB ASN 21 HB2 ASN 21 0.151 11.165 10.230 161 2HB ASN 21 HB1 ASN 21 0.369 11.385 8.498 162 1HD2 ASN 21 HD21 ASN 21 -0.796 10.123 7.074 163 2HD2 ASN 21 HD22 ASN 21 -2.173 9.204 7.557 164 H THR 22 HN THR 22 2.738 10.411 11.452 165 HA THR 22 HA THR 22 1.479 8.706 13.310 166 HB THR 22 HB THR 22 2.474 6.883 12.144 167 HG1 THR 22 HG1 THR 22 4.264 7.383 14.271 168 1HG2 THR 22 HG21 THR 22 4.414 8.628 11.332 169 2HG2 THR 22 HG22 THR 22 4.435 6.882 11.096 170 3HG2 THR 22 HG23 THR 22 5.271 7.595 12.471 171 H GLU 23 HN GLU 23 2.786 8.500 15.368 172 HA GLU 23 HA GLU 23 3.890 11.077 15.992 173 1HB GLU 23 HB2 GLU 23 3.475 8.615 17.692 174 2HB GLU 23 HB1 GLU 23 4.024 10.168 18.308 175 1HG GLU 23 HG2 GLU 23 1.933 11.196 17.569 176 2HG GLU 23 HG1 GLU 23 1.386 9.634 16.960 177 H PHE 24 HN PHE 24 5.377 8.412 17.652 178 HA PHE 24 HA PHE 24 7.965 9.372 17.234 179 1HB PHE 24 HB2 PHE 24 8.715 7.211 18.210 180 2HB PHE 24 HB1 PHE 24 7.467 8.012 19.156 181 HD1 PHE 24 HD1 PHE 24 5.602 6.835 19.822 182 HD2 PHE 24 HD2 PHE 24 7.914 5.381 16.560 183 HE1 PHE 24 HE1 PHE 24 4.252 4.779 19.786 184 HE2 PHE 24 HE2 PHE 24 6.565 3.325 16.513 185 HZ PHE 24 HZ PHE 24 4.730 3.022 18.129 186 H PHE 25 HN PHE 25 6.190 6.807 15.561 187 HA PHE 25 HA PHE 25 8.299 5.793 14.029 188 1HB PHE 25 HB2 PHE 25 6.165 4.643 14.183 189 2HB PHE 25 HB1 PHE 25 5.350 5.974 13.380 190 HD1 PHE 25 HD1 PHE 25 8.566 4.359 12.472 191 HD2 PHE 25 HD2 PHE 25 4.483 4.994 11.461 192 HE1 PHE 25 HE1 PHE 25 8.934 3.255 10.301 193 HE2 PHE 25 HE2 PHE 25 4.843 3.897 9.290 194 HZ PHE 25 HZ PHE 25 7.071 3.024 8.708 195 H LEU 26 HN LEU 26 6.703 8.804 13.876 196 HA LEU 26 HA LEU 26 6.705 9.590 11.272 197 1HB LEU 26 HB2 LEU 26 5.994 10.950 13.216 198 2HB LEU 26 HB1 LEU 26 7.675 11.233 13.612 199 HG LEU 26 HG LEU 26 6.422 12.113 11.013 200 1HD1 LEU 26 HD11 LEU 26 6.700 13.552 13.639 201 2HD1 LEU 26 HD12 LEU 26 5.240 13.294 12.684 202 3HD1 LEU 26 HD13 LEU 26 6.492 14.392 12.103 203 1HD2 LEU 26 HD21 LEU 26 8.618 12.316 10.535 204 2HD2 LEU 26 HD22 LEU 26 9.097 12.284 12.231 205 3HD2 LEU 26 HD23 LEU 26 8.494 13.778 11.514 206 H ARG 27 HN ARG 27 9.522 9.505 13.437 207 HA ARG 27 HA ARG 27 11.397 10.755 11.873 208 1HB ARG 27 HB2 ARG 27 13.097 9.427 13.018 209 2HB ARG 27 HB1 ARG 27 11.861 9.977 14.140 210 1HG ARG 27 HG2 ARG 27 10.823 7.766 14.086 211 2HG ARG 27 HG1 ARG 27 12.064 7.213 12.960 212 1HD ARG 27 HD2 ARG 27 13.788 7.669 14.633 213 2HD ARG 27 HD1 ARG 27 12.553 8.234 15.756 214 HE ARG 27 HE ARG 27 11.906 5.627 14.964 215 1HH1 ARG 27 HH11 ARG 27 14.336 7.316 16.815 216 2HH1 ARG 27 HH12 ARG 27 14.659 5.971 17.856 217 1HH2 ARG 27 HH21 ARG 27 12.332 3.853 16.336 218 2HH2 ARG 27 HH22 ARG 27 13.523 4.005 17.584 219 H GLU 28 HN GLU 28 10.195 7.453 11.567 220 HA GLU 28 HA GLU 28 12.062 6.828 9.458 221 1HB GLU 28 HB2 GLU 28 9.715 5.302 10.575 222 2HB GLU 28 HB1 GLU 28 10.770 4.691 9.308 223 1HG GLU 28 HG2 GLU 28 12.680 4.875 10.856 224 2HG GLU 28 HG1 GLU 28 11.567 5.388 12.125 225 H LYS 29 HN LYS 29 9.773 8.967 9.245 226 HA LYS 29 HA LYS 29 8.193 7.946 7.065 227 1HB LYS 29 HB2 LYS 29 7.104 10.042 7.015 228 2HB LYS 29 HB1 LYS 29 7.418 9.720 8.713 229 1HG LYS 29 HG2 LYS 29 9.343 11.227 8.645 230 2HG LYS 29 HG1 LYS 29 9.033 11.539 6.937 231 1HD LYS 29 HD2 LYS 29 6.829 12.444 7.506 232 2HD LYS 29 HD1 LYS 29 7.150 12.145 9.214 233 1HE LYS 29 HE2 LYS 29 9.055 13.682 9.117 234 2HE LYS 29 HE1 LYS 29 8.718 13.986 7.413 235 1HZ LYS 29 HZ1 LYS 29 6.937 15.273 7.900 236 2HZ LYS 29 HZ2 LYS 29 7.800 15.533 9.331 237 3HZ LYS 29 HZ3 LYS 29 6.534 14.413 9.300 238 H ASP 30 HN ASP 30 11.091 9.841 7.470 239 HA ASP 30 HA ASP 30 11.300 10.866 4.862 240 1HB ASP 30 HB2 ASP 30 12.654 11.681 6.751 241 2HB ASP 30 HB1 ASP 30 13.514 10.146 6.796 242 H LYS 31 HN LYS 31 12.270 7.792 6.277 243 HA LYS 31 HA LYS 31 13.602 6.917 3.871 244 1HB LYS 31 HB2 LYS 31 12.980 5.558 6.485 245 2HB LYS 31 HB1 LYS 31 13.718 4.708 5.137 246 1HG LYS 31 HG2 LYS 31 15.415 5.402 6.691 247 2HG LYS 31 HG1 LYS 31 15.592 6.299 5.184 248 1HD LYS 31 HD2 LYS 31 15.895 7.757 7.114 249 2HD LYS 31 HD1 LYS 31 14.463 8.221 6.197 250 1HE LYS 31 HE2 LYS 31 14.003 8.276 8.582 251 2HE LYS 31 HE1 LYS 31 13.058 7.011 7.801 252 1HZ LYS 31 HZ1 LYS 31 14.281 5.362 8.778 253 2HZ LYS 31 HZ2 LYS 31 14.329 6.531 9.999 254 3HZ LYS 31 HZ3 LYS 31 15.659 6.325 8.975 255 H MET 32 HN MET 32 11.185 7.540 2.971 256 HA MET 32 HA MET 32 9.119 5.697 3.132 257 1HB MET 32 HB2 MET 32 9.980 7.264 0.699 258 2HB MET 32 HB1 MET 32 8.402 6.531 0.939 259 1HG MET 32 HG2 MET 32 9.523 8.630 2.770 260 2HG MET 32 HG1 MET 32 8.562 9.009 1.345 261 1HE MET 32 HE1 MET 32 7.432 5.960 4.213 262 2HE MET 32 HE2 MET 32 7.370 7.319 5.335 263 3HE MET 32 HE3 MET 32 8.856 6.973 4.453 264 H LYS 33 HN LYS 33 9.220 3.614 2.892 265 HA LYS 33 HA LYS 33 11.227 2.318 1.313 266 1HB LYS 33 HB2 LYS 33 10.219 0.257 2.151 267 2HB LYS 33 HB1 LYS 33 10.475 1.408 3.453 268 1HG LYS 33 HG2 LYS 33 8.072 2.065 3.235 269 2HG LYS 33 HG1 LYS 33 7.874 0.725 2.106 270 1HD LYS 33 HD2 LYS 33 8.601 -0.840 3.849 271 2HD LYS 33 HD1 LYS 33 8.793 0.505 4.973 272 1HE LYS 33 HE2 LYS 33 6.405 1.003 4.777 273 2HE LYS 33 HE1 LYS 33 6.216 -0.341 3.653 274 1HZ LYS 33 HZ1 LYS 33 6.995 -0.512 6.513 275 2HZ LYS 33 HZ2 LYS 33 6.995 -1.827 5.449 276 3HZ LYS 33 HZ3 LYS 33 5.544 -1.041 5.821 277 H MET 34 HN MET 34 11.086 1.403 -0.648 278 HA MET 34 HA MET 34 8.730 1.908 -2.271 279 1HB MET 34 HB2 MET 34 10.960 2.205 -3.250 280 2HB MET 34 HB1 MET 34 11.347 0.524 -2.920 281 1HG MET 34 HG2 MET 34 9.605 -0.185 -4.472 282 2HG MET 34 HG1 MET 34 9.208 1.501 -4.798 283 1HE MET 34 HE1 MET 34 10.149 -0.715 -7.216 284 2HE MET 34 HE2 MET 34 10.833 0.614 -8.152 285 3HE MET 34 HE3 MET 34 9.345 0.854 -7.237 286 H ALA 35 HN ALA 35 7.509 0.139 -3.387 287 HA ALA 35 HA ALA 35 8.026 -2.516 -2.317 288 1HB ALA 35 HB1 ALA 35 6.177 -0.818 -1.054 289 2HB ALA 35 HB2 ALA 35 6.514 -2.516 -0.718 290 3HB ALA 35 HB3 ALA 35 5.252 -2.079 -1.869 291 H MET 36 HN MET 36 7.465 -4.113 -3.547 292 HA MET 36 HA MET 36 5.621 -3.691 -5.807 293 1HB MET 36 HB2 MET 36 7.937 -3.787 -6.649 294 2HB MET 36 HB1 MET 36 8.199 -5.296 -5.786 295 1HG MET 36 HG2 MET 36 6.442 -6.344 -7.178 296 2HG MET 36 HG1 MET 36 6.324 -4.843 -8.093 297 1HE MET 36 HE1 MET 36 9.695 -6.451 -6.668 298 2HE MET 36 HE2 MET 36 10.035 -7.576 -7.983 299 3HE MET 36 HE3 MET 36 8.585 -7.780 -7.000 300 H ALA 37 HN ALA 37 4.037 -5.307 -5.953 301 HA ALA 37 HA ALA 37 4.436 -7.692 -4.271 302 1HB ALA 37 HB1 ALA 37 3.034 -5.709 -3.273 303 2HB ALA 37 HB2 ALA 37 2.549 -7.387 -3.026 304 3HB ALA 37 HB3 ALA 37 1.757 -6.414 -4.264 305 H ARG 38 HN ARG 38 3.038 -9.450 -4.647 306 HA ARG 38 HA ARG 38 1.705 -9.498 -7.275 307 1HB ARG 38 HB2 ARG 38 3.300 -11.742 -6.000 308 2HB ARG 38 HB1 ARG 38 2.384 -11.870 -7.495 309 1HG ARG 38 HG2 ARG 38 3.859 -10.212 -8.534 310 2HG ARG 38 HG1 ARG 38 4.785 -10.108 -7.034 311 1HD ARG 38 HD2 ARG 38 5.343 -12.485 -7.218 312 2HD ARG 38 HD1 ARG 38 4.415 -12.589 -8.712 313 HE ARG 38 HE ARG 38 6.343 -10.581 -9.005 314 1HH1 ARG 38 HH11 ARG 38 6.155 -14.051 -8.663 315 2HH1 ARG 38 HH12 ARG 38 7.612 -14.343 -9.551 316 1HH2 ARG 38 HH21 ARG 38 8.264 -10.968 -10.175 317 2HH2 ARG 38 HH22 ARG 38 8.808 -12.595 -10.408 318 H ILE 39 HN ILE 39 -0.431 -10.047 -7.080 319 HA ILE 39 HA ILE 39 -1.289 -10.979 -4.444 320 HB ILE 39 HB ILE 39 -2.298 -8.925 -5.387 321 1HG1 ILE 39 HG12 ILE 39 -4.401 -11.058 -5.080 322 2HG1 ILE 39 HG11 ILE 39 -3.405 -10.540 -3.723 323 1HG2 ILE 39 HG21 ILE 39 -3.630 -10.802 -7.336 324 2HG2 ILE 39 HG22 ILE 39 -2.370 -9.636 -7.737 325 3HG2 ILE 39 HG23 ILE 39 -3.941 -9.075 -7.164 326 1HD1 ILE 39 HD11 ILE 39 -4.220 -8.260 -3.995 327 2HD1 ILE 39 HD12 ILE 39 -5.542 -9.397 -3.734 328 3HD1 ILE 39 HD13 ILE 39 -5.218 -8.779 -5.354 329 H SER 40 HN SER 40 -2.466 -12.764 -4.035 330 HA SER 40 HA SER 40 -3.594 -14.443 -6.064 331 1HB SER 40 HB2 SER 40 -1.231 -15.055 -6.331 332 2HB SER 40 HB1 SER 40 -1.114 -15.407 -4.606 333 HG SER 40 HG SER 40 -2.734 -17.033 -4.961 334 H PHE 41 HN PHE 41 -5.145 -15.799 -5.190 335 HA PHE 41 HA PHE 41 -5.801 -15.411 -2.411 336 1HB PHE 41 HB2 PHE 41 -7.141 -17.082 -4.544 337 2HB PHE 41 HB1 PHE 41 -7.794 -16.791 -2.936 338 HD1 PHE 41 HD1 PHE 41 -8.889 -14.755 -2.399 339 HD2 PHE 41 HD2 PHE 41 -6.954 -15.213 -6.164 340 HE1 PHE 41 HE1 PHE 41 -9.998 -12.716 -3.212 341 HE2 PHE 41 HE2 PHE 41 -8.060 -13.171 -6.982 342 HZ PHE 41 HZ PHE 41 -9.584 -11.921 -5.503 343 H LEU 42 HN LEU 42 -5.570 -16.780 -0.704 344 HA LEU 42 HA LEU 42 -4.182 -19.324 -1.188 345 1HB LEU 42 HB2 LEU 42 -4.498 -17.756 1.370 346 2HB LEU 42 HB1 LEU 42 -3.653 -19.277 1.225 347 HG LEU 42 HG LEU 42 -2.829 -16.636 0.023 348 1HD1 LEU 42 HD11 LEU 42 -2.526 -17.152 2.517 349 2HD1 LEU 42 HD12 LEU 42 -1.103 -16.640 1.612 350 3HD1 LEU 42 HD13 LEU 42 -1.337 -18.343 1.993 351 1HD2 LEU 42 HD21 LEU 42 -1.931 -19.425 -0.494 352 2HD2 LEU 42 HD22 LEU 42 -0.704 -18.162 -0.392 353 3HD2 LEU 42 HD23 LEU 42 -2.000 -18.037 -1.582 354 H GLY 43 HN GLY 43 -5.260 -21.179 -1.001 355 1HA GLY 43 HA2 GLY 43 -7.100 -22.576 -0.684 356 2HA GLY 43 HA1 GLY 43 -6.683 -22.228 0.982 357 H GLU 44 HN GLU 44 -8.079 -19.901 -1.271 358 HA GLU 44 HA GLU 44 -10.083 -18.820 -1.331 359 1HB GLU 44 HB2 GLU 44 -11.042 -21.224 0.220 360 2HB GLU 44 HB1 GLU 44 -12.089 -19.988 -0.463 361 1HG GLU 44 HG2 GLU 44 -11.336 -20.570 -2.700 362 2HG GLU 44 HG1 GLU 44 -10.252 -21.786 -2.025 363 H ASP 45 HN ASP 45 -9.950 -20.338 1.895 364 HA ASP 45 HA ASP 45 -11.326 -18.503 3.343 365 1HB ASP 45 HB2 ASP 45 -10.344 -20.654 4.182 366 2HB ASP 45 HB1 ASP 45 -8.800 -19.823 4.342 367 H GLU 46 HN GLU 46 -7.913 -18.205 2.382 368 HA GLU 46 HA GLU 46 -8.052 -15.387 3.199 369 1HB GLU 46 HB2 GLU 46 -5.918 -17.381 3.890 370 2HB GLU 46 HB1 GLU 46 -5.564 -15.664 3.826 371 1HG GLU 46 HG2 GLU 46 -5.987 -16.308 6.089 372 2HG GLU 46 HG1 GLU 46 -7.293 -15.269 5.527 373 H LEU 47 HN LEU 47 -6.904 -13.917 1.982 374 HA LEU 47 HA LEU 47 -5.670 -14.984 -0.471 375 1HB LEU 47 HB2 LEU 47 -6.204 -12.823 -1.537 376 2HB LEU 47 HB1 LEU 47 -7.627 -13.717 -1.044 377 HG LEU 47 HG LEU 47 -7.740 -12.230 0.990 378 1HD1 LEU 47 HD11 LEU 47 -5.301 -11.211 -0.242 379 2HD1 LEU 47 HD12 LEU 47 -5.896 -11.043 1.409 380 3HD1 LEU 47 HD13 LEU 47 -6.471 -9.952 0.151 381 1HD2 LEU 47 HD21 LEU 47 -8.396 -10.183 -0.535 382 2HD2 LEU 47 HD22 LEU 47 -9.333 -11.677 -0.559 383 3HD2 LEU 47 HD23 LEU 47 -8.148 -11.357 -1.826 384 H LYS 48 HN LYS 48 -3.587 -14.352 -0.978 385 HA LYS 48 HA LYS 48 -2.312 -12.539 0.965 386 1HB LYS 48 HB2 LYS 48 -0.410 -13.945 1.092 387 2HB LYS 48 HB1 LYS 48 -1.815 -14.978 1.279 388 1HG LYS 48 HG2 LYS 48 -0.507 -16.222 -0.131 389 2HG LYS 48 HG1 LYS 48 -1.535 -15.367 -1.281 390 1HD LYS 48 HD2 LYS 48 0.206 -13.781 -1.743 391 2HD LYS 48 HD1 LYS 48 1.201 -14.424 -0.438 392 1HE LYS 48 HE2 LYS 48 1.384 -16.547 -1.630 393 2HE LYS 48 HE1 LYS 48 0.384 -15.905 -2.933 394 1HZ LYS 48 HZ1 LYS 48 2.053 -14.551 -3.671 395 2HZ LYS 48 HZ2 LYS 48 2.969 -15.851 -3.095 396 3HZ LYS 48 HZ3 LYS 48 2.811 -14.450 -2.162 397 H VAL 49 HN VAL 49 -0.454 -11.390 0.332 398 HA VAL 49 HA VAL 49 0.130 -11.259 -2.525 399 HB VAL 49 HB VAL 49 -1.543 -9.466 -2.029 400 1HG1 VAL 49 HG11 VAL 49 -0.319 -9.117 0.318 401 2HG1 VAL 49 HG12 VAL 49 -1.284 -7.862 -0.460 402 3HG1 VAL 49 HG13 VAL 49 0.475 -7.846 -0.602 403 1HG2 VAL 49 HG21 VAL 49 1.110 -9.061 -3.201 404 2HG2 VAL 49 HG22 VAL 49 0.276 -7.573 -2.755 405 3HG2 VAL 49 HG23 VAL 49 -0.492 -8.716 -3.854 406 H SER 50 HN SER 50 2.217 -11.730 -2.625 407 HA SER 50 HA SER 50 4.028 -11.157 -0.433 408 1HB SER 50 HB2 SER 50 4.554 -12.387 -3.158 409 2HB SER 50 HB1 SER 50 5.695 -12.339 -1.814 410 HG SER 50 HG SER 50 4.811 -14.166 -1.290 411 H TYR 51 HN TYR 51 5.467 -9.440 -0.385 412 HA TYR 51 HA TYR 51 5.915 -8.024 -2.890 413 1HB TYR 51 HB2 TYR 51 5.448 -5.826 -1.787 414 2HB TYR 51 HB1 TYR 51 4.040 -6.841 -2.034 415 HD1 TYR 51 HD1 TYR 51 6.540 -5.944 0.573 416 HD2 TYR 51 HD2 TYR 51 2.584 -7.247 -0.283 417 HE1 TYR 51 HE1 TYR 51 5.959 -5.727 2.953 418 HE2 TYR 51 HE2 TYR 51 1.992 -7.036 2.092 419 HH TYR 51 HH TYR 51 3.753 -5.346 4.282 420 H ALA 52 HN ALA 52 7.784 -7.048 -3.133 421 HA ALA 52 HA ALA 52 9.832 -7.456 -1.091 422 1HB ALA 52 HB1 ALA 52 10.014 -6.623 -3.993 423 2HB ALA 52 HB2 ALA 52 10.390 -8.210 -3.328 424 3HB ALA 52 HB3 ALA 52 11.398 -6.824 -2.920 425 H VAL 53 HN VAL 53 10.821 -5.760 -0.035 426 HA VAL 53 HA VAL 53 10.161 -3.048 -0.931 427 HB VAL 53 HB VAL 53 9.839 -3.923 1.936 428 1HG1 VAL 53 HG11 VAL 53 9.448 -1.774 2.474 429 2HG1 VAL 53 HG12 VAL 53 8.631 -1.427 0.954 430 3HG1 VAL 53 HG13 VAL 53 10.393 -1.443 1.025 431 1HG2 VAL 53 HG21 VAL 53 7.900 -4.796 1.248 432 2HG2 VAL 53 HG22 VAL 53 7.989 -4.001 -0.322 433 3HG2 VAL 53 HG23 VAL 53 7.369 -3.125 1.074 434 HA PRO 54 HA PRO 54 14.448 -2.620 0.413 435 1HB PRO 54 HB2 PRO 54 15.123 -0.785 -1.422 436 2HB PRO 54 HB1 PRO 54 14.903 -2.485 -1.845 437 1HG PRO 54 HG2 PRO 54 13.225 -0.175 -2.505 438 2HG PRO 54 HG1 PRO 54 13.266 -1.780 -3.249 439 1HD PRO 54 HD2 PRO 54 11.440 -0.743 -1.235 440 2HD PRO 54 HD1 PRO 54 11.351 -2.267 -2.141 441 H LYS 55 HN LYS 55 15.431 -1.231 1.769 442 HA LYS 55 HA LYS 55 16.003 0.926 2.573 443 1HB LYS 55 HB2 LYS 55 13.108 1.615 2.062 444 2HB LYS 55 HB1 LYS 55 14.252 2.661 2.883 445 1HG LYS 55 HG2 LYS 55 15.643 2.712 0.862 446 2HG LYS 55 HG1 LYS 55 14.452 1.712 0.032 447 1HD LYS 55 HD2 LYS 55 14.148 4.066 -0.521 448 2HD LYS 55 HD1 LYS 55 12.761 3.446 0.377 449 1HE LYS 55 HE2 LYS 55 13.574 4.462 2.412 450 2HE LYS 55 HE1 LYS 55 15.043 4.993 1.598 451 1HZ LYS 55 HZ1 LYS 55 13.875 6.564 0.360 452 2HZ LYS 55 HZ2 LYS 55 13.188 6.683 1.901 453 3HZ LYS 55 HZ3 LYS 55 12.371 5.854 0.674 454 HA PRO 56 HA PRO 56 12.613 0.136 6.157 455 1HB PRO 56 HB2 PRO 56 12.300 -2.724 5.349 456 2HB PRO 56 HB1 PRO 56 11.152 -1.653 6.163 457 1HG PRO 56 HG2 PRO 56 10.885 -2.187 3.580 458 2HG PRO 56 HG1 PRO 56 10.586 -0.553 4.199 459 1HD PRO 56 HD2 PRO 56 12.903 -1.606 2.660 460 2HD PRO 56 HD1 PRO 56 12.167 0.008 2.624 461 H ASN 57 HN ASN 57 13.261 -0.689 8.135 462 HA ASN 57 HA ASN 57 14.656 -1.557 9.700 463 1HB ASN 57 HB2 ASN 57 15.436 -3.440 7.465 464 2HB ASN 57 HB1 ASN 57 15.929 -3.623 9.144 465 1HD2 ASN 57 HD21 ASN 57 14.780 -5.049 10.206 466 2HD2 ASN 57 HD22 ASN 57 13.110 -5.414 9.954 467 H GLY 58 HN GLY 58 15.451 0.732 8.380 468 1HA GLY 58 HA2 GLY 58 17.465 1.947 8.799 469 2HA GLY 58 HA1 GLY 58 18.373 0.463 8.556 470 H CYS 59 HN CYS 59 17.961 -0.478 6.213 471 HA CYS 59 HA CYS 59 17.349 1.197 4.075 472 1HB CYS 59 HB2 CYS 59 19.321 2.490 4.939 473 2HB CYS 59 HB1 CYS 59 20.331 1.095 4.581 474 H ARG 60 HN ARG 60 16.660 -1.300 4.300 475 HA ARG 60 HA ARG 60 18.118 -2.624 2.169 476 1HB ARG 60 HB2 ARG 60 18.369 -4.749 3.336 477 2HB ARG 60 HB1 ARG 60 19.265 -3.481 4.158 478 1HG ARG 60 HG2 ARG 60 16.517 -4.318 5.020 479 2HG ARG 60 HG1 ARG 60 17.979 -5.119 5.598 480 1HD ARG 60 HD2 ARG 60 17.232 -2.220 5.936 481 2HD ARG 60 HD1 ARG 60 17.324 -3.450 7.193 482 HE ARG 60 HE ARG 60 19.467 -1.898 6.203 483 1HH1 ARG 60 HH11 ARG 60 18.689 -5.099 7.360 484 2HH1 ARG 60 HH12 ARG 60 20.319 -5.465 7.815 485 1HH2 ARG 60 HH21 ARG 60 21.609 -2.380 6.802 486 2HH2 ARG 60 HH22 ARG 60 21.975 -3.921 7.501 487 H LYS 61 HN LYS 61 16.962 -4.633 1.430 488 HA LYS 61 HA LYS 61 14.118 -4.053 1.453 489 1HB LYS 61 HB2 LYS 61 13.986 -5.553 -0.492 490 2HB LYS 61 HB1 LYS 61 15.144 -4.250 -0.719 491 1HG LYS 61 HG2 LYS 61 16.967 -5.810 -0.160 492 2HG LYS 61 HG1 LYS 61 15.781 -7.109 -0.022 493 1HD LYS 61 HD2 LYS 61 16.870 -7.145 -2.207 494 2HD LYS 61 HD1 LYS 61 15.150 -6.785 -2.363 495 1HE LYS 61 HE2 LYS 61 15.678 -4.396 -2.553 496 2HE LYS 61 HE1 LYS 61 17.395 -4.769 -2.412 497 1HZ LYS 61 HZ1 LYS 61 15.933 -6.172 -4.500 498 2HZ LYS 61 HZ2 LYS 61 17.495 -5.522 -4.520 499 3HZ LYS 61 HZ3 LYS 61 16.156 -4.510 -4.734 500 H TRP 62 HN TRP 62 12.482 -5.572 1.770 501 HA TRP 62 HA TRP 62 13.242 -8.150 2.927 502 1HB TRP 62 HB2 TRP 62 11.590 -6.064 4.337 503 2HB TRP 62 HB1 TRP 62 11.467 -7.772 4.734 504 HD1 TRP 62 HD1 TRP 62 14.406 -5.232 4.410 505 HE1 TRP 62 HE1 TRP 62 15.993 -5.633 6.395 506 HE3 TRP 62 HE3 TRP 62 11.956 -9.124 6.650 507 HZ2 TRP 62 HZ2 TRP 62 16.188 -7.364 8.611 508 HZ3 TRP 62 HZ3 TRP 62 12.913 -10.096 8.699 509 HH2 TRP 62 HH2 TRP 62 14.986 -9.233 9.658 510 H GLU 63 HN GLU 63 11.815 -9.777 2.579 511 HA GLU 63 HA GLU 63 9.482 -9.152 0.899 512 1HB GLU 63 HB2 GLU 63 10.816 -11.833 1.327 513 2HB GLU 63 HB1 GLU 63 9.589 -11.445 0.131 514 1HG GLU 63 HG2 GLU 63 12.394 -10.364 0.207 515 2HG GLU 63 HG1 GLU 63 11.781 -11.606 -0.884 516 H THR 64 HN THR 64 7.408 -9.803 1.528 517 HA THR 64 HA THR 64 7.125 -11.601 3.782 518 HB THR 64 HB THR 64 7.544 -9.373 4.839 519 HG1 THR 64 HG1 THR 64 5.070 -10.686 5.204 520 1HG2 THR 64 HG21 THR 64 5.898 -7.662 4.815 521 2HG2 THR 64 HG22 THR 64 4.824 -8.628 3.804 522 3HG2 THR 64 HG23 THR 64 6.337 -8.008 3.142 523 H THR 65 HN THR 65 5.154 -12.566 3.928 524 HA THR 65 HA THR 65 3.310 -12.012 1.717 525 HB THR 65 HB THR 65 3.673 -14.441 3.478 526 HG1 THR 65 HG1 THR 65 4.237 -15.364 1.413 527 1HG2 THR 65 HG21 THR 65 1.354 -13.698 2.018 528 2HG2 THR 65 HG22 THR 65 1.678 -15.184 2.911 529 3HG2 THR 65 HG23 THR 65 2.124 -15.064 1.209 530 H PHE 66 HN PHE 66 1.708 -10.665 2.253 531 HA PHE 66 HA PHE 66 0.549 -10.841 4.947 532 1HB PHE 66 HB2 PHE 66 0.533 -8.705 2.832 533 2HB PHE 66 HB1 PHE 66 -0.690 -8.710 4.095 534 HD1 PHE 66 HD1 PHE 66 -0.014 -6.632 5.068 535 HD2 PHE 66 HD2 PHE 66 2.767 -9.832 4.681 536 HE1 PHE 66 HE1 PHE 66 1.532 -5.470 6.588 537 HE2 PHE 66 HE2 PHE 66 4.316 -8.676 6.201 538 HZ PHE 66 HZ PHE 66 3.700 -6.491 7.157 539 H LYS 67 HN LYS 67 -1.472 -11.664 5.277 540 HA LYS 67 HA LYS 67 -3.415 -11.768 3.176 541 1HB LYS 67 HB2 LYS 67 -3.497 -14.151 2.853 542 2HB LYS 67 HB1 LYS 67 -1.874 -13.572 2.525 543 1HG LYS 67 HG2 LYS 67 -2.602 -14.733 5.183 544 2HG LYS 67 HG1 LYS 67 -2.115 -15.745 3.822 545 1HD LYS 67 HD2 LYS 67 -0.027 -14.368 3.664 546 2HD LYS 67 HD1 LYS 67 -0.506 -13.582 5.171 547 1HE LYS 67 HE2 LYS 67 -0.046 -16.541 4.799 548 2HE LYS 67 HE1 LYS 67 1.088 -15.418 5.547 549 1HZ LYS 67 HZ1 LYS 67 -1.638 -16.049 6.544 550 2HZ LYS 67 HZ2 LYS 67 -0.554 -14.971 7.267 551 3HZ LYS 67 HZ3 LYS 67 -0.188 -16.621 7.204 552 H LYS 68 HN LYS 68 -5.431 -12.571 3.772 553 HA LYS 68 HA LYS 68 -6.158 -13.862 6.087 554 1HB LYS 68 HB2 LYS 68 -5.206 -11.905 7.269 555 2HB LYS 68 HB1 LYS 68 -6.363 -10.873 6.445 556 1HG LYS 68 HG2 LYS 68 -7.231 -11.266 8.611 557 2HG LYS 68 HG1 LYS 68 -8.185 -12.259 7.512 558 1HD LYS 68 HD2 LYS 68 -6.861 -14.220 8.123 559 2HD LYS 68 HD1 LYS 68 -5.871 -13.222 9.192 560 1HE LYS 68 HE2 LYS 68 -8.834 -13.711 9.473 561 2HE LYS 68 HE1 LYS 68 -7.567 -14.454 10.448 562 1HZ LYS 68 HZ1 LYS 68 -8.148 -11.544 10.315 563 2HZ LYS 68 HZ2 LYS 68 -6.957 -12.274 11.269 564 3HZ LYS 68 HZ3 LYS 68 -8.592 -12.577 11.578 565 H THR 69 HN THR 69 -8.200 -11.111 5.944 566 HA THR 69 HA THR 69 -9.848 -12.461 3.899 567 HB THR 69 HB THR 69 -11.851 -11.835 5.158 568 HG1 THR 69 HG1 THR 69 -11.132 -10.016 6.228 569 1HG2 THR 69 HG21 THR 69 -11.615 -13.840 6.079 570 2HG2 THR 69 HG22 THR 69 -10.897 -13.020 7.463 571 3HG2 THR 69 HG23 THR 69 -9.866 -13.668 6.187 572 H SER 70 HN SER 70 -11.317 -11.111 2.671 573 HA SER 70 HA SER 70 -10.654 -8.241 2.700 574 1HB SER 70 HB2 SER 70 -9.349 -9.223 0.896 575 2HB SER 70 HB1 SER 70 -10.791 -9.996 0.240 576 HG SER 70 HG SER 70 -11.317 -8.185 -0.688 577 H ASP 71 HN ASP 71 -12.261 -6.827 1.928 578 HA ASP 71 HA ASP 71 -14.968 -7.891 2.148 579 1HB ASP 71 HB2 ASP 71 -13.894 -5.070 2.119 580 2HB ASP 71 HB1 ASP 71 -15.610 -5.459 2.204 581 H ASP 72 HN ASP 72 -16.673 -7.075 0.687 582 HA ASP 72 HA ASP 72 -15.892 -7.442 -2.051 583 1HB ASP 72 HB2 ASP 72 -18.314 -7.277 -2.525 584 2HB ASP 72 HB1 ASP 72 -17.967 -8.425 -1.239 585 H GLY 73 HN GLY 73 -17.748 -5.776 -3.391 586 1HA GLY 73 HA2 GLY 73 -17.909 -3.688 -4.346 587 2HA GLY 73 HA1 GLY 73 -17.522 -3.030 -2.760 588 H GLU 74 HN GLU 74 -15.205 -3.229 -2.140 589 HA GLU 74 HA GLU 74 -13.425 -2.787 -4.442 590 1HB GLU 74 HB2 GLU 74 -13.294 -1.476 -1.707 591 2HB GLU 74 HB1 GLU 74 -12.169 -1.201 -3.033 592 1HG GLU 74 HG2 GLU 74 -13.967 -0.250 -4.376 593 2HG GLU 74 HG1 GLU 74 -15.109 -0.547 -3.067 594 H VAL 75 HN VAL 75 -11.231 -2.704 -2.118 595 HA VAL 75 HA VAL 75 -11.519 -5.471 -1.280 596 HB VAL 75 HB VAL 75 -10.470 -6.010 -3.273 597 1HG1 VAL 75 HG11 VAL 75 -9.593 -3.461 -3.413 598 2HG1 VAL 75 HG12 VAL 75 -9.064 -4.767 -4.473 599 3HG1 VAL 75 HG13 VAL 75 -8.088 -4.321 -3.078 600 1HG2 VAL 75 HG21 VAL 75 -7.900 -5.945 -1.896 601 2HG2 VAL 75 HG22 VAL 75 -8.863 -7.316 -2.443 602 3HG2 VAL 75 HG23 VAL 75 -9.221 -6.549 -0.896 603 H TYR 76 HN TYR 76 -11.655 -4.760 0.751 604 HA TYR 76 HA TYR 76 -9.289 -3.515 1.964 605 1HB TYR 76 HB2 TYR 76 -11.265 -2.282 2.475 606 2HB TYR 76 HB1 TYR 76 -12.182 -3.742 2.804 607 HD1 TYR 76 HD1 TYR 76 -12.954 -3.234 4.980 608 HD2 TYR 76 HD2 TYR 76 -8.801 -2.989 4.115 609 HE1 TYR 76 HE1 TYR 76 -12.472 -3.010 7.380 610 HE2 TYR 76 HE2 TYR 76 -8.304 -2.761 6.508 611 HH TYR 76 HH TYR 76 -10.682 -2.107 8.825 612 H TYR 77 HN TYR 77 -7.869 -5.022 2.745 613 HA TYR 77 HA TYR 77 -9.070 -7.386 4.012 614 1HB TYR 77 HB2 TYR 77 -7.303 -8.760 3.305 615 2HB TYR 77 HB1 TYR 77 -7.709 -7.784 1.903 616 HD1 TYR 77 HD1 TYR 77 -5.327 -7.795 4.799 617 HD2 TYR 77 HD2 TYR 77 -5.981 -6.810 0.709 618 HE1 TYR 77 HE1 TYR 77 -2.957 -7.171 4.576 619 HE2 TYR 77 HE2 TYR 77 -3.614 -6.183 0.478 620 HH TYR 77 HH TYR 77 -1.313 -7.039 2.060 621 H SER 78 HN SER 78 -8.644 -7.863 6.015 622 HA SER 78 HA SER 78 -6.579 -6.319 7.443 623 1HB SER 78 HB2 SER 78 -8.006 -6.487 9.436 624 2HB SER 78 HB1 SER 78 -8.875 -5.709 8.113 625 HG SER 78 HG SER 78 -9.840 -7.764 7.686 626 H GLU 79 HN GLU 79 -5.331 -7.447 9.019 627 HA GLU 79 HA GLU 79 -5.748 -10.315 9.274 628 1HB GLU 79 HB2 GLU 79 -3.457 -10.871 8.580 629 2HB GLU 79 HB1 GLU 79 -4.381 -10.150 7.266 630 1HG GLU 79 HG2 GLU 79 -3.293 -8.013 7.662 631 2HG GLU 79 HG1 GLU 79 -2.383 -8.726 8.990 632 H GLU 80 HN GLU 80 -5.405 -10.972 11.261 633 HA GLU 80 HA GLU 80 -4.770 -11.093 13.433 634 1HB GLU 80 HB2 GLU 80 -2.283 -9.761 12.344 635 2HB GLU 80 HB1 GLU 80 -2.428 -10.394 13.975 636 1HG GLU 80 HG2 GLU 80 -2.736 -12.632 13.120 637 2HG GLU 80 HG1 GLU 80 -2.713 -12.030 11.462 638 H ALA 81 HN ALA 81 -3.322 -8.029 12.474 639 HA ALA 81 HA ALA 81 -5.099 -6.190 13.417 640 1HB ALA 81 HB1 ALA 81 -3.627 -7.502 15.622 641 2HB ALA 81 HB2 ALA 81 -5.163 -6.636 15.647 642 3HB ALA 81 HB3 ALA 81 -3.643 -5.741 15.665 643 H LYS 82 HN LYS 82 -1.731 -6.704 14.365 644 HA LYS 82 HA LYS 82 -0.564 -4.343 13.814 645 1HB LYS 82 HB2 LYS 82 0.500 -7.104 13.209 646 2HB LYS 82 HB1 LYS 82 1.479 -5.655 13.072 647 1HG LYS 82 HG2 LYS 82 1.949 -6.733 15.154 648 2HG LYS 82 HG1 LYS 82 1.103 -5.221 15.474 649 1HD LYS 82 HD2 LYS 82 -0.914 -6.347 15.977 650 2HD LYS 82 HD1 LYS 82 -0.312 -7.870 15.317 651 1HE LYS 82 HE2 LYS 82 0.725 -6.464 17.775 652 2HE LYS 82 HE1 LYS 82 -0.316 -7.886 17.762 653 1HZ LYS 82 HZ1 LYS 82 1.562 -8.921 16.377 654 2HZ LYS 82 HZ2 LYS 82 1.789 -8.762 18.046 655 3HZ LYS 82 HZ3 LYS 82 2.520 -7.666 16.985 656 H LYS 83 HN LYS 83 -1.696 -6.722 11.457 657 HA LYS 83 HA LYS 83 -0.909 -4.837 9.332 658 1HB LYS 83 HB2 LYS 83 -1.055 -7.840 9.312 659 2HB LYS 83 HB1 LYS 83 -1.024 -6.902 7.828 660 1HG LYS 83 HG2 LYS 83 1.183 -7.630 8.242 661 2HG LYS 83 HG1 LYS 83 1.140 -5.911 8.635 662 1HD LYS 83 HD2 LYS 83 0.984 -6.433 10.999 663 2HD LYS 83 HD1 LYS 83 0.918 -8.157 10.638 664 1HE LYS 83 HE2 LYS 83 3.161 -8.037 9.673 665 2HE LYS 83 HE1 LYS 83 3.222 -6.310 10.025 666 1HZ LYS 83 HZ1 LYS 83 3.134 -8.544 11.973 667 2HZ LYS 83 HZ2 LYS 83 2.911 -6.925 12.411 668 3HZ LYS 83 HZ3 LYS 83 4.381 -7.424 11.741 669 H LYS 84 HN LYS 84 -2.542 -3.805 8.489 670 HA LYS 84 HA LYS 84 -4.988 -5.148 7.717 671 1HB LYS 84 HB2 LYS 84 -5.001 -2.846 9.691 672 2HB LYS 84 HB1 LYS 84 -6.425 -3.433 8.844 673 1HG LYS 84 HG2 LYS 84 -6.315 -5.535 9.974 674 2HG LYS 84 HG1 LYS 84 -4.751 -5.129 10.682 675 1HD LYS 84 HD2 LYS 84 -6.566 -4.868 12.305 676 2HD LYS 84 HD1 LYS 84 -5.781 -3.328 11.960 677 1HE LYS 84 HE2 LYS 84 -8.168 -3.012 12.042 678 2HE LYS 84 HE1 LYS 84 -7.602 -2.785 10.389 679 1HZ LYS 84 HZ1 LYS 84 -8.771 -4.532 9.671 680 2HZ LYS 84 HZ2 LYS 84 -9.663 -4.349 11.095 681 3HZ LYS 84 HZ3 LYS 84 -8.411 -5.484 11.023 682 H VAL 85 HN VAL 85 -5.640 -4.277 5.764 683 HA VAL 85 HA VAL 85 -4.917 -1.509 5.179 684 HB VAL 85 HB VAL 85 -3.592 -1.920 3.312 685 1HG1 VAL 85 HG11 VAL 85 -2.755 -4.153 5.138 686 2HG1 VAL 85 HG12 VAL 85 -2.498 -2.448 5.502 687 3HG1 VAL 85 HG13 VAL 85 -1.735 -3.171 4.088 688 1HG2 VAL 85 HG21 VAL 85 -3.249 -4.186 2.338 689 2HG2 VAL 85 HG22 VAL 85 -4.896 -3.579 2.176 690 3HG2 VAL 85 HG23 VAL 85 -4.517 -4.784 3.407 691 H GLU 86 HN GLU 86 -6.258 -0.488 3.808 692 HA GLU 86 HA GLU 86 -8.430 -2.056 2.588 693 1HB GLU 86 HB2 GLU 86 -9.263 -0.487 4.218 694 2HB GLU 86 HB1 GLU 86 -8.326 0.813 3.501 695 1HG GLU 86 HG2 GLU 86 -9.688 0.712 1.489 696 2HG GLU 86 HG1 GLU 86 -10.617 -0.616 2.175 697 H VAL 87 HN VAL 87 -8.531 -2.159 0.423 698 HA VAL 87 HA VAL 87 -6.697 -0.487 -1.101 699 HB VAL 87 HB VAL 87 -8.425 -2.716 -2.119 700 1HG1 VAL 87 HG11 VAL 87 -6.359 -0.963 -3.312 701 2HG1 VAL 87 HG12 VAL 87 -7.813 -1.653 -4.032 702 3HG1 VAL 87 HG13 VAL 87 -6.377 -2.654 -3.810 703 1HG2 VAL 87 HG21 VAL 87 -6.914 -4.255 -1.498 704 2HG2 VAL 87 HG22 VAL 87 -6.420 -3.043 -0.316 705 3HG2 VAL 87 HG23 VAL 87 -5.549 -3.195 -1.843 706 H LEU 88 HN LEU 88 -7.370 1.379 -1.745 707 HA LEU 88 HA LEU 88 -10.167 1.943 -2.322 708 1HB LEU 88 HB2 LEU 88 -7.689 3.661 -2.171 709 2HB LEU 88 HB1 LEU 88 -9.247 4.288 -2.660 710 HG LEU 88 HG LEU 88 -10.178 3.768 -0.469 711 1HD1 LEU 88 HD11 LEU 88 -7.409 2.782 0.197 712 2HD1 LEU 88 HD12 LEU 88 -8.868 1.800 0.076 713 3HD1 LEU 88 HD13 LEU 88 -8.724 3.009 1.349 714 1HD2 LEU 88 HD21 LEU 88 -7.736 5.455 -0.716 715 2HD2 LEU 88 HD22 LEU 88 -8.474 5.245 0.872 716 3HD2 LEU 88 HD23 LEU 88 -9.414 5.929 -0.454 717 H ASP 89 HN ASP 89 -9.917 3.923 -4.241 718 HA ASP 89 HA ASP 89 -9.969 4.243 -6.477 719 1HB ASP 89 HB2 ASP 89 -7.465 4.142 -6.000 720 2HB ASP 89 HB1 ASP 89 -7.512 2.509 -6.646 721 H THR 90 HN THR 90 -8.517 1.702 -7.994 722 HA THR 90 HA THR 90 -10.893 -0.008 -7.957 723 HB THR 90 HB THR 90 -9.611 1.120 -10.452 724 HG1 THR 90 HG1 THR 90 -10.989 2.648 -10.072 725 1HG2 THR 90 HG21 THR 90 -10.423 -1.186 -10.756 726 2HG2 THR 90 HG22 THR 90 -11.309 0.004 -11.712 727 3HG2 THR 90 HG23 THR 90 -12.024 -0.656 -10.241 728 H ASP 91 HN ASP 91 -9.757 -1.670 -6.968 729 HA ASP 91 HA ASP 91 -7.303 -2.621 -8.222 730 1HB ASP 91 HB2 ASP 91 -7.394 -2.439 -5.773 731 2HB ASP 91 HB1 ASP 91 -8.733 -3.577 -5.740 732 H TYR 92 HN TYR 92 -9.695 -2.857 -9.735 733 HA TYR 92 HA TYR 92 -9.768 -5.769 -10.054 734 1HB TYR 92 HB2 TYR 92 -12.194 -3.958 -10.017 735 2HB TYR 92 HB1 TYR 92 -12.216 -5.636 -10.544 736 HD1 TYR 92 HD1 TYR 92 -13.005 -7.156 -9.017 737 HD2 TYR 92 HD2 TYR 92 -11.028 -3.676 -7.577 738 HE1 TYR 92 HE1 TYR 92 -13.420 -7.883 -6.707 739 HE2 TYR 92 HE2 TYR 92 -11.429 -4.399 -5.262 740 HH TYR 92 HH TYR 92 -12.094 -7.333 -4.345 741 H LYS 93 HN LYS 93 -9.100 -2.853 -11.436 742 HA LYS 93 HA LYS 93 -9.838 -3.803 -14.121 743 1HB LYS 93 HB2 LYS 93 -9.814 -1.066 -12.928 744 2HB LYS 93 HB1 LYS 93 -9.513 -1.247 -14.650 745 1HG LYS 93 HG2 LYS 93 -11.874 -0.767 -14.084 746 2HG LYS 93 HG1 LYS 93 -11.649 -2.264 -14.986 747 1HD LYS 93 HD2 LYS 93 -11.974 -3.584 -13.039 748 2HD LYS 93 HD1 LYS 93 -11.884 -2.175 -11.986 749 1HE LYS 93 HE2 LYS 93 -14.188 -2.905 -12.252 750 2HE LYS 93 HE1 LYS 93 -13.951 -1.312 -12.970 751 1HZ LYS 93 HZ1 LYS 93 -15.211 -3.227 -14.232 752 2HZ LYS 93 HZ2 LYS 93 -13.642 -3.645 -14.706 753 3HZ LYS 93 HZ3 LYS 93 -14.250 -2.107 -15.061 754 H SER 94 HN SER 94 -7.669 -1.099 -13.448 755 HA SER 94 HA SER 94 -5.387 -2.735 -14.289 756 1HB SER 94 HB2 SER 94 -4.691 -0.995 -15.904 757 2HB SER 94 HB1 SER 94 -6.243 -1.718 -16.326 758 HG SER 94 HG SER 94 -6.091 0.655 -14.806 759 H TYR 95 HN TYR 95 -6.598 -0.166 -12.351 760 HA TYR 95 HA TYR 95 -3.954 0.141 -11.167 761 1HB TYR 95 HB2 TYR 95 -4.111 2.605 -11.197 762 2HB TYR 95 HB1 TYR 95 -4.010 1.924 -12.815 763 HD1 TYR 95 HD1 TYR 95 -5.578 2.525 -14.424 764 HD2 TYR 95 HD2 TYR 95 -6.481 3.176 -10.319 765 HE1 TYR 95 HE1 TYR 95 -7.617 3.737 -15.071 766 HE2 TYR 95 HE2 TYR 95 -8.524 4.388 -10.955 767 HH TYR 95 HH TYR 95 -9.721 4.402 -14.190 768 H ALA 96 HN ALA 96 -4.016 0.383 -8.993 769 HA ALA 96 HA ALA 96 -6.521 1.182 -7.705 770 1HB ALA 96 HB1 ALA 96 -5.746 -1.499 -7.961 771 2HB ALA 96 HB2 ALA 96 -7.035 -0.847 -6.950 772 3HB ALA 96 HB3 ALA 96 -5.414 -1.059 -6.287 773 H VAL 97 HN VAL 97 -6.307 1.934 -5.591 774 HA VAL 97 HA VAL 97 -3.544 2.348 -4.668 775 HB VAL 97 HB VAL 97 -4.046 4.540 -3.919 776 1HG1 VAL 97 HG11 VAL 97 -3.816 5.327 -5.985 777 2HG1 VAL 97 HG12 VAL 97 -5.540 5.105 -6.277 778 3HG1 VAL 97 HG13 VAL 97 -4.413 3.796 -6.626 779 1HG2 VAL 97 HG21 VAL 97 -6.872 3.673 -4.174 780 2HG2 VAL 97 HG22 VAL 97 -6.517 5.373 -4.482 781 3HG2 VAL 97 HG23 VAL 97 -6.098 4.650 -2.928 782 H ILE 98 HN ILE 98 -3.213 1.228 -2.858 783 HA ILE 98 HA ILE 98 -5.500 0.774 -1.060 784 HB ILE 98 HB ILE 98 -4.758 -1.259 -2.125 785 1HG1 ILE 98 HG12 ILE 98 -5.406 -1.279 0.328 786 2HG1 ILE 98 HG11 ILE 98 -4.463 -2.654 -0.230 787 1HG2 ILE 98 HG21 ILE 98 -2.034 -0.672 -0.980 788 2HG2 ILE 98 HG22 ILE 98 -2.490 -0.563 -2.680 789 3HG2 ILE 98 HG23 ILE 98 -2.497 -2.126 -1.862 790 1HD1 ILE 98 HD11 ILE 98 -3.071 -2.290 1.437 791 2HD1 ILE 98 HD12 ILE 98 -3.907 -0.799 1.864 792 3HD1 ILE 98 HD13 ILE 98 -2.606 -0.770 0.677 793 H TYR 99 HN TYR 99 -5.391 1.538 0.970 794 HA TYR 99 HA TYR 99 -2.796 2.524 1.883 795 1HB TYR 99 HB2 TYR 99 -3.890 3.998 3.347 796 2HB TYR 99 HB1 TYR 99 -4.857 4.034 1.883 797 HD1 TYR 99 HD1 TYR 99 -7.135 3.977 2.120 798 HD2 TYR 99 HD2 TYR 99 -4.739 2.192 5.147 799 HE1 TYR 99 HE1 TYR 99 -9.153 3.541 3.453 800 HE2 TYR 99 HE2 TYR 99 -6.753 1.738 6.483 801 HH TYR 99 HH TYR 99 -9.683 3.187 5.933 802 H ALA 100 HN ALA 100 -1.681 1.544 3.414 803 HA ALA 100 HA ALA 100 -2.939 -0.722 4.782 804 1HB ALA 100 HB1 ALA 100 -0.650 -1.519 5.182 805 2HB ALA 100 HB2 ALA 100 -0.021 -0.094 4.354 806 3HB ALA 100 HB3 ALA 100 -0.978 -1.280 3.466 807 H THR 101 HN THR 101 -3.271 -0.719 6.896 808 HA THR 101 HA THR 101 -1.911 1.308 8.537 809 HB THR 101 HB THR 101 -3.980 1.519 9.871 810 HG1 THR 101 HG1 THR 101 -5.169 -0.234 9.598 811 1HG2 THR 101 HG21 THR 101 -5.086 2.990 8.514 812 2HG2 THR 101 HG22 THR 101 -4.889 1.985 7.079 813 3HG2 THR 101 HG23 THR 101 -3.520 2.900 7.710 814 H ARG 102 HN ARG 102 -0.803 0.471 10.166 815 HA ARG 102 HA ARG 102 -1.254 -2.327 10.869 816 1HB ARG 102 HB2 ARG 102 1.048 -0.475 11.513 817 2HB ARG 102 HB1 ARG 102 0.954 -2.163 11.996 818 1HG ARG 102 HG2 ARG 102 0.919 -2.830 9.642 819 2HG ARG 102 HG1 ARG 102 1.026 -1.134 9.166 820 1HD ARG 102 HD2 ARG 102 3.211 -2.210 9.066 821 2HD ARG 102 HD1 ARG 102 3.183 -0.949 10.297 822 HE ARG 102 HE ARG 102 2.554 -3.388 11.515 823 1HH1 ARG 102 HH11 ARG 102 5.263 -1.817 9.976 824 2HH1 ARG 102 HH12 ARG 102 6.448 -2.684 10.893 825 1HH2 ARG 102 HH21 ARG 102 4.111 -4.531 12.722 826 2HH2 ARG 102 HH22 ARG 102 5.795 -4.225 12.452 827 H VAL 103 HN VAL 103 -1.692 -3.013 12.966 828 HA VAL 103 HA VAL 103 -1.979 -0.945 15.004 829 HB VAL 103 HB VAL 103 -4.181 -1.045 13.974 830 1HG1 VAL 103 HG11 VAL 103 -5.543 -3.140 14.314 831 2HG1 VAL 103 HG12 VAL 103 -4.023 -3.970 14.641 832 3HG1 VAL 103 HG13 VAL 103 -4.297 -3.216 13.072 833 1HG2 VAL 103 HG21 VAL 103 -4.186 -2.322 16.705 834 2HG2 VAL 103 HG22 VAL 103 -5.484 -1.372 15.982 835 3HG2 VAL 103 HG23 VAL 103 -3.949 -0.603 16.388 836 H LYS 104 HN LYS 104 -1.388 -1.506 16.911 837 HA LYS 104 HA LYS 104 -1.410 -4.283 17.797 838 1HB LYS 104 HB2 LYS 104 0.824 -3.976 16.834 839 2HB LYS 104 HB1 LYS 104 1.061 -2.532 17.799 840 1HG LYS 104 HG2 LYS 104 0.479 -5.097 19.187 841 2HG LYS 104 HG1 LYS 104 2.086 -4.837 18.513 842 1HD LYS 104 HD2 LYS 104 0.702 -2.984 20.450 843 2HD LYS 104 HD1 LYS 104 1.915 -4.182 20.891 844 1HE LYS 104 HE2 LYS 104 2.321 -1.847 19.027 845 2HE LYS 104 HE1 LYS 104 2.889 -1.951 20.690 846 1HZ LYS 104 HZ1 LYS 104 4.102 -4.036 19.891 847 2HZ LYS 104 HZ2 LYS 104 4.726 -2.534 19.425 848 3HZ LYS 104 HZ3 LYS 104 3.824 -3.452 18.327 849 H ASP 105 HN ASP 105 -1.432 -4.470 20.076 850 HA ASP 105 HA ASP 105 -2.791 -2.418 21.419 851 1HB ASP 105 HB2 ASP 105 -2.991 -4.771 22.064 852 2HB ASP 105 HB1 ASP 105 -1.304 -4.789 22.571 853 H GLY 106 HN GLY 106 -1.074 -0.734 20.698 854 1HA GLY 106 HA2 GLY 106 0.157 0.337 22.928 855 2HA GLY 106 HA1 GLY 106 1.381 -0.639 22.138 856 H ARG 107 HN ARG 107 0.493 -0.075 19.419 857 HA ARG 107 HA ARG 107 0.809 2.821 19.215 858 1HB ARG 107 HB2 ARG 107 2.722 2.706 17.770 859 2HB ARG 107 HB1 ARG 107 3.092 1.852 19.258 860 1HG ARG 107 HG2 ARG 107 2.530 -0.280 18.048 861 2HG ARG 107 HG1 ARG 107 2.449 0.676 16.569 862 1HD ARG 107 HD2 ARG 107 4.767 1.402 16.924 863 2HD ARG 107 HD1 ARG 107 4.848 0.415 18.383 864 HE ARG 107 HE ARG 107 4.092 -1.164 16.162 865 1HH1 ARG 107 HH11 ARG 107 6.853 0.432 17.575 866 2HH1 ARG 107 HH12 ARG 107 8.004 -0.641 16.851 867 1HH2 ARG 107 HH21 ARG 107 5.601 -2.579 15.206 868 2HH2 ARG 107 HH22 ARG 107 7.292 -2.351 15.503 869 H THR 108 HN THR 108 0.150 3.736 17.318 870 HA THR 108 HA THR 108 -1.162 1.967 15.365 871 HB THR 108 HB THR 108 -2.171 4.623 16.417 872 HG1 THR 108 HG1 THR 108 -3.379 2.074 16.620 873 1HG2 THR 108 HG21 THR 108 -2.679 3.524 13.926 874 2HG2 THR 108 HG22 THR 108 -3.615 4.772 14.750 875 3HG2 THR 108 HG23 THR 108 -4.072 3.075 14.908 876 H LEU 109 HN LEU 109 -0.688 2.379 13.261 877 HA LEU 109 HA LEU 109 0.524 4.953 12.568 878 1HB LEU 109 HB2 LEU 109 2.282 3.779 11.250 879 2HB LEU 109 HB1 LEU 109 2.450 3.625 12.988 880 HG LEU 109 HG LEU 109 1.217 1.494 11.244 881 1HD1 LEU 109 HD11 LEU 109 3.370 1.420 10.472 882 2HD1 LEU 109 HD12 LEU 109 3.500 0.376 11.887 883 3HD1 LEU 109 HD13 LEU 109 4.049 2.050 11.974 884 1HD2 LEU 109 HD21 LEU 109 0.533 0.800 13.265 885 2HD2 LEU 109 HD22 LEU 109 1.667 1.845 14.120 886 3HD2 LEU 109 HD23 LEU 109 2.208 0.294 13.475 887 H HIS 110 HN HIS 110 0.154 5.650 10.519 888 HA HIS 110 HA HIS 110 -1.542 3.914 8.850 889 1HB HIS 110 HB2 HIS 110 -1.525 6.936 8.966 890 2HB HIS 110 HB1 HIS 110 -2.598 5.938 7.990 891 HD1 HIS 110 HD1 HIS 110 -3.912 4.059 9.710 892 HD2 HIS 110 HD2 HIS 110 -2.804 7.784 11.178 893 HE1 HIS 110 HE1 HIS 110 -5.346 4.433 11.740 894 HE2 HIS 110 HE2 HIS 110 -4.590 6.650 12.667 895 H MET 111 HN MET 111 -1.119 3.735 6.696 896 HA MET 111 HA MET 111 0.853 5.365 5.388 897 1HB MET 111 HB2 MET 111 2.382 3.522 4.831 898 2HB MET 111 HB1 MET 111 2.325 3.820 6.563 899 1HG MET 111 HG2 MET 111 0.896 1.908 6.888 900 2HG MET 111 HG1 MET 111 0.816 1.637 5.148 901 1HE MET 111 HE1 MET 111 2.829 1.558 3.749 902 2HE MET 111 HE2 MET 111 4.029 0.302 4.056 903 3HE MET 111 HE3 MET 111 4.380 1.979 4.475 904 H MET 112 HN MET 112 0.471 5.443 3.253 905 HA MET 112 HA MET 112 -1.635 3.706 2.193 906 1HB MET 112 HB2 MET 112 -1.286 6.467 2.169 907 2HB MET 112 HB1 MET 112 -0.892 5.971 0.531 908 1HG MET 112 HG2 MET 112 -3.451 5.377 1.990 909 2HG MET 112 HG1 MET 112 -3.227 6.601 0.754 910 1HE MET 112 HE1 MET 112 -3.378 5.526 -2.281 911 2HE MET 112 HE2 MET 112 -1.967 4.478 -2.145 912 3HE MET 112 HE3 MET 112 -1.990 6.037 -1.320 913 H ARG 113 HN ARG 113 -1.436 2.684 0.213 914 HA ARG 113 HA ARG 113 1.168 2.740 -1.132 915 1HB ARG 113 HB2 ARG 113 -0.039 0.504 0.331 916 2HB ARG 113 HB1 ARG 113 0.455 0.089 -1.303 917 1HG ARG 113 HG2 ARG 113 2.717 0.822 -0.834 918 2HG ARG 113 HG1 ARG 113 2.237 1.336 0.785 919 1HD ARG 113 HD2 ARG 113 1.658 -0.968 1.348 920 2HD ARG 113 HD1 ARG 113 2.103 -1.484 -0.278 921 HE ARG 113 HE ARG 113 4.304 -0.192 0.836 922 1HH1 ARG 113 HH11 ARG 113 2.415 -3.083 1.347 923 2HH1 ARG 113 HH12 ARG 113 3.735 -3.972 2.031 924 1HH2 ARG 113 HH21 ARG 113 6.032 -1.351 1.730 925 2HH2 ARG 113 HH22 ARG 113 5.793 -2.985 2.250 926 H LEU 114 HN LEU 114 1.036 2.552 -3.367 927 HA LEU 114 HA LEU 114 -1.666 2.081 -4.468 928 1HB LEU 114 HB2 LEU 114 -0.948 4.457 -4.571 929 2HB LEU 114 HB1 LEU 114 0.427 3.971 -5.539 930 HG LEU 114 HG LEU 114 -2.453 3.628 -6.383 931 1HD1 LEU 114 HD11 LEU 114 -2.283 5.573 -7.657 932 2HD1 LEU 114 HD12 LEU 114 -0.527 5.632 -7.501 933 3HD1 LEU 114 HD13 LEU 114 -1.547 6.014 -6.115 934 1HD2 LEU 114 HD21 LEU 114 0.171 2.989 -7.640 935 2HD2 LEU 114 HD22 LEU 114 -1.155 3.536 -8.665 936 3HD2 LEU 114 HD23 LEU 114 -1.348 2.090 -7.675 937 H TYR 115 HN TYR 115 -1.651 0.153 -5.441 938 HA TYR 115 HA TYR 115 0.772 -0.750 -6.800 939 1HB TYR 115 HB2 TYR 115 -1.778 -2.203 -6.101 940 2HB TYR 115 HB1 TYR 115 -0.448 -2.923 -7.000 941 HD1 TYR 115 HD1 TYR 115 -1.718 -2.048 -3.748 942 HD2 TYR 115 HD2 TYR 115 1.784 -3.187 -5.871 943 HE1 TYR 115 HE1 TYR 115 -0.638 -2.660 -1.624 944 HE2 TYR 115 HE2 TYR 115 2.873 -3.809 -3.757 945 HH TYR 115 HH TYR 115 2.127 -4.513 -1.434 946 H SER 116 HN SER 116 1.021 -0.543 -8.899 947 HA SER 116 HA SER 116 -1.367 -0.171 -10.578 948 1HB SER 116 HB2 SER 116 0.201 1.729 -10.632 949 2HB SER 116 HB1 SER 116 1.504 0.644 -11.117 950 HG SER 116 HG SER 116 -0.720 1.531 -12.578 951 H ARG 117 HN ARG 117 -1.832 -1.680 -12.071 952 HA ARG 117 HA ARG 117 -0.361 -4.110 -12.111 953 1HB ARG 117 HB2 ARG 117 -2.678 -3.111 -13.755 954 2HB ARG 117 HB1 ARG 117 -1.955 -4.692 -14.012 955 1HG ARG 117 HG2 ARG 117 -3.851 -5.011 -12.634 956 2HG ARG 117 HG1 ARG 117 -2.432 -5.201 -11.606 957 1HD ARG 117 HD2 ARG 117 -2.710 -2.907 -10.800 958 2HD ARG 117 HD1 ARG 117 -4.131 -2.718 -11.823 959 HE ARG 117 HE ARG 117 -4.051 -3.886 -9.263 960 1HH1 ARG 117 HH11 ARG 117 -5.558 -4.315 -12.388 961 2HH1 ARG 117 HH12 ARG 117 -6.925 -5.160 -11.745 962 1HH2 ARG 117 HH21 ARG 117 -5.851 -4.981 -8.425 963 2HH2 ARG 117 HH22 ARG 117 -7.095 -5.532 -9.496 964 H SER 118 HN SER 118 -0.600 -1.373 -14.324 965 HA SER 118 HA SER 118 1.674 -2.509 -15.812 966 1HB SER 118 HB2 SER 118 -0.646 -0.948 -16.972 967 2HB SER 118 HB1 SER 118 0.772 -1.489 -17.869 968 HG SER 118 HG SER 118 -0.978 -2.932 -18.108 969 HA PRO 119 HA PRO 119 4.067 1.077 -14.876 970 1HB PRO 119 HB2 PRO 119 4.585 1.103 -17.822 971 2HB PRO 119 HB1 PRO 119 5.728 1.228 -16.479 972 1HG PRO 119 HG2 PRO 119 5.443 -1.056 -17.819 973 2HG PRO 119 HG1 PRO 119 5.698 -1.049 -16.065 974 1HD PRO 119 HD2 PRO 119 3.229 -1.617 -17.615 975 2HD PRO 119 HD1 PRO 119 3.735 -2.230 -16.029 976 H GLU 120 HN GLU 120 2.065 1.188 -17.797 977 HA GLU 120 HA GLU 120 1.935 4.013 -17.967 978 1HB GLU 120 HB2 GLU 120 0.078 1.902 -19.070 979 2HB GLU 120 HB1 GLU 120 0.042 3.603 -19.514 980 1HG GLU 120 HG2 GLU 120 2.318 3.413 -20.389 981 2HG GLU 120 HG1 GLU 120 2.329 1.701 -19.966 982 H VAL 121 HN VAL 121 1.515 3.944 -15.422 983 HA VAL 121 HA VAL 121 -0.987 3.397 -14.372 984 HB VAL 121 HB VAL 121 0.867 5.652 -13.588 985 1HG1 VAL 121 HG11 VAL 121 -1.190 6.127 -12.562 986 2HG1 VAL 121 HG12 VAL 121 -0.255 5.282 -11.328 987 3HG1 VAL 121 HG13 VAL 121 -1.511 4.426 -12.223 988 1HG2 VAL 121 HG21 VAL 121 2.224 4.119 -12.722 989 2HG2 VAL 121 HG22 VAL 121 1.230 2.862 -13.458 990 3HG2 VAL 121 HG23 VAL 121 0.893 3.403 -11.814 991 H SER 122 HN SER 122 -2.928 4.188 -14.718 992 HA SER 122 HA SER 122 -3.418 6.325 -16.521 993 1HB SER 122 HB2 SER 122 -4.959 4.412 -16.254 994 2HB SER 122 HB1 SER 122 -5.318 4.944 -14.613 995 HG SER 122 HG SER 122 -6.492 6.561 -15.367 996 HA PRO 123 HA PRO 123 -3.404 9.988 -14.048 997 1HB PRO 123 HB2 PRO 123 -5.905 11.003 -14.825 998 2HB PRO 123 HB1 PRO 123 -4.362 11.326 -15.622 999 1HG PRO 123 HG2 PRO 123 -6.486 9.357 -16.326 1000 2HG PRO 123 HG1 PRO 123 -5.445 10.317 -17.393 1001 1HD PRO 123 HD2 PRO 123 -4.977 7.722 -17.003 1002 2HD PRO 123 HD1 PRO 123 -3.635 8.878 -17.121 1003 H ALA 124 HN ALA 124 -6.358 8.052 -14.179 1004 HA ALA 124 HA ALA 124 -7.593 9.055 -11.869 1005 1HB ALA 124 HB1 ALA 124 -9.171 7.771 -12.779 1006 2HB ALA 124 HB2 ALA 124 -8.377 6.403 -12.001 1007 3HB ALA 124 HB3 ALA 124 -7.989 6.816 -13.672 1008 H ALA 125 HN ALA 125 -5.387 6.318 -12.335 1009 HA ALA 125 HA ALA 125 -5.429 5.250 -9.792 1010 1HB ALA 125 HB1 ALA 125 -2.846 5.553 -11.259 1011 2HB ALA 125 HB2 ALA 125 -4.124 4.524 -11.901 1012 3HB ALA 125 HB3 ALA 125 -3.436 4.191 -10.310 1013 H THR 126 HN THR 126 -3.121 7.677 -11.008 1014 HA THR 126 HA THR 126 -2.107 8.264 -8.398 1015 HB THR 126 HB THR 126 -0.870 10.064 -9.521 1016 HG1 THR 126 HG1 THR 126 -2.296 9.299 -11.848 1017 1HG2 THR 126 HG21 THR 126 0.544 8.441 -10.011 1018 2HG2 THR 126 HG22 THR 126 -0.202 8.388 -11.608 1019 3HG2 THR 126 HG23 THR 126 -0.760 7.300 -10.338 1020 H ALA 127 HN ALA 127 -4.298 9.947 -10.624 1021 HA ALA 127 HA ALA 127 -4.644 12.224 -8.990 1022 1HB ALA 127 HB1 ALA 127 -6.623 11.257 -11.026 1023 2HB ALA 127 HB2 ALA 127 -5.120 12.080 -11.446 1024 3HB ALA 127 HB3 ALA 127 -6.337 12.909 -10.477 1025 H ILE 128 HN ILE 128 -6.603 9.265 -9.327 1026 HA ILE 128 HA ILE 128 -8.706 10.109 -7.687 1027 HB ILE 128 HB ILE 128 -7.709 7.313 -8.221 1028 1HG1 ILE 128 HG12 ILE 128 -10.103 8.843 -9.266 1029 2HG1 ILE 128 HG11 ILE 128 -8.610 8.581 -10.154 1030 1HG2 ILE 128 HG21 ILE 128 -10.160 8.231 -6.732 1031 2HG2 ILE 128 HG22 ILE 128 -8.857 7.203 -6.138 1032 3HG2 ILE 128 HG23 ILE 128 -9.957 6.599 -7.376 1033 1HD1 ILE 128 HD11 ILE 128 -9.067 6.103 -9.883 1034 2HD1 ILE 128 HD12 ILE 128 -10.119 7.001 -10.977 1035 3HD1 ILE 128 HD13 ILE 128 -10.686 6.573 -9.363 1036 H PHE 129 HN PHE 129 -5.807 8.178 -6.801 1037 HA PHE 129 HA PHE 129 -6.367 7.927 -4.083 1038 1HB PHE 129 HB2 PHE 129 -4.477 6.733 -4.760 1039 2HB PHE 129 HB1 PHE 129 -3.807 8.098 -5.644 1040 HD1 PHE 129 HD1 PHE 129 -4.931 7.664 -2.114 1041 HD2 PHE 129 HD2 PHE 129 -1.757 8.651 -4.771 1042 HE1 PHE 129 HE1 PHE 129 -3.506 8.233 -0.196 1043 HE2 PHE 129 HE2 PHE 129 -0.322 9.214 -2.855 1044 HZ PHE 129 HZ PHE 129 -1.198 9.010 -0.565 1045 H ARG 130 HN ARG 130 -4.681 10.496 -5.812 1046 HA ARG 130 HA ARG 130 -4.308 12.175 -3.554 1047 1HB ARG 130 HB2 ARG 130 -2.881 12.450 -5.474 1048 2HB ARG 130 HB1 ARG 130 -4.263 12.701 -6.529 1049 1HG ARG 130 HG2 ARG 130 -4.749 14.809 -5.381 1050 2HG ARG 130 HG1 ARG 130 -3.334 14.567 -4.352 1051 1HD ARG 130 HD2 ARG 130 -2.908 16.092 -6.261 1052 2HD ARG 130 HD1 ARG 130 -1.869 14.667 -6.269 1053 HE ARG 130 HE ARG 130 -4.157 14.162 -7.824 1054 1HH1 ARG 130 HH11 ARG 130 -1.236 16.073 -7.888 1055 2HH1 ARG 130 HH12 ARG 130 -1.141 16.093 -9.617 1056 1HH2 ARG 130 HH21 ARG 130 -4.028 14.182 -10.092 1057 2HH2 ARG 130 HH22 ARG 130 -2.726 15.020 -10.868 1058 H LYS 131 HN LYS 131 -6.853 11.702 -5.886 1059 HA LYS 131 HA LYS 131 -8.302 14.080 -5.460 1060 1HB LYS 131 HB2 LYS 131 -8.632 12.513 -7.382 1061 2HB LYS 131 HB1 LYS 131 -9.399 11.384 -6.276 1062 1HG LYS 131 HG2 LYS 131 -11.204 12.898 -5.873 1063 2HG LYS 131 HG1 LYS 131 -10.392 14.181 -6.770 1064 1HD LYS 131 HD2 LYS 131 -12.149 13.175 -8.117 1065 2HD LYS 131 HD1 LYS 131 -10.566 12.848 -8.822 1066 1HE LYS 131 HE2 LYS 131 -10.593 10.615 -7.791 1067 2HE LYS 131 HE1 LYS 131 -12.198 10.948 -7.143 1068 1HZ LYS 131 HZ1 LYS 131 -11.747 11.222 -10.032 1069 2HZ LYS 131 HZ2 LYS 131 -13.160 10.807 -9.200 1070 3HZ LYS 131 HZ3 LYS 131 -11.919 9.671 -9.377 1071 H LEU 132 HN LEU 132 -8.485 10.866 -3.955 1072 HA LEU 132 HA LEU 132 -10.694 11.379 -2.301 1073 1HB LEU 132 HB2 LEU 132 -10.204 9.398 -1.228 1074 2HB LEU 132 HB1 LEU 132 -9.390 9.162 -2.761 1075 HG LEU 132 HG LEU 132 -7.322 10.129 -1.435 1076 1HD1 LEU 132 HD11 LEU 132 -7.296 9.815 0.848 1077 2HD1 LEU 132 HD12 LEU 132 -8.680 8.724 0.820 1078 3HD1 LEU 132 HD13 LEU 132 -8.918 10.453 0.580 1079 1HD2 LEU 132 HD21 LEU 132 -8.416 7.441 -1.811 1080 2HD2 LEU 132 HD22 LEU 132 -7.210 7.564 -0.530 1081 3HD2 LEU 132 HD23 LEU 132 -6.811 8.078 -2.169 1082 H ALA 133 HN ALA 133 -7.253 11.981 -1.943 1083 HA ALA 133 HA ALA 133 -7.435 13.077 0.701 1084 1HB ALA 133 HB1 ALA 133 -5.292 12.971 -1.395 1085 2HB ALA 133 HB2 ALA 133 -5.315 12.256 0.217 1086 3HB ALA 133 HB3 ALA 133 -5.103 13.995 0.029 1087 H GLY 134 HN GLY 134 -7.539 14.298 -2.593 1088 1HA GLY 134 HA2 GLY 134 -7.242 17.030 -2.111 1089 2HA GLY 134 HA1 GLY 134 -8.157 16.339 -3.444 1090 H GLU 135 HN GLU 135 -10.051 14.947 -1.775 1091 HA GLU 135 HA GLU 135 -12.141 16.688 -1.608 1092 1HB GLU 135 HB2 GLU 135 -11.635 14.450 0.360 1093 2HB GLU 135 HB1 GLU 135 -13.198 15.143 -0.048 1094 1HG GLU 135 HG2 GLU 135 -12.883 14.330 -2.375 1095 2HG GLU 135 HG1 GLU 135 -11.402 13.532 -1.848 1096 H ARG 136 HN ARG 136 -9.731 15.978 0.847 1097 HA ARG 136 HA ARG 136 -10.762 18.050 2.619 1098 1HB ARG 136 HB2 ARG 136 -9.989 15.861 3.546 1099 2HB ARG 136 HB1 ARG 136 -8.373 16.218 2.957 1100 1HG ARG 136 HG2 ARG 136 -8.549 16.679 5.327 1101 2HG ARG 136 HG1 ARG 136 -8.268 18.168 4.424 1102 1HD ARG 136 HD2 ARG 136 -9.961 18.476 6.160 1103 2HD ARG 136 HD1 ARG 136 -10.636 18.711 4.548 1104 HE ARG 136 HE ARG 136 -11.028 16.041 5.302 1105 1HH1 ARG 136 HH11 ARG 136 -12.122 19.237 6.174 1106 2HH1 ARG 136 HH12 ARG 136 -13.670 18.693 6.727 1107 1HH2 ARG 136 HH21 ARG 136 -13.068 15.324 6.029 1108 2HH2 ARG 136 HH22 ARG 136 -14.207 16.474 6.646 1109 H ASN 137 HN ASN 137 -7.836 17.171 0.861 1110 HA ASN 137 HA ASN 137 -6.981 19.136 -0.528 1111 1HB ASN 137 HB2 ASN 137 -5.844 20.882 0.745 1112 2HB ASN 137 HB1 ASN 137 -7.548 20.850 1.173 1113 1HD2 ASN 137 HD21 ASN 137 -4.611 21.274 2.407 1114 2HD2 ASN 137 HD22 ASN 137 -4.851 20.700 4.019 1115 H TYR 138 HN TYR 138 -4.876 18.804 -1.213 1116 HA TYR 138 HA TYR 138 -3.528 16.507 -0.435 1117 1HB TYR 138 HB2 TYR 138 -3.026 17.559 -2.552 1118 2HB TYR 138 HB1 TYR 138 -2.443 19.009 -1.743 1119 HD1 TYR 138 HD1 TYR 138 -0.346 18.850 -3.008 1120 HD2 TYR 138 HD2 TYR 138 -1.553 15.756 -0.348 1121 HE1 TYR 138 HE1 TYR 138 1.943 17.956 -3.020 1122 HE2 TYR 138 HE2 TYR 138 0.735 14.851 -0.354 1123 HH TYR 138 HH TYR 138 2.870 15.274 -2.464 1124 H THR 139 HN THR 139 -3.424 16.400 1.789 1125 HA THR 139 HA THR 139 -1.801 18.395 3.189 1126 HB THR 139 HB THR 139 -3.961 17.991 4.164 1127 HG1 THR 139 HG1 THR 139 -3.308 17.593 6.198 1128 1HG2 THR 139 HG21 THR 139 -4.484 15.734 5.134 1129 2HG2 THR 139 HG22 THR 139 -3.193 15.091 4.118 1130 3HG2 THR 139 HG23 THR 139 -4.596 15.865 3.381 1131 H ASP 140 HN ASP 140 0.048 17.947 4.230 1132 HA ASP 140 HA ASP 140 1.515 15.615 3.565 1133 1HB ASP 140 HB2 ASP 140 2.599 17.765 4.178 1134 2HB ASP 140 HB1 ASP 140 2.004 17.580 5.824 1135 H GLU 141 HN GLU 141 -0.866 16.357 5.912 1136 HA GLU 141 HA GLU 141 -0.372 14.782 8.084 1137 1HB GLU 141 HB2 GLU 141 -2.382 16.164 7.819 1138 2HB GLU 141 HB1 GLU 141 -2.979 15.068 6.588 1139 1HG GLU 141 HG2 GLU 141 -3.065 13.267 8.262 1140 2HG GLU 141 HG1 GLU 141 -2.564 14.427 9.491 1141 H MET 142 HN MET 142 -0.935 13.771 4.821 1142 HA MET 142 HA MET 142 -0.361 11.039 5.519 1143 1HB MET 142 HB2 MET 142 -2.289 10.116 4.253 1144 2HB MET 142 HB1 MET 142 -2.765 10.934 5.733 1145 1HG MET 142 HG2 MET 142 -3.373 12.916 4.382 1146 2HG MET 142 HG1 MET 142 -2.987 11.997 2.928 1147 1HE MET 142 HE1 MET 142 -5.058 12.198 6.114 1148 2HE MET 142 HE2 MET 142 -4.835 10.450 6.183 1149 3HE MET 142 HE3 MET 142 -6.428 11.123 5.841 1150 H VAL 143 HN VAL 143 1.494 12.070 4.391 1151 HA VAL 143 HA VAL 143 1.209 11.690 1.482 1152 HB VAL 143 HB VAL 143 1.458 14.114 2.070 1153 1HG1 VAL 143 HG11 VAL 143 3.403 14.975 3.051 1154 2HG1 VAL 143 HG12 VAL 143 4.301 13.478 2.806 1155 3HG1 VAL 143 HG13 VAL 143 3.034 13.558 4.032 1156 1HG2 VAL 143 HG21 VAL 143 2.850 14.555 0.254 1157 2HG2 VAL 143 HG22 VAL 143 2.310 12.905 -0.058 1158 3HG2 VAL 143 HG23 VAL 143 3.913 13.192 0.616 1159 H ALA 144 HN ALA 144 2.805 10.604 0.440 1160 HA ALA 144 HA ALA 144 5.402 10.169 1.488 1161 1HB ALA 144 HB1 ALA 144 4.642 8.623 3.010 1162 2HB ALA 144 HB2 ALA 144 5.029 7.594 1.631 1163 3HB ALA 144 HB3 ALA 144 3.357 8.050 1.957 1164 H MET 145 HN MET 145 6.761 9.658 -0.175 1165 HA MET 145 HA MET 145 5.521 8.578 -2.620 1166 1HB MET 145 HB2 MET 145 7.658 10.704 -2.481 1167 2HB MET 145 HB1 MET 145 6.998 10.013 -3.956 1168 1HG MET 145 HG2 MET 145 4.813 10.923 -3.433 1169 2HG MET 145 HG1 MET 145 5.422 11.552 -1.906 1170 1HE MET 145 HE1 MET 145 4.866 14.795 -3.231 1171 2HE MET 145 HE2 MET 145 3.998 13.307 -2.852 1172 3HE MET 145 HE3 MET 145 4.132 13.848 -4.524 1173 H LEU 146 HN LEU 146 6.665 7.164 -3.867 1174 HA LEU 146 HA LEU 146 8.429 5.401 -2.674 1175 1HB LEU 146 HB2 LEU 146 8.792 4.437 -4.823 1176 2HB LEU 146 HB1 LEU 146 7.127 4.968 -4.757 1177 HG LEU 146 HG LEU 146 9.348 6.476 -6.139 1178 1HD1 LEU 146 HD11 LEU 146 7.459 5.590 -8.003 1179 2HD1 LEU 146 HD12 LEU 146 7.810 4.197 -6.982 1180 3HD1 LEU 146 HD13 LEU 146 9.121 5.032 -7.811 1181 1HD2 LEU 146 HD21 LEU 146 7.432 7.700 -7.169 1182 2HD2 LEU 146 HD22 LEU 146 7.631 7.981 -5.439 1183 3HD2 LEU 146 HD23 LEU 146 6.368 6.894 -6.016 1184 HA PRO 147 HA PRO 147 12.342 7.425 -2.703 1185 1HB PRO 147 HB2 PRO 147 13.977 5.279 -2.585 1186 2HB PRO 147 HB1 PRO 147 12.971 5.784 -1.221 1187 1HG PRO 147 HG2 PRO 147 12.446 3.643 -3.256 1188 2HG PRO 147 HG1 PRO 147 12.275 3.569 -1.493 1189 1HD PRO 147 HD2 PRO 147 10.164 3.979 -3.118 1190 2HD PRO 147 HD1 PRO 147 10.276 4.725 -1.510 1191 H ARG 148 HN ARG 148 11.931 8.171 -4.958 1192 HA ARG 148 HA ARG 148 13.061 6.629 -7.109 1193 1HB ARG 148 HB2 ARG 148 12.165 9.519 -7.077 1194 2HB ARG 148 HB1 ARG 148 12.514 8.559 -8.509 1195 1HG ARG 148 HG2 ARG 148 10.668 7.037 -7.903 1196 2HG ARG 148 HG1 ARG 148 10.298 8.078 -6.528 1197 1HD ARG 148 HD2 ARG 148 10.228 8.891 -9.432 1198 2HD ARG 148 HD1 ARG 148 8.825 8.535 -8.424 1199 HE ARG 148 HE ARG 148 10.327 10.537 -7.176 1200 1HH1 ARG 148 HH11 ARG 148 8.369 10.073 -10.026 1201 2HH1 ARG 148 HH12 ARG 148 7.887 11.734 -10.118 1202 1HH2 ARG 148 HH21 ARG 148 9.696 12.720 -7.293 1203 2HH2 ARG 148 HH22 ARG 148 8.641 13.238 -8.566 1204 H GLN 149 HN GLN 149 14.411 8.508 -4.688 1205 HA GLN 149 HA GLN 149 16.605 9.531 -6.312 1206 1HB GLN 149 HB2 GLN 149 15.640 10.987 -4.616 1207 2HB GLN 149 HB1 GLN 149 16.022 9.814 -3.363 1208 1HG GLN 149 HG2 GLN 149 18.370 10.134 -3.713 1209 2HG GLN 149 HG1 GLN 149 18.061 11.188 -5.089 1210 1HE2 GLN 149 HE21 GLN 149 15.694 11.945 -2.976 1211 2HE2 GLN 149 HE22 GLN 149 16.462 13.227 -2.116 1212 H GLU 150 HN GLU 150 18.846 9.169 -5.686 1213 HA GLU 150 HA GLU 150 20.160 7.070 -5.966 1214 1HB GLU 150 HB2 GLU 150 20.482 8.375 -3.256 1215 2HB GLU 150 HB1 GLU 150 21.674 7.359 -4.048 1216 1HG GLU 150 HG2 GLU 150 22.434 9.497 -4.451 1217 2HG GLU 150 HG1 GLU 150 21.598 9.072 -5.943 1218 H GLU 151 HN GLU 151 20.658 6.297 -2.818 1219 HA GLU 151 HA GLU 151 19.165 3.848 -3.126 1220 1HB GLU 151 HB2 GLU 151 20.273 3.249 -0.913 1221 2HB GLU 151 HB1 GLU 151 21.351 3.521 -2.272 1222 1HG GLU 151 HG2 GLU 151 20.775 5.848 -0.550 1223 2HG GLU 151 HG1 GLU 151 21.765 4.562 0.142 1224 H CYS 152 HN CYS 152 19.303 4.486 0.149 1225 HA CYS 152 HA CYS 152 16.446 4.958 0.265 1226 1HB CYS 152 HB2 CYS 152 16.830 4.640 2.752 1227 2HB CYS 152 HB1 CYS 152 17.230 3.264 1.734 1228 H THR 153 HN THR 153 16.394 7.139 -0.512 1229 HA THR 153 HA THR 153 16.642 9.099 1.579 1230 HB THR 153 HB THR 153 18.955 9.060 0.846 1231 HG1 THR 153 HG1 THR 153 18.463 11.102 1.322 1232 1HG2 THR 153 HG21 THR 153 19.397 8.484 -1.261 1233 2HG2 THR 153 HG22 THR 153 19.050 10.166 -1.661 1234 3HG2 THR 153 HG23 THR 153 17.787 8.946 -1.817 1235 H VAL 154 HN VAL 154 14.306 8.728 0.704 1236 HA VAL 154 HA VAL 154 13.663 10.048 -1.765 1237 HB VAL 154 HB VAL 154 12.308 8.174 -0.965 1238 1HG1 VAL 154 HG11 VAL 154 12.340 9.652 1.474 1239 2HG1 VAL 154 HG12 VAL 154 11.770 8.012 1.172 1240 3HG1 VAL 154 HG13 VAL 154 10.671 9.378 0.980 1241 1HG2 VAL 154 HG21 VAL 154 10.920 9.247 -2.371 1242 2HG2 VAL 154 HG22 VAL 154 11.192 10.814 -1.611 1243 3HG2 VAL 154 HG23 VAL 154 10.048 9.677 -0.898 1244 H ASP 155 HN ASP 155 14.640 12.172 -1.297 1245 HA ASP 155 HA ASP 155 13.867 13.851 0.807 1246 1HB ASP 155 HB2 ASP 155 15.764 14.359 -0.665 1247 2HB ASP 155 HB1 ASP 155 14.661 14.618 -2.012 1248 H GLU 156 HN GLU 156 12.182 15.225 1.153 1249 HA GLU 156 HA GLU 156 10.394 16.162 -0.800 1250 1HB GLU 156 HB2 GLU 156 8.390 14.857 -0.263 1251 2HB GLU 156 HB1 GLU 156 9.657 13.832 -0.922 1252 1HG GLU 156 HG2 GLU 156 10.225 13.085 1.331 1253 2HG GLU 156 HG1 GLU 156 8.955 14.112 1.991 1254 H VAL 157 HN VAL 157 9.154 17.788 0.007 1255 HA VAL 157 HA VAL 157 8.322 19.318 1.474 1256 HB VAL 157 HB VAL 157 8.468 17.103 3.526 1257 1HG1 VAL 157 HG11 VAL 157 6.889 18.345 4.793 1258 2HG1 VAL 157 HG12 VAL 157 6.648 19.501 3.482 1259 3HG1 VAL 157 HG13 VAL 157 8.181 19.464 4.354 1260 1HG2 VAL 157 HG21 VAL 157 5.935 17.026 2.922 1261 2HG2 VAL 157 HG22 VAL 157 7.104 16.178 1.909 1262 3HG2 VAL 157 HG23 VAL 157 6.467 17.742 1.402 Start of MODEL 7 1 1H MET 1 HT1 MET 1 -20.388 -5.488 -17.664 2 2H MET 1 HT2 MET 1 -20.586 -4.048 -18.526 3 3H MET 1 HT3 MET 1 -21.097 -4.145 -16.918 4 HA MET 1 HA MET 1 -18.290 -4.341 -17.848 5 1HB MET 1 HB2 MET 1 -19.778 -2.124 -16.423 6 2HB MET 1 HB1 MET 1 -18.052 -2.130 -16.757 7 1HG MET 1 HG2 MET 1 -18.522 -2.164 -19.158 8 2HG MET 1 HG1 MET 1 -20.250 -2.134 -18.812 9 1HE MET 1 HE1 MET 1 -21.460 -0.146 -17.574 10 2HE MET 1 HE2 MET 1 -20.681 1.373 -17.130 11 3HE MET 1 HE3 MET 1 -20.278 -0.110 -16.265 12 H THR 2 HN THR 2 -19.288 -6.376 -16.314 13 HA THR 2 HA THR 2 -17.654 -6.209 -13.986 14 HB THR 2 HB THR 2 -20.651 -6.326 -13.579 15 HG1 THR 2 HG1 THR 2 -18.696 -4.377 -12.988 16 1HG2 THR 2 HG21 THR 2 -18.523 -6.347 -11.458 17 2HG2 THR 2 HG22 THR 2 -19.367 -7.789 -12.022 18 3HG2 THR 2 HG23 THR 2 -20.267 -6.488 -11.242 19 H VAL 3 HN VAL 3 -17.004 -8.198 -13.386 20 HA VAL 3 HA VAL 3 -18.609 -10.543 -13.843 21 HB VAL 3 HB VAL 3 -16.981 -11.694 -15.288 22 1HG1 VAL 3 HG11 VAL 3 -17.682 -10.754 -17.336 23 2HG1 VAL 3 HG12 VAL 3 -17.848 -9.146 -16.629 24 3HG1 VAL 3 HG13 VAL 3 -18.978 -10.426 -16.186 25 1HG2 VAL 3 HG21 VAL 3 -15.662 -8.987 -15.474 26 2HG2 VAL 3 HG22 VAL 3 -15.262 -10.386 -16.469 27 3HG2 VAL 3 HG23 VAL 3 -14.987 -10.435 -14.728 28 HA PRO 4 HA PRO 4 -16.416 -11.828 -10.214 29 1HB PRO 4 HB2 PRO 4 -16.749 -14.543 -11.430 30 2HB PRO 4 HB1 PRO 4 -17.138 -13.986 -9.799 31 1HG PRO 4 HG2 PRO 4 -19.064 -14.348 -11.573 32 2HG PRO 4 HG1 PRO 4 -19.098 -12.939 -10.495 33 1HD PRO 4 HD2 PRO 4 -18.338 -13.099 -13.385 34 2HD PRO 4 HD1 PRO 4 -19.248 -11.839 -12.525 35 H ASP 5 HN ASP 5 -15.209 -14.688 -11.564 36 HA ASP 5 HA ASP 5 -13.149 -15.387 -12.191 37 1HB ASP 5 HB2 ASP 5 -12.880 -12.559 -13.237 38 2HB ASP 5 HB1 ASP 5 -11.776 -13.881 -13.600 39 H ARG 6 HN ARG 6 -11.524 -15.796 -10.867 40 HA ARG 6 HA ARG 6 -10.972 -14.184 -8.613 41 1HB ARG 6 HB2 ARG 6 -9.376 -16.468 -9.786 42 2HB ARG 6 HB1 ARG 6 -9.144 -15.784 -8.183 43 1HG ARG 6 HG2 ARG 6 -11.394 -16.481 -7.551 44 2HG ARG 6 HG1 ARG 6 -11.643 -17.150 -9.164 45 1HD ARG 6 HD2 ARG 6 -11.065 -18.908 -7.592 46 2HD ARG 6 HD1 ARG 6 -9.791 -18.711 -8.795 47 HE ARG 6 HE ARG 6 -9.140 -17.142 -6.579 48 1HH1 ARG 6 HH11 ARG 6 -9.493 -20.512 -7.412 49 2HH1 ARG 6 HH12 ARG 6 -8.331 -21.052 -6.247 50 1HH2 ARG 6 HH21 ARG 6 -7.612 -17.851 -5.044 51 2HH2 ARG 6 HH22 ARG 6 -7.263 -19.541 -4.902 52 H SER 7 HN SER 7 -9.636 -14.340 -11.813 53 HA SER 7 HA SER 7 -7.113 -13.304 -11.559 54 1HB SER 7 HB2 SER 7 -9.171 -12.665 -13.684 55 2HB SER 7 HB1 SER 7 -7.446 -12.322 -13.825 56 HG SER 7 HG SER 7 -7.247 -14.697 -13.353 57 H GLU 8 HN GLU 8 -10.156 -11.630 -11.200 58 HA GLU 8 HA GLU 8 -9.624 -9.018 -11.551 59 1HB GLU 8 HB2 GLU 8 -11.146 -8.504 -9.692 60 2HB GLU 8 HB1 GLU 8 -11.764 -9.809 -10.698 61 1HG GLU 8 HG2 GLU 8 -11.067 -11.447 -9.061 62 2HG GLU 8 HG1 GLU 8 -10.327 -10.187 -8.079 63 H ILE 9 HN ILE 9 -8.369 -11.021 -8.961 64 HA ILE 9 HA ILE 9 -6.543 -8.845 -8.256 65 HB ILE 9 HB ILE 9 -7.936 -10.580 -6.209 66 1HG1 ILE 9 HG12 ILE 9 -8.389 -7.780 -7.181 67 2HG1 ILE 9 HG11 ILE 9 -9.568 -9.041 -6.859 68 1HG2 ILE 9 HG21 ILE 9 -6.420 -8.162 -5.445 69 2HG2 ILE 9 HG22 ILE 9 -5.478 -9.566 -5.937 70 3HG2 ILE 9 HG23 ILE 9 -6.612 -9.692 -4.595 71 1HD1 ILE 9 HD11 ILE 9 -9.133 -8.767 -4.440 72 2HD1 ILE 9 HD12 ILE 9 -9.782 -7.321 -5.211 73 3HD1 ILE 9 HD13 ILE 9 -8.064 -7.417 -4.824 74 H ALA 10 HN ALA 10 -5.516 -10.442 -9.916 75 HA ALA 10 HA ALA 10 -3.694 -12.140 -8.398 76 1HB ALA 10 HB1 ALA 10 -4.173 -14.117 -9.387 77 2HB ALA 10 HB2 ALA 10 -4.665 -13.363 -10.905 78 3HB ALA 10 HB3 ALA 10 -5.771 -13.389 -9.532 79 H GLY 11 HN GLY 11 -1.636 -11.999 -9.129 80 1HA GLY 11 HA2 GLY 11 -0.390 -11.963 -11.398 81 2HA GLY 11 HA1 GLY 11 -1.210 -10.422 -11.581 82 H LYS 12 HN LYS 12 0.152 -8.786 -11.253 83 HA LYS 12 HA LYS 12 2.097 -8.998 -9.044 84 1HB LYS 12 HB2 LYS 12 2.524 -7.687 -11.732 85 2HB LYS 12 HB1 LYS 12 3.662 -7.646 -10.394 86 1HG LYS 12 HG2 LYS 12 3.929 -10.060 -10.527 87 2HG LYS 12 HG1 LYS 12 2.759 -10.124 -11.848 88 1HD LYS 12 HD2 LYS 12 4.221 -8.715 -13.213 89 2HD LYS 12 HD1 LYS 12 5.387 -8.638 -11.890 90 1HE LYS 12 HE2 LYS 12 4.519 -11.136 -13.341 91 2HE LYS 12 HE1 LYS 12 6.043 -10.282 -13.579 92 1HZ LYS 12 HZ1 LYS 12 5.181 -11.955 -11.337 93 2HZ LYS 12 HZ2 LYS 12 6.221 -10.664 -11.006 94 3HZ LYS 12 HZ3 LYS 12 6.689 -11.866 -12.099 95 H TRP 13 HN TRP 13 2.273 -7.331 -7.688 96 HA TRP 13 HA TRP 13 0.653 -4.919 -8.204 97 1HB TRP 13 HB2 TRP 13 1.378 -6.352 -5.649 98 2HB TRP 13 HB1 TRP 13 0.778 -4.699 -5.648 99 HD1 TRP 13 HD1 TRP 13 -0.970 -6.600 -8.291 100 HE1 TRP 13 HE1 TRP 13 -3.302 -7.331 -7.479 101 HE3 TRP 13 HE3 TRP 13 -0.432 -5.648 -3.297 102 HZ2 TRP 13 HZ2 TRP 13 -4.715 -7.492 -5.047 103 HZ3 TRP 13 HZ3 TRP 13 -2.319 -6.127 -1.795 104 HH2 TRP 13 HH2 TRP 13 -4.419 -7.029 -2.655 105 H TYR 14 HN TYR 14 1.692 -2.949 -8.190 106 HA TYR 14 HA TYR 14 4.531 -2.983 -7.382 107 1HB TYR 14 HB2 TYR 14 3.199 -1.318 -9.520 108 2HB TYR 14 HB1 TYR 14 4.864 -1.116 -8.998 109 HD1 TYR 14 HD1 TYR 14 2.731 -4.045 -9.977 110 HD2 TYR 14 HD2 TYR 14 6.372 -1.913 -10.525 111 HE1 TYR 14 HE1 TYR 14 3.448 -5.710 -11.636 112 HE2 TYR 14 HE2 TYR 14 7.099 -3.573 -12.186 113 HH TYR 14 HH TYR 14 5.430 -5.397 -13.816 114 H VAL 15 HN VAL 15 4.956 -1.844 -5.616 115 HA VAL 15 HA VAL 15 3.096 0.288 -4.873 116 HB VAL 15 HB VAL 15 3.076 -1.028 -3.034 117 1HG1 VAL 15 HG11 VAL 15 5.393 -2.001 -2.174 118 2HG1 VAL 15 HG12 VAL 15 5.774 -1.862 -3.888 119 3HG1 VAL 15 HG13 VAL 15 4.396 -2.827 -3.367 120 1HG2 VAL 15 HG21 VAL 15 5.473 0.724 -2.487 121 2HG2 VAL 15 HG22 VAL 15 4.511 -0.093 -1.260 122 3HG2 VAL 15 HG23 VAL 15 3.779 1.155 -2.265 123 H VAL 16 HN VAL 16 3.590 2.286 -4.871 124 HA VAL 16 HA VAL 16 6.330 3.258 -4.694 125 HB VAL 16 HB VAL 16 4.730 3.211 -7.168 126 1HG1 VAL 16 HG11 VAL 16 6.025 5.771 -6.264 127 2HG1 VAL 16 HG12 VAL 16 4.371 5.524 -6.815 128 3HG1 VAL 16 HG13 VAL 16 5.709 5.400 -7.957 129 1HG2 VAL 16 HG21 VAL 16 7.514 3.025 -6.303 130 2HG2 VAL 16 HG22 VAL 16 7.294 3.899 -7.819 131 3HG2 VAL 16 HG23 VAL 16 6.690 2.250 -7.656 132 H ALA 17 HN ALA 17 2.904 4.095 -5.172 133 HA ALA 17 HA ALA 17 3.240 6.685 -3.899 134 1HB ALA 17 HB1 ALA 17 0.493 6.075 -4.247 135 2HB ALA 17 HB2 ALA 17 1.353 5.505 -5.678 136 3HB ALA 17 HB3 ALA 17 1.492 7.190 -5.177 137 H LEU 18 HN LEU 18 2.697 7.184 -1.812 138 HA LEU 18 HA LEU 18 1.081 5.331 -0.260 139 1HB LEU 18 HB2 LEU 18 3.924 6.010 0.489 140 2HB LEU 18 HB1 LEU 18 2.774 5.281 1.586 141 HG LEU 18 HG LEU 18 2.618 3.380 -0.134 142 1HD1 LEU 18 HD11 LEU 18 5.286 3.624 -1.047 143 2HD1 LEU 18 HD12 LEU 18 4.428 5.101 -1.484 144 3HD1 LEU 18 HD13 LEU 18 3.804 3.534 -1.997 145 1HD2 LEU 18 HD21 LEU 18 3.687 3.195 2.059 146 2HD2 LEU 18 HD22 LEU 18 5.187 3.823 1.377 147 3HD2 LEU 18 HD23 LEU 18 4.553 2.270 0.833 148 H ALA 19 HN ALA 19 1.249 6.190 2.182 149 HA ALA 19 HA ALA 19 1.465 8.995 2.573 150 1HB ALA 19 HB1 ALA 19 -1.130 7.952 1.689 151 2HB ALA 19 HB2 ALA 19 -0.514 9.601 1.693 152 3HB ALA 19 HB3 ALA 19 -1.202 8.915 3.165 153 H SER 20 HN SER 20 2.137 9.074 4.666 154 HA SER 20 HA SER 20 0.638 7.604 6.663 155 1HB SER 20 HB2 SER 20 2.546 6.300 7.486 156 2HB SER 20 HB1 SER 20 2.153 5.872 5.821 157 HG SER 20 HG SER 20 4.142 6.341 5.393 158 H ASN 21 HN ASN 21 1.202 8.005 8.791 159 HA ASN 21 HA ASN 21 3.245 9.842 9.530 160 1HB ASN 21 HB2 ASN 21 0.424 10.797 9.259 161 2HB ASN 21 HB1 ASN 21 1.398 11.399 10.597 162 1HD2 ASN 21 HD21 ASN 21 1.058 11.270 7.137 163 2HD2 ASN 21 HD22 ASN 21 2.132 12.575 6.784 164 H THR 22 HN THR 22 3.807 9.463 11.561 165 HA THR 22 HA THR 22 1.986 8.561 13.582 166 HB THR 22 HB THR 22 3.149 6.381 13.948 167 HG1 THR 22 HG1 THR 22 5.005 7.066 12.599 168 1HG2 THR 22 HG21 THR 22 1.963 5.122 12.392 169 2HG2 THR 22 HG22 THR 22 2.043 6.388 11.168 170 3HG2 THR 22 HG23 THR 22 1.011 6.593 12.583 171 H GLU 23 HN GLU 23 2.945 8.520 15.663 172 HA GLU 23 HA GLU 23 5.039 10.364 16.017 173 1HB GLU 23 HB2 GLU 23 3.797 8.423 17.968 174 2HB GLU 23 HB1 GLU 23 4.912 9.706 18.419 175 1HG GLU 23 HG2 GLU 23 2.238 10.104 17.096 176 2HG GLU 23 HG1 GLU 23 2.572 10.309 18.814 177 H PHE 24 HN PHE 24 5.333 7.308 17.743 178 HA PHE 24 HA PHE 24 8.147 7.269 17.355 179 1HB PHE 24 HB2 PHE 24 6.216 5.315 18.589 180 2HB PHE 24 HB1 PHE 24 7.938 4.975 18.468 181 HD1 PHE 24 HD1 PHE 24 6.068 8.091 19.352 182 HD2 PHE 24 HD2 PHE 24 8.854 5.109 20.560 183 HE1 PHE 24 HE1 PHE 24 6.467 9.317 21.444 184 HE2 PHE 24 HE2 PHE 24 9.256 6.331 22.656 185 HZ PHE 24 HZ PHE 24 8.062 8.437 23.101 186 H PHE 25 HN PHE 25 5.476 5.501 15.900 187 HA PHE 25 HA PHE 25 6.905 3.502 14.597 188 1HB PHE 25 HB2 PHE 25 4.458 3.533 14.775 189 2HB PHE 25 HB1 PHE 25 4.393 4.897 13.670 190 HD1 PHE 25 HD1 PHE 25 3.569 4.301 11.622 191 HD2 PHE 25 HD2 PHE 25 6.153 1.607 13.665 192 HE1 PHE 25 HE1 PHE 25 3.439 2.743 9.723 193 HE2 PHE 25 HE2 PHE 25 6.030 0.046 11.768 194 HZ PHE 25 HZ PHE 25 4.671 0.613 9.794 195 H LEU 26 HN LEU 26 6.807 6.880 13.929 196 HA LEU 26 HA LEU 26 7.155 7.111 11.241 197 1HB LEU 26 HB2 LEU 26 8.124 9.186 11.580 198 2HB LEU 26 HB1 LEU 26 7.196 8.936 13.039 199 HG LEU 26 HG LEU 26 9.243 9.929 13.685 200 1HD1 LEU 26 HD11 LEU 26 8.471 7.463 14.658 201 2HD1 LEU 26 HD12 LEU 26 9.552 8.613 15.435 202 3HD1 LEU 26 HD13 LEU 26 10.211 7.319 14.437 203 1HD2 LEU 26 HD21 LEU 26 11.049 7.843 12.684 204 2HD2 LEU 26 HD22 LEU 26 11.256 9.593 12.758 205 3HD2 LEU 26 HD23 LEU 26 10.324 8.870 11.447 206 H ARG 27 HN ARG 27 9.457 5.776 13.506 207 HA ARG 27 HA ARG 27 11.813 5.938 12.078 208 1HB ARG 27 HB2 ARG 27 10.838 3.617 13.753 209 2HB ARG 27 HB1 ARG 27 12.506 3.882 13.261 210 1HG ARG 27 HG2 ARG 27 12.471 6.036 14.496 211 2HG ARG 27 HG1 ARG 27 10.857 5.626 15.077 212 1HD ARG 27 HD2 ARG 27 13.374 4.039 15.564 213 2HD ARG 27 HD1 ARG 27 12.566 5.082 16.732 214 HE ARG 27 HE ARG 27 10.732 3.173 15.813 215 1HH1 ARG 27 HH11 ARG 27 13.634 3.375 17.741 216 2HH1 ARG 27 HH12 ARG 27 13.238 1.994 18.708 217 1HH2 ARG 27 HH21 ARG 27 10.209 1.355 17.085 218 2HH2 ARG 27 HH22 ARG 27 11.294 0.847 18.335 219 H GLU 28 HN GLU 28 9.234 3.528 11.784 220 HA GLU 28 HA GLU 28 10.536 2.037 9.730 221 1HB GLU 28 HB2 GLU 28 8.809 1.074 11.223 222 2HB GLU 28 HB1 GLU 28 7.604 2.108 10.468 223 1HG GLU 28 HG2 GLU 28 7.900 0.995 8.356 224 2HG GLU 28 HG1 GLU 28 9.223 0.032 9.012 225 H LYS 29 HN LYS 29 8.548 4.869 9.801 226 HA LYS 29 HA LYS 29 7.644 4.784 7.111 227 1HB LYS 29 HB2 LYS 29 6.502 6.154 8.759 228 2HB LYS 29 HB1 LYS 29 7.954 7.109 9.018 229 1HG LYS 29 HG2 LYS 29 7.820 7.920 6.705 230 2HG LYS 29 HG1 LYS 29 6.343 6.983 6.475 231 1HD LYS 29 HD2 LYS 29 5.218 8.277 8.188 232 2HD LYS 29 HD1 LYS 29 6.704 9.164 8.530 233 1HE LYS 29 HE2 LYS 29 5.169 9.197 5.932 234 2HE LYS 29 HE1 LYS 29 5.190 10.480 7.140 235 1HZ LYS 29 HZ1 LYS 29 6.722 11.149 5.541 236 2HZ LYS 29 HZ2 LYS 29 7.377 9.600 5.359 237 3HZ LYS 29 HZ3 LYS 29 7.693 10.491 6.761 238 H ASP 30 HN ASP 30 10.487 6.153 8.682 239 HA ASP 30 HA ASP 30 11.413 7.694 6.525 240 1HB ASP 30 HB2 ASP 30 12.231 7.957 8.830 241 2HB ASP 30 HB1 ASP 30 13.025 6.389 8.724 242 H LYS 31 HN LYS 31 12.022 4.308 7.366 243 HA LYS 31 HA LYS 31 14.049 3.868 5.442 244 1HB LYS 31 HB2 LYS 31 13.631 1.470 5.853 245 2HB LYS 31 HB1 LYS 31 13.785 2.390 7.344 246 1HG LYS 31 HG2 LYS 31 11.366 2.422 7.584 247 2HG LYS 31 HG1 LYS 31 11.196 1.507 6.086 248 1HD LYS 31 HD2 LYS 31 12.582 0.571 8.599 249 2HD LYS 31 HD1 LYS 31 10.991 0.057 8.039 250 1HE LYS 31 HE2 LYS 31 13.603 -0.378 6.595 251 2HE LYS 31 HE1 LYS 31 12.705 -1.596 7.498 252 1HZ LYS 31 HZ1 LYS 31 10.807 -0.970 5.887 253 2HZ LYS 31 HZ2 LYS 31 12.047 -1.981 5.341 254 3HZ LYS 31 HZ3 LYS 31 12.045 -0.344 4.917 255 H MET 32 HN MET 32 12.381 5.212 3.873 256 HA MET 32 HA MET 32 10.639 3.399 2.429 257 1HB MET 32 HB2 MET 32 11.343 6.289 1.892 258 2HB MET 32 HB1 MET 32 10.151 5.357 0.997 259 1HG MET 32 HG2 MET 32 8.941 5.026 3.176 260 2HG MET 32 HG1 MET 32 10.051 6.207 3.868 261 1HE MET 32 HE1 MET 32 7.923 5.419 0.930 262 2HE MET 32 HE2 MET 32 8.417 6.845 0.018 263 3HE MET 32 HE3 MET 32 6.817 6.781 0.755 264 H LYS 33 HN LYS 33 10.986 2.555 0.439 265 HA LYS 33 HA LYS 33 13.336 3.299 -1.103 266 1HB LYS 33 HB2 LYS 33 12.865 0.491 -0.078 267 2HB LYS 33 HB1 LYS 33 14.047 0.908 -1.305 268 1HG LYS 33 HG2 LYS 33 14.161 2.274 1.337 269 2HG LYS 33 HG1 LYS 33 14.736 0.617 1.196 270 1HD LYS 33 HD2 LYS 33 16.532 2.278 0.930 271 2HD LYS 33 HD1 LYS 33 16.327 1.264 -0.489 272 1HE LYS 33 HE2 LYS 33 14.984 3.933 -0.316 273 2HE LYS 33 HE1 LYS 33 16.678 3.816 -0.777 274 1HZ LYS 33 HZ1 LYS 33 16.126 3.149 -2.806 275 2HZ LYS 33 HZ2 LYS 33 14.534 3.584 -2.452 276 3HZ LYS 33 HZ3 LYS 33 15.040 1.987 -2.240 277 H MET 34 HN MET 34 13.298 1.363 -3.061 278 HA MET 34 HA MET 34 10.835 1.974 -4.417 279 1HB MET 34 HB2 MET 34 13.014 -0.010 -5.119 280 2HB MET 34 HB1 MET 34 11.711 0.482 -6.189 281 1HG MET 34 HG2 MET 34 13.864 2.283 -5.100 282 2HG MET 34 HG1 MET 34 13.824 1.589 -6.718 283 1HE MET 34 HE1 MET 34 12.278 3.649 -4.115 284 2HE MET 34 HE2 MET 34 10.667 3.902 -4.787 285 3HE MET 34 HE3 MET 34 11.897 5.154 -4.951 286 H ALA 35 HN ALA 35 8.999 0.569 -4.698 287 HA ALA 35 HA ALA 35 9.254 -1.921 -3.147 288 1HB ALA 35 HB1 ALA 35 8.037 0.001 -2.019 289 2HB ALA 35 HB2 ALA 35 7.240 -1.570 -2.051 290 3HB ALA 35 HB3 ALA 35 6.744 -0.308 -3.174 291 H MET 36 HN MET 36 8.586 -3.700 -4.003 292 HA MET 36 HA MET 36 6.894 -3.640 -6.415 293 1HB MET 36 HB2 MET 36 9.226 -4.295 -6.939 294 2HB MET 36 HB1 MET 36 9.122 -5.585 -5.751 295 1HG MET 36 HG2 MET 36 7.366 -6.659 -7.057 296 2HG MET 36 HG1 MET 36 7.456 -5.361 -8.246 297 1HE MET 36 HE1 MET 36 11.113 -5.849 -9.625 298 2HE MET 36 HE2 MET 36 10.715 -4.907 -8.189 299 3HE MET 36 HE3 MET 36 9.683 -4.815 -9.616 300 H ALA 37 HN ALA 37 5.575 -5.718 -6.645 301 HA ALA 37 HA ALA 37 5.281 -7.324 -4.283 302 1HB ALA 37 HB1 ALA 37 3.046 -5.419 -4.942 303 2HB ALA 37 HB2 ALA 37 4.166 -5.252 -3.592 304 3HB ALA 37 HB3 ALA 37 3.057 -6.620 -3.652 305 H ARG 38 HN ARG 38 3.886 -9.083 -4.478 306 HA ARG 38 HA ARG 38 2.805 -9.582 -7.175 307 1HB ARG 38 HB2 ARG 38 3.541 -11.926 -6.954 308 2HB ARG 38 HB1 ARG 38 4.897 -10.805 -6.906 309 1HG ARG 38 HG2 ARG 38 5.016 -10.997 -4.499 310 2HG ARG 38 HG1 ARG 38 3.607 -12.058 -4.491 311 1HD ARG 38 HD2 ARG 38 5.668 -13.339 -4.299 312 2HD ARG 38 HD1 ARG 38 4.833 -13.703 -5.808 313 HE ARG 38 HE ARG 38 6.699 -11.670 -6.286 314 1HH1 ARG 38 HH11 ARG 38 6.593 -15.053 -5.462 315 2HH1 ARG 38 HH12 ARG 38 8.105 -15.418 -6.221 316 1HH2 ARG 38 HH21 ARG 38 8.695 -12.143 -7.291 317 2HH2 ARG 38 HH22 ARG 38 9.301 -13.765 -7.260 318 H ILE 39 HN ILE 39 0.721 -10.137 -7.167 319 HA ILE 39 HA ILE 39 -0.595 -10.659 -4.624 320 HB ILE 39 HB ILE 39 -1.754 -9.005 -5.700 321 1HG1 ILE 39 HG12 ILE 39 -3.882 -9.907 -6.514 322 2HG1 ILE 39 HG11 ILE 39 -3.157 -11.494 -6.676 323 1HG2 ILE 39 HG21 ILE 39 -0.647 -8.874 -7.754 324 2HG2 ILE 39 HG22 ILE 39 -2.350 -9.107 -8.156 325 3HG2 ILE 39 HG23 ILE 39 -1.219 -10.454 -8.256 326 1HD1 ILE 39 HD11 ILE 39 -3.638 -11.950 -4.573 327 2HD1 ILE 39 HD12 ILE 39 -4.414 -10.369 -4.425 328 3HD1 ILE 39 HD13 ILE 39 -2.705 -10.558 -4.032 329 H SER 40 HN SER 40 -1.558 -12.493 -4.015 330 HA SER 40 HA SER 40 -2.260 -14.589 -5.864 331 1HB SER 40 HB2 SER 40 0.100 -15.089 -5.672 332 2HB SER 40 HB1 SER 40 0.032 -14.976 -3.915 333 HG SER 40 HG SER 40 -0.675 -16.955 -3.834 334 H PHE 41 HN PHE 41 -3.974 -15.716 -5.082 335 HA PHE 41 HA PHE 41 -5.023 -15.044 -2.484 336 1HB PHE 41 HB2 PHE 41 -5.999 -16.724 -4.774 337 2HB PHE 41 HB1 PHE 41 -6.800 -16.808 -3.210 338 HD1 PHE 41 HD1 PHE 41 -8.894 -15.928 -3.941 339 HD2 PHE 41 HD2 PHE 41 -5.303 -13.726 -4.552 340 HE1 PHE 41 HE1 PHE 41 -10.218 -13.924 -4.480 341 HE2 PHE 41 HE2 PHE 41 -6.620 -11.723 -5.088 342 HZ PHE 41 HZ PHE 41 -9.079 -11.817 -5.054 343 H LEU 42 HN LEU 42 -4.453 -15.984 -0.650 344 HA LEU 42 HA LEU 42 -3.217 -18.614 -0.662 345 1HB LEU 42 HB2 LEU 42 -2.204 -16.768 0.622 346 2HB LEU 42 HB1 LEU 42 -3.647 -16.661 1.603 347 HG LEU 42 HG LEU 42 -1.788 -17.804 2.752 348 1HD1 LEU 42 HD11 LEU 42 -3.179 -19.141 3.881 349 2HD1 LEU 42 HD12 LEU 42 -3.664 -20.033 2.439 350 3HD1 LEU 42 HD13 LEU 42 -4.412 -18.479 2.809 351 1HD2 LEU 42 HD21 LEU 42 -1.251 -18.948 0.367 352 2HD2 LEU 42 HD22 LEU 42 -2.091 -20.265 1.186 353 3HD2 LEU 42 HD23 LEU 42 -0.656 -19.545 1.916 354 H GLY 43 HN GLY 43 -4.140 -20.449 -0.056 355 1HA GLY 43 HA2 GLY 43 -6.048 -21.810 0.233 356 2HA GLY 43 HA1 GLY 43 -5.665 -21.298 1.863 357 H GLU 44 HN GLU 44 -7.166 -19.533 -0.810 358 HA GLU 44 HA GLU 44 -9.049 -18.302 -0.966 359 1HB GLU 44 HB2 GLU 44 -11.143 -19.427 -0.359 360 2HB GLU 44 HB1 GLU 44 -10.040 -20.477 -1.229 361 1HG GLU 44 HG2 GLU 44 -9.426 -21.578 0.851 362 2HG GLU 44 HG1 GLU 44 -10.508 -20.509 1.745 363 H ASP 45 HN ASP 45 -9.115 -19.563 2.386 364 HA ASP 45 HA ASP 45 -10.658 -17.593 3.508 365 1HB ASP 45 HB2 ASP 45 -9.924 -19.660 4.657 366 2HB ASP 45 HB1 ASP 45 -8.313 -18.972 4.823 367 H GLU 46 HN GLU 46 -7.340 -17.341 2.454 368 HA GLU 46 HA GLU 46 -7.389 -14.524 3.265 369 1HB GLU 46 HB2 GLU 46 -4.980 -16.281 3.744 370 2HB GLU 46 HB1 GLU 46 -5.151 -14.585 4.164 371 1HG GLU 46 HG2 GLU 46 -5.424 -15.693 6.177 372 2HG GLU 46 HG1 GLU 46 -7.074 -15.340 5.665 373 H LEU 47 HN LEU 47 -6.572 -13.155 1.776 374 HA LEU 47 HA LEU 47 -5.180 -14.356 -0.520 375 1HB LEU 47 HB2 LEU 47 -5.956 -12.615 -1.917 376 2HB LEU 47 HB1 LEU 47 -7.340 -13.162 -0.999 377 HG LEU 47 HG LEU 47 -7.497 -10.812 -1.159 378 1HD1 LEU 47 HD11 LEU 47 -7.853 -11.918 1.113 379 2HD1 LEU 47 HD12 LEU 47 -7.703 -10.162 1.053 380 3HD1 LEU 47 HD13 LEU 47 -6.335 -11.144 1.570 381 1HD2 LEU 47 HD21 LEU 47 -5.771 -9.445 -1.355 382 2HD2 LEU 47 HD22 LEU 47 -4.712 -10.850 -1.248 383 3HD2 LEU 47 HD23 LEU 47 -5.122 -9.941 0.207 384 H LYS 48 HN LYS 48 -3.058 -13.878 -0.791 385 HA LYS 48 HA LYS 48 -2.016 -11.683 0.868 386 1HB LYS 48 HB2 LYS 48 -0.015 -12.958 1.263 387 2HB LYS 48 HB1 LYS 48 -1.415 -13.933 1.673 388 1HG LYS 48 HG2 LYS 48 -0.066 -15.437 0.575 389 2HG LYS 48 HG1 LYS 48 -1.149 -14.901 -0.709 390 1HD LYS 48 HD2 LYS 48 0.534 -13.413 -1.577 391 2HD LYS 48 HD1 LYS 48 1.592 -13.744 -0.206 392 1HE LYS 48 HE2 LYS 48 0.703 -15.755 -2.271 393 2HE LYS 48 HE1 LYS 48 2.276 -14.958 -2.229 394 1HZ LYS 48 HZ1 LYS 48 2.508 -17.092 -1.250 395 2HZ LYS 48 HZ2 LYS 48 1.172 -16.860 -0.239 396 3HZ LYS 48 HZ3 LYS 48 2.585 -15.966 0.010 397 H VAL 49 HN VAL 49 -0.130 -10.594 0.236 398 HA VAL 49 HA VAL 49 0.596 -10.733 -2.599 399 HB VAL 49 HB VAL 49 -1.043 -8.909 -2.400 400 1HG1 VAL 49 HG11 VAL 49 -1.055 -7.372 -0.762 401 2HG1 VAL 49 HG12 VAL 49 0.694 -7.162 -0.811 402 3HG1 VAL 49 HG13 VAL 49 -0.006 -8.506 0.089 403 1HG2 VAL 49 HG21 VAL 49 0.259 -8.186 -4.076 404 2HG2 VAL 49 HG22 VAL 49 1.748 -8.525 -3.195 405 3HG2 VAL 49 HG23 VAL 49 0.871 -7.025 -2.900 406 H SER 50 HN SER 50 2.732 -11.198 -2.546 407 HA SER 50 HA SER 50 4.350 -10.360 -0.292 408 1HB SER 50 HB2 SER 50 4.474 -12.618 -1.611 409 2HB SER 50 HB1 SER 50 5.458 -11.694 -2.745 410 HG SER 50 HG SER 50 6.872 -11.212 -1.029 411 H TYR 51 HN TYR 51 5.203 -8.373 -0.235 412 HA TYR 51 HA TYR 51 5.906 -7.095 -2.779 413 1HB TYR 51 HB2 TYR 51 5.838 -4.959 -1.578 414 2HB TYR 51 HB1 TYR 51 4.313 -5.823 -1.434 415 HD1 TYR 51 HD1 TYR 51 3.329 -5.964 0.637 416 HD2 TYR 51 HD2 TYR 51 7.537 -5.380 0.417 417 HE1 TYR 51 HE1 TYR 51 3.416 -5.719 3.078 418 HE2 TYR 51 HE2 TYR 51 7.637 -5.141 2.862 419 HH TYR 51 HH TYR 51 6.218 -5.905 4.847 420 H ALA 52 HN ALA 52 7.953 -6.497 -3.239 421 HA ALA 52 HA ALA 52 9.974 -6.936 -1.142 422 1HB ALA 52 HB1 ALA 52 9.956 -8.795 -2.756 423 2HB ALA 52 HB2 ALA 52 11.473 -7.898 -2.784 424 3HB ALA 52 HB3 ALA 52 10.277 -7.650 -4.056 425 H VAL 53 HN VAL 53 10.632 -4.933 -0.631 426 HA VAL 53 HA VAL 53 10.844 -2.873 -2.635 427 HB VAL 53 HB VAL 53 11.511 -1.397 -0.815 428 1HG1 VAL 53 HG11 VAL 53 9.453 -2.071 0.755 429 2HG1 VAL 53 HG12 VAL 53 9.088 -3.086 -0.640 430 3HG1 VAL 53 HG13 VAL 53 9.246 -1.340 -0.835 431 1HG2 VAL 53 HG21 VAL 53 11.776 -3.972 0.671 432 2HG2 VAL 53 HG22 VAL 53 11.343 -2.505 1.549 433 3HG2 VAL 53 HG23 VAL 53 12.852 -2.575 0.640 434 HA PRO 54 HA PRO 54 15.191 -3.929 -3.169 435 1HB PRO 54 HB2 PRO 54 15.269 -3.001 -5.766 436 2HB PRO 54 HB1 PRO 54 14.797 -4.629 -5.282 437 1HG PRO 54 HG2 PRO 54 13.155 -2.589 -6.433 438 2HG PRO 54 HG1 PRO 54 12.678 -4.217 -5.929 439 1HD PRO 54 HD2 PRO 54 12.365 -1.641 -4.521 440 2HD PRO 54 HD1 PRO 54 11.435 -3.142 -4.352 441 H LYS 55 HN LYS 55 17.124 -2.857 -3.623 442 HA LYS 55 HA LYS 55 17.626 -0.299 -4.411 443 1HB LYS 55 HB2 LYS 55 16.262 0.512 -2.550 444 2HB LYS 55 HB1 LYS 55 17.249 -0.393 -1.413 445 1HG LYS 55 HG2 LYS 55 17.816 1.982 -1.416 446 2HG LYS 55 HG1 LYS 55 19.174 0.994 -1.940 447 1HD LYS 55 HD2 LYS 55 17.342 2.101 -4.009 448 2HD LYS 55 HD1 LYS 55 18.480 3.193 -3.222 449 1HE LYS 55 HE2 LYS 55 20.326 1.688 -3.859 450 2HE LYS 55 HE1 LYS 55 19.174 0.655 -4.698 451 1HZ LYS 55 HZ1 LYS 55 18.979 2.097 -6.404 452 2HZ LYS 55 HZ2 LYS 55 20.522 2.578 -5.905 453 3HZ LYS 55 HZ3 LYS 55 19.166 3.470 -5.432 454 HA PRO 56 HA PRO 56 21.105 -3.225 -3.187 455 1HB PRO 56 HB2 PRO 56 22.055 -3.605 -5.706 456 2HB PRO 56 HB1 PRO 56 20.792 -4.611 -4.987 457 1HG PRO 56 HG2 PRO 56 20.527 -2.304 -6.878 458 2HG PRO 56 HG1 PRO 56 19.692 -3.869 -6.899 459 1HD PRO 56 HD2 PRO 56 18.526 -1.629 -5.945 460 2HD PRO 56 HD1 PRO 56 18.194 -3.234 -5.262 461 H ASN 57 HN ASN 57 21.159 -0.482 -2.815 462 HA ASN 57 HA ASN 57 23.850 0.142 -3.030 463 1HB ASN 57 HB2 ASN 57 23.408 0.330 -5.459 464 2HB ASN 57 HB1 ASN 57 22.181 1.548 -5.132 465 1HD2 ASN 57 HD21 ASN 57 22.848 3.521 -5.499 466 2HD2 ASN 57 HD22 ASN 57 24.454 4.118 -5.279 467 H GLY 58 HN GLY 58 21.814 0.275 -1.120 468 1HA GLY 58 HA2 GLY 58 22.247 2.830 -0.014 469 2HA GLY 58 HA1 GLY 58 20.652 2.794 -0.752 470 H CYS 59 HN CYS 59 19.781 0.265 -0.192 471 HA CYS 59 HA CYS 59 20.157 -0.293 2.616 472 1HB CYS 59 HB2 CYS 59 17.551 0.806 1.566 473 2HB CYS 59 HB1 CYS 59 17.652 -0.119 3.057 474 H ARG 60 HN ARG 60 20.502 -1.667 0.064 475 HA ARG 60 HA ARG 60 20.186 -3.697 -0.888 476 1HB ARG 60 HB2 ARG 60 20.779 -4.244 1.536 477 2HB ARG 60 HB1 ARG 60 19.071 -4.584 1.768 478 1HG ARG 60 HG2 ARG 60 20.254 -6.635 1.356 479 2HG ARG 60 HG1 ARG 60 19.204 -6.290 -0.018 480 1HD ARG 60 HD2 ARG 60 21.404 -7.063 -0.750 481 2HD ARG 60 HD1 ARG 60 21.098 -5.406 -1.266 482 HE ARG 60 HE ARG 60 22.930 -4.783 -0.075 483 1HH1 ARG 60 HH11 ARG 60 21.762 -7.795 1.250 484 2HH1 ARG 60 HH12 ARG 60 23.010 -7.896 2.446 485 1HH2 ARG 60 HH21 ARG 60 24.572 -4.918 1.496 486 2HH2 ARG 60 HH22 ARG 60 24.605 -6.265 2.585 487 H LYS 61 HN LYS 61 17.781 -5.331 0.611 488 HA LYS 61 HA LYS 61 15.517 -4.036 -0.603 489 1HB LYS 61 HB2 LYS 61 14.958 -5.883 -2.105 490 2HB LYS 61 HB1 LYS 61 16.520 -5.196 -2.528 491 1HG LYS 61 HG2 LYS 61 17.647 -7.034 -1.388 492 2HG LYS 61 HG1 LYS 61 16.082 -7.722 -0.949 493 1HD LYS 61 HD2 LYS 61 15.533 -7.994 -3.315 494 2HD LYS 61 HD1 LYS 61 17.087 -7.287 -3.762 495 1HE LYS 61 HE2 LYS 61 18.243 -9.122 -2.625 496 2HE LYS 61 HE1 LYS 61 16.688 -9.831 -2.188 497 1HZ LYS 61 HZ1 LYS 61 17.960 -10.648 -4.285 498 2HZ LYS 61 HZ2 LYS 61 17.270 -9.288 -5.016 499 3HZ LYS 61 HZ3 LYS 61 16.277 -10.476 -4.334 500 H TRP 62 HN TRP 62 13.582 -4.704 0.308 501 HA TRP 62 HA TRP 62 13.793 -6.918 2.248 502 1HB TRP 62 HB2 TRP 62 12.139 -4.404 2.546 503 2HB TRP 62 HB1 TRP 62 12.199 -5.737 3.690 504 HD1 TRP 62 HD1 TRP 62 15.087 -3.755 2.002 505 HE1 TRP 62 HE1 TRP 62 16.651 -2.916 3.865 506 HE3 TRP 62 HE3 TRP 62 12.516 -5.493 6.066 507 HZ2 TRP 62 HZ2 TRP 62 16.779 -2.981 6.682 508 HZ3 TRP 62 HZ3 TRP 62 13.428 -5.062 8.310 509 HH2 TRP 62 HH2 TRP 62 15.516 -3.832 8.610 510 H GLU 63 HN GLU 63 12.087 -8.335 2.445 511 HA GLU 63 HA GLU 63 9.807 -7.940 0.644 512 1HB GLU 63 HB2 GLU 63 9.916 -10.297 -0.060 513 2HB GLU 63 HB1 GLU 63 11.342 -9.395 -0.552 514 1HG GLU 63 HG2 GLU 63 12.578 -10.342 1.342 515 2HG GLU 63 HG1 GLU 63 11.148 -11.270 1.792 516 H THR 64 HN THR 64 7.864 -8.691 1.378 517 HA THR 64 HA THR 64 7.712 -10.419 3.694 518 HB THR 64 HB THR 64 6.753 -7.554 3.813 519 HG1 THR 64 HG1 THR 64 8.179 -7.479 5.594 520 1HG2 THR 64 HG21 THR 64 6.291 -9.816 5.735 521 2HG2 THR 64 HG22 THR 64 5.081 -8.843 4.902 522 3HG2 THR 64 HG23 THR 64 6.092 -8.112 6.149 523 H THR 65 HN THR 65 5.860 -11.574 3.731 524 HA THR 65 HA THR 65 3.995 -11.143 1.537 525 HB THR 65 HB THR 65 4.369 -13.438 3.464 526 HG1 THR 65 HG1 THR 65 5.917 -13.085 1.724 527 1HG2 THR 65 HG21 THR 65 2.194 -12.909 1.563 528 2HG2 THR 65 HG22 THR 65 2.242 -13.950 2.985 529 3HG2 THR 65 HG23 THR 65 2.932 -14.509 1.462 530 H PHE 66 HN PHE 66 2.259 -9.938 1.870 531 HA PHE 66 HA PHE 66 1.087 -9.751 4.550 532 1HB PHE 66 HB2 PHE 66 0.966 -8.063 2.080 533 2HB PHE 66 HB1 PHE 66 -0.354 -7.971 3.239 534 HD1 PHE 66 HD1 PHE 66 0.112 -5.632 3.669 535 HD2 PHE 66 HD2 PHE 66 3.049 -8.624 4.404 536 HE1 PHE 66 HE1 PHE 66 1.393 -4.034 5.031 537 HE2 PHE 66 HE2 PHE 66 4.335 -7.030 5.768 538 HZ PHE 66 HZ PHE 66 3.507 -4.731 6.083 539 H LYS 67 HN LYS 67 -0.848 -10.681 5.038 540 HA LYS 67 HA LYS 67 -2.594 -11.549 2.858 541 1HB LYS 67 HB2 LYS 67 -2.734 -13.819 3.633 542 2HB LYS 67 HB1 LYS 67 -1.037 -13.429 3.390 543 1HG LYS 67 HG2 LYS 67 -0.750 -13.103 5.783 544 2HG LYS 67 HG1 LYS 67 -2.459 -13.459 6.043 545 1HD LYS 67 HD2 LYS 67 -1.074 -15.412 6.520 546 2HD LYS 67 HD1 LYS 67 -2.131 -15.707 5.139 547 1HE LYS 67 HE2 LYS 67 -0.262 -15.216 3.623 548 2HE LYS 67 HE1 LYS 67 0.788 -14.956 5.015 549 1HZ LYS 67 HZ1 LYS 67 0.776 -17.241 3.850 550 2HZ LYS 67 HZ2 LYS 67 -0.652 -17.506 4.717 551 3HZ LYS 67 HZ3 LYS 67 0.789 -17.184 5.542 552 H LYS 68 HN LYS 68 -4.682 -11.236 3.314 553 HA LYS 68 HA LYS 68 -5.684 -11.405 6.020 554 1HB LYS 68 HB2 LYS 68 -5.768 -8.793 4.506 555 2HB LYS 68 HB1 LYS 68 -6.650 -9.114 5.984 556 1HG LYS 68 HG2 LYS 68 -4.869 -8.020 6.845 557 2HG LYS 68 HG1 LYS 68 -4.236 -9.662 6.890 558 1HD LYS 68 HD2 LYS 68 -2.928 -9.302 4.940 559 2HD LYS 68 HD1 LYS 68 -3.756 -7.793 4.580 560 1HE LYS 68 HE2 LYS 68 -2.825 -6.815 6.631 561 2HE LYS 68 HE1 LYS 68 -1.979 -8.327 6.954 562 1HZ LYS 68 HZ1 LYS 68 -0.520 -7.982 5.233 563 2HZ LYS 68 HZ2 LYS 68 -0.751 -6.400 5.784 564 3HZ LYS 68 HZ3 LYS 68 -1.556 -6.938 4.397 565 H THR 69 HN THR 69 -8.129 -10.162 5.698 566 HA THR 69 HA THR 69 -9.420 -11.914 3.743 567 HB THR 69 HB THR 69 -10.633 -10.189 5.916 568 HG1 THR 69 HG1 THR 69 -9.960 -12.939 5.837 569 1HG2 THR 69 HG21 THR 69 -12.382 -10.588 4.432 570 2HG2 THR 69 HG22 THR 69 -12.535 -11.864 5.640 571 3HG2 THR 69 HG23 THR 69 -11.821 -12.220 4.067 572 H SER 70 HN SER 70 -11.173 -11.022 2.351 573 HA SER 70 HA SER 70 -10.794 -8.162 1.766 574 1HB SER 70 HB2 SER 70 -10.889 -8.651 -0.652 575 2HB SER 70 HB1 SER 70 -9.495 -9.400 0.126 576 HG SER 70 HG SER 70 -11.488 -10.561 -1.238 577 H ASP 71 HN ASP 71 -12.569 -6.996 1.370 578 HA ASP 71 HA ASP 71 -15.154 -8.339 1.566 579 1HB ASP 71 HB2 ASP 71 -14.756 -6.405 3.015 580 2HB ASP 71 HB1 ASP 71 -14.469 -5.391 1.604 581 H ASP 72 HN ASP 72 -16.909 -7.855 0.131 582 HA ASP 72 HA ASP 72 -16.129 -7.853 -2.627 583 1HB ASP 72 HB2 ASP 72 -17.983 -9.244 -1.801 584 2HB ASP 72 HB1 ASP 72 -18.885 -7.792 -1.376 585 H GLY 73 HN GLY 73 -17.254 -6.452 -4.258 586 1HA GLY 73 HA2 GLY 73 -18.154 -4.396 -4.964 587 2HA GLY 73 HA1 GLY 73 -17.993 -3.785 -3.325 588 H GLU 74 HN GLU 74 -15.430 -4.096 -2.719 589 HA GLU 74 HA GLU 74 -13.809 -2.949 -4.873 590 1HB GLU 74 HB2 GLU 74 -13.993 -1.759 -2.089 591 2HB GLU 74 HB1 GLU 74 -12.948 -1.198 -3.387 592 1HG GLU 74 HG2 GLU 74 -14.900 -0.569 -4.700 593 2HG GLU 74 HG1 GLU 74 -15.956 -1.142 -3.408 594 H VAL 75 HN VAL 75 -11.657 -2.416 -2.756 595 HA VAL 75 HA VAL 75 -11.196 -5.217 -2.004 596 HB VAL 75 HB VAL 75 -9.802 -5.054 -3.866 597 1HG1 VAL 75 HG11 VAL 75 -9.527 -2.249 -3.091 598 2HG1 VAL 75 HG12 VAL 75 -9.542 -2.995 -4.686 599 3HG1 VAL 75 HG13 VAL 75 -8.061 -2.986 -3.731 600 1HG2 VAL 75 HG21 VAL 75 -7.494 -5.042 -2.965 601 2HG2 VAL 75 HG22 VAL 75 -8.617 -6.014 -2.014 602 3HG2 VAL 75 HG23 VAL 75 -8.128 -4.420 -1.443 603 H TYR 76 HN TYR 76 -11.064 -5.386 0.066 604 HA TYR 76 HA TYR 76 -9.693 -3.339 1.661 605 1HB TYR 76 HB2 TYR 76 -11.886 -2.640 2.027 606 2HB TYR 76 HB1 TYR 76 -12.536 -4.267 1.887 607 HD1 TYR 76 HD1 TYR 76 -10.223 -2.357 4.126 608 HD2 TYR 76 HD2 TYR 76 -13.320 -5.247 3.813 609 HE1 TYR 76 HE1 TYR 76 -10.262 -2.558 6.570 610 HE2 TYR 76 HE2 TYR 76 -13.379 -5.454 6.263 611 HH TYR 76 HH TYR 76 -10.979 -3.948 8.293 612 H TYR 77 HN TYR 77 -8.056 -4.445 2.601 613 HA TYR 77 HA TYR 77 -8.619 -7.177 3.480 614 1HB TYR 77 HB2 TYR 77 -6.372 -7.737 3.213 615 2HB TYR 77 HB1 TYR 77 -6.715 -6.692 1.852 616 HD1 TYR 77 HD1 TYR 77 -5.441 -6.363 5.368 617 HD2 TYR 77 HD2 TYR 77 -5.102 -5.165 1.298 618 HE1 TYR 77 HE1 TYR 77 -3.466 -5.014 5.935 619 HE2 TYR 77 HE2 TYR 77 -3.130 -3.809 1.857 620 HH TYR 77 HH TYR 77 -1.341 -3.822 3.666 621 H SER 78 HN SER 78 -8.576 -7.769 5.553 622 HA SER 78 HA SER 78 -7.455 -5.925 7.539 623 1HB SER 78 HB2 SER 78 -9.803 -5.308 7.375 624 2HB SER 78 HB1 SER 78 -10.285 -6.992 7.578 625 HG SER 78 HG SER 78 -9.385 -6.924 9.670 626 H GLU 79 HN GLU 79 -6.703 -6.878 9.405 627 HA GLU 79 HA GLU 79 -7.307 -9.591 10.115 628 1HB GLU 79 HB2 GLU 79 -4.830 -8.946 8.623 629 2HB GLU 79 HB1 GLU 79 -4.647 -10.007 10.010 630 1HG GLU 79 HG2 GLU 79 -6.533 -10.487 7.723 631 2HG GLU 79 HG1 GLU 79 -4.938 -11.215 7.891 632 H GLU 80 HN GLU 80 -7.195 -9.757 12.244 633 HA GLU 80 HA GLU 80 -7.011 -9.007 14.409 634 1HB GLU 80 HB2 GLU 80 -4.716 -9.293 15.252 635 2HB GLU 80 HB1 GLU 80 -5.171 -10.582 14.151 636 1HG GLU 80 HG2 GLU 80 -2.981 -10.067 13.562 637 2HG GLU 80 HG1 GLU 80 -3.955 -9.241 12.349 638 H ALA 81 HN ALA 81 -7.068 -7.207 15.618 639 HA ALA 81 HA ALA 81 -7.337 -4.740 15.016 640 1HB ALA 81 HB1 ALA 81 -5.624 -5.800 17.207 641 2HB ALA 81 HB2 ALA 81 -7.181 -4.977 17.286 642 3HB ALA 81 HB3 ALA 81 -5.712 -4.056 16.965 643 H LYS 82 HN LYS 82 -3.950 -5.092 15.909 644 HA LYS 82 HA LYS 82 -2.696 -3.093 14.856 645 1HB LYS 82 HB2 LYS 82 -1.863 -5.958 14.579 646 2HB LYS 82 HB1 LYS 82 -0.840 -4.663 13.992 647 1HG LYS 82 HG2 LYS 82 -0.144 -5.359 16.194 648 2HG LYS 82 HG1 LYS 82 -0.763 -3.710 16.245 649 1HD LYS 82 HD2 LYS 82 -2.807 -4.423 17.232 650 2HD LYS 82 HD1 LYS 82 -2.424 -6.123 16.946 651 1HE LYS 82 HE2 LYS 82 -0.570 -5.980 18.517 652 2HE LYS 82 HE1 LYS 82 -0.901 -4.268 18.772 653 1HZ LYS 82 HZ1 LYS 82 -3.125 -6.084 19.225 654 2HZ LYS 82 HZ2 LYS 82 -2.653 -4.713 20.095 655 3HZ LYS 82 HZ3 LYS 82 -1.853 -6.183 20.337 656 H LYS 83 HN LYS 83 -3.764 -5.732 12.626 657 HA LYS 83 HA LYS 83 -3.011 -3.932 10.432 658 1HB LYS 83 HB2 LYS 83 -3.641 -6.880 10.395 659 2HB LYS 83 HB1 LYS 83 -3.283 -5.924 8.969 660 1HG LYS 83 HG2 LYS 83 -1.422 -6.364 11.293 661 2HG LYS 83 HG1 LYS 83 -1.346 -7.193 9.737 662 1HD LYS 83 HD2 LYS 83 -1.008 -5.015 8.627 663 2HD LYS 83 HD1 LYS 83 -1.012 -4.230 10.208 664 1HE LYS 83 HE2 LYS 83 0.947 -6.316 9.253 665 2HE LYS 83 HE1 LYS 83 1.265 -4.590 9.423 666 1HZ LYS 83 HZ1 LYS 83 0.879 -6.615 11.528 667 2HZ LYS 83 HZ2 LYS 83 0.578 -4.984 11.856 668 3HZ LYS 83 HZ3 LYS 83 2.118 -5.475 11.360 669 H LYS 84 HN LYS 84 -4.448 -2.801 9.426 670 HA LYS 84 HA LYS 84 -7.078 -3.821 8.786 671 1HB LYS 84 HB2 LYS 84 -6.721 -1.324 10.467 672 2HB LYS 84 HB1 LYS 84 -8.224 -1.789 9.684 673 1HG LYS 84 HG2 LYS 84 -6.794 -3.387 11.796 674 2HG LYS 84 HG1 LYS 84 -8.197 -2.351 12.066 675 1HD LYS 84 HD2 LYS 84 -9.517 -3.741 10.547 676 2HD LYS 84 HD1 LYS 84 -8.112 -4.769 10.263 677 1HE LYS 84 HE2 LYS 84 -8.073 -5.368 12.636 678 2HE LYS 84 HE1 LYS 84 -9.477 -4.339 12.918 679 1HZ LYS 84 HZ1 LYS 84 -9.320 -6.965 11.669 680 2HZ LYS 84 HZ2 LYS 84 -10.427 -5.878 10.995 681 3HZ LYS 84 HZ3 LYS 84 -10.540 -6.294 12.630 682 H VAL 85 HN VAL 85 -7.257 -3.334 6.656 683 HA VAL 85 HA VAL 85 -6.372 -0.697 5.751 684 HB VAL 85 HB VAL 85 -5.372 -3.258 4.517 685 1HG1 VAL 85 HG11 VAL 85 -4.039 -0.816 3.724 686 2HG1 VAL 85 HG12 VAL 85 -5.749 -0.805 3.301 687 3HG1 VAL 85 HG13 VAL 85 -4.710 -2.110 2.735 688 1HG2 VAL 85 HG21 VAL 85 -3.132 -2.115 5.246 689 2HG2 VAL 85 HG22 VAL 85 -4.060 -3.078 6.392 690 3HG2 VAL 85 HG23 VAL 85 -4.164 -1.322 6.429 691 H GLU 86 HN GLU 86 -7.532 0.134 4.138 692 HA GLU 86 HA GLU 86 -9.440 -1.622 2.736 693 1HB GLU 86 HB2 GLU 86 -10.447 0.048 4.363 694 2HB GLU 86 HB1 GLU 86 -9.836 1.319 3.315 695 1HG GLU 86 HG2 GLU 86 -11.864 -0.787 2.603 696 2HG GLU 86 HG1 GLU 86 -12.163 0.930 2.859 697 H VAL 87 HN VAL 87 -8.784 -1.899 0.715 698 HA VAL 87 HA VAL 87 -7.081 0.058 -0.547 699 HB VAL 87 HB VAL 87 -8.128 -2.485 -1.761 700 1HG1 VAL 87 HG11 VAL 87 -5.862 -2.237 -2.974 701 2HG1 VAL 87 HG12 VAL 87 -5.955 -0.554 -2.455 702 3HG1 VAL 87 HG13 VAL 87 -7.215 -1.228 -3.487 703 1HG2 VAL 87 HG21 VAL 87 -6.116 -2.051 0.320 704 2HG2 VAL 87 HG22 VAL 87 -5.572 -3.042 -1.034 705 3HG2 VAL 87 HG23 VAL 87 -7.003 -3.512 -0.118 706 H LEU 88 HN LEU 88 -7.826 1.715 -1.571 707 HA LEU 88 HA LEU 88 -10.556 1.868 -2.511 708 1HB LEU 88 HB2 LEU 88 -8.308 3.882 -2.550 709 2HB LEU 88 HB1 LEU 88 -9.969 4.224 -2.986 710 HG LEU 88 HG LEU 88 -9.127 3.289 -0.245 711 1HD1 LEU 88 HD11 LEU 88 -8.252 5.581 -1.126 712 2HD1 LEU 88 HD12 LEU 88 -8.978 5.473 0.477 713 3HD1 LEU 88 HD13 LEU 88 -9.919 6.097 -0.877 714 1HD2 LEU 88 HD21 LEU 88 -11.322 3.974 0.432 715 2HD2 LEU 88 HD22 LEU 88 -11.484 2.882 -0.943 716 3HD2 LEU 88 HD23 LEU 88 -11.666 4.622 -1.172 717 H ASP 89 HN ASP 89 -10.406 3.555 -4.641 718 HA ASP 89 HA ASP 89 -10.231 3.655 -6.893 719 1HB ASP 89 HB2 ASP 89 -7.741 3.605 -6.240 720 2HB ASP 89 HB1 ASP 89 -7.776 1.921 -6.744 721 H THR 90 HN THR 90 -8.718 0.999 -8.067 722 HA THR 90 HA THR 90 -10.970 -0.820 -7.742 723 HB THR 90 HB THR 90 -10.021 0.011 -10.487 724 HG1 THR 90 HG1 THR 90 -11.227 1.691 -10.152 725 1HG2 THR 90 HG21 THR 90 -11.825 -1.190 -11.363 726 2HG2 THR 90 HG22 THR 90 -12.574 -1.386 -9.779 727 3HG2 THR 90 HG23 THR 90 -11.094 -2.262 -10.170 728 H ASP 91 HN ASP 91 -9.878 -2.519 -6.957 729 HA ASP 91 HA ASP 91 -7.336 -3.292 -8.174 730 1HB ASP 91 HB2 ASP 91 -7.633 -3.184 -5.663 731 2HB ASP 91 HB1 ASP 91 -8.728 -4.554 -5.799 732 H TYR 92 HN TYR 92 -9.682 -3.540 -9.744 733 HA TYR 92 HA TYR 92 -9.730 -6.452 -10.119 734 1HB TYR 92 HB2 TYR 92 -12.132 -4.617 -10.288 735 2HB TYR 92 HB1 TYR 92 -12.124 -6.314 -10.742 736 HD1 TYR 92 HD1 TYR 92 -13.185 -7.674 -9.244 737 HD2 TYR 92 HD2 TYR 92 -11.034 -4.321 -7.753 738 HE1 TYR 92 HE1 TYR 92 -13.819 -8.291 -6.952 739 HE2 TYR 92 HE2 TYR 92 -11.650 -4.937 -5.457 740 HH TYR 92 HH TYR 92 -13.753 -6.359 -4.439 741 H LYS 93 HN LYS 93 -8.473 -3.930 -11.413 742 HA LYS 93 HA LYS 93 -9.078 -4.781 -14.133 743 1HB LYS 93 HB2 LYS 93 -8.931 -2.253 -14.762 744 2HB LYS 93 HB1 LYS 93 -10.449 -2.939 -14.211 745 1HG LYS 93 HG2 LYS 93 -9.943 -2.077 -11.937 746 2HG LYS 93 HG1 LYS 93 -8.521 -1.277 -12.601 747 1HD LYS 93 HD2 LYS 93 -11.372 -0.800 -13.473 748 2HD LYS 93 HD1 LYS 93 -10.436 0.253 -12.413 749 1HE LYS 93 HE2 LYS 93 -10.336 1.225 -14.564 750 2HE LYS 93 HE1 LYS 93 -8.769 0.467 -14.296 751 1HZ LYS 93 HZ1 LYS 93 -10.401 0.101 -16.456 752 2HZ LYS 93 HZ2 LYS 93 -10.620 -1.311 -15.552 753 3HZ LYS 93 HZ3 LYS 93 -9.067 -0.853 -16.042 754 H SER 94 HN SER 94 -7.228 -1.859 -13.689 755 HA SER 94 HA SER 94 -4.765 -3.437 -13.951 756 1HB SER 94 HB2 SER 94 -3.942 -1.826 -15.633 757 2HB SER 94 HB1 SER 94 -5.389 -2.678 -16.171 758 HG SER 94 HG SER 94 -5.031 0.001 -15.528 759 H TYR 95 HN TYR 95 -6.332 -0.819 -12.397 760 HA TYR 95 HA TYR 95 -3.806 -0.176 -11.071 761 1HB TYR 95 HB2 TYR 95 -4.260 2.244 -11.207 762 2HB TYR 95 HB1 TYR 95 -4.023 1.523 -12.795 763 HD1 TYR 95 HD1 TYR 95 -5.661 1.736 -14.460 764 HD2 TYR 95 HD2 TYR 95 -6.645 2.702 -10.435 765 HE1 TYR 95 HE1 TYR 95 -7.795 2.690 -15.218 766 HE2 TYR 95 HE2 TYR 95 -8.786 3.658 -11.183 767 HH TYR 95 HH TYR 95 -10.020 3.173 -14.310 768 H ALA 96 HN ALA 96 -3.972 0.081 -8.938 769 HA ALA 96 HA ALA 96 -6.568 0.677 -7.728 770 1HB ALA 96 HB1 ALA 96 -5.342 -1.932 -7.737 771 2HB ALA 96 HB2 ALA 96 -6.921 -1.441 -7.129 772 3HB ALA 96 HB3 ALA 96 -5.501 -1.324 -6.090 773 H VAL 97 HN VAL 97 -6.451 1.615 -5.710 774 HA VAL 97 HA VAL 97 -3.749 2.300 -4.759 775 HB VAL 97 HB VAL 97 -4.466 4.472 -4.160 776 1HG1 VAL 97 HG11 VAL 97 -5.973 4.844 -6.510 777 2HG1 VAL 97 HG12 VAL 97 -4.849 3.527 -6.837 778 3HG1 VAL 97 HG13 VAL 97 -4.240 5.085 -6.286 779 1HG2 VAL 97 HG21 VAL 97 -7.015 5.005 -4.768 780 2HG2 VAL 97 HG22 VAL 97 -6.511 4.452 -3.172 781 3HG2 VAL 97 HG23 VAL 97 -7.182 3.305 -4.330 782 H ILE 98 HN ILE 98 -3.337 1.789 -2.641 783 HA ILE 98 HA ILE 98 -5.658 0.882 -1.087 784 HB ILE 98 HB ILE 98 -4.630 -0.995 -0.465 785 1HG1 ILE 98 HG12 ILE 98 -2.086 -1.084 -0.017 786 2HG1 ILE 98 HG11 ILE 98 -2.151 0.671 -0.128 787 1HG2 ILE 98 HG21 ILE 98 -2.440 -0.549 -2.436 788 2HG2 ILE 98 HG22 ILE 98 -4.110 -0.638 -2.990 789 3HG2 ILE 98 HG23 ILE 98 -3.397 -1.996 -2.122 790 1HD1 ILE 98 HD11 ILE 98 -4.226 -0.144 1.598 791 2HD1 ILE 98 HD12 ILE 98 -2.768 0.769 1.986 792 3HD1 ILE 98 HD13 ILE 98 -2.758 -0.992 2.080 793 H TYR 99 HN TYR 99 -5.852 1.341 1.053 794 HA TYR 99 HA TYR 99 -3.942 3.264 2.194 795 1HB TYR 99 HB2 TYR 99 -5.820 4.619 1.654 796 2HB TYR 99 HB1 TYR 99 -6.959 3.393 2.199 797 HD1 TYR 99 HD1 TYR 99 -3.968 4.320 4.143 798 HD2 TYR 99 HD2 TYR 99 -8.164 4.858 3.684 799 HE1 TYR 99 HE1 TYR 99 -4.067 5.379 6.360 800 HE2 TYR 99 HE2 TYR 99 -8.273 5.922 5.899 801 HH TYR 99 HH TYR 99 -6.621 7.180 7.426 802 H ALA 100 HN ALA 100 -2.965 2.258 3.815 803 HA ALA 100 HA ALA 100 -4.406 0.218 5.331 804 1HB ALA 100 HB1 ALA 100 -2.248 -0.498 6.145 805 2HB ALA 100 HB2 ALA 100 -1.471 0.893 5.390 806 3HB ALA 100 HB3 ALA 100 -2.209 -0.357 4.388 807 H THR 101 HN THR 101 -4.599 0.197 7.529 808 HA THR 101 HA THR 101 -3.743 2.546 9.041 809 HB THR 101 HB THR 101 -5.965 2.699 10.128 810 HG1 THR 101 HG1 THR 101 -7.556 1.400 9.603 811 1HG2 THR 101 HG21 THR 101 -6.336 4.305 8.658 812 2HG2 THR 101 HG22 THR 101 -7.146 3.111 7.643 813 3HG2 THR 101 HG23 THR 101 -5.431 3.451 7.409 814 H ARG 102 HN ARG 102 -2.846 1.960 10.914 815 HA ARG 102 HA ARG 102 -3.124 -0.827 11.755 816 1HB ARG 102 HB2 ARG 102 -1.148 1.230 12.741 817 2HB ARG 102 HB1 ARG 102 -1.097 -0.502 13.020 818 1HG ARG 102 HG2 ARG 102 -0.621 -0.931 10.719 819 2HG ARG 102 HG1 ARG 102 -0.879 0.764 10.300 820 1HD ARG 102 HD2 ARG 102 1.504 0.234 10.433 821 2HD ARG 102 HD1 ARG 102 1.035 1.407 11.663 822 HE ARG 102 HE ARG 102 1.724 -0.080 13.238 823 1HH1 ARG 102 HH11 ARG 102 1.036 -1.849 10.310 824 2HH1 ARG 102 HH12 ARG 102 1.516 -3.374 10.972 825 1HH2 ARG 102 HH21 ARG 102 2.355 -2.086 14.109 826 2HH2 ARG 102 HH22 ARG 102 2.264 -3.511 13.128 827 H VAL 103 HN VAL 103 -3.703 -1.421 13.838 828 HA VAL 103 HA VAL 103 -4.466 0.683 15.700 829 HB VAL 103 HB VAL 103 -6.524 0.280 14.464 830 1HG1 VAL 103 HG11 VAL 103 -6.297 -2.580 15.376 831 2HG1 VAL 103 HG12 VAL 103 -6.011 -2.007 13.732 832 3HG1 VAL 103 HG13 VAL 103 -7.617 -1.874 14.446 833 1HG2 VAL 103 HG21 VAL 103 -6.385 0.562 17.058 834 2HG2 VAL 103 HG22 VAL 103 -6.977 -1.099 17.073 835 3HG2 VAL 103 HG23 VAL 103 -7.924 0.166 16.291 836 H LYS 104 HN LYS 104 -3.748 0.237 17.624 837 HA LYS 104 HA LYS 104 -3.847 -2.414 18.760 838 1HB LYS 104 HB2 LYS 104 -1.414 -2.511 19.234 839 2HB LYS 104 HB1 LYS 104 -1.770 -2.595 17.513 840 1HG LYS 104 HG2 LYS 104 -1.209 -0.230 17.281 841 2HG LYS 104 HG1 LYS 104 -0.853 -0.147 19.006 842 1HD LYS 104 HD2 LYS 104 0.571 -1.896 16.999 843 2HD LYS 104 HD1 LYS 104 1.186 -0.380 17.663 844 1HE LYS 104 HE2 LYS 104 1.130 -1.351 19.912 845 2HE LYS 104 HE1 LYS 104 0.533 -2.867 19.239 846 1HZ LYS 104 HZ1 LYS 104 2.844 -3.111 19.537 847 2HZ LYS 104 HZ2 LYS 104 3.186 -1.620 18.817 848 3HZ LYS 104 HZ3 LYS 104 2.616 -2.903 17.873 849 H ASP 105 HN ASP 105 -4.035 -2.313 20.944 850 HA ASP 105 HA ASP 105 -4.545 -1.322 22.945 851 1HB ASP 105 HB2 ASP 105 -2.630 -0.165 23.980 852 2HB ASP 105 HB1 ASP 105 -2.130 -1.635 23.152 853 H GLY 106 HN GLY 106 -5.848 -0.028 20.879 854 1HA GLY 106 HA2 GLY 106 -7.026 1.900 20.469 855 2HA GLY 106 HA1 GLY 106 -6.501 2.463 22.051 856 H ARG 107 HN ARG 107 -4.437 1.571 19.343 857 HA ARG 107 HA ARG 107 -3.470 4.356 19.232 858 1HB ARG 107 HB2 ARG 107 -1.797 2.646 19.982 859 2HB ARG 107 HB1 ARG 107 -1.983 1.840 18.432 860 1HG ARG 107 HG2 ARG 107 -0.047 3.120 18.182 861 2HG ARG 107 HG1 ARG 107 -1.305 4.072 17.386 862 1HD ARG 107 HD2 ARG 107 -1.549 5.400 19.448 863 2HD ARG 107 HD1 ARG 107 -0.222 4.481 20.168 864 HE ARG 107 HE ARG 107 0.553 5.611 17.684 865 1HH1 ARG 107 HH11 ARG 107 -0.001 6.420 21.028 866 2HH1 ARG 107 HH12 ARG 107 1.029 7.811 20.990 867 1HH2 ARG 107 HH21 ARG 107 1.897 7.415 17.618 868 2HH2 ARG 107 HH22 ARG 107 2.112 8.382 19.038 869 H THR 108 HN THR 108 -3.249 5.344 17.238 870 HA THR 108 HA THR 108 -4.366 3.863 14.945 871 HB THR 108 HB THR 108 -4.722 6.789 15.626 872 HG1 THR 108 HG1 THR 108 -6.480 4.571 15.670 873 1HG2 THR 108 HG21 THR 108 -4.620 6.418 13.199 874 2HG2 THR 108 HG22 THR 108 -6.212 6.938 13.752 875 3HG2 THR 108 HG23 THR 108 -5.929 5.245 13.344 876 H LEU 109 HN LEU 109 -3.271 3.926 13.061 877 HA LEU 109 HA LEU 109 -1.050 5.823 12.750 878 1HB LEU 109 HB2 LEU 109 -0.818 2.878 12.138 879 2HB LEU 109 HB1 LEU 109 0.430 4.085 11.939 880 HG LEU 109 HG LEU 109 0.931 2.772 13.876 881 1HD1 LEU 109 HD11 LEU 109 0.090 5.592 14.285 882 2HD1 LEU 109 HD12 LEU 109 1.696 4.869 14.335 883 3HD1 LEU 109 HD13 LEU 109 0.586 4.644 15.686 884 1HD2 LEU 109 HD21 LEU 109 -1.806 2.565 14.184 885 2HD2 LEU 109 HD22 LEU 109 -1.300 3.546 15.558 886 3HD2 LEU 109 HD23 LEU 109 -0.577 1.961 15.295 887 H HIS 110 HN HIS 110 -0.755 6.556 10.678 888 HA HIS 110 HA HIS 110 -2.673 5.502 8.710 889 1HB HIS 110 HB2 HIS 110 -1.312 8.199 8.792 890 2HB HIS 110 HB1 HIS 110 -2.493 7.676 7.592 891 HD1 HIS 110 HD1 HIS 110 -2.409 7.816 11.402 892 HD2 HIS 110 HD2 HIS 110 -4.948 8.612 8.211 893 HE1 HIS 110 HE1 HIS 110 -4.541 8.658 12.435 894 HE2 HIS 110 HE2 HIS 110 -6.036 9.206 10.482 895 H MET 111 HN MET 111 -2.039 4.745 6.776 896 HA MET 111 HA MET 111 0.502 5.260 5.621 897 1HB MET 111 HB2 MET 111 1.256 3.713 7.354 898 2HB MET 111 HB1 MET 111 0.076 2.522 6.823 899 1HG MET 111 HG2 MET 111 1.215 2.382 4.653 900 2HG MET 111 HG1 MET 111 2.411 3.545 5.221 901 1HE MET 111 HE1 MET 111 1.736 -0.757 6.087 902 2HE MET 111 HE2 MET 111 0.513 0.513 6.060 903 3HE MET 111 HE3 MET 111 1.286 0.066 7.581 904 H MET 112 HN MET 112 0.034 5.339 3.549 905 HA MET 112 HA MET 112 -2.003 3.521 2.451 906 1HB MET 112 HB2 MET 112 -1.049 6.224 1.522 907 2HB MET 112 HB1 MET 112 -2.064 5.183 0.541 908 1HG MET 112 HG2 MET 112 -3.473 6.773 1.574 909 2HG MET 112 HG1 MET 112 -3.750 5.229 2.376 910 1HE MET 112 HE1 MET 112 -5.048 7.057 3.712 911 2HE MET 112 HE2 MET 112 -4.217 8.613 3.747 912 3HE MET 112 HE3 MET 112 -4.390 7.671 5.228 913 H ARG 113 HN ARG 113 -1.668 2.656 0.333 914 HA ARG 113 HA ARG 113 1.014 2.747 -0.762 915 1HB ARG 113 HB2 ARG 113 1.210 0.931 0.841 916 2HB ARG 113 HB1 ARG 113 -0.244 0.172 0.207 917 1HG ARG 113 HG2 ARG 113 0.820 -0.434 -1.798 918 2HG ARG 113 HG1 ARG 113 2.185 0.635 -1.486 919 1HD ARG 113 HD2 ARG 113 1.473 -1.816 0.118 920 2HD ARG 113 HD1 ARG 113 2.749 -1.724 -1.096 921 HE ARG 113 HE ARG 113 3.126 0.272 0.869 922 1HH1 ARG 113 HH11 ARG 113 3.420 -3.171 0.384 923 2HH1 ARG 113 HH12 ARG 113 4.654 -3.361 1.584 924 1HH2 ARG 113 HH21 ARG 113 4.749 0.023 2.449 925 2HH2 ARG 113 HH22 ARG 113 5.407 -1.549 2.758 926 H LEU 114 HN LEU 114 0.959 2.719 -2.916 927 HA LEU 114 HA LEU 114 -1.615 2.156 -4.206 928 1HB LEU 114 HB2 LEU 114 -0.548 4.392 -4.459 929 2HB LEU 114 HB1 LEU 114 0.797 3.624 -5.276 930 HG LEU 114 HG LEU 114 -2.045 3.561 -6.293 931 1HD1 LEU 114 HD11 LEU 114 0.182 5.247 -7.388 932 2HD1 LEU 114 HD12 LEU 114 -0.908 5.847 -6.138 933 3HD1 LEU 114 HD13 LEU 114 -1.549 5.356 -7.707 934 1HD2 LEU 114 HD21 LEU 114 -1.057 1.819 -7.390 935 2HD2 LEU 114 HD22 LEU 114 0.562 2.504 -7.254 936 3HD2 LEU 114 HD23 LEU 114 -0.569 3.143 -8.448 937 H TYR 115 HN TYR 115 -1.869 0.334 -5.335 938 HA TYR 115 HA TYR 115 0.538 -1.108 -6.221 939 1HB TYR 115 HB2 TYR 115 -2.247 -2.090 -5.597 940 2HB TYR 115 HB1 TYR 115 -1.028 -3.087 -6.377 941 HD1 TYR 115 HD1 TYR 115 1.388 -2.288 -4.835 942 HD2 TYR 115 HD2 TYR 115 -2.574 -3.143 -3.545 943 HE1 TYR 115 HE1 TYR 115 2.257 -2.967 -2.637 944 HE2 TYR 115 HE2 TYR 115 -1.718 -3.822 -1.342 945 HH TYR 115 HH TYR 115 0.569 -4.733 -0.458 946 H SER 116 HN SER 116 0.995 -0.820 -8.316 947 HA SER 116 HA SER 116 -1.231 -0.444 -10.195 948 1HB SER 116 HB2 SER 116 0.430 0.414 -11.777 949 2HB SER 116 HB1 SER 116 0.538 1.289 -10.250 950 HG SER 116 HG SER 116 2.347 -0.424 -11.453 951 H ARG 117 HN ARG 117 -1.768 -2.015 -11.571 952 HA ARG 117 HA ARG 117 -0.469 -4.550 -11.380 953 1HB ARG 117 HB2 ARG 117 -2.757 -3.578 -13.088 954 2HB ARG 117 HB1 ARG 117 -2.154 -5.228 -13.141 955 1HG ARG 117 HG2 ARG 117 -3.967 -5.340 -11.693 956 2HG ARG 117 HG1 ARG 117 -2.573 -5.270 -10.617 957 1HD ARG 117 HD2 ARG 117 -3.038 -2.687 -10.705 958 2HD ARG 117 HD1 ARG 117 -4.649 -3.203 -11.183 959 HE ARG 117 HE ARG 117 -5.025 -3.718 -9.002 960 1HH1 ARG 117 HH11 ARG 117 -1.588 -3.886 -9.583 961 2HH1 ARG 117 HH12 ARG 117 -1.198 -4.236 -7.934 962 1HH2 ARG 117 HH21 ARG 117 -4.509 -4.176 -6.825 963 2HH2 ARG 117 HH22 ARG 117 -2.855 -4.406 -6.369 964 H SER 118 HN SER 118 -0.474 -1.941 -13.711 965 HA SER 118 HA SER 118 1.571 -3.411 -15.240 966 1HB SER 118 HB2 SER 118 -0.523 -1.522 -16.345 967 2HB SER 118 HB1 SER 118 0.767 -2.279 -17.280 968 HG SER 118 HG SER 118 -1.563 -3.385 -16.228 969 HA PRO 119 HA PRO 119 4.547 -0.236 -14.575 970 1HB PRO 119 HB2 PRO 119 5.046 0.317 -17.331 971 2HB PRO 119 HB1 PRO 119 5.996 -0.701 -16.249 972 1HG PRO 119 HG2 PRO 119 3.944 -1.463 -18.241 973 2HG PRO 119 HG1 PRO 119 5.326 -2.391 -17.634 974 1HD PRO 119 HD2 PRO 119 2.808 -2.977 -16.908 975 2HD PRO 119 HD1 PRO 119 4.164 -3.137 -15.770 976 H GLU 120 HN GLU 120 2.253 0.348 -17.220 977 HA GLU 120 HA GLU 120 2.387 3.206 -16.937 978 1HB GLU 120 HB2 GLU 120 1.935 2.237 -19.119 979 2HB GLU 120 HB1 GLU 120 0.509 1.420 -18.495 980 1HG GLU 120 HG2 GLU 120 -0.109 3.368 -19.789 981 2HG GLU 120 HG1 GLU 120 -0.561 3.573 -18.098 982 H VAL 121 HN VAL 121 1.187 4.459 -15.641 983 HA VAL 121 HA VAL 121 -1.085 3.199 -14.250 984 HB VAL 121 HB VAL 121 0.740 5.405 -13.272 985 1HG1 VAL 121 HG11 VAL 121 -1.551 5.763 -12.505 986 2HG1 VAL 121 HG12 VAL 121 -0.506 5.274 -11.171 987 3HG1 VAL 121 HG13 VAL 121 -1.613 4.109 -11.897 988 1HG2 VAL 121 HG21 VAL 121 0.431 2.504 -12.548 989 2HG2 VAL 121 HG22 VAL 121 1.219 3.668 -11.483 990 3HG2 VAL 121 HG23 VAL 121 1.882 3.349 -13.086 991 H SER 122 HN SER 122 -3.008 3.950 -14.765 992 HA SER 122 HA SER 122 -3.454 6.072 -16.542 993 1HB SER 122 HB2 SER 122 -5.837 5.800 -15.975 994 2HB SER 122 HB1 SER 122 -5.059 4.239 -16.239 995 HG SER 122 HG SER 122 -6.375 5.059 -14.098 996 HA PRO 123 HA PRO 123 -3.400 9.806 -14.200 997 1HB PRO 123 HB2 PRO 123 -5.818 10.916 -15.029 998 2HB PRO 123 HB1 PRO 123 -4.280 11.071 -15.883 999 1HG PRO 123 HG2 PRO 123 -6.541 9.182 -16.375 1000 2HG PRO 123 HG1 PRO 123 -5.515 10.034 -17.545 1001 1HD PRO 123 HD2 PRO 123 -5.130 7.448 -17.018 1002 2HD PRO 123 HD1 PRO 123 -3.750 8.541 -17.269 1003 H ALA 124 HN ALA 124 -6.451 8.007 -14.295 1004 HA ALA 124 HA ALA 124 -7.608 9.131 -11.992 1005 1HB ALA 124 HB1 ALA 124 -8.413 7.308 -13.883 1006 2HB ALA 124 HB2 ALA 124 -9.317 7.762 -12.439 1007 3HB ALA 124 HB3 ALA 124 -8.290 6.328 -12.422 1008 H ALA 125 HN ALA 125 -5.643 6.205 -12.434 1009 HA ALA 125 HA ALA 125 -5.732 5.179 -9.881 1010 1HB ALA 125 HB1 ALA 125 -3.645 4.093 -10.363 1011 2HB ALA 125 HB2 ALA 125 -3.281 5.271 -11.624 1012 3HB ALA 125 HB3 ALA 125 -4.614 4.138 -11.835 1013 H THR 126 HN THR 126 -3.279 7.438 -11.134 1014 HA THR 126 HA THR 126 -2.159 7.924 -8.552 1015 HB THR 126 HB THR 126 -1.838 9.431 -11.147 1016 HG1 THR 126 HG1 THR 126 -0.071 8.161 -11.442 1017 1HG2 THR 126 HG21 THR 126 0.077 9.452 -8.838 1018 2HG2 THR 126 HG22 THR 126 -1.165 10.683 -9.060 1019 3HG2 THR 126 HG23 THR 126 0.082 10.462 -10.285 1020 H ALA 127 HN ALA 127 -4.248 9.829 -10.724 1021 HA ALA 127 HA ALA 127 -4.419 12.089 -9.036 1022 1HB ALA 127 HB1 ALA 127 -6.063 12.915 -10.499 1023 2HB ALA 127 HB2 ALA 127 -6.519 11.295 -11.027 1024 3HB ALA 127 HB3 ALA 127 -4.962 11.969 -11.503 1025 H ILE 128 HN ILE 128 -6.620 9.307 -9.447 1026 HA ILE 128 HA ILE 128 -8.621 10.202 -7.732 1027 HB ILE 128 HB ILE 128 -7.800 7.363 -8.342 1028 1HG1 ILE 128 HG12 ILE 128 -10.112 9.045 -9.342 1029 2HG1 ILE 128 HG11 ILE 128 -8.638 8.727 -10.246 1030 1HG2 ILE 128 HG21 ILE 128 -10.079 6.770 -7.498 1031 2HG2 ILE 128 HG22 ILE 128 -10.191 8.401 -6.835 1032 3HG2 ILE 128 HG23 ILE 128 -8.947 7.296 -6.252 1033 1HD1 ILE 128 HD11 ILE 128 -10.518 6.584 -9.298 1034 2HD1 ILE 128 HD12 ILE 128 -9.156 6.408 -10.404 1035 3HD1 ILE 128 HD13 ILE 128 -10.578 7.325 -10.899 1036 H PHE 129 HN PHE 129 -5.716 8.253 -6.957 1037 HA PHE 129 HA PHE 129 -6.307 7.841 -4.255 1038 1HB PHE 129 HB2 PHE 129 -4.419 6.707 -5.279 1039 2HB PHE 129 HB1 PHE 129 -3.608 8.242 -5.573 1040 HD1 PHE 129 HD1 PHE 129 -1.695 8.299 -4.279 1041 HD2 PHE 129 HD2 PHE 129 -5.317 6.875 -2.557 1042 HE1 PHE 129 HE1 PHE 129 -0.587 8.144 -2.087 1043 HE2 PHE 129 HE2 PHE 129 -4.217 6.718 -0.364 1044 HZ PHE 129 HZ PHE 129 -1.850 7.356 -0.125 1045 H ARG 130 HN ARG 130 -4.756 10.542 -5.887 1046 HA ARG 130 HA ARG 130 -4.313 12.064 -3.498 1047 1HB ARG 130 HB2 ARG 130 -2.881 12.394 -5.436 1048 2HB ARG 130 HB1 ARG 130 -4.268 12.818 -6.428 1049 1HG ARG 130 HG2 ARG 130 -4.618 14.824 -5.066 1050 2HG ARG 130 HG1 ARG 130 -3.199 14.408 -4.102 1051 1HD ARG 130 HD2 ARG 130 -2.668 16.078 -5.823 1052 2HD ARG 130 HD1 ARG 130 -1.785 14.574 -6.082 1053 HE ARG 130 HE ARG 130 -2.817 14.405 -8.102 1054 1HH1 ARG 130 HH11 ARG 130 -4.756 16.484 -6.078 1055 2HH1 ARG 130 HH12 ARG 130 -5.934 16.790 -7.309 1056 1HH2 ARG 130 HH21 ARG 130 -4.367 14.808 -9.719 1057 2HH2 ARG 130 HH22 ARG 130 -5.714 15.841 -9.373 1058 H LYS 131 HN LYS 131 -6.751 11.868 -5.994 1059 HA LYS 131 HA LYS 131 -8.241 14.174 -5.338 1060 1HB LYS 131 HB2 LYS 131 -8.381 12.812 -7.468 1061 2HB LYS 131 HB1 LYS 131 -9.294 11.621 -6.557 1062 1HG LYS 131 HG2 LYS 131 -11.057 13.211 -6.147 1063 2HG LYS 131 HG1 LYS 131 -10.123 14.491 -6.923 1064 1HD LYS 131 HD2 LYS 131 -11.808 13.647 -8.452 1065 2HD LYS 131 HD1 LYS 131 -10.197 13.237 -9.041 1066 1HE LYS 131 HE2 LYS 131 -11.680 11.346 -9.311 1067 2HE LYS 131 HE1 LYS 131 -10.450 10.977 -8.103 1068 1HZ LYS 131 HZ1 LYS 131 -11.970 10.892 -6.452 1069 2HZ LYS 131 HZ2 LYS 131 -13.024 10.519 -7.722 1070 3HZ LYS 131 HZ3 LYS 131 -12.953 12.098 -7.119 1071 H LEU 132 HN LEU 132 -8.685 10.742 -4.478 1072 HA LEU 132 HA LEU 132 -10.899 11.164 -2.782 1073 1HB LEU 132 HB2 LEU 132 -10.496 8.924 -1.945 1074 2HB LEU 132 HB1 LEU 132 -10.347 8.960 -3.689 1075 HG LEU 132 HG LEU 132 -7.818 9.104 -3.309 1076 1HD1 LEU 132 HD11 LEU 132 -7.695 7.675 -0.910 1077 2HD1 LEU 132 HD12 LEU 132 -8.730 9.064 -0.584 1078 3HD1 LEU 132 HD13 LEU 132 -7.103 9.306 -1.220 1079 1HD2 LEU 132 HD21 LEU 132 -9.513 6.700 -2.733 1080 2HD2 LEU 132 HD22 LEU 132 -7.753 6.594 -2.772 1081 3HD2 LEU 132 HD23 LEU 132 -8.637 7.114 -4.207 1082 H ALA 133 HN ALA 133 -7.435 11.204 -2.293 1083 HA ALA 133 HA ALA 133 -7.453 11.381 0.533 1084 1HB ALA 133 HB1 ALA 133 -5.462 11.979 -1.611 1085 2HB ALA 133 HB2 ALA 133 -5.366 10.835 -0.272 1086 3HB ALA 133 HB3 ALA 133 -5.159 12.560 0.027 1087 H GLY 134 HN GLY 134 -7.574 13.748 -2.078 1088 1HA GLY 134 HA2 GLY 134 -7.326 16.079 -0.533 1089 2HA GLY 134 HA1 GLY 134 -8.124 15.977 -2.094 1090 H GLU 135 HN GLU 135 -10.114 14.069 -1.278 1091 HA GLU 135 HA GLU 135 -12.200 15.700 -0.533 1092 1HB GLU 135 HB2 GLU 135 -11.957 12.765 0.153 1093 2HB GLU 135 HB1 GLU 135 -13.451 13.679 -0.009 1094 1HG GLU 135 HG2 GLU 135 -12.912 14.048 -2.396 1095 2HG GLU 135 HG1 GLU 135 -11.495 13.018 -2.199 1096 H ARG 136 HN ARG 136 -10.233 13.614 1.569 1097 HA ARG 136 HA ARG 136 -11.472 14.682 3.957 1098 1HB ARG 136 HB2 ARG 136 -9.101 12.827 3.654 1099 2HB ARG 136 HB1 ARG 136 -9.927 13.198 5.162 1100 1HG ARG 136 HG2 ARG 136 -11.961 12.167 4.322 1101 2HG ARG 136 HG1 ARG 136 -11.165 11.825 2.785 1102 1HD ARG 136 HD2 ARG 136 -9.557 10.391 3.937 1103 2HD ARG 136 HD1 ARG 136 -10.340 10.741 5.478 1104 HE ARG 136 HE ARG 136 -12.266 9.731 3.715 1105 1HH1 ARG 136 HH11 ARG 136 -9.416 8.652 5.422 1106 2HH1 ARG 136 HH12 ARG 136 -9.953 7.009 5.529 1107 1HH2 ARG 136 HH21 ARG 136 -12.968 7.572 3.858 1108 2HH2 ARG 136 HH22 ARG 136 -11.967 6.396 4.642 1109 H ASN 137 HN ASN 137 -8.182 14.629 2.591 1110 HA ASN 137 HA ASN 137 -7.576 17.291 2.877 1111 1HB ASN 137 HB2 ASN 137 -6.164 17.308 4.942 1112 2HB ASN 137 HB1 ASN 137 -7.885 17.137 5.266 1113 1HD2 ASN 137 HD21 ASN 137 -4.952 16.079 6.162 1114 2HD2 ASN 137 HD22 ASN 137 -5.361 14.511 6.763 1115 H TYR 138 HN TYR 138 -5.925 17.503 1.522 1116 HA TYR 138 HA TYR 138 -4.107 15.257 1.095 1117 1HB TYR 138 HB2 TYR 138 -5.121 16.282 -0.883 1118 2HB TYR 138 HB1 TYR 138 -4.455 17.847 -0.433 1119 HD1 TYR 138 HD1 TYR 138 -2.630 14.636 -0.202 1120 HD2 TYR 138 HD2 TYR 138 -3.169 18.245 -2.390 1121 HE1 TYR 138 HE1 TYR 138 -0.605 14.141 -1.507 1122 HE2 TYR 138 HE2 TYR 138 -1.147 17.760 -3.701 1123 HH TYR 138 HH TYR 138 0.431 14.704 -3.588 1124 H THR 139 HN THR 139 -3.752 16.455 3.539 1125 HA THR 139 HA THR 139 -1.500 18.292 3.308 1126 HB THR 139 HB THR 139 -1.696 18.517 5.737 1127 HG1 THR 139 HG1 THR 139 -3.294 17.375 6.841 1128 1HG2 THR 139 HG21 THR 139 -3.127 20.009 4.616 1129 2HG2 THR 139 HG22 THR 139 -4.083 19.280 5.907 1130 3HG2 THR 139 HG23 THR 139 -4.286 18.733 4.243 1131 H ASP 140 HN ASP 140 0.474 17.920 4.489 1132 HA ASP 140 HA ASP 140 1.682 15.480 3.977 1133 1HB ASP 140 HB2 ASP 140 2.921 17.566 4.483 1134 2HB ASP 140 HB1 ASP 140 2.419 17.437 6.165 1135 H GLU 141 HN GLU 141 -0.406 16.418 6.579 1136 HA GLU 141 HA GLU 141 0.279 14.742 8.629 1137 1HB GLU 141 HB2 GLU 141 -1.600 16.348 8.694 1138 2HB GLU 141 HB1 GLU 141 -2.535 15.274 7.669 1139 1HG GLU 141 HG2 GLU 141 -2.422 13.538 9.404 1140 2HG GLU 141 HG1 GLU 141 -1.537 14.657 10.438 1141 H MET 142 HN MET 142 -0.930 13.849 5.504 1142 HA MET 142 HA MET 142 -0.571 11.048 6.181 1143 1HB MET 142 HB2 MET 142 -3.151 12.050 4.955 1144 2HB MET 142 HB1 MET 142 -2.700 10.363 5.163 1145 1HG MET 142 HG2 MET 142 -2.700 10.637 7.570 1146 2HG MET 142 HG1 MET 142 -3.113 12.342 7.386 1147 1HE MET 142 HE1 MET 142 -5.902 11.747 4.889 1148 2HE MET 142 HE2 MET 142 -4.849 12.939 5.652 1149 3HE MET 142 HE3 MET 142 -6.471 12.660 6.285 1150 H VAL 143 HN VAL 143 1.250 12.136 4.814 1151 HA VAL 143 HA VAL 143 0.696 11.502 1.992 1152 HB VAL 143 HB VAL 143 2.308 13.846 3.019 1153 1HG1 VAL 143 HG11 VAL 143 2.055 12.748 0.224 1154 2HG1 VAL 143 HG12 VAL 143 3.521 12.895 1.189 1155 3HG1 VAL 143 HG13 VAL 143 2.706 14.345 0.603 1156 1HG2 VAL 143 HG21 VAL 143 -0.359 13.752 2.578 1157 2HG2 VAL 143 HG22 VAL 143 0.216 14.217 0.976 1158 3HG2 VAL 143 HG23 VAL 143 0.616 15.203 2.383 1159 H ALA 144 HN ALA 144 2.354 10.611 0.813 1160 HA ALA 144 HA ALA 144 4.999 10.267 1.797 1161 1HB ALA 144 HB1 ALA 144 5.000 8.208 2.694 1162 2HB ALA 144 HB2 ALA 144 3.844 7.590 1.515 1163 3HB ALA 144 HB3 ALA 144 3.276 8.481 2.927 1164 H MET 145 HN MET 145 6.292 10.055 0.055 1165 HA MET 145 HA MET 145 5.105 9.004 -2.432 1166 1HB MET 145 HB2 MET 145 6.397 10.719 -3.662 1167 2HB MET 145 HB1 MET 145 5.196 11.419 -2.585 1168 1HG MET 145 HG2 MET 145 6.952 11.864 -0.932 1169 2HG MET 145 HG1 MET 145 8.150 11.192 -2.036 1170 1HE MET 145 HE1 MET 145 5.285 13.479 -1.661 1171 2HE MET 145 HE2 MET 145 5.204 14.049 -3.328 1172 3HE MET 145 HE3 MET 145 5.915 15.072 -2.080 1173 H LEU 146 HN LEU 146 6.349 7.667 -3.657 1174 HA LEU 146 HA LEU 146 8.334 6.110 -2.718 1175 1HB LEU 146 HB2 LEU 146 8.991 5.635 -4.981 1176 2HB LEU 146 HB1 LEU 146 7.257 5.877 -4.938 1177 HG LEU 146 HG LEU 146 9.275 7.921 -5.880 1178 1HD1 LEU 146 HD11 LEU 146 7.752 5.804 -7.259 1179 2HD1 LEU 146 HD12 LEU 146 9.285 6.562 -7.683 1180 3HD1 LEU 146 HD13 LEU 146 7.767 7.387 -8.035 1181 1HD2 LEU 146 HD21 LEU 146 7.162 9.023 -6.762 1182 2HD2 LEU 146 HD22 LEU 146 7.443 9.118 -5.024 1183 3HD2 LEU 146 HD23 LEU 146 6.280 7.959 -5.667 1184 HA PRO 147 HA PRO 147 11.811 8.766 -1.955 1185 1HB PRO 147 HB2 PRO 147 13.761 6.856 -1.917 1186 2HB PRO 147 HB1 PRO 147 12.657 7.154 -0.569 1187 1HG PRO 147 HG2 PRO 147 12.528 5.055 -2.700 1188 2HG PRO 147 HG1 PRO 147 12.221 4.908 -0.961 1189 1HD PRO 147 HD2 PRO 147 10.218 5.081 -2.747 1190 2HD PRO 147 HD1 PRO 147 10.097 5.800 -1.127 1191 H ARG 148 HN ARG 148 13.038 9.965 -3.275 1192 HA ARG 148 HA ARG 148 13.660 8.860 -5.923 1193 1HB ARG 148 HB2 ARG 148 13.518 11.744 -5.023 1194 2HB ARG 148 HB1 ARG 148 13.935 11.212 -6.646 1195 1HG ARG 148 HG2 ARG 148 11.701 11.784 -6.831 1196 2HG ARG 148 HG1 ARG 148 11.646 10.034 -6.619 1197 1HD ARG 148 HD2 ARG 148 11.168 10.334 -4.241 1198 2HD ARG 148 HD1 ARG 148 11.242 12.081 -4.440 1199 HE ARG 148 HE ARG 148 9.017 10.424 -4.967 1200 1HH1 ARG 148 HH11 ARG 148 10.682 13.237 -6.198 1201 2HH1 ARG 148 HH12 ARG 148 9.276 13.881 -6.975 1202 1HH2 ARG 148 HH21 ARG 148 7.167 11.279 -5.981 1203 2HH2 ARG 148 HH22 ARG 148 7.281 12.774 -6.849 1204 H GLN 149 HN GLN 149 15.337 7.954 -3.978 1205 HA GLN 149 HA GLN 149 17.852 9.025 -4.891 1206 1HB GLN 149 HB2 GLN 149 18.743 9.816 -2.904 1207 2HB GLN 149 HB1 GLN 149 17.087 10.388 -2.817 1208 1HG GLN 149 HG2 GLN 149 18.189 7.956 -1.429 1209 2HG GLN 149 HG1 GLN 149 17.857 9.516 -0.682 1210 1HE2 GLN 149 HE21 GLN 149 16.769 6.558 -0.723 1211 2HE2 GLN 149 HE22 GLN 149 15.067 6.808 -0.590 1212 H GLU 150 HN GLU 150 19.727 7.750 -3.855 1213 HA GLU 150 HA GLU 150 18.868 4.949 -3.717 1214 1HB GLU 150 HB2 GLU 150 21.244 4.437 -4.347 1215 2HB GLU 150 HB1 GLU 150 20.292 5.267 -5.568 1216 1HG GLU 150 HG2 GLU 150 21.353 7.399 -4.858 1217 2HG GLU 150 HG1 GLU 150 22.384 6.468 -3.770 1218 H GLU 151 HN GLU 151 18.385 5.709 -1.379 1219 HA GLU 151 HA GLU 151 20.393 4.506 0.280 1220 1HB GLU 151 HB2 GLU 151 19.749 7.434 0.658 1221 2HB GLU 151 HB1 GLU 151 20.554 6.443 1.868 1222 1HG GLU 151 HG2 GLU 151 22.340 5.984 0.202 1223 2HG GLU 151 HG1 GLU 151 21.559 7.141 -0.875 1224 H CYS 152 HN CYS 152 18.375 6.796 1.881 1225 HA CYS 152 HA CYS 152 16.051 5.198 2.134 1226 1HB CYS 152 HB2 CYS 152 18.247 4.787 4.071 1227 2HB CYS 152 HB1 CYS 152 16.650 5.015 4.777 1228 H THR 153 HN THR 153 15.258 7.248 1.567 1229 HA THR 153 HA THR 153 14.433 8.849 3.779 1230 HB THR 153 HB THR 153 16.642 9.824 3.517 1231 HG1 THR 153 HG1 THR 153 14.880 11.265 3.867 1232 1HG2 THR 153 HG21 THR 153 15.918 10.386 0.651 1233 2HG2 THR 153 HG22 THR 153 17.060 9.154 1.187 1234 3HG2 THR 153 HG23 THR 153 17.400 10.859 1.482 1235 H VAL 154 HN VAL 154 12.943 10.596 3.060 1236 HA VAL 154 HA VAL 154 12.016 10.348 0.302 1237 HB VAL 154 HB VAL 154 10.690 8.686 1.461 1238 1HG1 VAL 154 HG11 VAL 154 10.752 10.573 3.593 1239 2HG1 VAL 154 HG12 VAL 154 10.133 8.923 3.601 1240 3HG1 VAL 154 HG13 VAL 154 9.068 10.263 3.175 1241 1HG2 VAL 154 HG21 VAL 154 9.650 10.112 -0.299 1242 2HG2 VAL 154 HG22 VAL 154 8.997 11.135 0.980 1243 3HG2 VAL 154 HG23 VAL 154 8.495 9.449 0.857 1244 H ASP 155 HN ASP 155 12.820 12.496 0.116 1245 HA ASP 155 HA ASP 155 12.130 14.659 1.732 1246 1HB ASP 155 HB2 ASP 155 13.879 14.754 -0.007 1247 2HB ASP 155 HB1 ASP 155 12.636 14.679 -1.252 1248 H GLU 156 HN GLU 156 10.408 15.968 1.897 1249 HA GLU 156 HA GLU 156 8.429 16.354 -0.060 1250 1HB GLU 156 HB2 GLU 156 6.543 15.168 0.996 1251 2HB GLU 156 HB1 GLU 156 7.782 14.059 0.426 1252 1HG GLU 156 HG2 GLU 156 8.636 13.839 2.701 1253 2HG GLU 156 HG1 GLU 156 7.398 14.955 3.274 1254 H VAL 157 HN VAL 157 9.872 18.065 1.490 1255 HA VAL 157 HA VAL 157 7.787 19.545 2.818 1256 HB VAL 157 HB VAL 157 8.991 19.817 4.950 1257 1HG1 VAL 157 HG11 VAL 157 7.193 18.115 4.660 1258 2HG1 VAL 157 HG12 VAL 157 8.343 17.741 5.944 1259 3HG1 VAL 157 HG13 VAL 157 8.450 16.906 4.394 1260 1HG2 VAL 157 HG21 VAL 157 10.920 17.985 3.616 1261 2HG2 VAL 157 HG22 VAL 157 10.700 17.850 5.361 1262 3HG2 VAL 157 HG23 VAL 157 11.217 19.380 4.653 Start of MODEL 8 1 1H MET 1 HT1 MET 1 -18.476 -15.828 -15.216 2 2H MET 1 HT2 MET 1 -18.206 -16.014 -16.874 3 3H MET 1 HT3 MET 1 -19.052 -17.202 -16.016 4 HA MET 1 HA MET 1 -19.949 -14.614 -17.007 5 1HB MET 1 HB2 MET 1 -21.186 -17.342 -16.600 6 2HB MET 1 HB1 MET 1 -22.077 -15.959 -17.216 7 1HG MET 1 HG2 MET 1 -21.431 -17.280 -19.072 8 2HG MET 1 HG1 MET 1 -20.435 -15.828 -19.087 9 1HE MET 1 HE1 MET 1 -18.578 -17.017 -20.784 10 2HE MET 1 HE2 MET 1 -19.844 -18.244 -20.830 11 3HE MET 1 HE3 MET 1 -18.167 -18.716 -20.552 12 H THR 2 HN THR 2 -21.211 -13.220 -15.920 13 HA THR 2 HA THR 2 -22.136 -12.133 -14.152 14 HB THR 2 HB THR 2 -23.792 -13.397 -12.842 15 HG1 THR 2 HG1 THR 2 -23.335 -15.405 -12.507 16 1HG2 THR 2 HG21 THR 2 -24.952 -12.900 -14.693 17 2HG2 THR 2 HG22 THR 2 -24.838 -14.637 -14.982 18 3HG2 THR 2 HG23 THR 2 -23.712 -13.535 -15.774 19 H VAL 3 HN VAL 3 -19.481 -12.764 -13.749 20 HA VAL 3 HA VAL 3 -19.343 -12.689 -10.874 21 HB VAL 3 HB VAL 3 -17.947 -14.935 -12.342 22 1HG1 VAL 3 HG11 VAL 3 -17.455 -13.657 -9.769 23 2HG1 VAL 3 HG12 VAL 3 -16.432 -14.741 -10.710 24 3HG1 VAL 3 HG13 VAL 3 -17.675 -15.402 -9.648 25 1HG2 VAL 3 HG21 VAL 3 -20.237 -14.931 -10.388 26 2HG2 VAL 3 HG22 VAL 3 -19.306 -16.373 -10.793 27 3HG2 VAL 3 HG23 VAL 3 -20.227 -15.538 -12.043 28 HA PRO 4 HA PRO 4 -16.165 -9.812 -12.139 29 1HB PRO 4 HB2 PRO 4 -15.218 -10.223 -9.350 30 2HB PRO 4 HB1 PRO 4 -15.605 -8.722 -10.198 31 1HG PRO 4 HG2 PRO 4 -17.259 -9.696 -8.358 32 2HG PRO 4 HG1 PRO 4 -17.888 -8.956 -9.844 33 1HD PRO 4 HD2 PRO 4 -17.641 -11.850 -9.123 34 2HD PRO 4 HD1 PRO 4 -18.950 -11.009 -9.979 35 H ASP 5 HN ASP 5 -15.578 -12.905 -10.645 36 HA ASP 5 HA ASP 5 -13.935 -14.453 -10.924 37 1HB ASP 5 HB2 ASP 5 -12.914 -12.574 -13.069 38 2HB ASP 5 HB1 ASP 5 -12.360 -14.224 -12.809 39 H ARG 6 HN ARG 6 -12.386 -14.772 -9.478 40 HA ARG 6 HA ARG 6 -11.114 -12.656 -8.126 41 1HB ARG 6 HB2 ARG 6 -9.777 -14.407 -7.029 42 2HB ARG 6 HB1 ARG 6 -11.491 -14.798 -7.043 43 1HG ARG 6 HG2 ARG 6 -11.117 -16.309 -8.939 44 2HG ARG 6 HG1 ARG 6 -9.394 -15.930 -8.885 45 1HD ARG 6 HD2 ARG 6 -9.276 -16.810 -6.602 46 2HD ARG 6 HD1 ARG 6 -10.995 -17.191 -6.661 47 HE ARG 6 HE ARG 6 -9.734 -18.453 -8.816 48 1HH1 ARG 6 HH11 ARG 6 -9.830 -18.623 -5.329 49 2HH1 ARG 6 HH12 ARG 6 -9.458 -20.313 -5.277 50 1HH2 ARG 6 HH21 ARG 6 -9.246 -20.676 -8.748 51 2HH2 ARG 6 HH22 ARG 6 -9.126 -21.479 -7.218 52 H SER 7 HN SER 7 -10.278 -14.417 -10.976 53 HA SER 7 HA SER 7 -7.531 -14.198 -11.062 54 1HB SER 7 HB2 SER 7 -7.744 -14.297 -13.514 55 2HB SER 7 HB1 SER 7 -8.807 -15.457 -12.719 56 HG SER 7 HG SER 7 -9.612 -13.931 -14.505 57 H GLU 8 HN GLU 8 -9.943 -11.720 -11.928 58 HA GLU 8 HA GLU 8 -8.265 -9.918 -13.179 59 1HB GLU 8 HB2 GLU 8 -9.808 -8.121 -12.345 60 2HB GLU 8 HB1 GLU 8 -10.592 -9.453 -13.178 61 1HG GLU 8 HG2 GLU 8 -11.204 -10.413 -11.013 62 2HG GLU 8 HG1 GLU 8 -10.465 -9.040 -10.201 63 H ILE 9 HN ILE 9 -8.762 -10.339 -9.684 64 HA ILE 9 HA ILE 9 -7.049 -8.173 -8.982 65 HB ILE 9 HB ILE 9 -8.134 -10.482 -7.382 66 1HG1 ILE 9 HG12 ILE 9 -8.681 -7.537 -7.611 67 2HG1 ILE 9 HG11 ILE 9 -9.810 -8.880 -7.712 68 1HG2 ILE 9 HG21 ILE 9 -7.157 -9.449 -5.373 69 2HG2 ILE 9 HG22 ILE 9 -6.282 -8.312 -6.400 70 3HG2 ILE 9 HG23 ILE 9 -5.925 -10.036 -6.489 71 1HD1 ILE 9 HD11 ILE 9 -10.139 -7.621 -5.669 72 2HD1 ILE 9 HD12 ILE 9 -8.458 -7.885 -5.214 73 3HD1 ILE 9 HD13 ILE 9 -9.571 -9.249 -5.302 74 H ALA 10 HN ALA 10 -6.569 -11.628 -9.470 75 HA ALA 10 HA ALA 10 -3.968 -11.836 -8.447 76 1HB ALA 10 HB1 ALA 10 -4.035 -13.949 -9.224 77 2HB ALA 10 HB2 ALA 10 -4.545 -13.451 -10.837 78 3HB ALA 10 HB3 ALA 10 -5.731 -13.582 -9.538 79 H GLY 11 HN GLY 11 -2.054 -11.078 -9.146 80 1HA GLY 11 HA2 GLY 11 -1.067 -10.977 -11.688 81 2HA GLY 11 HA1 GLY 11 -1.968 -9.478 -11.543 82 H LYS 12 HN LYS 12 -0.269 -8.071 -11.619 83 HA LYS 12 HA LYS 12 1.731 -8.323 -9.470 84 1HB LYS 12 HB2 LYS 12 2.005 -6.960 -12.152 85 2HB LYS 12 HB1 LYS 12 3.226 -6.960 -10.890 86 1HG LYS 12 HG2 LYS 12 3.424 -9.383 -11.069 87 2HG LYS 12 HG1 LYS 12 2.188 -9.391 -12.329 88 1HD LYS 12 HD2 LYS 12 4.424 -9.497 -13.301 89 2HD LYS 12 HD1 LYS 12 3.618 -7.990 -13.739 90 1HE LYS 12 HE2 LYS 12 4.856 -6.816 -11.988 91 2HE LYS 12 HE1 LYS 12 5.651 -8.323 -11.534 92 1HZ LYS 12 HZ1 LYS 12 5.853 -7.422 -14.316 93 2HZ LYS 12 HZ2 LYS 12 6.960 -8.298 -13.384 94 3HZ LYS 12 HZ3 LYS 12 6.790 -6.632 -13.148 95 H TRP 13 HN TRP 13 1.808 -6.815 -7.987 96 HA TRP 13 HA TRP 13 0.326 -4.302 -8.394 97 1HB TRP 13 HB2 TRP 13 0.983 -5.883 -5.903 98 2HB TRP 13 HB1 TRP 13 0.385 -4.233 -5.846 99 HD1 TRP 13 HD1 TRP 13 -1.188 -6.330 -8.536 100 HE1 TRP 13 HE1 TRP 13 -3.585 -6.958 -7.843 101 HE3 TRP 13 HE3 TRP 13 -1.049 -4.839 -3.646 102 HZ2 TRP 13 HZ2 TRP 13 -5.195 -6.846 -5.546 103 HZ3 TRP 13 HZ3 TRP 13 -3.064 -5.142 -2.268 104 HH2 TRP 13 HH2 TRP 13 -5.095 -6.125 -3.203 105 H TYR 14 HN TYR 14 1.438 -2.363 -8.208 106 HA TYR 14 HA TYR 14 4.265 -2.582 -7.389 107 1HB TYR 14 HB2 TYR 14 3.972 -2.189 -9.825 108 2HB TYR 14 HB1 TYR 14 3.129 -0.689 -9.454 109 HD1 TYR 14 HD1 TYR 14 4.579 0.892 -10.427 110 HD2 TYR 14 HD2 TYR 14 6.134 -2.017 -7.742 111 HE1 TYR 14 HE1 TYR 14 6.727 2.087 -10.384 112 HE2 TYR 14 HE2 TYR 14 8.285 -0.830 -7.689 113 HH TYR 14 HH TYR 14 9.210 1.394 -9.893 114 H VAL 15 HN VAL 15 4.548 -1.649 -5.470 115 HA VAL 15 HA VAL 15 2.863 0.596 -4.683 116 HB VAL 15 HB VAL 15 3.060 -1.091 -3.010 117 1HG1 VAL 15 HG11 VAL 15 5.080 -2.176 -3.699 118 2HG1 VAL 15 HG12 VAL 15 5.248 -1.681 -2.015 119 3HG1 VAL 15 HG13 VAL 15 6.030 -0.748 -3.289 120 1HG2 VAL 15 HG21 VAL 15 4.934 0.900 -1.854 121 2HG2 VAL 15 HG22 VAL 15 3.422 0.261 -1.212 122 3HG2 VAL 15 HG23 VAL 15 3.391 1.491 -2.474 123 H VAL 16 HN VAL 16 3.432 2.580 -4.898 124 HA VAL 16 HA VAL 16 6.226 3.436 -4.710 125 HB VAL 16 HB VAL 16 4.541 3.484 -7.129 126 1HG1 VAL 16 HG11 VAL 16 5.510 5.591 -7.986 127 2HG1 VAL 16 HG12 VAL 16 6.125 5.935 -6.374 128 3HG1 VAL 16 HG13 VAL 16 4.389 5.842 -6.650 129 1HG2 VAL 16 HG21 VAL 16 6.415 2.373 -7.644 130 2HG2 VAL 16 HG22 VAL 16 7.344 3.141 -6.358 131 3HG2 VAL 16 HG23 VAL 16 7.103 3.977 -7.891 132 H ALA 17 HN ALA 17 2.868 4.533 -5.202 133 HA ALA 17 HA ALA 17 3.398 7.049 -3.863 134 1HB ALA 17 HB1 ALA 17 1.644 6.348 -5.799 135 2HB ALA 17 HB2 ALA 17 1.459 7.766 -4.769 136 3HB ALA 17 HB3 ALA 17 0.604 6.274 -4.376 137 H LEU 18 HN LEU 18 3.051 7.457 -1.723 138 HA LEU 18 HA LEU 18 1.221 5.756 -0.217 139 1HB LEU 18 HB2 LEU 18 4.003 6.185 0.840 140 2HB LEU 18 HB1 LEU 18 2.772 5.108 1.451 141 HG LEU 18 HG LEU 18 4.134 4.698 -1.210 142 1HD1 LEU 18 HD11 LEU 18 4.953 3.972 1.562 143 2HD1 LEU 18 HD12 LEU 18 5.939 4.490 0.195 144 3HD1 LEU 18 HD13 LEU 18 5.292 2.850 0.245 145 1HD2 LEU 18 HD21 LEU 18 3.408 2.258 -0.245 146 2HD2 LEU 18 HD22 LEU 18 2.455 3.207 -1.380 147 3HD2 LEU 18 HD23 LEU 18 2.092 3.269 0.343 148 H ALA 19 HN ALA 19 1.103 6.548 2.129 149 HA ALA 19 HA ALA 19 1.900 9.218 2.720 150 1HB ALA 19 HB1 ALA 19 -0.555 8.910 1.288 151 2HB ALA 19 HB2 ALA 19 0.205 10.387 1.874 152 3HB ALA 19 HB3 ALA 19 -0.905 9.496 2.912 153 H SER 20 HN SER 20 2.353 9.027 4.864 154 HA SER 20 HA SER 20 0.306 7.889 6.589 155 1HB SER 20 HB2 SER 20 1.804 6.198 7.552 156 2HB SER 20 HB1 SER 20 1.532 5.917 5.837 157 HG SER 20 HG SER 20 3.778 7.289 6.886 158 H ASN 21 HN ASN 21 0.537 8.211 8.756 159 HA ASN 21 HA ASN 21 2.804 9.743 9.769 160 1HB ASN 21 HB2 ASN 21 -0.074 10.626 9.981 161 2HB ASN 21 HB1 ASN 21 1.153 11.156 11.111 162 1HD2 ASN 21 HD21 ASN 21 2.848 10.919 8.356 163 2HD2 ASN 21 HD22 ASN 21 2.614 12.502 7.721 164 H THR 22 HN THR 22 3.301 9.254 11.842 165 HA THR 22 HA THR 22 1.520 8.018 13.677 166 HB THR 22 HB THR 22 3.631 6.233 12.441 167 HG1 THR 22 HG1 THR 22 0.801 6.129 12.289 168 1HG2 THR 22 HG21 THR 22 1.563 5.590 14.527 169 2HG2 THR 22 HG22 THR 22 3.295 5.758 14.809 170 3HG2 THR 22 HG23 THR 22 2.692 4.455 13.786 171 H GLU 23 HN GLU 23 4.884 8.355 12.677 172 HA GLU 23 HA GLU 23 5.578 9.701 15.111 173 1HB GLU 23 HB2 GLU 23 6.797 6.994 14.523 174 2HB GLU 23 HB1 GLU 23 7.384 8.114 15.742 175 1HG GLU 23 HG2 GLU 23 5.212 7.939 16.902 176 2HG GLU 23 HG1 GLU 23 4.702 6.748 15.708 177 H PHE 24 HN PHE 24 6.666 11.345 14.284 178 HA PHE 24 HA PHE 24 7.858 11.423 11.766 179 1HB PHE 24 HB2 PHE 24 7.162 13.428 12.982 180 2HB PHE 24 HB1 PHE 24 8.423 13.154 14.180 181 HD1 PHE 24 HD1 PHE 24 8.541 12.941 10.467 182 HD2 PHE 24 HD2 PHE 24 9.892 14.924 13.982 183 HE1 PHE 24 HE1 PHE 24 10.109 14.266 9.112 184 HE2 PHE 24 HE2 PHE 24 11.462 16.254 12.632 185 HZ PHE 24 HZ PHE 24 11.572 15.925 10.194 186 H PHE 25 HN PHE 25 9.291 10.789 14.936 187 HA PHE 25 HA PHE 25 11.971 10.767 14.019 188 1HB PHE 25 HB2 PHE 25 10.654 9.688 16.503 189 2HB PHE 25 HB1 PHE 25 12.380 9.519 16.208 190 HD1 PHE 25 HD1 PHE 25 13.509 10.917 17.623 191 HD2 PHE 25 HD2 PHE 25 10.019 12.371 15.668 192 HE1 PHE 25 HE1 PHE 25 13.903 13.147 18.581 193 HE2 PHE 25 HE2 PHE 25 10.409 14.601 16.621 194 HZ PHE 25 HZ PHE 25 12.353 14.993 18.081 195 H LEU 26 HN LEU 26 9.715 8.110 14.763 196 HA LEU 26 HA LEU 26 11.583 6.117 13.905 197 1HB LEU 26 HB2 LEU 26 8.641 5.916 14.528 198 2HB LEU 26 HB1 LEU 26 9.704 4.550 14.245 199 HG LEU 26 HG LEU 26 9.896 6.515 16.529 200 1HD1 LEU 26 HD11 LEU 26 8.949 4.945 17.878 201 2HD1 LEU 26 HD12 LEU 26 9.506 3.595 16.889 202 3HD1 LEU 26 HD13 LEU 26 8.121 4.557 16.370 203 1HD2 LEU 26 HD21 LEU 26 11.602 4.725 17.304 204 2HD2 LEU 26 HD22 LEU 26 12.108 5.952 16.143 205 3HD2 LEU 26 HD23 LEU 26 11.705 4.328 15.588 206 H ARG 27 HN ARG 27 8.526 7.354 12.537 207 HA ARG 27 HA ARG 27 8.518 5.700 10.282 208 1HB ARG 27 HB2 ARG 27 7.335 8.462 10.578 209 2HB ARG 27 HB1 ARG 27 6.948 7.321 9.299 210 1HG ARG 27 HG2 ARG 27 6.389 7.007 12.239 211 2HG ARG 27 HG1 ARG 27 5.217 7.246 10.942 212 1HD ARG 27 HD2 ARG 27 7.004 4.849 11.340 213 2HD ARG 27 HD1 ARG 27 5.261 4.914 11.598 214 HE ARG 27 HE ARG 27 6.590 4.480 9.138 215 1HH1 ARG 27 HH11 ARG 27 3.793 6.048 10.511 216 2HH1 ARG 27 HH12 ARG 27 2.889 6.000 9.039 217 1HH2 ARG 27 HH21 ARG 27 5.405 4.408 7.204 218 2HH2 ARG 27 HH22 ARG 27 3.804 5.063 7.157 219 H GLU 28 HN GLU 28 9.935 8.924 10.725 220 HA GLU 28 HA GLU 28 10.613 9.500 8.112 221 1HB GLU 28 HB2 GLU 28 10.923 11.093 9.926 222 2HB GLU 28 HB1 GLU 28 12.198 10.097 10.615 223 1HG GLU 28 HG2 GLU 28 13.575 10.482 8.642 224 2HG GLU 28 HG1 GLU 28 12.292 11.463 7.935 225 H LYS 29 HN LYS 29 12.596 7.723 10.483 226 HA LYS 29 HA LYS 29 14.610 7.095 8.535 227 1HB LYS 29 HB2 LYS 29 15.167 7.368 10.912 228 2HB LYS 29 HB1 LYS 29 14.163 5.981 11.312 229 1HG LYS 29 HG2 LYS 29 15.629 4.527 10.034 230 2HG LYS 29 HG1 LYS 29 16.620 5.912 9.572 231 1HD LYS 29 HD2 LYS 29 16.171 4.929 12.391 232 2HD LYS 29 HD1 LYS 29 17.621 4.654 11.424 233 1HE LYS 29 HE2 LYS 29 17.999 7.073 11.313 234 2HE LYS 29 HE1 LYS 29 16.553 7.342 12.285 235 1HZ LYS 29 HZ1 LYS 29 19.053 5.986 13.132 236 2HZ LYS 29 HZ2 LYS 29 17.635 5.997 14.054 237 3HZ LYS 29 HZ3 LYS 29 18.431 7.450 13.712 238 H ASP 30 HN ASP 30 11.883 5.427 10.002 239 HA ASP 30 HA ASP 30 12.427 2.852 9.005 240 1HB ASP 30 HB2 ASP 30 10.823 3.296 10.826 241 2HB ASP 30 HB1 ASP 30 9.746 4.080 9.673 242 H LYS 31 HN LYS 31 10.446 5.500 7.679 243 HA LYS 31 HA LYS 31 9.446 4.085 5.472 244 1HB LYS 31 HB2 LYS 31 8.790 6.218 4.578 245 2HB LYS 31 HB1 LYS 31 8.559 6.259 6.318 246 1HG LYS 31 HG2 LYS 31 10.670 7.490 6.553 247 2HG LYS 31 HG1 LYS 31 10.853 7.478 4.801 248 1HD LYS 31 HD2 LYS 31 9.931 9.602 5.588 249 2HD LYS 31 HD1 LYS 31 8.781 8.741 4.562 250 1HE LYS 31 HE2 LYS 31 7.608 7.936 6.548 251 2HE LYS 31 HE1 LYS 31 8.769 8.772 7.579 252 1HZ LYS 31 HZ1 LYS 31 8.045 10.869 6.503 253 2HZ LYS 31 HZ2 LYS 31 6.825 10.109 7.395 254 3HZ LYS 31 HZ3 LYS 31 6.827 10.005 5.707 255 H MET 32 HN MET 32 10.266 6.057 3.381 256 HA MET 32 HA MET 32 11.795 6.217 1.702 257 1HB MET 32 HB2 MET 32 13.906 5.393 3.694 258 2HB MET 32 HB1 MET 32 14.104 6.375 2.250 259 1HG MET 32 HG2 MET 32 12.702 8.120 3.333 260 2HG MET 32 HG1 MET 32 12.727 7.154 4.804 261 1HE MET 32 HE1 MET 32 16.419 6.396 4.651 262 2HE MET 32 HE2 MET 32 14.884 6.028 5.439 263 3HE MET 32 HE3 MET 32 16.011 7.161 6.186 264 H LYS 33 HN LYS 33 10.975 4.397 0.557 265 HA LYS 33 HA LYS 33 12.835 2.327 0.112 266 1HB LYS 33 HB2 LYS 33 11.785 0.440 1.125 267 2HB LYS 33 HB1 LYS 33 11.965 1.661 2.371 268 1HG LYS 33 HG2 LYS 33 9.428 1.042 0.873 269 2HG LYS 33 HG1 LYS 33 9.808 0.551 2.523 270 1HD LYS 33 HD2 LYS 33 9.996 2.957 3.131 271 2HD LYS 33 HD1 LYS 33 9.452 3.366 1.502 272 1HE LYS 33 HE2 LYS 33 7.915 1.774 3.550 273 2HE LYS 33 HE1 LYS 33 7.595 3.441 3.073 274 1HZ LYS 33 HZ1 LYS 33 7.312 1.007 1.402 275 2HZ LYS 33 HZ2 LYS 33 7.222 2.578 0.780 276 3HZ LYS 33 HZ3 LYS 33 6.083 2.051 1.915 277 H MET 34 HN MET 34 12.479 1.422 -1.851 278 HA MET 34 HA MET 34 9.968 2.070 -3.213 279 1HB MET 34 HB2 MET 34 12.426 0.632 -4.254 280 2HB MET 34 HB1 MET 34 11.079 1.209 -5.223 281 1HG MET 34 HG2 MET 34 11.643 3.505 -4.687 282 2HG MET 34 HG1 MET 34 12.953 2.956 -3.644 283 1HE MET 34 HE1 MET 34 12.642 2.936 -8.157 284 2HE MET 34 HE2 MET 34 11.360 2.645 -6.982 285 3HE MET 34 HE3 MET 34 12.391 1.315 -7.509 286 H ALA 35 HN ALA 35 8.633 0.276 -4.215 287 HA ALA 35 HA ALA 35 9.381 -2.380 -3.375 288 1HB ALA 35 HB1 ALA 35 7.117 -2.577 -2.089 289 2HB ALA 35 HB2 ALA 35 7.329 -0.837 -1.888 290 3HB ALA 35 HB3 ALA 35 8.563 -1.949 -1.300 291 H MET 36 HN MET 36 8.343 -4.005 -4.304 292 HA MET 36 HA MET 36 6.228 -3.397 -6.261 293 1HB MET 36 HB2 MET 36 8.432 -5.468 -6.498 294 2HB MET 36 HB1 MET 36 7.166 -5.172 -7.683 295 1HG MET 36 HG2 MET 36 8.043 -2.945 -8.089 296 2HG MET 36 HG1 MET 36 9.289 -3.202 -6.869 297 1HE MET 36 HE1 MET 36 10.499 -2.856 -10.515 298 2HE MET 36 HE2 MET 36 11.657 -3.017 -9.195 299 3HE MET 36 HE3 MET 36 10.188 -2.067 -8.969 300 H ALA 37 HN ALA 37 4.761 -5.322 -6.619 301 HA ALA 37 HA ALA 37 4.890 -7.330 -4.528 302 1HB ALA 37 HB1 ALA 37 2.629 -6.816 -3.681 303 2HB ALA 37 HB2 ALA 37 2.623 -5.358 -4.674 304 3HB ALA 37 HB3 ALA 37 3.797 -5.531 -3.370 305 H ARG 38 HN ARG 38 3.407 -9.036 -4.727 306 HA ARG 38 HA ARG 38 1.991 -9.238 -7.291 307 1HB ARG 38 HB2 ARG 38 4.114 -10.408 -7.567 308 2HB ARG 38 HB1 ARG 38 3.841 -11.309 -6.084 309 1HG ARG 38 HG2 ARG 38 1.897 -12.392 -7.121 310 2HG ARG 38 HG1 ARG 38 2.227 -11.513 -8.615 311 1HD ARG 38 HD2 ARG 38 4.066 -13.485 -7.264 312 2HD ARG 38 HD1 ARG 38 3.119 -13.780 -8.721 313 HE ARG 38 HE ARG 38 4.744 -11.536 -9.141 314 1HH1 ARG 38 HH11 ARG 38 5.030 -14.989 -8.714 315 2HH1 ARG 38 HH12 ARG 38 6.484 -15.109 -9.647 316 1HH2 ARG 38 HH21 ARG 38 6.656 -11.693 -10.368 317 2HH2 ARG 38 HH22 ARG 38 7.408 -13.239 -10.585 318 H ILE 39 HN ILE 39 -0.091 -9.829 -6.957 319 HA ILE 39 HA ILE 39 -0.749 -10.918 -4.314 320 HB ILE 39 HB ILE 39 -1.848 -8.817 -4.856 321 1HG1 ILE 39 HG12 ILE 39 -3.783 -11.145 -4.839 322 2HG1 ILE 39 HG11 ILE 39 -2.974 -10.488 -3.419 323 1HG2 ILE 39 HG21 ILE 39 -2.989 -10.341 -7.191 324 2HG2 ILE 39 HG22 ILE 39 -1.968 -8.903 -7.236 325 3HG2 ILE 39 HG23 ILE 39 -3.616 -8.795 -6.619 326 1HD1 ILE 39 HD11 ILE 39 -4.200 -8.505 -3.501 327 2HD1 ILE 39 HD12 ILE 39 -5.374 -9.775 -3.851 328 3HD1 ILE 39 HD13 ILE 39 -4.718 -8.795 -5.161 329 H SER 40 HN SER 40 -1.987 -12.675 -3.993 330 HA SER 40 HA SER 40 -3.180 -14.152 -6.152 331 1HB SER 40 HB2 SER 40 -0.836 -14.866 -6.362 332 2HB SER 40 HB1 SER 40 -0.821 -15.337 -4.662 333 HG SER 40 HG SER 40 -2.035 -17.050 -5.105 334 H PHE 41 HN PHE 41 -4.723 -15.597 -5.421 335 HA PHE 41 HA PHE 41 -5.587 -15.213 -2.712 336 1HB PHE 41 HB2 PHE 41 -6.717 -16.908 -4.943 337 2HB PHE 41 HB1 PHE 41 -7.487 -16.682 -3.376 338 HD1 PHE 41 HD1 PHE 41 -9.265 -15.255 -3.435 339 HD2 PHE 41 HD2 PHE 41 -5.916 -14.431 -5.932 340 HE1 PHE 41 HE1 PHE 41 -10.382 -13.228 -4.268 341 HE2 PHE 41 HE2 PHE 41 -7.025 -12.406 -6.762 342 HZ PHE 41 HZ PHE 41 -9.261 -11.800 -5.933 343 H LEU 42 HN LEU 42 -5.197 -16.426 -0.995 344 HA LEU 42 HA LEU 42 -3.818 -18.981 -1.334 345 1HB LEU 42 HB2 LEU 42 -2.920 -17.150 0.164 346 2HB LEU 42 HB1 LEU 42 -4.292 -17.431 1.213 347 HG LEU 42 HG LEU 42 -2.206 -18.502 2.005 348 1HD1 LEU 42 HD11 LEU 42 -3.253 -20.357 2.837 349 2HD1 LEU 42 HD12 LEU 42 -4.060 -20.725 1.314 350 3HD1 LEU 42 HD13 LEU 42 -4.638 -19.396 2.321 351 1HD2 LEU 42 HD21 LEU 42 -1.554 -19.064 -0.453 352 2HD2 LEU 42 HD22 LEU 42 -2.477 -20.537 -0.159 353 3HD2 LEU 42 HD23 LEU 42 -1.088 -20.150 0.856 354 H GLY 43 HN GLY 43 -4.720 -20.892 -0.837 355 1HA GLY 43 HA2 GLY 43 -7.420 -21.326 -0.746 356 2HA GLY 43 HA1 GLY 43 -6.241 -22.452 -0.102 357 H GLU 44 HN GLU 44 -8.778 -22.249 0.906 358 HA GLU 44 HA GLU 44 -9.609 -22.505 3.047 359 1HB GLU 44 HB2 GLU 44 -7.447 -20.604 3.975 360 2HB GLU 44 HB1 GLU 44 -8.554 -21.504 5.000 361 1HG GLU 44 HG2 GLU 44 -6.484 -22.714 3.182 362 2HG GLU 44 HG1 GLU 44 -6.331 -22.512 4.926 363 H ASP 45 HN ASP 45 -8.400 -19.169 3.147 364 HA ASP 45 HA ASP 45 -10.654 -17.873 2.169 365 1HB ASP 45 HB2 ASP 45 -11.743 -18.977 4.172 366 2HB ASP 45 HB1 ASP 45 -10.702 -17.997 5.197 367 H GLU 46 HN GLU 46 -8.092 -17.372 1.782 368 HA GLU 46 HA GLU 46 -7.771 -14.728 2.903 369 1HB GLU 46 HB2 GLU 46 -5.744 -16.901 3.454 370 2HB GLU 46 HB1 GLU 46 -5.466 -15.190 3.732 371 1HG GLU 46 HG2 GLU 46 -7.239 -15.142 5.385 372 2HG GLU 46 HG1 GLU 46 -7.597 -16.838 5.072 373 H LEU 47 HN LEU 47 -6.891 -13.413 1.449 374 HA LEU 47 HA LEU 47 -5.450 -14.619 -0.817 375 1HB LEU 47 HB2 LEU 47 -6.130 -12.797 -2.206 376 2HB LEU 47 HB1 LEU 47 -7.559 -13.450 -1.434 377 HG LEU 47 HG LEU 47 -6.142 -10.944 -0.528 378 1HD1 LEU 47 HD11 LEU 47 -8.371 -9.974 -1.505 379 2HD1 LEU 47 HD12 LEU 47 -8.326 -11.431 -2.497 380 3HD1 LEU 47 HD13 LEU 47 -6.990 -10.282 -2.560 381 1HD2 LEU 47 HD21 LEU 47 -8.708 -10.808 0.351 382 2HD2 LEU 47 HD22 LEU 47 -7.347 -11.380 1.315 383 3HD2 LEU 47 HD23 LEU 47 -8.388 -12.538 0.486 384 H LYS 48 HN LYS 48 -3.342 -14.227 -0.890 385 HA LYS 48 HA LYS 48 -2.313 -12.077 0.816 386 1HB LYS 48 HB2 LYS 48 -0.213 -13.323 0.885 387 2HB LYS 48 HB1 LYS 48 -1.564 -14.296 1.436 388 1HG LYS 48 HG2 LYS 48 -0.343 -15.764 0.135 389 2HG LYS 48 HG1 LYS 48 -1.615 -15.223 -0.959 390 1HD LYS 48 HD2 LYS 48 -0.114 -13.738 -2.079 391 2HD LYS 48 HD1 LYS 48 1.136 -13.993 -0.863 392 1HE LYS 48 HE2 LYS 48 1.320 -16.329 -1.543 393 2HE LYS 48 HE1 LYS 48 0.051 -16.086 -2.743 394 1HZ LYS 48 HZ1 LYS 48 2.014 -15.899 -3.941 395 2HZ LYS 48 HZ2 LYS 48 2.804 -15.020 -2.732 396 3HZ LYS 48 HZ3 LYS 48 1.593 -14.285 -3.657 397 H VAL 49 HN VAL 49 -0.474 -10.903 0.211 398 HA VAL 49 HA VAL 49 0.149 -10.805 -2.633 399 HB VAL 49 HB VAL 49 -1.576 -9.078 -2.279 400 1HG1 VAL 49 HG11 VAL 49 0.146 -7.294 -0.725 401 2HG1 VAL 49 HG12 VAL 49 -0.446 -8.695 0.169 402 3HG1 VAL 49 HG13 VAL 49 -1.585 -7.597 -0.603 403 1HG2 VAL 49 HG21 VAL 49 -0.564 -7.554 -3.619 404 2HG2 VAL 49 HG22 VAL 49 0.629 -8.848 -3.732 405 3HG2 VAL 49 HG23 VAL 49 0.900 -7.491 -2.640 406 H SER 50 HN SER 50 2.253 -10.999 -2.806 407 HA SER 50 HA SER 50 3.972 -10.477 -0.534 408 1HB SER 50 HB2 SER 50 4.213 -12.526 -1.981 409 2HB SER 50 HB1 SER 50 4.735 -11.469 -3.292 410 HG SER 50 HG SER 50 6.015 -11.991 -0.827 411 H TYR 51 HN TYR 51 5.741 -9.014 -0.574 412 HA TYR 51 HA TYR 51 5.764 -7.149 -2.819 413 1HB TYR 51 HB2 TYR 51 5.723 -5.205 -1.377 414 2HB TYR 51 HB1 TYR 51 4.295 -6.187 -1.082 415 HD1 TYR 51 HD1 TYR 51 3.721 -6.725 1.105 416 HD2 TYR 51 HD2 TYR 51 7.729 -5.593 0.240 417 HE1 TYR 51 HE1 TYR 51 4.234 -6.723 3.510 418 HE2 TYR 51 HE2 TYR 51 8.254 -5.595 2.641 419 HH TYR 51 HH TYR 51 6.150 -6.924 4.978 420 H ALA 52 HN ALA 52 7.723 -6.613 -3.485 421 HA ALA 52 HA ALA 52 10.012 -7.359 -1.794 422 1HB ALA 52 HB1 ALA 52 11.305 -7.420 -3.907 423 2HB ALA 52 HB2 ALA 52 9.823 -7.060 -4.792 424 3HB ALA 52 HB3 ALA 52 9.964 -8.564 -3.883 425 H VAL 53 HN VAL 53 10.750 -5.669 -0.721 426 HA VAL 53 HA VAL 53 10.636 -3.010 -1.925 427 HB VAL 53 HB VAL 53 11.338 -3.754 0.910 428 1HG1 VAL 53 HG11 VAL 53 11.954 -1.466 -0.190 429 2HG1 VAL 53 HG12 VAL 53 11.266 -1.519 1.433 430 3HG1 VAL 53 HG13 VAL 53 10.243 -1.117 0.054 431 1HG2 VAL 53 HG21 VAL 53 8.815 -2.582 0.892 432 2HG2 VAL 53 HG22 VAL 53 9.191 -4.280 1.186 433 3HG2 VAL 53 HG23 VAL 53 8.780 -3.736 -0.441 434 HA PRO 54 HA PRO 54 15.126 -3.521 -2.365 435 1HB PRO 54 HB2 PRO 54 15.184 -1.887 -4.641 436 2HB PRO 54 HB1 PRO 54 15.093 -3.648 -4.622 437 1HG PRO 54 HG2 PRO 54 13.101 -1.869 -5.520 438 2HG PRO 54 HG1 PRO 54 12.926 -3.611 -5.258 439 1HD PRO 54 HD2 PRO 54 12.149 -1.341 -3.503 440 2HD PRO 54 HD1 PRO 54 11.378 -2.929 -3.701 441 H LYS 55 HN LYS 55 16.794 -2.241 -1.804 442 HA LYS 55 HA LYS 55 16.756 0.615 -1.889 443 1HB LYS 55 HB2 LYS 55 16.575 -0.751 0.804 444 2HB LYS 55 HB1 LYS 55 17.062 0.920 0.574 445 1HG LYS 55 HG2 LYS 55 14.879 1.436 -0.377 446 2HG LYS 55 HG1 LYS 55 14.388 -0.244 -0.147 447 1HD LYS 55 HD2 LYS 55 15.394 1.380 2.154 448 2HD LYS 55 HD1 LYS 55 13.720 1.500 1.632 449 1HE LYS 55 HE2 LYS 55 13.426 -0.895 1.948 450 2HE LYS 55 HE1 LYS 55 15.118 -1.053 2.413 451 1HZ LYS 55 HZ1 LYS 55 14.156 -0.913 4.451 452 2HZ LYS 55 HZ2 LYS 55 12.869 0.048 3.922 453 3HZ LYS 55 HZ3 LYS 55 14.392 0.740 4.173 454 HA PRO 56 HA PRO 56 21.029 -0.674 -2.083 455 1HB PRO 56 HB2 PRO 56 22.116 1.711 -2.695 456 2HB PRO 56 HB1 PRO 56 21.183 0.767 -3.861 457 1HG PRO 56 HG2 PRO 56 20.355 3.136 -2.241 458 2HG PRO 56 HG1 PRO 56 19.971 2.735 -3.924 459 1HD PRO 56 HD2 PRO 56 18.267 2.321 -1.807 460 2HD PRO 56 HD1 PRO 56 18.207 1.418 -3.331 461 H ASN 57 HN ASN 57 22.623 -0.881 -0.664 462 HA ASN 57 HA ASN 57 23.913 -0.664 1.185 463 1HB ASN 57 HB2 ASN 57 23.200 2.257 0.893 464 2HB ASN 57 HB1 ASN 57 24.484 1.624 1.918 465 1HD2 ASN 57 HD21 ASN 57 23.901 3.058 -0.933 466 2HD2 ASN 57 HD22 ASN 57 25.263 2.504 -1.840 467 H GLY 58 HN GLY 58 23.568 -1.211 3.208 468 1HA GLY 58 HA2 GLY 58 22.582 -1.488 5.251 469 2HA GLY 58 HA1 GLY 58 22.056 0.178 5.096 470 H CYS 59 HN CYS 59 20.111 0.400 3.509 471 HA CYS 59 HA CYS 59 17.919 -0.859 4.661 472 1HB CYS 59 HB2 CYS 59 18.166 0.450 1.952 473 2HB CYS 59 HB1 CYS 59 16.644 0.034 2.724 474 H ARG 60 HN ARG 60 19.554 -1.598 1.589 475 HA ARG 60 HA ARG 60 19.568 -3.448 0.266 476 1HB ARG 60 HB2 ARG 60 18.654 -4.864 2.776 477 2HB ARG 60 HB1 ARG 60 19.389 -5.617 1.369 478 1HG ARG 60 HG2 ARG 60 21.456 -4.398 1.778 479 2HG ARG 60 HG1 ARG 60 20.723 -3.623 3.185 480 1HD ARG 60 HD2 ARG 60 21.180 -6.583 2.822 481 2HD ARG 60 HD1 ARG 60 22.132 -5.506 3.843 482 HE ARG 60 HE ARG 60 19.451 -5.313 4.617 483 1HH1 ARG 60 HH11 ARG 60 22.047 -7.647 4.641 484 2HH1 ARG 60 HH12 ARG 60 21.463 -8.468 6.049 485 1HH2 ARG 60 HH21 ARG 60 18.683 -6.392 6.470 486 2HH2 ARG 60 HH22 ARG 60 19.554 -7.756 7.087 487 H LYS 61 HN LYS 61 17.839 -5.784 0.443 488 HA LYS 61 HA LYS 61 15.326 -4.560 -0.459 489 1HB LYS 61 HB2 LYS 61 16.547 -5.706 -2.236 490 2HB LYS 61 HB1 LYS 61 16.588 -7.181 -1.281 491 1HG LYS 61 HG2 LYS 61 14.114 -7.248 -1.366 492 2HG LYS 61 HG1 LYS 61 14.148 -5.845 -2.433 493 1HD LYS 61 HD2 LYS 61 15.472 -8.495 -3.010 494 2HD LYS 61 HD1 LYS 61 13.912 -7.982 -3.654 495 1HE LYS 61 HE2 LYS 61 15.501 -7.556 -5.351 496 2HE LYS 61 HE1 LYS 61 15.108 -5.993 -4.640 497 1HZ LYS 61 HZ1 LYS 61 17.610 -7.028 -4.992 498 2HZ LYS 61 HZ2 LYS 61 17.326 -7.238 -3.339 499 3HZ LYS 61 HZ3 LYS 61 17.209 -5.698 -4.028 500 H TRP 62 HN TRP 62 13.334 -5.576 0.082 501 HA TRP 62 HA TRP 62 13.496 -7.657 2.148 502 1HB TRP 62 HB2 TRP 62 13.250 -5.533 3.334 503 2HB TRP 62 HB1 TRP 62 11.831 -5.143 2.369 504 HD1 TRP 62 HD1 TRP 62 9.815 -5.310 3.935 505 HE1 TRP 62 HE1 TRP 62 8.951 -7.008 5.664 506 HE3 TRP 62 HE3 TRP 62 13.726 -8.614 3.867 507 HZ2 TRP 62 HZ2 TRP 62 9.808 -9.421 6.844 508 HZ3 TRP 62 HZ3 TRP 62 13.618 -10.593 5.327 509 HH2 TRP 62 HH2 TRP 62 11.700 -10.986 6.784 510 H GLU 63 HN GLU 63 11.842 -9.123 2.173 511 HA GLU 63 HA GLU 63 9.599 -8.687 0.352 512 1HB GLU 63 HB2 GLU 63 9.797 -10.965 -0.551 513 2HB GLU 63 HB1 GLU 63 11.194 -9.977 -0.954 514 1HG GLU 63 HG2 GLU 63 12.446 -11.041 0.872 515 2HG GLU 63 HG1 GLU 63 11.047 -12.061 1.210 516 H THR 64 HN THR 64 7.701 -9.362 1.127 517 HA THR 64 HA THR 64 7.535 -11.421 3.139 518 HB THR 64 HB THR 64 6.848 -8.556 3.815 519 HG1 THR 64 HG1 THR 64 8.572 -10.325 5.187 520 1HG2 THR 64 HG21 THR 64 6.473 -10.960 5.579 521 2HG2 THR 64 HG22 THR 64 5.168 -10.166 4.699 522 3HG2 THR 64 HG23 THR 64 6.059 -9.281 5.937 523 H THR 65 HN THR 65 5.628 -12.419 3.123 524 HA THR 65 HA THR 65 3.576 -11.400 1.291 525 HB THR 65 HB THR 65 4.212 -14.149 2.357 526 HG1 THR 65 HG1 THR 65 5.475 -13.714 0.647 527 1HG2 THR 65 HG21 THR 65 2.436 -14.942 0.757 528 2HG2 THR 65 HG22 THR 65 1.830 -13.284 0.758 529 3HG2 THR 65 HG23 THR 65 1.873 -14.209 2.258 530 H PHE 66 HN PHE 66 1.766 -10.513 2.144 531 HA PHE 66 HA PHE 66 0.973 -11.446 4.828 532 1HB PHE 66 HB2 PHE 66 0.044 -9.241 5.303 533 2HB PHE 66 HB1 PHE 66 1.755 -9.128 4.922 534 HD1 PHE 66 HD1 PHE 66 2.488 -7.597 3.359 535 HD2 PHE 66 HD2 PHE 66 -1.612 -8.732 3.391 536 HE1 PHE 66 HE1 PHE 66 1.994 -5.840 1.709 537 HE2 PHE 66 HE2 PHE 66 -2.112 -6.984 1.734 538 HZ PHE 66 HZ PHE 66 -0.309 -5.534 0.892 539 H LYS 67 HN LYS 67 -0.858 -12.497 4.912 540 HA LYS 67 HA LYS 67 -2.754 -12.219 2.687 541 1HB LYS 67 HB2 LYS 67 -3.359 -14.453 2.953 542 2HB LYS 67 HB1 LYS 67 -1.632 -14.469 3.275 543 1HG LYS 67 HG2 LYS 67 -3.821 -14.511 5.340 544 2HG LYS 67 HG1 LYS 67 -2.821 -15.876 4.842 545 1HD LYS 67 HD2 LYS 67 -0.820 -14.579 5.614 546 2HD LYS 67 HD1 LYS 67 -1.934 -13.379 6.277 547 1HE LYS 67 HE2 LYS 67 -1.199 -14.957 7.996 548 2HE LYS 67 HE1 LYS 67 -2.935 -15.075 7.710 549 1HZ LYS 67 HZ1 LYS 67 -1.093 -16.866 6.272 550 2HZ LYS 67 HZ2 LYS 67 -2.716 -17.106 6.680 551 3HZ LYS 67 HZ3 LYS 67 -1.521 -17.216 7.872 552 H LYS 68 HN LYS 68 -5.063 -12.404 3.173 553 HA LYS 68 HA LYS 68 -6.089 -12.171 5.784 554 1HB LYS 68 HB2 LYS 68 -6.645 -9.804 5.862 555 2HB LYS 68 HB1 LYS 68 -4.908 -10.016 5.725 556 1HG LYS 68 HG2 LYS 68 -6.761 -9.331 3.455 557 2HG LYS 68 HG1 LYS 68 -5.741 -8.189 4.328 558 1HD LYS 68 HD2 LYS 68 -3.762 -9.569 3.620 559 2HD LYS 68 HD1 LYS 68 -4.860 -10.482 2.584 560 1HE LYS 68 HE2 LYS 68 -5.482 -8.377 1.450 561 2HE LYS 68 HE1 LYS 68 -4.295 -7.529 2.437 562 1HZ LYS 68 HZ1 LYS 68 -3.287 -7.991 0.369 563 2HZ LYS 68 HZ2 LYS 68 -3.777 -9.610 0.392 564 3HZ LYS 68 HZ3 LYS 68 -2.599 -9.068 1.478 565 H THR 69 HN THR 69 -8.318 -10.538 5.373 566 HA THR 69 HA THR 69 -9.683 -11.967 3.180 567 HB THR 69 HB THR 69 -11.754 -11.735 4.469 568 HG1 THR 69 HG1 THR 69 -11.627 -10.037 5.743 569 1HG2 THR 69 HG21 THR 69 -11.241 -13.687 5.362 570 2HG2 THR 69 HG22 THR 69 -10.512 -12.828 6.718 571 3HG2 THR 69 HG23 THR 69 -9.521 -13.303 5.337 572 H SER 70 HN SER 70 -11.679 -10.720 2.334 573 HA SER 70 HA SER 70 -11.180 -7.837 2.364 574 1HB SER 70 HB2 SER 70 -11.421 -7.718 -0.095 575 2HB SER 70 HB1 SER 70 -10.014 -8.659 0.398 576 HG SER 70 HG SER 70 -11.826 -9.443 -1.237 577 H ASP 71 HN ASP 71 -12.867 -6.490 1.936 578 HA ASP 71 HA ASP 71 -15.518 -7.654 2.313 579 1HB ASP 71 HB2 ASP 71 -14.829 -5.805 3.772 580 2HB ASP 71 HB1 ASP 71 -14.600 -4.770 2.366 581 H ASP 72 HN ASP 72 -17.329 -7.073 0.996 582 HA ASP 72 HA ASP 72 -16.762 -7.066 -1.795 583 1HB ASP 72 HB2 ASP 72 -19.405 -6.708 -0.362 584 2HB ASP 72 HB1 ASP 72 -19.204 -7.106 -2.066 585 H GLY 73 HN GLY 73 -18.953 -5.448 -2.741 586 1HA GLY 73 HA2 GLY 73 -19.433 -3.313 -3.433 587 2HA GLY 73 HA1 GLY 73 -18.752 -2.746 -1.916 588 H GLU 74 HN GLU 74 -16.273 -2.974 -1.867 589 HA GLU 74 HA GLU 74 -15.116 -2.226 -4.466 590 1HB GLU 74 HB2 GLU 74 -14.498 -0.916 -1.803 591 2HB GLU 74 HB1 GLU 74 -13.756 -0.519 -3.346 592 1HG GLU 74 HG2 GLU 74 -15.893 0.271 -4.192 593 2HG GLU 74 HG1 GLU 74 -16.668 -0.167 -2.669 594 H VAL 75 HN VAL 75 -12.566 -1.825 -2.573 595 HA VAL 75 HA VAL 75 -12.146 -4.690 -2.114 596 HB VAL 75 HB VAL 75 -11.007 -4.420 -4.140 597 1HG1 VAL 75 HG11 VAL 75 -11.093 -2.036 -4.371 598 2HG1 VAL 75 HG12 VAL 75 -9.433 -2.578 -4.610 599 3HG1 VAL 75 HG13 VAL 75 -9.907 -1.827 -3.091 600 1HG2 VAL 75 HG21 VAL 75 -9.268 -5.523 -3.321 601 2HG2 VAL 75 HG22 VAL 75 -9.473 -4.761 -1.746 602 3HG2 VAL 75 HG23 VAL 75 -8.483 -3.981 -2.979 603 H TYR 76 HN TYR 76 -11.575 -5.071 -0.127 604 HA TYR 76 HA TYR 76 -9.991 -3.108 1.361 605 1HB TYR 76 HB2 TYR 76 -12.469 -4.424 2.482 606 2HB TYR 76 HB1 TYR 76 -11.449 -3.238 3.285 607 HD1 TYR 76 HD1 TYR 76 -11.666 -0.906 2.815 608 HD2 TYR 76 HD2 TYR 76 -14.007 -3.736 0.683 609 HE1 TYR 76 HE1 TYR 76 -13.109 0.912 2.013 610 HE2 TYR 76 HE2 TYR 76 -15.460 -1.927 -0.133 611 HH TYR 76 HH TYR 76 -14.677 1.217 -0.108 612 H TYR 77 HN TYR 77 -8.681 -4.020 2.975 613 HA TYR 77 HA TYR 77 -8.912 -6.900 3.347 614 1HB TYR 77 HB2 TYR 77 -6.785 -7.462 2.654 615 2HB TYR 77 HB1 TYR 77 -7.220 -6.236 1.481 616 HD1 TYR 77 HD1 TYR 77 -5.583 -4.709 0.947 617 HD2 TYR 77 HD2 TYR 77 -5.558 -6.421 4.846 618 HE1 TYR 77 HE1 TYR 77 -3.487 -3.530 1.451 619 HE2 TYR 77 HE2 TYR 77 -3.471 -5.234 5.360 620 HH TYR 77 HH TYR 77 -1.542 -4.261 4.087 621 H SER 78 HN SER 78 -8.531 -7.563 5.357 622 HA SER 78 HA SER 78 -6.990 -5.923 7.200 623 1HB SER 78 HB2 SER 78 -9.908 -6.583 7.691 624 2HB SER 78 HB1 SER 78 -8.823 -5.845 8.867 625 HG SER 78 HG SER 78 -10.308 -4.566 7.225 626 H GLU 79 HN GLU 79 -6.281 -7.083 9.061 627 HA GLU 79 HA GLU 79 -7.156 -9.774 9.508 628 1HB GLU 79 HB2 GLU 79 -5.130 -9.365 7.579 629 2HB GLU 79 HB1 GLU 79 -4.358 -10.075 8.991 630 1HG GLU 79 HG2 GLU 79 -6.709 -11.188 7.486 631 2HG GLU 79 HG1 GLU 79 -5.054 -11.796 7.454 632 H GLU 80 HN GLU 80 -6.627 -10.571 11.435 633 HA GLU 80 HA GLU 80 -6.127 -10.511 13.657 634 1HB GLU 80 HB2 GLU 80 -3.475 -9.981 12.341 635 2HB GLU 80 HB1 GLU 80 -3.627 -10.206 14.074 636 1HG GLU 80 HG2 GLU 80 -4.478 -12.436 13.749 637 2HG GLU 80 HG1 GLU 80 -4.466 -12.217 12.000 638 H ALA 81 HN ALA 81 -5.251 -9.323 15.500 639 HA ALA 81 HA ALA 81 -5.932 -6.530 15.351 640 1HB ALA 81 HB1 ALA 81 -5.243 -6.508 17.747 641 2HB ALA 81 HB2 ALA 81 -4.751 -8.194 17.588 642 3HB ALA 81 HB3 ALA 81 -6.446 -7.748 17.388 643 H LYS 82 HN LYS 82 -4.306 -6.420 13.554 644 HA LYS 82 HA LYS 82 -1.754 -5.480 14.590 645 1HB LYS 82 HB2 LYS 82 -2.070 -7.354 12.242 646 2HB LYS 82 HB1 LYS 82 -0.570 -6.574 12.720 647 1HG LYS 82 HG2 LYS 82 -0.615 -7.777 14.845 648 2HG LYS 82 HG1 LYS 82 -2.127 -8.555 14.370 649 1HD LYS 82 HD2 LYS 82 -0.207 -10.026 13.988 650 2HD LYS 82 HD1 LYS 82 -1.005 -9.602 12.473 651 1HE LYS 82 HE2 LYS 82 0.699 -7.885 12.067 652 2HE LYS 82 HE1 LYS 82 1.501 -8.330 13.572 653 1HZ LYS 82 HZ1 LYS 82 1.022 -10.409 11.556 654 2HZ LYS 82 HZ2 LYS 82 2.267 -10.279 12.694 655 3HZ LYS 82 HZ3 LYS 82 2.287 -9.311 11.307 656 H LYS 83 HN LYS 83 -3.867 -5.774 11.686 657 HA LYS 83 HA LYS 83 -3.803 -2.953 11.342 658 1HB LYS 83 HB2 LYS 83 -2.484 -2.742 9.352 659 2HB LYS 83 HB1 LYS 83 -1.512 -3.488 10.611 660 1HG LYS 83 HG2 LYS 83 -2.855 -4.957 8.351 661 2HG LYS 83 HG1 LYS 83 -1.152 -4.509 8.416 662 1HD LYS 83 HD2 LYS 83 -0.936 -5.870 10.490 663 2HD LYS 83 HD1 LYS 83 -2.603 -6.403 10.259 664 1HE LYS 83 HE2 LYS 83 -1.021 -8.049 9.395 665 2HE LYS 83 HE1 LYS 83 -2.012 -7.369 8.104 666 1HZ LYS 83 HZ1 LYS 83 0.474 -7.600 7.690 667 2HZ LYS 83 HZ2 LYS 83 0.662 -6.277 8.726 668 3HZ LYS 83 HZ3 LYS 83 -0.239 -6.114 7.305 669 H LYS 84 HN LYS 84 -5.528 -2.319 10.377 670 HA LYS 84 HA LYS 84 -7.019 -4.168 8.646 671 1HB LYS 84 HB2 LYS 84 -8.962 -2.743 9.076 672 2HB LYS 84 HB1 LYS 84 -8.256 -3.274 10.596 673 1HG LYS 84 HG2 LYS 84 -7.134 -1.103 10.816 674 2HG LYS 84 HG1 LYS 84 -7.891 -0.575 9.312 675 1HD LYS 84 HD2 LYS 84 -10.101 -0.886 10.320 676 2HD LYS 84 HD1 LYS 84 -9.341 -1.408 11.825 677 1HE LYS 84 HE2 LYS 84 -8.261 0.777 12.034 678 2HE LYS 84 HE1 LYS 84 -9.016 1.296 10.527 679 1HZ LYS 84 HZ1 LYS 84 -10.190 0.961 13.176 680 2HZ LYS 84 HZ2 LYS 84 -11.165 0.562 11.853 681 3HZ LYS 84 HZ3 LYS 84 -10.517 2.118 11.986 682 H VAL 85 HN VAL 85 -7.567 -3.487 6.519 683 HA VAL 85 HA VAL 85 -6.530 -0.863 5.719 684 HB VAL 85 HB VAL 85 -5.775 -3.441 4.354 685 1HG1 VAL 85 HG11 VAL 85 -5.447 -2.205 2.541 686 2HG1 VAL 85 HG12 VAL 85 -4.183 -1.350 3.426 687 3HG1 VAL 85 HG13 VAL 85 -5.830 -0.724 3.413 688 1HG2 VAL 85 HG21 VAL 85 -3.443 -2.393 5.033 689 2HG2 VAL 85 HG22 VAL 85 -4.355 -3.419 6.139 690 3HG2 VAL 85 HG23 VAL 85 -4.418 -1.667 6.306 691 H GLU 86 HN GLU 86 -7.481 0.113 4.034 692 HA GLU 86 HA GLU 86 -9.785 -1.245 2.794 693 1HB GLU 86 HB2 GLU 86 -9.479 1.739 3.093 694 2HB GLU 86 HB1 GLU 86 -10.943 0.829 2.759 695 1HG GLU 86 HG2 GLU 86 -9.421 0.796 5.356 696 2HG GLU 86 HG1 GLU 86 -10.889 1.717 5.039 697 H VAL 87 HN VAL 87 -9.570 -1.562 0.636 698 HA VAL 87 HA VAL 87 -7.466 -0.089 -0.764 699 HB VAL 87 HB VAL 87 -8.978 -2.488 -1.772 700 1HG1 VAL 87 HG11 VAL 87 -7.824 -2.250 -3.650 701 2HG1 VAL 87 HG12 VAL 87 -6.310 -2.218 -2.755 702 3HG1 VAL 87 HG13 VAL 87 -7.201 -0.722 -3.034 703 1HG2 VAL 87 HG21 VAL 87 -6.364 -3.220 -1.071 704 2HG2 VAL 87 HG22 VAL 87 -7.874 -3.746 -0.326 705 3HG2 VAL 87 HG23 VAL 87 -7.023 -2.337 0.307 706 H LEU 88 HN LEU 88 -7.940 1.551 -1.983 707 HA LEU 88 HA LEU 88 -10.692 1.964 -2.900 708 1HB LEU 88 HB2 LEU 88 -8.384 3.896 -2.733 709 2HB LEU 88 HB1 LEU 88 -10.031 4.307 -3.164 710 HG LEU 88 HG LEU 88 -9.085 3.310 -0.478 711 1HD1 LEU 88 HD11 LEU 88 -8.883 5.825 -1.519 712 2HD1 LEU 88 HD12 LEU 88 -8.990 5.440 0.199 713 3HD1 LEU 88 HD13 LEU 88 -10.442 5.892 -0.694 714 1HD2 LEU 88 HD21 LEU 88 -11.591 4.201 -0.062 715 2HD2 LEU 88 HD22 LEU 88 -11.193 2.513 -0.379 716 3HD2 LEU 88 HD23 LEU 88 -11.761 3.545 -1.691 717 H ASP 89 HN ASP 89 -10.428 3.707 -4.906 718 HA ASP 89 HA ASP 89 -10.207 3.897 -7.143 719 1HB ASP 89 HB2 ASP 89 -7.769 4.061 -6.362 720 2HB ASP 89 HB1 ASP 89 -7.600 2.412 -6.944 721 H THR 90 HN THR 90 -8.405 1.520 -8.419 722 HA THR 90 HA THR 90 -10.596 -0.430 -8.464 723 HB THR 90 HB THR 90 -9.075 0.598 -10.864 724 HG1 THR 90 HG1 THR 90 -10.595 2.051 -10.703 725 1HG2 THR 90 HG21 THR 90 -11.286 -1.434 -10.719 726 2HG2 THR 90 HG22 THR 90 -9.609 -1.737 -11.171 727 3HG2 THR 90 HG23 THR 90 -10.631 -0.731 -12.198 728 H ASP 91 HN ASP 91 -9.641 -2.051 -7.362 729 HA ASP 91 HA ASP 91 -6.916 -2.842 -8.069 730 1HB ASP 91 HB2 ASP 91 -7.536 -2.628 -5.668 731 2HB ASP 91 HB1 ASP 91 -8.723 -3.910 -5.885 732 H TYR 92 HN TYR 92 -9.070 -3.209 -9.944 733 HA TYR 92 HA TYR 92 -8.800 -6.082 -10.371 734 1HB TYR 92 HB2 TYR 92 -11.501 -4.764 -10.675 735 2HB TYR 92 HB1 TYR 92 -11.122 -6.476 -10.750 736 HD1 TYR 92 HD1 TYR 92 -10.756 -3.667 -8.299 737 HD2 TYR 92 HD2 TYR 92 -11.818 -7.730 -8.964 738 HE1 TYR 92 HE1 TYR 92 -11.376 -3.886 -5.933 739 HE2 TYR 92 HE2 TYR 92 -12.438 -7.963 -6.599 740 HH TYR 92 HH TYR 92 -11.988 -6.912 -4.465 741 H LYS 93 HN LYS 93 -7.655 -3.691 -11.602 742 HA LYS 93 HA LYS 93 -8.434 -4.254 -14.348 743 1HB LYS 93 HB2 LYS 93 -8.780 -1.604 -13.009 744 2HB LYS 93 HB1 LYS 93 -8.312 -1.638 -14.701 745 1HG LYS 93 HG2 LYS 93 -10.757 -2.986 -13.571 746 2HG LYS 93 HG1 LYS 93 -10.737 -1.413 -14.373 747 1HD LYS 93 HD2 LYS 93 -9.805 -2.496 -16.391 748 2HD LYS 93 HD1 LYS 93 -9.955 -4.060 -15.590 749 1HE LYS 93 HE2 LYS 93 -12.368 -3.741 -15.413 750 2HE LYS 93 HE1 LYS 93 -12.221 -2.165 -16.190 751 1HZ LYS 93 HZ1 LYS 93 -11.870 -3.092 -18.220 752 2HZ LYS 93 HZ2 LYS 93 -12.819 -4.320 -17.548 753 3HZ LYS 93 HZ3 LYS 93 -11.137 -4.487 -17.602 754 H SER 94 HN SER 94 -6.662 -1.331 -13.844 755 HA SER 94 HA SER 94 -4.139 -2.780 -14.251 756 1HB SER 94 HB2 SER 94 -3.440 -1.041 -15.872 757 2HB SER 94 HB1 SER 94 -4.847 -1.950 -16.421 758 HG SER 94 HG SER 94 -4.621 0.664 -16.128 759 H TYR 95 HN TYR 95 -5.805 -0.199 -12.692 760 HA TYR 95 HA TYR 95 -3.354 0.428 -11.228 761 1HB TYR 95 HB2 TYR 95 -3.808 2.841 -11.365 762 2HB TYR 95 HB1 TYR 95 -3.524 2.145 -12.956 763 HD1 TYR 95 HD1 TYR 95 -5.027 2.566 -14.673 764 HD2 TYR 95 HD2 TYR 95 -6.311 3.078 -10.649 765 HE1 TYR 95 HE1 TYR 95 -7.157 3.495 -15.476 766 HE2 TYR 95 HE2 TYR 95 -8.447 4.006 -11.444 767 HH TYR 95 HH TYR 95 -9.530 3.700 -14.570 768 H ALA 96 HN ALA 96 -3.656 0.704 -9.082 769 HA ALA 96 HA ALA 96 -6.354 1.159 -8.046 770 1HB ALA 96 HB1 ALA 96 -5.102 -0.906 -6.487 771 2HB ALA 96 HB2 ALA 96 -5.219 -1.403 -8.175 772 3HB ALA 96 HB3 ALA 96 -6.667 -0.916 -7.297 773 H VAL 97 HN VAL 97 -6.425 1.887 -5.899 774 HA VAL 97 HA VAL 97 -3.833 2.639 -4.743 775 HB VAL 97 HB VAL 97 -4.549 4.799 -4.174 776 1HG1 VAL 97 HG11 VAL 97 -4.151 5.386 -6.283 777 2HG1 VAL 97 HG12 VAL 97 -5.894 5.361 -6.534 778 3HG1 VAL 97 HG13 VAL 97 -4.932 3.934 -6.908 779 1HG2 VAL 97 HG21 VAL 97 -7.289 3.715 -4.537 780 2HG2 VAL 97 HG22 VAL 97 -7.034 5.433 -4.848 781 3HG2 VAL 97 HG23 VAL 97 -6.642 4.751 -3.270 782 H ILE 98 HN ILE 98 -3.589 1.925 -2.740 783 HA ILE 98 HA ILE 98 -5.983 1.351 -1.139 784 HB ILE 98 HB ILE 98 -5.333 -0.742 -2.068 785 1HG1 ILE 98 HG12 ILE 98 -5.868 -0.639 0.408 786 2HG1 ILE 98 HG11 ILE 98 -4.986 -2.066 -0.128 787 1HG2 ILE 98 HG21 ILE 98 -2.546 -0.024 -1.226 788 2HG2 ILE 98 HG22 ILE 98 -3.148 -0.355 -2.851 789 3HG2 ILE 98 HG23 ILE 98 -3.026 -1.659 -1.671 790 1HD1 ILE 98 HD11 ILE 98 -4.242 -0.034 1.789 791 2HD1 ILE 98 HD12 ILE 98 -2.992 -0.294 0.576 792 3HD1 ILE 98 HD13 ILE 98 -3.583 -1.646 1.537 793 H TYR 99 HN TYR 99 -5.900 2.213 0.824 794 HA TYR 99 HA TYR 99 -3.271 3.016 1.850 795 1HB TYR 99 HB2 TYR 99 -4.369 4.701 3.169 796 2HB TYR 99 HB1 TYR 99 -4.964 4.832 1.520 797 HD1 TYR 99 HD1 TYR 99 -7.248 4.986 1.162 798 HD2 TYR 99 HD2 TYR 99 -5.854 3.264 4.795 799 HE1 TYR 99 HE1 TYR 99 -9.560 4.882 1.997 800 HE2 TYR 99 HE2 TYR 99 -8.162 3.148 5.634 801 HH TYR 99 HH TYR 99 -10.387 4.519 5.098 802 H ALA 100 HN ALA 100 -2.454 1.957 3.519 803 HA ALA 100 HA ALA 100 -4.163 0.036 4.911 804 1HB ALA 100 HB1 ALA 100 -1.865 -0.770 5.766 805 2HB ALA 100 HB2 ALA 100 -1.212 0.253 4.486 806 3HB ALA 100 HB3 ALA 100 -2.305 -1.071 4.085 807 H THR 101 HN THR 101 -4.494 0.017 7.068 808 HA THR 101 HA THR 101 -3.250 2.140 8.680 809 HB THR 101 HB THR 101 -5.388 2.372 9.902 810 HG1 THR 101 HG1 THR 101 -6.336 0.581 7.923 811 1HG2 THR 101 HG21 THR 101 -6.456 3.769 8.434 812 2HG2 THR 101 HG22 THR 101 -6.142 2.728 7.045 813 3HG2 THR 101 HG23 THR 101 -4.838 3.694 7.735 814 H ARG 102 HN ARG 102 -2.290 1.404 10.486 815 HA ARG 102 HA ARG 102 -2.418 -1.410 11.059 816 1HB ARG 102 HB2 ARG 102 -0.330 0.043 11.172 817 2HB ARG 102 HB1 ARG 102 -0.969 0.667 12.685 818 1HG ARG 102 HG2 ARG 102 -0.932 -1.535 13.664 819 2HG ARG 102 HG1 ARG 102 -0.415 -2.235 12.129 820 1HD ARG 102 HD2 ARG 102 1.638 -0.858 12.244 821 2HD ARG 102 HD1 ARG 102 1.129 -0.289 13.834 822 HE ARG 102 HE ARG 102 1.126 -3.072 13.895 823 1HH1 ARG 102 HH11 ARG 102 3.422 -0.471 13.537 824 2HH1 ARG 102 HH12 ARG 102 4.731 -1.364 14.236 825 1HH2 ARG 102 HH21 ARG 102 2.844 -4.248 14.814 826 2HH2 ARG 102 HH22 ARG 102 4.404 -3.509 14.961 827 H VAL 103 HN VAL 103 -3.153 -2.397 12.899 828 HA VAL 103 HA VAL 103 -4.480 -0.852 14.966 829 HB VAL 103 HB VAL 103 -6.565 -2.166 14.825 830 1HG1 VAL 103 HG11 VAL 103 -7.518 -1.031 12.854 831 2HG1 VAL 103 HG12 VAL 103 -5.887 -0.595 12.344 832 3HG1 VAL 103 HG13 VAL 103 -6.539 0.043 13.853 833 1HG2 VAL 103 HG21 VAL 103 -5.057 -3.576 12.789 834 2HG2 VAL 103 HG22 VAL 103 -6.644 -3.073 12.209 835 3HG2 VAL 103 HG23 VAL 103 -6.510 -4.064 13.660 836 H LYS 104 HN LYS 104 -3.543 -1.643 16.707 837 HA LYS 104 HA LYS 104 -3.779 -4.420 17.388 838 1HB LYS 104 HB2 LYS 104 -1.317 -4.729 17.754 839 2HB LYS 104 HB1 LYS 104 -1.798 -4.642 16.069 840 1HG LYS 104 HG2 LYS 104 -1.058 -2.333 15.950 841 2HG LYS 104 HG1 LYS 104 -0.617 -2.376 17.657 842 1HD LYS 104 HD2 LYS 104 0.572 -4.135 15.513 843 2HD LYS 104 HD1 LYS 104 1.325 -2.677 16.162 844 1HE LYS 104 HE2 LYS 104 1.328 -3.699 18.399 845 2HE LYS 104 HE1 LYS 104 0.622 -5.163 17.719 846 1HZ LYS 104 HZ1 LYS 104 3.030 -5.333 17.998 847 2HZ LYS 104 HZ2 LYS 104 3.255 -4.026 16.949 848 3HZ LYS 104 HZ3 LYS 104 2.584 -5.467 16.372 849 H ASP 105 HN ASP 105 -3.497 -4.794 19.587 850 HA ASP 105 HA ASP 105 -3.826 -4.186 21.765 851 1HB ASP 105 HB2 ASP 105 -1.908 -3.015 22.779 852 2HB ASP 105 HB1 ASP 105 -1.393 -4.296 21.688 853 H GLY 106 HN GLY 106 -5.273 -2.586 19.874 854 1HA GLY 106 HA2 GLY 106 -6.670 -0.771 19.937 855 2HA GLY 106 HA1 GLY 106 -6.168 -0.531 21.602 856 H ARG 107 HN ARG 107 -4.453 -0.311 18.461 857 HA ARG 107 HA ARG 107 -4.039 2.535 18.940 858 1HB ARG 107 HB2 ARG 107 -1.704 2.509 18.862 859 2HB ARG 107 HB1 ARG 107 -2.103 1.173 19.926 860 1HG ARG 107 HG2 ARG 107 -1.838 -0.332 17.904 861 2HG ARG 107 HG1 ARG 107 -1.136 1.066 17.088 862 1HD ARG 107 HD2 ARG 107 0.454 1.253 19.040 863 2HD ARG 107 HD1 ARG 107 -0.134 -0.322 19.565 864 HE ARG 107 HE ARG 107 0.719 -0.437 16.872 865 1HH1 ARG 107 HH11 ARG 107 1.926 -0.276 20.141 866 2HH1 ARG 107 HH12 ARG 107 3.456 -0.986 19.748 867 1HH2 ARG 107 HH21 ARG 107 2.739 -1.359 16.346 868 2HH2 ARG 107 HH22 ARG 107 3.918 -1.603 17.591 869 H THR 108 HN THR 108 -4.088 3.714 17.117 870 HA THR 108 HA THR 108 -4.335 2.227 14.596 871 HB THR 108 HB THR 108 -5.446 4.928 15.370 872 HG1 THR 108 HG1 THR 108 -6.635 2.376 15.079 873 1HG2 THR 108 HG21 THR 108 -6.060 3.321 12.907 874 2HG2 THR 108 HG22 THR 108 -4.989 4.722 12.942 875 3HG2 THR 108 HG23 THR 108 -6.697 4.905 13.343 876 H LEU 109 HN LEU 109 -3.359 2.887 12.742 877 HA LEU 109 HA LEU 109 -1.479 5.138 12.832 878 1HB LEU 109 HB2 LEU 109 -0.830 2.354 11.858 879 2HB LEU 109 HB1 LEU 109 0.173 3.758 11.570 880 HG LEU 109 HG LEU 109 0.478 3.993 14.027 881 1HD1 LEU 109 HD11 LEU 109 -0.092 1.446 14.959 882 2HD1 LEU 109 HD12 LEU 109 -1.525 1.904 14.040 883 3HD1 LEU 109 HD13 LEU 109 -0.956 2.932 15.353 884 1HD2 LEU 109 HD21 LEU 109 1.294 1.366 12.794 885 2HD2 LEU 109 HD22 LEU 109 2.020 2.087 14.231 886 3HD2 LEU 109 HD23 LEU 109 2.157 2.898 12.670 887 H HIS 110 HN HIS 110 -1.285 6.222 10.842 888 HA HIS 110 HA HIS 110 -3.192 5.262 8.811 889 1HB HIS 110 HB2 HIS 110 -2.126 8.040 9.318 890 2HB HIS 110 HB1 HIS 110 -3.228 7.606 8.012 891 HD1 HIS 110 HD1 HIS 110 -4.435 9.613 9.679 892 HD2 HIS 110 HD2 HIS 110 -4.523 5.625 10.821 893 HE1 HIS 110 HE1 HIS 110 -6.345 9.425 11.302 894 HE2 HIS 110 HE2 HIS 110 -6.319 7.020 12.052 895 H MET 111 HN MET 111 -2.569 4.738 6.816 896 HA MET 111 HA MET 111 -0.156 5.783 5.681 897 1HB MET 111 HB2 MET 111 0.803 3.982 7.004 898 2HB MET 111 HB1 MET 111 -0.319 2.830 6.290 899 1HG MET 111 HG2 MET 111 0.696 3.178 4.104 900 2HG MET 111 HG1 MET 111 1.802 4.361 4.795 901 1HE MET 111 HE1 MET 111 1.367 0.388 6.624 902 2HE MET 111 HE2 MET 111 1.532 -0.024 4.917 903 3HE MET 111 HE3 MET 111 0.269 1.091 5.438 904 H MET 112 HN MET 112 -0.201 5.836 3.541 905 HA MET 112 HA MET 112 -2.469 4.561 2.176 906 1HB MET 112 HB2 MET 112 -0.972 7.108 1.691 907 2HB MET 112 HB1 MET 112 -1.844 6.336 0.381 908 1HG MET 112 HG2 MET 112 -3.913 6.488 1.684 909 2HG MET 112 HG1 MET 112 -3.023 7.300 2.973 910 1HE MET 112 HE1 MET 112 -4.940 10.185 2.013 911 2HE MET 112 HE2 MET 112 -5.218 8.514 2.507 912 3HE MET 112 HE3 MET 112 -5.667 9.045 0.884 913 H ARG 113 HN ARG 113 -2.118 3.722 0.031 914 HA ARG 113 HA ARG 113 0.590 3.415 -0.898 915 1HB ARG 113 HB2 ARG 113 0.463 1.607 0.741 916 2HB ARG 113 HB1 ARG 113 -0.988 0.987 -0.033 917 1HG ARG 113 HG2 ARG 113 0.227 0.376 -1.989 918 2HG ARG 113 HG1 ARG 113 1.673 1.199 -1.410 919 1HD ARG 113 HD2 ARG 113 0.373 -1.202 -0.130 920 2HD ARG 113 HD1 ARG 113 1.835 -1.225 -1.114 921 HE ARG 113 HE ARG 113 2.156 0.566 1.042 922 1HH1 ARG 113 HH11 ARG 113 1.999 -2.847 0.336 923 2HH1 ARG 113 HH12 ARG 113 2.983 -3.301 1.687 924 1HH2 ARG 113 HH21 ARG 113 3.453 -0.024 2.818 925 2HH2 ARG 113 HH22 ARG 113 3.810 -1.695 3.100 926 H LEU 114 HN LEU 114 0.734 2.935 -3.065 927 HA LEU 114 HA LEU 114 -1.834 2.656 -4.489 928 1HB LEU 114 HB2 LEU 114 -0.813 4.919 -4.632 929 2HB LEU 114 HB1 LEU 114 0.604 4.208 -5.374 930 HG LEU 114 HG LEU 114 -2.169 4.147 -6.576 931 1HD1 LEU 114 HD11 LEU 114 -0.944 6.413 -6.318 932 2HD1 LEU 114 HD12 LEU 114 -1.617 5.974 -7.887 933 3HD1 LEU 114 HD13 LEU 114 0.112 5.796 -7.589 934 1HD2 LEU 114 HD21 LEU 114 -1.095 2.383 -7.589 935 2HD2 LEU 114 HD22 LEU 114 0.498 3.126 -7.440 936 3HD2 LEU 114 HD23 LEU 114 -0.640 3.714 -8.652 937 H TYR 115 HN TYR 115 -1.965 0.758 -5.481 938 HA TYR 115 HA TYR 115 0.503 -0.570 -6.352 939 1HB TYR 115 HB2 TYR 115 -2.257 -1.621 -5.751 940 2HB TYR 115 HB1 TYR 115 -1.044 -2.588 -6.581 941 HD1 TYR 115 HD1 TYR 115 -2.511 -2.245 -3.551 942 HD2 TYR 115 HD2 TYR 115 1.394 -2.252 -5.237 943 HE1 TYR 115 HE1 TYR 115 -1.580 -2.941 -1.382 944 HE2 TYR 115 HE2 TYR 115 2.334 -2.948 -3.075 945 HH TYR 115 HH TYR 115 1.387 -4.227 -0.980 946 H SER 116 HN SER 116 1.023 -0.332 -8.416 947 HA SER 116 HA SER 116 -1.151 -0.054 -10.381 948 1HB SER 116 HB2 SER 116 0.484 1.078 -11.835 949 2HB SER 116 HB1 SER 116 0.332 1.905 -10.285 950 HG SER 116 HG SER 116 2.427 0.256 -11.211 951 H ARG 117 HN ARG 117 -1.373 -1.538 -11.931 952 HA ARG 117 HA ARG 117 -0.067 -4.010 -11.786 953 1HB ARG 117 HB2 ARG 117 -1.841 -2.734 -13.841 954 2HB ARG 117 HB1 ARG 117 -1.135 -4.318 -14.123 955 1HG ARG 117 HG2 ARG 117 -3.464 -4.313 -13.201 956 2HG ARG 117 HG1 ARG 117 -2.292 -5.264 -12.292 957 1HD ARG 117 HD2 ARG 117 -2.073 -3.485 -10.659 958 2HD ARG 117 HD1 ARG 117 -3.155 -2.459 -11.596 959 HE ARG 117 HE ARG 117 -4.888 -3.496 -10.559 960 1HH1 ARG 117 HH11 ARG 117 -2.158 -5.671 -10.502 961 2HH1 ARG 117 HH12 ARG 117 -3.013 -6.920 -9.665 962 1HH2 ARG 117 HH21 ARG 117 -6.006 -5.128 -9.440 963 2HH2 ARG 117 HH22 ARG 117 -5.195 -6.608 -9.050 964 H SER 118 HN SER 118 0.428 -1.274 -13.974 965 HA SER 118 HA SER 118 2.994 -2.486 -14.752 966 1HB SER 118 HB2 SER 118 1.076 -1.041 -16.599 967 2HB SER 118 HB1 SER 118 2.686 -1.610 -17.040 968 HG SER 118 HG SER 118 1.451 -3.260 -17.648 969 HA PRO 119 HA PRO 119 5.201 1.175 -13.720 970 1HB PRO 119 HB2 PRO 119 6.143 1.797 -16.348 971 2HB PRO 119 HB1 PRO 119 7.021 0.991 -15.048 972 1HG PRO 119 HG2 PRO 119 5.610 -0.170 -17.373 973 2HG PRO 119 HG1 PRO 119 6.970 -0.818 -16.441 974 1HD PRO 119 HD2 PRO 119 4.495 -1.845 -16.233 975 2HD PRO 119 HD1 PRO 119 5.584 -1.747 -14.831 976 H GLU 120 HN GLU 120 3.377 1.316 -16.759 977 HA GLU 120 HA GLU 120 2.988 4.153 -16.641 978 1HB GLU 120 HB2 GLU 120 1.539 2.049 -18.262 979 2HB GLU 120 HB1 GLU 120 1.432 3.786 -18.515 980 1HG GLU 120 HG2 GLU 120 3.915 2.112 -18.809 981 2HG GLU 120 HG1 GLU 120 2.919 2.731 -20.126 982 H VAL 121 HN VAL 121 1.414 5.253 -15.602 983 HA VAL 121 HA VAL 121 -0.845 3.697 -14.524 984 HB VAL 121 HB VAL 121 0.587 5.970 -13.139 985 1HG1 VAL 121 HG11 VAL 121 -0.913 5.118 -11.207 986 2HG1 VAL 121 HG12 VAL 121 -1.906 4.440 -12.498 987 3HG1 VAL 121 HG13 VAL 121 -1.614 6.178 -12.431 988 1HG2 VAL 121 HG21 VAL 121 1.961 4.064 -12.961 989 2HG2 VAL 121 HG22 VAL 121 0.581 2.996 -12.708 990 3HG2 VAL 121 HG23 VAL 121 1.059 4.133 -11.448 991 H SER 122 HN SER 122 -2.815 4.461 -14.902 992 HA SER 122 HA SER 122 -3.266 6.544 -16.727 993 1HB SER 122 HB2 SER 122 -4.847 4.678 -16.378 994 2HB SER 122 HB1 SER 122 -5.214 5.297 -14.767 995 HG SER 122 HG SER 122 -5.958 7.225 -15.810 996 HA PRO 123 HA PRO 123 -3.080 10.293 -14.400 997 1HB PRO 123 HB2 PRO 123 -5.427 11.471 -15.381 998 2HB PRO 123 HB1 PRO 123 -3.819 11.613 -16.097 999 1HG PRO 123 HG2 PRO 123 -6.070 9.802 -16.830 1000 2HG PRO 123 HG1 PRO 123 -4.889 10.608 -17.878 1001 1HD PRO 123 HD2 PRO 123 -4.688 8.002 -17.324 1002 2HD PRO 123 HD1 PRO 123 -3.240 9.025 -17.440 1003 H ALA 124 HN ALA 124 -6.198 8.633 -14.611 1004 HA ALA 124 HA ALA 124 -7.451 9.873 -12.428 1005 1HB ALA 124 HB1 ALA 124 -9.135 8.298 -12.655 1006 2HB ALA 124 HB2 ALA 124 -8.022 7.032 -13.170 1007 3HB ALA 124 HB3 ALA 124 -8.437 8.343 -14.273 1008 H ALA 125 HN ALA 125 -5.691 6.788 -12.627 1009 HA ALA 125 HA ALA 125 -6.016 5.936 -10.031 1010 1HB ALA 125 HB1 ALA 125 -4.597 5.071 -12.197 1011 2HB ALA 125 HB2 ALA 125 -4.597 4.322 -10.601 1012 3HB ALA 125 HB3 ALA 125 -3.324 5.459 -11.039 1013 H THR 126 HN THR 126 -3.374 7.967 -11.287 1014 HA THR 126 HA THR 126 -2.249 8.377 -8.683 1015 HB THR 126 HB THR 126 -0.750 9.964 -9.821 1016 HG1 THR 126 HG1 THR 126 -1.541 10.918 -11.504 1017 1HG2 THR 126 HG21 THR 126 -1.066 7.202 -10.607 1018 2HG2 THR 126 HG22 THR 126 0.401 8.129 -10.289 1019 3HG2 THR 126 HG23 THR 126 -0.345 8.175 -11.887 1020 H ALA 127 HN ALA 127 -4.125 10.398 -10.926 1021 HA ALA 127 HA ALA 127 -4.121 12.675 -9.241 1022 1HB ALA 127 HB1 ALA 127 -6.214 12.164 -11.320 1023 2HB ALA 127 HB2 ALA 127 -4.556 12.587 -11.750 1024 3HB ALA 127 HB3 ALA 127 -5.526 13.700 -10.789 1025 H ILE 128 HN ILE 128 -6.557 10.128 -9.774 1026 HA ILE 128 HA ILE 128 -8.479 11.290 -8.102 1027 HB ILE 128 HB ILE 128 -8.172 8.389 -8.868 1028 1HG1 ILE 128 HG12 ILE 128 -9.737 10.724 -9.956 1029 2HG1 ILE 128 HG11 ILE 128 -8.649 9.640 -10.811 1030 1HG2 ILE 128 HG21 ILE 128 -9.423 8.584 -6.775 1031 2HG2 ILE 128 HG22 ILE 128 -10.480 8.099 -8.101 1032 3HG2 ILE 128 HG23 ILE 128 -10.498 9.765 -7.523 1033 1HD1 ILE 128 HD11 ILE 128 -10.635 8.842 -11.553 1034 2HD1 ILE 128 HD12 ILE 128 -11.494 9.287 -10.080 1035 3HD1 ILE 128 HD13 ILE 128 -10.467 7.855 -10.103 1036 H PHE 129 HN PHE 129 -5.920 8.901 -7.370 1037 HA PHE 129 HA PHE 129 -6.733 8.422 -4.728 1038 1HB PHE 129 HB2 PHE 129 -4.900 7.177 -5.964 1039 2HB PHE 129 HB1 PHE 129 -3.850 8.548 -5.633 1040 HD1 PHE 129 HD1 PHE 129 -6.392 7.046 -3.387 1041 HD2 PHE 129 HD2 PHE 129 -2.250 7.618 -4.188 1042 HE1 PHE 129 HE1 PHE 129 -5.838 6.108 -1.182 1043 HE2 PHE 129 HE2 PHE 129 -1.691 6.679 -1.981 1044 HZ PHE 129 HZ PHE 129 -3.489 5.924 -0.477 1045 H ARG 130 HN ARG 130 -4.602 10.857 -6.120 1046 HA ARG 130 HA ARG 130 -4.045 12.230 -3.698 1047 1HB ARG 130 HB2 ARG 130 -2.617 12.504 -5.667 1048 2HB ARG 130 HB1 ARG 130 -3.969 13.151 -6.584 1049 1HG ARG 130 HG2 ARG 130 -4.046 15.099 -5.123 1050 2HG ARG 130 HG1 ARG 130 -2.701 14.452 -4.179 1051 1HD ARG 130 HD2 ARG 130 -1.261 14.553 -6.148 1052 2HD ARG 130 HD1 ARG 130 -2.611 15.149 -7.113 1053 HE ARG 130 HE ARG 130 -2.258 16.870 -4.940 1054 1HH1 ARG 130 HH11 ARG 130 -0.583 15.897 -7.841 1055 2HH1 ARG 130 HH12 ARG 130 0.225 17.416 -8.033 1056 1HH2 ARG 130 HH21 ARG 130 -1.196 18.871 -5.193 1057 2HH2 ARG 130 HH22 ARG 130 -0.122 19.103 -6.531 1058 H LYS 131 HN LYS 131 -6.509 12.389 -6.173 1059 HA LYS 131 HA LYS 131 -7.794 14.777 -5.518 1060 1HB LYS 131 HB2 LYS 131 -8.329 13.550 -7.541 1061 2HB LYS 131 HB1 LYS 131 -8.895 12.184 -6.602 1062 1HG LYS 131 HG2 LYS 131 -10.799 13.407 -5.833 1063 2HG LYS 131 HG1 LYS 131 -10.196 14.891 -6.574 1064 1HD LYS 131 HD2 LYS 131 -10.479 13.997 -8.772 1065 2HD LYS 131 HD1 LYS 131 -10.833 12.390 -8.135 1066 1HE LYS 131 HE2 LYS 131 -12.894 13.228 -7.140 1067 2HE LYS 131 HE1 LYS 131 -12.525 14.854 -7.717 1068 1HZ LYS 131 HZ1 LYS 131 -13.250 12.468 -9.306 1069 2HZ LYS 131 HZ2 LYS 131 -12.501 13.810 -10.014 1070 3HZ LYS 131 HZ3 LYS 131 -14.011 13.979 -9.270 1071 H LEU 132 HN LEU 132 -8.209 11.495 -4.259 1072 HA LEU 132 HA LEU 132 -10.349 11.977 -2.518 1073 1HB LEU 132 HB2 LEU 132 -8.030 10.061 -2.232 1074 2HB LEU 132 HB1 LEU 132 -9.470 10.026 -1.234 1075 HG LEU 132 HG LEU 132 -9.396 9.559 -4.218 1076 1HD1 LEU 132 HD11 LEU 132 -9.780 7.649 -1.919 1077 2HD1 LEU 132 HD12 LEU 132 -8.374 7.737 -2.980 1078 3HD1 LEU 132 HD13 LEU 132 -9.939 7.243 -3.627 1079 1HD2 LEU 132 HD21 LEU 132 -11.771 8.638 -3.516 1080 2HD2 LEU 132 HD22 LEU 132 -11.527 10.333 -3.938 1081 3HD2 LEU 132 HD23 LEU 132 -11.600 9.848 -2.244 1082 H ALA 133 HN ALA 133 -6.869 12.345 -2.151 1083 HA ALA 133 HA ALA 133 -6.973 13.207 0.576 1084 1HB ALA 133 HB1 ALA 133 -4.595 14.080 -0.079 1085 2HB ALA 133 HB2 ALA 133 -4.858 13.119 -1.534 1086 3HB ALA 133 HB3 ALA 133 -4.899 12.346 0.049 1087 H GLY 134 HN GLY 134 -7.025 14.747 -2.578 1088 1HA GLY 134 HA2 GLY 134 -6.572 17.398 -1.809 1089 2HA GLY 134 HA1 GLY 134 -7.496 16.900 -3.217 1090 H GLU 135 HN GLU 135 -9.593 15.544 -1.947 1091 HA GLU 135 HA GLU 135 -11.460 17.486 -1.487 1092 1HB GLU 135 HB2 GLU 135 -11.377 14.761 -0.174 1093 2HB GLU 135 HB1 GLU 135 -12.805 15.777 -0.323 1094 1HG GLU 135 HG2 GLU 135 -11.254 14.529 -2.581 1095 2HG GLU 135 HG1 GLU 135 -12.829 14.021 -1.977 1096 H ARG 136 HN ARG 136 -9.317 15.956 0.853 1097 HA ARG 136 HA ARG 136 -10.314 17.664 2.995 1098 1HB ARG 136 HB2 ARG 136 -8.199 15.500 3.051 1099 2HB ARG 136 HB1 ARG 136 -8.822 16.356 4.455 1100 1HG ARG 136 HG2 ARG 136 -10.423 14.568 2.635 1101 2HG ARG 136 HG1 ARG 136 -9.807 14.139 4.230 1102 1HD ARG 136 HD2 ARG 136 -11.160 15.931 5.223 1103 2HD ARG 136 HD1 ARG 136 -11.781 16.338 3.624 1104 HE ARG 136 HE ARG 136 -13.286 14.653 3.867 1105 1HH1 ARG 136 HH11 ARG 136 -10.580 13.981 5.971 1106 2HH1 ARG 136 HH12 ARG 136 -11.278 12.531 6.611 1107 1HH2 ARG 136 HH21 ARG 136 -14.205 12.747 4.716 1108 2HH2 ARG 136 HH22 ARG 136 -13.335 11.833 5.901 1109 H ASN 137 HN ASN 137 -9.048 18.994 0.857 1110 HA ASN 137 HA ASN 137 -7.329 20.387 0.291 1111 1HB ASN 137 HB2 ASN 137 -6.720 21.973 2.080 1112 2HB ASN 137 HB1 ASN 137 -8.456 21.699 2.000 1113 1HD2 ASN 137 HD21 ASN 137 -5.768 21.791 3.981 1114 2HD2 ASN 137 HD22 ASN 137 -6.447 21.044 5.384 1115 H TYR 138 HN TYR 138 -6.400 17.765 0.654 1116 HA TYR 138 HA TYR 138 -4.515 16.526 1.009 1117 1HB TYR 138 HB2 TYR 138 -3.677 18.263 -0.602 1118 2HB TYR 138 HB1 TYR 138 -3.094 19.186 0.780 1119 HD1 TYR 138 HD1 TYR 138 -2.641 16.095 -1.173 1120 HD2 TYR 138 HD2 TYR 138 -1.101 18.541 1.948 1121 HE1 TYR 138 HE1 TYR 138 -0.549 14.803 -1.202 1122 HE2 TYR 138 HE2 TYR 138 0.998 17.258 1.927 1123 HH TYR 138 HH TYR 138 1.336 14.312 0.562 1124 H THR 139 HN THR 139 -4.586 15.757 3.056 1125 HA THR 139 HA THR 139 -3.837 17.481 5.287 1126 HB THR 139 HB THR 139 -5.815 16.155 5.612 1127 HG1 THR 139 HG1 THR 139 -5.075 15.999 7.563 1128 1HG2 THR 139 HG21 THR 139 -5.567 14.364 4.084 1129 2HG2 THR 139 HG22 THR 139 -5.673 13.661 5.698 1130 3HG2 THR 139 HG23 THR 139 -4.109 13.788 4.893 1131 H ASP 140 HN ASP 140 -1.928 17.402 6.317 1132 HA ASP 140 HA ASP 140 0.226 15.865 5.327 1133 1HB ASP 140 HB2 ASP 140 1.439 16.588 7.358 1134 2HB ASP 140 HB1 ASP 140 0.642 17.937 6.560 1135 H GLU 141 HN GLU 141 -2.323 15.242 7.535 1136 HA GLU 141 HA GLU 141 -1.546 13.397 9.322 1137 1HB GLU 141 HB2 GLU 141 -3.882 14.061 8.978 1138 2HB GLU 141 HB1 GLU 141 -3.929 13.150 7.483 1139 1HG GLU 141 HG2 GLU 141 -3.489 11.084 8.772 1140 2HG GLU 141 HG1 GLU 141 -3.601 12.036 10.250 1141 H MET 142 HN MET 142 -1.540 12.964 5.858 1142 HA MET 142 HA MET 142 -0.058 10.487 6.178 1143 1HB MET 142 HB2 MET 142 -2.490 10.616 4.391 1144 2HB MET 142 HB1 MET 142 -1.429 9.234 4.636 1145 1HG MET 142 HG2 MET 142 -2.141 9.030 6.927 1146 2HG MET 142 HG1 MET 142 -3.135 10.478 6.772 1147 1HE MET 142 HE1 MET 142 -5.863 9.338 4.229 1148 2HE MET 142 HE2 MET 142 -4.322 10.099 3.834 1149 3HE MET 142 HE3 MET 142 -5.248 10.659 5.225 1150 H VAL 143 HN VAL 143 1.725 10.944 5.110 1151 HA VAL 143 HA VAL 143 1.539 11.903 2.357 1152 HB VAL 143 HB VAL 143 3.365 13.218 4.373 1153 1HG1 VAL 143 HG11 VAL 143 3.525 14.870 2.346 1154 2HG1 VAL 143 HG12 VAL 143 3.016 13.455 1.424 1155 3HG1 VAL 143 HG13 VAL 143 4.491 13.391 2.384 1156 1HG2 VAL 143 HG21 VAL 143 0.927 14.411 3.050 1157 2HG2 VAL 143 HG22 VAL 143 2.008 15.207 4.195 1158 3HG2 VAL 143 HG23 VAL 143 1.000 13.858 4.721 1159 H ALA 144 HN ALA 144 2.998 10.919 1.059 1160 HA ALA 144 HA ALA 144 5.610 10.186 1.850 1161 1HB ALA 144 HB1 ALA 144 3.640 8.279 2.545 1162 2HB ALA 144 HB2 ALA 144 5.394 8.136 2.666 1163 3HB ALA 144 HB3 ALA 144 4.570 7.626 1.197 1164 H MET 145 HN MET 145 6.886 9.840 0.055 1165 HA MET 145 HA MET 145 5.516 9.300 -2.485 1166 1HB MET 145 HB2 MET 145 7.535 11.498 -2.051 1167 2HB MET 145 HB1 MET 145 6.831 11.054 -3.598 1168 1HG MET 145 HG2 MET 145 4.627 11.707 -2.790 1169 2HG MET 145 HG1 MET 145 5.319 12.109 -1.219 1170 1HE MET 145 HE1 MET 145 5.621 12.631 -4.951 1171 2HE MET 145 HE2 MET 145 7.294 13.110 -4.663 1172 3HE MET 145 HE3 MET 145 6.104 14.313 -5.160 1173 H LEU 146 HN LEU 146 6.487 7.775 -3.656 1174 HA LEU 146 HA LEU 146 8.516 6.174 -2.878 1175 1HB LEU 146 HB2 LEU 146 7.039 5.918 -4.890 1176 2HB LEU 146 HB1 LEU 146 8.096 7.024 -5.745 1177 HG LEU 146 HG LEU 146 8.557 4.692 -6.321 1178 1HD1 LEU 146 HD11 LEU 146 10.364 6.590 -5.947 1179 2HD1 LEU 146 HD12 LEU 146 10.814 4.948 -6.407 1180 3HD1 LEU 146 HD13 LEU 146 10.934 5.456 -4.722 1181 1HD2 LEU 146 HD21 LEU 146 8.234 4.303 -3.538 1182 2HD2 LEU 146 HD22 LEU 146 9.881 3.833 -3.955 1183 3HD2 LEU 146 HD23 LEU 146 8.517 3.092 -4.789 1184 HA PRO 147 HA PRO 147 12.179 8.673 -2.541 1185 1HB PRO 147 HB2 PRO 147 13.871 6.531 -3.323 1186 2HB PRO 147 HB1 PRO 147 13.498 7.059 -1.683 1187 1HG PRO 147 HG2 PRO 147 12.313 4.851 -3.272 1188 2HG PRO 147 HG1 PRO 147 12.541 4.981 -1.521 1189 1HD PRO 147 HD2 PRO 147 10.124 5.244 -2.629 1190 2HD PRO 147 HD1 PRO 147 10.612 6.246 -1.242 1191 H ARG 148 HN ARG 148 13.086 10.005 -3.940 1192 HA ARG 148 HA ARG 148 12.810 9.495 -6.785 1193 1HB ARG 148 HB2 ARG 148 13.479 11.844 -7.040 1194 2HB ARG 148 HB1 ARG 148 12.141 11.668 -5.912 1195 1HG ARG 148 HG2 ARG 148 13.674 11.884 -4.036 1196 2HG ARG 148 HG1 ARG 148 15.032 12.017 -5.150 1197 1HD ARG 148 HD2 ARG 148 12.718 13.942 -4.942 1198 2HD ARG 148 HD1 ARG 148 14.339 14.203 -4.304 1199 HE ARG 148 HE ARG 148 15.076 14.693 -6.424 1200 1HH1 ARG 148 HH11 ARG 148 11.823 13.436 -6.590 1201 2HH1 ARG 148 HH12 ARG 148 11.664 13.729 -8.287 1202 1HH2 ARG 148 HH21 ARG 148 14.860 15.090 -8.654 1203 2HH2 ARG 148 HH22 ARG 148 13.384 14.671 -9.458 1204 H GLN 149 HN GLN 149 15.052 8.401 -4.800 1205 HA GLN 149 HA GLN 149 17.124 8.502 -6.829 1206 1HB GLN 149 HB2 GLN 149 17.558 9.621 -4.058 1207 2HB GLN 149 HB1 GLN 149 18.866 9.196 -5.151 1208 1HG GLN 149 HG2 GLN 149 16.739 11.248 -5.709 1209 2HG GLN 149 HG1 GLN 149 18.369 11.598 -5.136 1210 1HE2 GLN 149 HE21 GLN 149 16.549 11.733 -7.766 1211 2HE2 GLN 149 HE22 GLN 149 17.722 11.437 -8.999 1212 H GLU 150 HN GLU 150 18.641 6.837 -6.663 1213 HA GLU 150 HA GLU 150 17.765 4.512 -5.286 1214 1HB GLU 150 HB2 GLU 150 19.879 3.492 -6.106 1215 2HB GLU 150 HB1 GLU 150 18.927 4.251 -7.372 1216 1HG GLU 150 HG2 GLU 150 20.416 6.219 -7.265 1217 2HG GLU 150 HG1 GLU 150 21.395 5.374 -6.064 1218 H GLU 151 HN GLU 151 17.785 6.017 -3.235 1219 HA GLU 151 HA GLU 151 19.808 4.990 -1.491 1220 1HB GLU 151 HB2 GLU 151 19.705 7.982 -1.944 1221 2HB GLU 151 HB1 GLU 151 20.619 7.180 -0.676 1222 1HG GLU 151 HG2 GLU 151 21.954 6.043 -2.399 1223 2HG GLU 151 HG1 GLU 151 21.068 6.928 -3.638 1224 H CYS 152 HN CYS 152 19.107 4.927 0.587 1225 HA CYS 152 HA CYS 152 16.409 5.163 1.204 1226 1HB CYS 152 HB2 CYS 152 18.620 5.423 3.249 1227 2HB CYS 152 HB1 CYS 152 17.025 4.709 3.466 1228 H THR 153 HN THR 153 16.041 7.371 0.220 1229 HA THR 153 HA THR 153 15.984 9.381 2.317 1230 HB THR 153 HB THR 153 18.173 9.801 1.335 1231 HG1 THR 153 HG1 THR 153 17.152 11.662 1.915 1232 1HG2 THR 153 HG21 THR 153 17.215 8.945 -1.040 1233 2HG2 THR 153 HG22 THR 153 18.679 9.907 -0.848 1234 3HG2 THR 153 HG23 THR 153 17.157 10.691 -1.271 1235 H VAL 154 HN VAL 154 13.741 9.119 2.117 1236 HA VAL 154 HA VAL 154 12.383 9.566 -0.363 1237 HB VAL 154 HB VAL 154 11.513 8.136 1.530 1238 1HG1 VAL 154 HG11 VAL 154 10.963 8.973 3.525 1239 2HG1 VAL 154 HG12 VAL 154 10.141 10.359 2.814 1240 3HG1 VAL 154 HG13 VAL 154 11.887 10.400 3.054 1241 1HG2 VAL 154 HG21 VAL 154 10.208 9.670 -0.381 1242 2HG2 VAL 154 HG22 VAL 154 9.265 9.891 1.093 1243 3HG2 VAL 154 HG23 VAL 154 9.567 8.267 0.473 1244 H ASP 155 HN ASP 155 11.173 11.347 -0.994 1245 HA ASP 155 HA ASP 155 12.141 13.892 -0.379 1246 1HB ASP 155 HB2 ASP 155 10.901 13.385 -2.442 1247 2HB ASP 155 HB1 ASP 155 9.433 13.136 -1.501 1248 H GLU 156 HN GLU 156 11.536 15.468 1.064 1249 HA GLU 156 HA GLU 156 10.605 16.418 2.912 1250 1HB GLU 156 HB2 GLU 156 8.507 16.460 1.829 1251 2HB GLU 156 HB1 GLU 156 8.294 14.723 1.986 1252 1HG GLU 156 HG2 GLU 156 8.007 14.962 4.392 1253 2HG GLU 156 HG1 GLU 156 8.260 16.701 4.257 1254 H VAL 157 HN VAL 157 10.937 16.094 5.021 1255 HA VAL 157 HA VAL 157 11.876 13.625 5.978 1256 HB VAL 157 HB VAL 157 11.837 14.646 8.213 1257 1HG1 VAL 157 HG11 VAL 157 13.534 15.206 6.315 1258 2HG1 VAL 157 HG12 VAL 157 13.556 16.127 7.819 1259 3HG1 VAL 157 HG13 VAL 157 12.789 16.803 6.382 1260 1HG2 VAL 157 HG21 VAL 157 11.009 16.904 8.550 1261 2HG2 VAL 157 HG22 VAL 157 9.707 15.857 7.987 1262 3HG2 VAL 157 HG23 VAL 157 10.478 16.982 6.870 Start of MODEL 9 1 1H MET 1 HT1 MET 1 -18.599 -12.860 -24.512 2 2H MET 1 HT2 MET 1 -18.799 -14.459 -23.997 3 3H MET 1 HT3 MET 1 -17.492 -14.048 -24.989 4 HA MET 1 HA MET 1 -16.477 -14.162 -22.956 5 1HB MET 1 HB2 MET 1 -16.072 -12.004 -24.045 6 2HB MET 1 HB1 MET 1 -17.476 -11.319 -23.238 7 1HG MET 1 HG2 MET 1 -16.397 -11.646 -21.074 8 2HG MET 1 HG1 MET 1 -14.990 -12.335 -21.881 9 1HE MET 1 HE1 MET 1 -13.366 -10.556 -20.650 10 2HE MET 1 HE2 MET 1 -14.808 -9.992 -19.807 11 3HE MET 1 HE3 MET 1 -13.735 -8.833 -20.592 12 H THR 2 HN THR 2 -19.572 -12.469 -22.594 13 HA THR 2 HA THR 2 -21.143 -12.489 -20.954 14 HB THR 2 HB THR 2 -19.544 -14.802 -19.839 15 HG1 THR 2 HG1 THR 2 -21.060 -16.059 -20.922 16 1HG2 THR 2 HG21 THR 2 -21.700 -13.429 -18.670 17 2HG2 THR 2 HG22 THR 2 -20.969 -14.952 -18.164 18 3HG2 THR 2 HG23 THR 2 -22.330 -14.957 -19.285 19 H VAL 3 HN VAL 3 -18.016 -13.218 -19.374 20 HA VAL 3 HA VAL 3 -18.047 -10.672 -18.022 21 HB VAL 3 HB VAL 3 -18.193 -13.205 -16.374 22 1HG1 VAL 3 HG11 VAL 3 -18.039 -10.324 -15.494 23 2HG1 VAL 3 HG12 VAL 3 -16.714 -11.486 -15.430 24 3HG1 VAL 3 HG13 VAL 3 -18.154 -11.735 -14.442 25 1HG2 VAL 3 HG21 VAL 3 -20.385 -12.716 -17.177 26 2HG2 VAL 3 HG22 VAL 3 -20.202 -11.002 -16.807 27 3HG2 VAL 3 HG23 VAL 3 -20.304 -12.180 -15.499 28 HA PRO 4 HA PRO 4 -13.671 -11.150 -18.570 29 1HB PRO 4 HB2 PRO 4 -13.568 -9.638 -15.985 30 2HB PRO 4 HB1 PRO 4 -12.717 -9.328 -17.502 31 1HG PRO 4 HG2 PRO 4 -14.800 -7.848 -16.834 32 2HG PRO 4 HG1 PRO 4 -14.606 -8.401 -18.510 33 1HD PRO 4 HD2 PRO 4 -16.427 -9.434 -16.372 34 2HD PRO 4 HD1 PRO 4 -16.736 -9.213 -18.107 35 H ASP 5 HN ASP 5 -12.736 -10.871 -15.370 36 HA ASP 5 HA ASP 5 -13.296 -13.442 -14.365 37 1HB ASP 5 HB2 ASP 5 -11.854 -14.183 -16.198 38 2HB ASP 5 HB1 ASP 5 -10.578 -13.101 -15.651 39 H ARG 6 HN ARG 6 -13.036 -13.337 -12.239 40 HA ARG 6 HA ARG 6 -11.921 -11.055 -10.990 41 1HB ARG 6 HB2 ARG 6 -12.713 -13.723 -9.810 42 2HB ARG 6 HB1 ARG 6 -12.352 -12.276 -8.879 43 1HG ARG 6 HG2 ARG 6 -14.619 -12.626 -10.831 44 2HG ARG 6 HG1 ARG 6 -14.741 -12.585 -9.072 45 1HD ARG 6 HD2 ARG 6 -13.942 -10.289 -9.048 46 2HD ARG 6 HD1 ARG 6 -13.741 -10.323 -10.799 47 HE ARG 6 HE ARG 6 -16.136 -9.802 -9.384 48 1HH1 ARG 6 HH11 ARG 6 -14.935 -11.376 -12.260 49 2HH1 ARG 6 HH12 ARG 6 -16.430 -11.219 -13.119 50 1HH2 ARG 6 HH21 ARG 6 -18.100 -9.592 -10.518 51 2HH2 ARG 6 HH22 ARG 6 -18.224 -10.205 -12.133 52 H SER 7 HN SER 7 -10.712 -14.231 -11.745 53 HA SER 7 HA SER 7 -8.526 -14.438 -10.068 54 1HB SER 7 HB2 SER 7 -8.744 -15.323 -12.956 55 2HB SER 7 HB1 SER 7 -7.537 -15.895 -11.804 56 HG SER 7 HG SER 7 -9.344 -16.630 -10.510 57 H GLU 8 HN GLU 8 -8.975 -12.393 -12.850 58 HA GLU 8 HA GLU 8 -6.429 -11.822 -13.672 59 1HB GLU 8 HB2 GLU 8 -7.229 -9.679 -14.423 60 2HB GLU 8 HB1 GLU 8 -8.510 -10.861 -14.648 61 1HG GLU 8 HG2 GLU 8 -9.553 -10.063 -12.552 62 2HG GLU 8 HG1 GLU 8 -8.305 -8.825 -12.443 63 H ILE 9 HN ILE 9 -8.070 -10.612 -10.795 64 HA ILE 9 HA ILE 9 -6.368 -8.597 -10.018 65 HB ILE 9 HB ILE 9 -7.731 -10.591 -8.201 66 1HG1 ILE 9 HG12 ILE 9 -8.610 -8.042 -9.533 67 2HG1 ILE 9 HG11 ILE 9 -9.429 -9.599 -9.486 68 1HG2 ILE 9 HG21 ILE 9 -5.873 -9.181 -7.194 69 2HG2 ILE 9 HG22 ILE 9 -7.455 -9.065 -6.425 70 3HG2 ILE 9 HG23 ILE 9 -6.907 -7.785 -7.506 71 1HD1 ILE 9 HD11 ILE 9 -9.166 -7.610 -7.250 72 2HD1 ILE 9 HD12 ILE 9 -9.824 -9.234 -7.055 73 3HD1 ILE 9 HD13 ILE 9 -10.632 -8.075 -8.110 74 H ALA 10 HN ALA 10 -5.881 -12.059 -9.813 75 HA ALA 10 HA ALA 10 -3.604 -11.979 -8.112 76 1HB ALA 10 HB1 ALA 10 -4.372 -14.084 -10.133 77 2HB ALA 10 HB2 ALA 10 -4.952 -14.011 -8.469 78 3HB ALA 10 HB3 ALA 10 -3.239 -14.277 -8.797 79 H GLY 11 HN GLY 11 -1.543 -11.439 -8.572 80 1HA GLY 11 HA2 GLY 11 -0.075 -12.006 -10.812 81 2HA GLY 11 HA1 GLY 11 -0.882 -10.498 -11.209 82 H LYS 12 HN LYS 12 0.828 -9.117 -11.222 83 HA LYS 12 HA LYS 12 2.385 -8.926 -8.727 84 1HB LYS 12 HB2 LYS 12 3.754 -9.549 -10.686 85 2HB LYS 12 HB1 LYS 12 3.234 -8.082 -11.504 86 1HG LYS 12 HG2 LYS 12 4.296 -6.733 -9.761 87 2HG LYS 12 HG1 LYS 12 4.824 -8.207 -8.948 88 1HD LYS 12 HD2 LYS 12 6.101 -8.817 -10.983 89 2HD LYS 12 HD1 LYS 12 5.637 -7.273 -11.700 90 1HE LYS 12 HE2 LYS 12 7.231 -7.643 -9.165 91 2HE LYS 12 HE1 LYS 12 7.882 -7.173 -10.734 92 1HZ LYS 12 HZ1 LYS 12 6.862 -5.518 -8.748 93 2HZ LYS 12 HZ2 LYS 12 5.774 -5.439 -10.040 94 3HZ LYS 12 HZ3 LYS 12 7.406 -5.073 -10.287 95 H TRP 13 HN TRP 13 2.123 -7.168 -7.566 96 HA TRP 13 HA TRP 13 0.857 -4.816 -8.799 97 1HB TRP 13 HB2 TRP 13 0.842 -5.856 -5.963 98 2HB TRP 13 HB1 TRP 13 0.257 -4.258 -6.397 99 HD1 TRP 13 HD1 TRP 13 -0.626 -6.735 -9.023 100 HE1 TRP 13 HE1 TRP 13 -3.102 -7.397 -8.823 101 HE3 TRP 13 HE3 TRP 13 -1.635 -4.756 -4.419 102 HZ2 TRP 13 HZ2 TRP 13 -5.195 -7.123 -6.967 103 HZ3 TRP 13 HZ3 TRP 13 -3.902 -5.004 -3.502 104 HH2 TRP 13 HH2 TRP 13 -5.647 -6.167 -4.752 105 H TYR 14 HN TYR 14 1.959 -2.925 -8.864 106 HA TYR 14 HA TYR 14 4.608 -2.863 -7.613 107 1HB TYR 14 HB2 TYR 14 3.394 -1.064 -9.720 108 2HB TYR 14 HB1 TYR 14 5.031 -0.919 -9.091 109 HD1 TYR 14 HD1 TYR 14 2.886 -3.667 -10.471 110 HD2 TYR 14 HD2 TYR 14 6.661 -1.706 -10.490 111 HE1 TYR 14 HE1 TYR 14 3.685 -5.234 -12.188 112 HE2 TYR 14 HE2 TYR 14 7.470 -3.266 -12.208 113 HH TYR 14 HH TYR 14 5.905 -4.851 -14.136 114 H VAL 15 HN VAL 15 4.990 -1.709 -5.839 115 HA VAL 15 HA VAL 15 3.045 0.368 -5.120 116 HB VAL 15 HB VAL 15 2.825 -1.041 -3.347 117 1HG1 VAL 15 HG11 VAL 15 4.948 -2.160 -2.321 118 2HG1 VAL 15 HG12 VAL 15 5.630 -1.831 -3.909 119 3HG1 VAL 15 HG13 VAL 15 4.188 -2.829 -3.764 120 1HG2 VAL 15 HG21 VAL 15 4.075 -0.213 -1.415 121 2HG2 VAL 15 HG22 VAL 15 3.545 1.114 -2.449 122 3HG2 VAL 15 HG23 VAL 15 5.225 0.581 -2.490 123 H VAL 16 HN VAL 16 3.627 2.347 -5.110 124 HA VAL 16 HA VAL 16 6.369 3.160 -4.548 125 HB VAL 16 HB VAL 16 6.449 4.628 -6.529 126 1HG1 VAL 16 HG11 VAL 16 6.869 2.874 -8.194 127 2HG1 VAL 16 HG12 VAL 16 6.041 1.708 -7.162 128 3HG1 VAL 16 HG13 VAL 16 7.541 2.460 -6.617 129 1HG2 VAL 16 HG21 VAL 16 4.786 4.869 -8.029 130 2HG2 VAL 16 HG22 VAL 16 3.768 4.289 -6.716 131 3HG2 VAL 16 HG23 VAL 16 4.330 3.169 -7.953 132 H ALA 17 HN ALA 17 2.995 4.005 -5.066 133 HA ALA 17 HA ALA 17 3.343 6.653 -3.896 134 1HB ALA 17 HB1 ALA 17 0.598 5.998 -4.295 135 2HB ALA 17 HB2 ALA 17 1.508 5.473 -5.712 136 3HB ALA 17 HB3 ALA 17 1.591 7.153 -5.180 137 H LEU 18 HN LEU 18 3.171 6.956 -1.756 138 HA LEU 18 HA LEU 18 1.386 5.203 -0.228 139 1HB LEU 18 HB2 LEU 18 4.253 5.826 0.473 140 2HB LEU 18 HB1 LEU 18 3.108 5.135 1.603 141 HG LEU 18 HG LEU 18 2.856 3.201 0.000 142 1HD1 LEU 18 HD11 LEU 18 3.715 3.447 -2.033 143 2HD1 LEU 18 HD12 LEU 18 5.310 3.284 -1.298 144 3HD1 LEU 18 HD13 LEU 18 4.614 4.885 -1.553 145 1HD2 LEU 18 HD21 LEU 18 5.668 3.561 0.995 146 2HD2 LEU 18 HD22 LEU 18 4.737 2.069 0.858 147 3HD2 LEU 18 HD23 LEU 18 4.303 3.271 2.073 148 H ALA 19 HN ALA 19 1.513 6.083 2.210 149 HA ALA 19 HA ALA 19 1.780 8.883 2.573 150 1HB ALA 19 HB1 ALA 19 -0.983 8.700 3.020 151 2HB ALA 19 HB2 ALA 19 -0.695 7.985 1.430 152 3HB ALA 19 HB3 ALA 19 -0.156 9.625 1.770 153 H SER 20 HN SER 20 2.406 8.969 4.658 154 HA SER 20 HA SER 20 0.864 7.416 6.609 155 1HB SER 20 HB2 SER 20 2.957 6.525 7.625 156 2HB SER 20 HB1 SER 20 2.653 5.910 5.999 157 HG SER 20 HG SER 20 4.681 7.534 6.928 158 H ASN 21 HN ASN 21 1.326 7.893 8.810 159 HA ASN 21 HA ASN 21 2.860 10.222 9.486 160 1HB ASN 21 HB2 ASN 21 0.838 11.323 10.595 161 2HB ASN 21 HB1 ASN 21 0.953 11.453 8.844 162 1HD2 ASN 21 HD21 ASN 21 -0.283 9.925 7.584 163 2HD2 ASN 21 HD22 ASN 21 -1.809 9.390 8.182 164 H THR 22 HN THR 22 3.782 9.798 11.330 165 HA THR 22 HA THR 22 2.530 8.835 13.655 166 HB THR 22 HB THR 22 3.990 6.806 11.958 167 HG1 THR 22 HG1 THR 22 2.100 5.938 11.784 168 1HG2 THR 22 HG21 THR 22 3.382 6.615 14.892 169 2HG2 THR 22 HG22 THR 22 4.956 6.504 14.105 170 3HG2 THR 22 HG23 THR 22 3.758 5.234 13.862 171 H GLU 23 HN GLU 23 5.591 8.518 11.880 172 HA GLU 23 HA GLU 23 6.971 10.280 13.671 173 1HB GLU 23 HB2 GLU 23 7.699 7.344 13.660 174 2HB GLU 23 HB1 GLU 23 8.681 8.615 14.373 175 1HG GLU 23 HG2 GLU 23 6.811 9.137 15.907 176 2HG GLU 23 HG1 GLU 23 5.925 7.769 15.238 177 H PHE 24 HN PHE 24 8.632 11.238 12.623 178 HA PHE 24 HA PHE 24 9.045 10.610 9.863 179 1HB PHE 24 HB2 PHE 24 10.295 12.643 11.705 180 2HB PHE 24 HB1 PHE 24 10.762 12.477 10.017 181 HD1 PHE 24 HD1 PHE 24 7.453 12.476 11.770 182 HD2 PHE 24 HD2 PHE 24 9.942 14.222 8.792 183 HE1 PHE 24 HE1 PHE 24 5.610 13.957 11.105 184 HE2 PHE 24 HE2 PHE 24 8.101 15.710 8.124 185 HZ PHE 24 HZ PHE 24 5.932 15.579 9.281 186 H PHE 25 HN PHE 25 11.040 10.351 12.785 187 HA PHE 25 HA PHE 25 13.321 9.368 11.376 188 1HB PHE 25 HB2 PHE 25 12.615 9.470 14.304 189 2HB PHE 25 HB1 PHE 25 14.127 8.790 13.716 190 HD1 PHE 25 HD1 PHE 25 12.190 11.867 12.817 191 HD2 PHE 25 HD2 PHE 25 15.860 10.201 14.185 192 HE1 PHE 25 HE1 PHE 25 13.205 14.105 12.807 193 HE2 PHE 25 HE2 PHE 25 16.880 12.439 14.180 194 HZ PHE 25 HZ PHE 25 15.552 14.394 13.491 195 H LEU 26 HN LEU 26 10.932 7.793 13.506 196 HA LEU 26 HA LEU 26 12.009 5.214 13.314 197 1HB LEU 26 HB2 LEU 26 10.416 5.839 15.036 198 2HB LEU 26 HB1 LEU 26 9.167 6.071 13.829 199 HG LEU 26 HG LEU 26 9.222 3.672 13.302 200 1HD1 LEU 26 HD11 LEU 26 11.646 3.787 14.857 201 2HD1 LEU 26 HD12 LEU 26 11.048 2.511 13.798 202 3HD1 LEU 26 HD13 LEU 26 10.547 2.560 15.488 203 1HD2 LEU 26 HD21 LEU 26 8.354 2.871 15.534 204 2HD2 LEU 26 HD22 LEU 26 7.587 4.320 14.883 205 3HD2 LEU 26 HD23 LEU 26 8.783 4.459 16.171 206 H ARG 27 HN ARG 27 9.388 6.726 11.434 207 HA ARG 27 HA ARG 27 8.879 4.430 9.863 208 1HB ARG 27 HB2 ARG 27 8.272 7.332 9.292 209 2HB ARG 27 HB1 ARG 27 7.632 5.971 8.382 210 1HG ARG 27 HG2 ARG 27 7.097 6.661 11.260 211 2HG ARG 27 HG1 ARG 27 5.955 6.673 9.914 212 1HD ARG 27 HD2 ARG 27 7.303 4.272 11.140 213 2HD ARG 27 HD1 ARG 27 5.595 4.697 11.240 214 HE ARG 27 HE ARG 27 6.203 4.477 8.549 215 1HH1 ARG 27 HH11 ARG 27 6.204 2.406 11.358 216 2HH1 ARG 27 HH12 ARG 27 5.860 0.970 10.454 217 1HH2 ARG 27 HH21 ARG 27 5.753 2.592 7.360 218 2HH2 ARG 27 HH22 ARG 27 5.603 1.075 8.183 219 H GLU 28 HN GLU 28 11.123 7.095 9.518 220 HA GLU 28 HA GLU 28 11.780 6.988 6.859 221 1HB GLU 28 HB2 GLU 28 12.767 8.594 8.417 222 2HB GLU 28 HB1 GLU 28 13.682 7.306 9.187 223 1HG GLU 28 HG2 GLU 28 14.922 6.938 7.125 224 2HG GLU 28 HG1 GLU 28 13.990 8.206 6.331 225 H LYS 29 HN LYS 29 13.009 4.878 9.444 226 HA LYS 29 HA LYS 29 14.622 3.350 7.627 227 1HB LYS 29 HB2 LYS 29 15.008 1.862 9.569 228 2HB LYS 29 HB1 LYS 29 15.356 3.549 9.914 229 1HG LYS 29 HG2 LYS 29 13.224 3.759 11.074 230 2HG LYS 29 HG1 LYS 29 12.858 2.070 10.716 231 1HD LYS 29 HD2 LYS 29 14.835 1.381 11.994 232 2HD LYS 29 HD1 LYS 29 15.189 3.071 12.354 233 1HE LYS 29 HE2 LYS 29 13.055 3.262 13.537 234 2HE LYS 29 HE1 LYS 29 12.702 1.574 13.175 235 1HZ LYS 29 HZ1 LYS 29 14.770 1.006 14.413 236 2HZ LYS 29 HZ2 LYS 29 13.552 1.684 15.372 237 3HZ LYS 29 HZ3 LYS 29 14.876 2.624 14.898 238 H ASP 30 HN ASP 30 11.448 2.965 9.128 239 HA ASP 30 HA ASP 30 11.011 0.290 8.378 240 1HB ASP 30 HB2 ASP 30 9.626 1.471 10.041 241 2HB ASP 30 HB1 ASP 30 8.963 2.483 8.762 242 H LYS 31 HN LYS 31 9.829 3.280 6.818 243 HA LYS 31 HA LYS 31 9.625 1.745 4.317 244 1HB LYS 31 HB2 LYS 31 7.967 4.086 5.269 245 2HB LYS 31 HB1 LYS 31 7.916 3.457 3.627 246 1HG LYS 31 HG2 LYS 31 7.209 1.272 4.507 247 2HG LYS 31 HG1 LYS 31 7.201 1.953 6.134 248 1HD LYS 31 HD2 LYS 31 5.475 3.537 5.491 249 2HD LYS 31 HD1 LYS 31 5.520 2.942 3.830 250 1HE LYS 31 HE2 LYS 31 4.740 1.336 6.263 251 2HE LYS 31 HE1 LYS 31 3.627 2.007 5.073 252 1HZ LYS 31 HZ1 LYS 31 3.901 0.198 3.854 253 2HZ LYS 31 HZ2 LYS 31 4.965 -0.446 4.999 254 3HZ LYS 31 HZ3 LYS 31 5.563 0.494 3.726 255 H MET 32 HN MET 32 10.868 2.356 2.692 256 HA MET 32 HA MET 32 11.555 4.968 1.991 257 1HB MET 32 HB2 MET 32 12.827 4.843 4.141 258 2HB MET 32 HB1 MET 32 13.789 3.549 3.445 259 1HG MET 32 HG2 MET 32 14.919 5.703 3.348 260 2HG MET 32 HG1 MET 32 14.623 5.040 1.741 261 1HE MET 32 HE1 MET 32 11.651 7.285 3.832 262 2HE MET 32 HE2 MET 32 12.830 8.596 3.835 263 3HE MET 32 HE3 MET 32 13.250 7.032 4.533 264 H LYS 33 HN LYS 33 12.133 1.561 1.856 265 HA LYS 33 HA LYS 33 13.832 1.669 -0.487 266 1HB LYS 33 HB2 LYS 33 12.432 -0.682 0.813 267 2HB LYS 33 HB1 LYS 33 13.661 -0.789 -0.436 268 1HG LYS 33 HG2 LYS 33 14.606 -1.316 1.718 269 2HG LYS 33 HG1 LYS 33 15.298 0.187 1.115 270 1HD LYS 33 HD2 LYS 33 13.970 1.489 2.599 271 2HD LYS 33 HD1 LYS 33 12.983 0.096 3.041 272 1HE LYS 33 HE2 LYS 33 15.925 0.386 3.626 273 2HE LYS 33 HE1 LYS 33 14.635 0.747 4.771 274 1HZ LYS 33 HZ1 LYS 33 13.990 -1.501 4.837 275 2HZ LYS 33 HZ2 LYS 33 15.676 -1.512 4.971 276 3HZ LYS 33 HZ3 LYS 33 14.943 -1.912 3.501 277 H MET 34 HN MET 34 13.140 0.887 -2.638 278 HA MET 34 HA MET 34 10.445 1.686 -3.218 279 1HB MET 34 HB2 MET 34 10.841 0.743 -5.499 280 2HB MET 34 HB1 MET 34 12.026 1.936 -5.005 281 1HG MET 34 HG2 MET 34 13.562 0.063 -4.421 282 2HG MET 34 HG1 MET 34 12.374 -1.043 -5.107 283 1HE MET 34 HE1 MET 34 15.398 -0.839 -7.684 284 2HE MET 34 HE2 MET 34 14.331 -1.990 -6.881 285 3HE MET 34 HE3 MET 34 15.355 -0.921 -5.923 286 H ALA 35 HN ALA 35 8.727 0.146 -4.121 287 HA ALA 35 HA ALA 35 9.127 -2.494 -2.878 288 1HB ALA 35 HB1 ALA 35 6.852 -2.392 -1.976 289 2HB ALA 35 HB2 ALA 35 6.715 -0.734 -2.561 290 3HB ALA 35 HB3 ALA 35 7.906 -1.137 -1.325 291 H MET 36 HN MET 36 8.225 -4.210 -3.719 292 HA MET 36 HA MET 36 6.678 -3.959 -6.213 293 1HB MET 36 HB2 MET 36 8.651 -6.142 -5.470 294 2HB MET 36 HB1 MET 36 7.731 -6.047 -6.966 295 1HG MET 36 HG2 MET 36 8.912 -4.023 -7.589 296 2HG MET 36 HG1 MET 36 9.804 -4.060 -6.070 297 1HE MET 36 HE1 MET 36 11.545 -4.326 -9.288 298 2HE MET 36 HE2 MET 36 12.731 -4.765 -8.058 299 3HE MET 36 HE3 MET 36 11.528 -3.520 -7.720 300 H ALA 37 HN ALA 37 5.170 -5.927 -6.492 301 HA ALA 37 HA ALA 37 4.641 -7.336 -4.015 302 1HB ALA 37 HB1 ALA 37 3.195 -4.960 -4.699 303 2HB ALA 37 HB2 ALA 37 3.122 -5.940 -3.236 304 3HB ALA 37 HB3 ALA 37 2.107 -6.344 -4.619 305 H ARG 38 HN ARG 38 3.037 -8.948 -4.115 306 HA ARG 38 HA ARG 38 2.057 -9.743 -6.741 307 1HB ARG 38 HB2 ARG 38 4.198 -10.886 -6.587 308 2HB ARG 38 HB1 ARG 38 3.797 -11.492 -4.987 309 1HG ARG 38 HG2 ARG 38 1.936 -12.778 -5.993 310 2HG ARG 38 HG1 ARG 38 2.472 -12.235 -7.584 311 1HD ARG 38 HD2 ARG 38 4.654 -13.297 -7.196 312 2HD ARG 38 HD1 ARG 38 4.088 -13.863 -5.624 313 HE ARG 38 HE ARG 38 2.285 -14.747 -7.561 314 1HH1 ARG 38 HH11 ARG 38 5.604 -15.281 -6.622 315 2HH1 ARG 38 HH12 ARG 38 5.640 -16.906 -7.220 316 1HH2 ARG 38 HH21 ARG 38 2.332 -16.880 -8.345 317 2HH2 ARG 38 HH22 ARG 38 3.784 -17.813 -8.199 318 H ILE 39 HN ILE 39 -0.063 -9.988 -6.424 319 HA ILE 39 HA ILE 39 -1.041 -10.783 -3.791 320 HB ILE 39 HB ILE 39 -2.033 -8.786 -4.762 321 1HG1 ILE 39 HG12 ILE 39 -3.995 -11.091 -4.709 322 2HG1 ILE 39 HG11 ILE 39 -3.401 -10.231 -3.293 323 1HG2 ILE 39 HG21 ILE 39 -1.799 -9.212 -7.099 324 2HG2 ILE 39 HG22 ILE 39 -3.515 -8.999 -6.754 325 3HG2 ILE 39 HG23 ILE 39 -2.860 -10.616 -7.002 326 1HD1 ILE 39 HD11 ILE 39 -4.902 -8.892 -5.522 327 2HD1 ILE 39 HD12 ILE 39 -4.519 -8.243 -3.929 328 3HD1 ILE 39 HD13 ILE 39 -5.675 -9.564 -4.088 329 H SER 40 HN SER 40 -2.378 -12.504 -3.406 330 HA SER 40 HA SER 40 -3.262 -14.249 -5.515 331 1HB SER 40 HB2 SER 40 -0.917 -14.968 -5.279 332 2HB SER 40 HB1 SER 40 -1.178 -15.248 -3.557 333 HG SER 40 HG SER 40 -1.972 -17.118 -4.051 334 H PHE 41 HN PHE 41 -4.891 -15.627 -4.859 335 HA PHE 41 HA PHE 41 -6.119 -14.969 -2.329 336 1HB PHE 41 HB2 PHE 41 -7.015 -16.800 -4.564 337 2HB PHE 41 HB1 PHE 41 -7.980 -16.397 -3.151 338 HD1 PHE 41 HD1 PHE 41 -9.727 -15.058 -3.746 339 HD2 PHE 41 HD2 PHE 41 -5.923 -14.331 -5.510 340 HE1 PHE 41 HE1 PHE 41 -10.644 -13.102 -4.922 341 HE2 PHE 41 HE2 PHE 41 -6.830 -12.376 -6.680 342 HZ PHE 41 HZ PHE 41 -9.194 -11.757 -6.389 343 H LEU 42 HN LEU 42 -6.086 -16.153 -0.503 344 HA LEU 42 HA LEU 42 -5.061 -18.909 -0.677 345 1HB LEU 42 HB2 LEU 42 -4.600 -16.806 1.419 346 2HB LEU 42 HB1 LEU 42 -4.385 -18.507 1.773 347 HG LEU 42 HG LEU 42 -2.266 -17.388 1.245 348 1HD1 LEU 42 HD11 LEU 42 -3.321 -19.730 -0.091 349 2HD1 LEU 42 HD12 LEU 42 -1.743 -19.464 0.649 350 3HD1 LEU 42 HD13 LEU 42 -2.028 -18.968 -1.019 351 1HD2 LEU 42 HD21 LEU 42 -3.181 -17.103 -1.591 352 2HD2 LEU 42 HD22 LEU 42 -1.798 -16.364 -0.786 353 3HD2 LEU 42 HD23 LEU 42 -3.431 -15.806 -0.422 354 H GLY 43 HN GLY 43 -6.218 -20.508 0.224 355 1HA GLY 43 HA2 GLY 43 -8.933 -20.235 0.694 356 2HA GLY 43 HA1 GLY 43 -7.969 -21.606 1.211 357 H GLU 44 HN GLU 44 -9.347 -21.793 3.019 358 HA GLU 44 HA GLU 44 -9.838 -21.590 5.225 359 1HB GLU 44 HB2 GLU 44 -7.485 -19.693 5.263 360 2HB GLU 44 HB1 GLU 44 -8.278 -20.359 6.683 361 1HG GLU 44 HG2 GLU 44 -7.615 -22.609 6.001 362 2HG GLU 44 HG1 GLU 44 -6.819 -21.939 4.576 363 H ASP 45 HN ASP 45 -8.679 -18.331 4.445 364 HA ASP 45 HA ASP 45 -10.965 -16.974 3.940 365 1HB ASP 45 HB2 ASP 45 -11.659 -16.021 6.132 366 2HB ASP 45 HB1 ASP 45 -11.957 -17.751 6.032 367 H GLU 46 HN GLU 46 -8.339 -16.721 3.252 368 HA GLU 46 HA GLU 46 -7.825 -13.984 4.014 369 1HB GLU 46 HB2 GLU 46 -5.929 -16.194 4.805 370 2HB GLU 46 HB1 GLU 46 -5.448 -14.508 4.710 371 1HG GLU 46 HG2 GLU 46 -7.075 -13.932 6.424 372 2HG GLU 46 HG1 GLU 46 -7.594 -15.615 6.504 373 H LEU 47 HN LEU 47 -6.889 -12.893 2.441 374 HA LEU 47 HA LEU 47 -5.563 -14.384 0.270 375 1HB LEU 47 HB2 LEU 47 -7.190 -11.832 0.087 376 2HB LEU 47 HB1 LEU 47 -6.307 -12.556 -1.245 377 HG LEU 47 HG LEU 47 -7.748 -14.586 -1.026 378 1HD1 LEU 47 HD11 LEU 47 -8.857 -12.977 1.193 379 2HD1 LEU 47 HD12 LEU 47 -8.691 -14.725 1.024 380 3HD1 LEU 47 HD13 LEU 47 -10.001 -13.880 0.200 381 1HD2 LEU 47 HD21 LEU 47 -8.209 -12.800 -2.672 382 2HD2 LEU 47 HD22 LEU 47 -9.288 -12.043 -1.503 383 3HD2 LEU 47 HD23 LEU 47 -9.660 -13.644 -2.133 384 H LYS 48 HN LYS 48 -3.452 -13.811 -0.039 385 HA LYS 48 HA LYS 48 -2.552 -11.414 1.413 386 1HB LYS 48 HB2 LYS 48 -0.539 -12.542 1.981 387 2HB LYS 48 HB1 LYS 48 -1.868 -13.636 2.326 388 1HG LYS 48 HG2 LYS 48 -0.341 -15.035 1.342 389 2HG LYS 48 HG1 LYS 48 -1.364 -14.596 -0.026 390 1HD LYS 48 HD2 LYS 48 0.249 -13.002 -0.803 391 2HD LYS 48 HD1 LYS 48 1.213 -13.190 0.662 392 1HE LYS 48 HE2 LYS 48 2.207 -14.394 -1.207 393 2HE LYS 48 HE1 LYS 48 1.681 -15.508 0.054 394 1HZ LYS 48 HZ1 LYS 48 0.526 -16.572 -1.486 395 2HZ LYS 48 HZ2 LYS 48 0.909 -15.416 -2.660 396 3HZ LYS 48 HZ3 LYS 48 -0.456 -15.209 -1.684 397 H VAL 49 HN VAL 49 -0.772 -10.237 0.688 398 HA VAL 49 HA VAL 49 -0.056 -10.549 -2.146 399 HB VAL 49 HB VAL 49 -1.692 -8.716 -1.977 400 1HG1 VAL 49 HG11 VAL 49 -0.526 -8.182 0.451 401 2HG1 VAL 49 HG12 VAL 49 -1.678 -7.145 -0.386 402 3HG1 VAL 49 HG13 VAL 49 0.054 -6.858 -0.557 403 1HG2 VAL 49 HG21 VAL 49 -0.607 -7.526 -3.528 404 2HG2 VAL 49 HG22 VAL 49 0.719 -8.661 -3.272 405 3HG2 VAL 49 HG23 VAL 49 0.707 -7.112 -2.428 406 H SER 50 HN SER 50 2.032 -11.138 -2.032 407 HA SER 50 HA SER 50 3.756 -10.257 0.095 408 1HB SER 50 HB2 SER 50 3.918 -12.521 -0.970 409 2HB SER 50 HB1 SER 50 4.494 -11.736 -2.442 410 HG SER 50 HG SER 50 6.142 -10.788 -0.906 411 H TYR 51 HN TYR 51 5.425 -8.777 -0.007 412 HA TYR 51 HA TYR 51 5.861 -7.437 -2.562 413 1HB TYR 51 HB2 TYR 51 5.931 -5.224 -1.248 414 2HB TYR 51 HB1 TYR 51 4.362 -5.899 -1.655 415 HD1 TYR 51 HD1 TYR 51 6.850 -5.875 1.144 416 HD2 TYR 51 HD2 TYR 51 2.760 -6.061 -0.012 417 HE1 TYR 51 HE1 TYR 51 6.181 -5.765 3.507 418 HE2 TYR 51 HE2 TYR 51 2.082 -5.945 2.345 419 HH TYR 51 HH TYR 51 3.227 -6.587 4.620 420 H ALA 52 HN ALA 52 7.902 -7.209 -3.047 421 HA ALA 52 HA ALA 52 9.911 -7.554 -0.920 422 1HB ALA 52 HB1 ALA 52 10.125 -7.991 -3.900 423 2HB ALA 52 HB2 ALA 52 10.031 -9.238 -2.658 424 3HB ALA 52 HB3 ALA 52 11.446 -8.190 -2.753 425 H VAL 53 HN VAL 53 10.679 -5.650 -0.218 426 HA VAL 53 HA VAL 53 10.789 -3.383 -2.028 427 HB VAL 53 HB VAL 53 11.363 -2.044 -0.082 428 1HG1 VAL 53 HG11 VAL 53 8.955 -3.093 -0.618 429 2HG1 VAL 53 HG12 VAL 53 9.245 -1.957 0.699 430 3HG1 VAL 53 HG13 VAL 53 9.177 -3.689 1.028 431 1HG2 VAL 53 HG21 VAL 53 12.682 -3.237 1.351 432 2HG2 VAL 53 HG22 VAL 53 11.733 -4.711 1.176 433 3HG2 VAL 53 HG23 VAL 53 11.132 -3.391 2.179 434 HA PRO 54 HA PRO 54 15.157 -4.378 -2.691 435 1HB PRO 54 HB2 PRO 54 15.059 -2.570 -4.938 436 2HB PRO 54 HB1 PRO 54 15.175 -4.330 -4.946 437 1HG PRO 54 HG2 PRO 54 12.983 -2.949 -5.813 438 2HG PRO 54 HG1 PRO 54 12.923 -4.603 -5.180 439 1HD PRO 54 HD2 PRO 54 12.284 -2.025 -3.794 440 2HD PRO 54 HD1 PRO 54 11.427 -3.577 -3.736 441 H LYS 55 HN LYS 55 16.930 -3.428 -2.046 442 HA LYS 55 HA LYS 55 17.003 -1.081 -0.633 443 1HB LYS 55 HB2 LYS 55 19.386 -1.400 -0.440 444 2HB LYS 55 HB1 LYS 55 18.573 -2.949 -0.311 445 1HG LYS 55 HG2 LYS 55 19.175 -3.507 -2.572 446 2HG LYS 55 HG1 LYS 55 19.905 -1.915 -2.798 447 1HD LYS 55 HD2 LYS 55 21.532 -2.422 -1.035 448 2HD LYS 55 HD1 LYS 55 20.801 -4.014 -0.821 449 1HE LYS 55 HE2 LYS 55 21.373 -4.582 -3.134 450 2HE LYS 55 HE1 LYS 55 22.104 -2.992 -3.343 451 1HZ LYS 55 HZ1 LYS 55 23.065 -4.633 -1.125 452 2HZ LYS 55 HZ2 LYS 55 23.911 -3.558 -2.120 453 3HZ LYS 55 HZ3 LYS 55 23.517 -5.101 -2.687 454 HA PRO 56 HA PRO 56 19.450 0.679 -4.661 455 1HB PRO 56 HB2 PRO 56 16.955 0.191 -6.249 456 2HB PRO 56 HB1 PRO 56 18.626 0.339 -6.802 457 1HG PRO 56 HG2 PRO 56 17.495 -2.054 -6.537 458 2HG PRO 56 HG1 PRO 56 19.191 -1.793 -6.094 459 1HD PRO 56 HD2 PRO 56 16.828 -2.205 -4.359 460 2HD PRO 56 HD1 PRO 56 18.528 -2.581 -4.058 461 H ASN 57 HN ASN 57 15.937 1.140 -5.106 462 HA ASN 57 HA ASN 57 16.251 3.981 -4.814 463 1HB ASN 57 HB2 ASN 57 13.790 2.267 -5.164 464 2HB ASN 57 HB1 ASN 57 13.772 4.023 -5.141 465 1HD2 ASN 57 HD21 ASN 57 16.615 3.278 -6.587 466 2HD2 ASN 57 HD22 ASN 57 16.107 3.255 -8.234 467 H GLY 58 HN GLY 58 17.181 3.146 -2.532 468 1HA GLY 58 HA2 GLY 58 15.685 4.404 -0.559 469 2HA GLY 58 HA1 GLY 58 15.330 2.686 -0.446 470 H CYS 59 HN CYS 59 16.692 1.423 0.662 471 HA CYS 59 HA CYS 59 19.461 1.721 0.778 472 1HB CYS 59 HB2 CYS 59 19.683 2.485 3.165 473 2HB CYS 59 HB1 CYS 59 19.165 3.726 2.031 474 H ARG 60 HN ARG 60 17.709 -0.398 0.430 475 HA ARG 60 HA ARG 60 18.798 -2.487 1.731 476 1HB ARG 60 HB2 ARG 60 17.102 -1.069 3.620 477 2HB ARG 60 HB1 ARG 60 16.681 -2.769 3.484 478 1HG ARG 60 HG2 ARG 60 18.965 -3.402 3.996 479 2HG ARG 60 HG1 ARG 60 19.436 -1.705 4.079 480 1HD ARG 60 HD2 ARG 60 19.089 -2.607 6.310 481 2HD ARG 60 HD1 ARG 60 17.887 -1.370 5.946 482 HE ARG 60 HE ARG 60 16.285 -2.948 6.262 483 1HH1 ARG 60 HH11 ARG 60 19.258 -4.596 5.459 484 2HH1 ARG 60 HH12 ARG 60 18.564 -6.175 5.600 485 1HH2 ARG 60 HH21 ARG 60 15.378 -5.027 6.458 486 2HH2 ARG 60 HH22 ARG 60 16.365 -6.421 6.169 487 H LYS 61 HN LYS 61 17.566 -4.532 1.831 488 HA LYS 61 HA LYS 61 15.283 -4.488 -0.025 489 1HB LYS 61 HB2 LYS 61 16.019 -6.675 -0.868 490 2HB LYS 61 HB1 LYS 61 17.240 -5.437 -1.125 491 1HG LYS 61 HG2 LYS 61 18.476 -6.256 0.820 492 2HG LYS 61 HG1 LYS 61 17.250 -7.501 1.070 493 1HD LYS 61 HD2 LYS 61 17.760 -8.448 -1.126 494 2HD LYS 61 HD1 LYS 61 18.974 -7.196 -1.391 495 1HE LYS 61 HE2 LYS 61 20.238 -8.022 0.540 496 2HE LYS 61 HE1 LYS 61 19.026 -9.278 0.795 497 1HZ LYS 61 HZ1 LYS 61 20.765 -8.984 -1.598 498 2HZ LYS 61 HZ2 LYS 61 19.569 -10.164 -1.407 499 3HZ LYS 61 HZ3 LYS 61 20.920 -10.158 -0.390 500 H TRP 62 HN TRP 62 13.460 -5.682 0.556 501 HA TRP 62 HA TRP 62 13.663 -7.644 2.668 502 1HB TRP 62 HB2 TRP 62 13.590 -5.551 3.954 503 2HB TRP 62 HB1 TRP 62 12.076 -5.123 3.167 504 HD1 TRP 62 HD1 TRP 62 10.222 -5.381 4.905 505 HE1 TRP 62 HE1 TRP 62 9.555 -7.156 6.645 506 HE3 TRP 62 HE3 TRP 62 14.146 -8.610 4.324 507 HZ2 TRP 62 HZ2 TRP 62 10.555 -9.599 7.639 508 HZ3 TRP 62 HZ3 TRP 62 14.214 -10.643 5.709 509 HH2 TRP 62 HH2 TRP 62 12.455 -11.125 7.332 510 H GLU 63 HN GLU 63 11.866 -8.948 2.932 511 HA GLU 63 HA GLU 63 9.651 -8.529 1.043 512 1HB GLU 63 HB2 GLU 63 11.057 -11.148 1.607 513 2HB GLU 63 HB1 GLU 63 9.616 -10.964 0.618 514 1HG GLU 63 HG2 GLU 63 11.515 -11.170 -0.814 515 2HG GLU 63 HG1 GLU 63 10.901 -9.523 -0.916 516 H THR 64 HN THR 64 7.621 -9.070 1.790 517 HA THR 64 HA THR 64 7.316 -10.527 4.274 518 HB THR 64 HB THR 64 6.531 -7.619 4.059 519 HG1 THR 64 HG1 THR 64 8.218 -7.273 5.233 520 1HG2 THR 64 HG21 THR 64 4.814 -8.973 5.233 521 2HG2 THR 64 HG22 THR 64 5.596 -7.756 6.243 522 3HG2 THR 64 HG23 THR 64 6.055 -9.453 6.389 523 H THR 65 HN THR 65 5.408 -11.561 4.402 524 HA THR 65 HA THR 65 3.587 -11.280 2.149 525 HB THR 65 HB THR 65 3.765 -13.323 4.369 526 HG1 THR 65 HG1 THR 65 5.394 -13.561 2.873 527 1HG2 THR 65 HG21 THR 65 2.290 -14.337 2.200 528 2HG2 THR 65 HG22 THR 65 1.559 -12.796 2.650 529 3HG2 THR 65 HG23 THR 65 1.754 -14.066 3.858 530 H PHE 66 HN PHE 66 1.934 -9.923 2.297 531 HA PHE 66 HA PHE 66 0.787 -9.294 4.931 532 1HB PHE 66 HB2 PHE 66 1.525 -7.482 3.310 533 2HB PHE 66 HB1 PHE 66 0.203 -7.984 2.267 534 HD1 PHE 66 HD1 PHE 66 0.550 -7.321 5.925 535 HD2 PHE 66 HD2 PHE 66 -1.522 -6.494 2.302 536 HE1 PHE 66 HE1 PHE 66 -0.957 -5.801 7.138 537 HE2 PHE 66 HE2 PHE 66 -3.035 -4.975 3.508 538 HZ PHE 66 HZ PHE 66 -2.752 -4.625 5.929 539 H LYS 67 HN LYS 67 -1.141 -10.216 5.516 540 HA LYS 67 HA LYS 67 -2.977 -11.033 3.393 541 1HB LYS 67 HB2 LYS 67 -3.156 -13.283 4.084 542 2HB LYS 67 HB1 LYS 67 -1.432 -12.951 4.003 543 1HG LYS 67 HG2 LYS 67 -1.358 -12.670 6.421 544 2HG LYS 67 HG1 LYS 67 -3.092 -12.985 6.513 545 1HD LYS 67 HD2 LYS 67 -1.857 -14.991 7.080 546 2HD LYS 67 HD1 LYS 67 -2.714 -15.224 5.556 547 1HE LYS 67 HE2 LYS 67 -0.647 -14.768 4.328 548 2HE LYS 67 HE1 LYS 67 0.207 -14.526 5.852 549 1HZ LYS 67 HZ1 LYS 67 0.237 -16.828 4.623 550 2HZ LYS 67 HZ2 LYS 67 -1.217 -17.054 5.456 551 3HZ LYS 67 HZ3 LYS 67 0.207 -16.741 6.313 552 H LYS 68 HN LYS 68 -5.065 -10.914 3.879 553 HA LYS 68 HA LYS 68 -6.130 -11.004 6.522 554 1HB LYS 68 HB2 LYS 68 -6.271 -8.344 5.089 555 2HB LYS 68 HB1 LYS 68 -7.009 -8.735 6.627 556 1HG LYS 68 HG2 LYS 68 -4.692 -9.097 7.525 557 2HG LYS 68 HG1 LYS 68 -4.096 -8.396 6.019 558 1HD LYS 68 HD2 LYS 68 -5.405 -6.369 6.458 559 2HD LYS 68 HD1 LYS 68 -5.976 -7.070 7.969 560 1HE LYS 68 HE2 LYS 68 -3.724 -7.117 8.840 561 2HE LYS 68 HE1 LYS 68 -3.091 -6.532 7.303 562 1HZ LYS 68 HZ1 LYS 68 -4.707 -5.077 9.298 563 2HZ LYS 68 HZ2 LYS 68 -4.617 -4.546 7.695 564 3HZ LYS 68 HZ3 LYS 68 -3.212 -4.646 8.632 565 H THR 69 HN THR 69 -8.458 -9.327 5.746 566 HA THR 69 HA THR 69 -9.683 -11.213 3.864 567 HB THR 69 HB THR 69 -10.963 -9.205 5.736 568 HG1 THR 69 HG1 THR 69 -11.176 -10.799 7.115 569 1HG2 THR 69 HG21 THR 69 -12.615 -9.464 4.181 570 2HG2 THR 69 HG22 THR 69 -12.968 -10.805 5.270 571 3HG2 THR 69 HG23 THR 69 -12.112 -11.102 3.758 572 H SER 70 HN SER 70 -10.544 -10.523 1.936 573 HA SER 70 HA SER 70 -10.449 -7.644 1.340 574 1HB SER 70 HB2 SER 70 -9.588 -8.193 -0.938 575 2HB SER 70 HB1 SER 70 -8.443 -8.572 0.347 576 HG SER 70 HG SER 70 -10.227 -10.511 -0.665 577 H ASP 71 HN ASP 71 -12.743 -7.794 1.749 578 HA ASP 71 HA ASP 71 -14.217 -8.985 -0.514 579 1HB ASP 71 HB2 ASP 71 -15.185 -8.549 2.320 580 2HB ASP 71 HB1 ASP 71 -16.163 -9.176 0.995 581 H ASP 72 HN ASP 72 -16.238 -7.869 -1.087 582 HA ASP 72 HA ASP 72 -17.622 -5.882 -0.975 583 1HB ASP 72 HB2 ASP 72 -16.134 -4.679 0.597 584 2HB ASP 72 HB1 ASP 72 -14.987 -4.415 -0.711 585 H GLY 73 HN GLY 73 -17.960 -4.323 -2.780 586 1HA GLY 73 HA2 GLY 73 -17.616 -5.360 -5.266 587 2HA GLY 73 HA1 GLY 73 -17.685 -3.622 -4.985 588 H GLU 74 HN GLU 74 -15.364 -3.294 -3.542 589 HA GLU 74 HA GLU 74 -13.311 -3.794 -5.579 590 1HB GLU 74 HB2 GLU 74 -13.355 -1.753 -3.340 591 2HB GLU 74 HB1 GLU 74 -12.107 -1.903 -4.573 592 1HG GLU 74 HG2 GLU 74 -13.729 -1.358 -6.302 593 2HG GLU 74 HG1 GLU 74 -14.998 -1.238 -5.085 594 H VAL 75 HN VAL 75 -11.724 -2.926 -2.750 595 HA VAL 75 HA VAL 75 -11.770 -5.653 -1.688 596 HB VAL 75 HB VAL 75 -9.360 -4.348 -2.887 597 1HG1 VAL 75 HG11 VAL 75 -7.944 -6.001 -1.667 598 2HG1 VAL 75 HG12 VAL 75 -9.332 -6.363 -0.642 599 3HG1 VAL 75 HG13 VAL 75 -8.630 -4.749 -0.632 600 1HG2 VAL 75 HG21 VAL 75 -10.183 -5.921 -4.346 601 2HG2 VAL 75 HG22 VAL 75 -10.776 -6.966 -3.057 602 3HG2 VAL 75 HG23 VAL 75 -9.052 -6.903 -3.413 603 H TYR 76 HN TYR 76 -12.141 -5.522 0.401 604 HA TYR 76 HA TYR 76 -11.005 -3.266 1.918 605 1HB TYR 76 HB2 TYR 76 -13.266 -2.981 2.267 606 2HB TYR 76 HB1 TYR 76 -13.621 -4.694 2.098 607 HD1 TYR 76 HD1 TYR 76 -14.873 -5.161 4.018 608 HD2 TYR 76 HD2 TYR 76 -11.180 -3.084 4.407 609 HE1 TYR 76 HE1 TYR 76 -15.006 -5.390 6.463 610 HE2 TYR 76 HE2 TYR 76 -11.306 -3.304 6.851 611 HH TYR 76 HH TYR 76 -13.828 -3.833 8.531 612 H TYR 77 HN TYR 77 -9.364 -3.786 3.175 613 HA TYR 77 HA TYR 77 -8.892 -6.562 3.900 614 1HB TYR 77 HB2 TYR 77 -7.238 -4.408 3.191 615 2HB TYR 77 HB1 TYR 77 -6.868 -4.782 4.869 616 HD1 TYR 77 HD1 TYR 77 -7.883 -7.106 2.155 617 HD2 TYR 77 HD2 TYR 77 -4.762 -5.805 4.738 618 HE1 TYR 77 HE1 TYR 77 -6.478 -8.974 1.392 619 HE2 TYR 77 HE2 TYR 77 -3.357 -7.677 3.988 620 HH TYR 77 HH TYR 77 -3.870 -9.378 1.280 621 H SER 78 HN SER 78 -8.768 -7.365 5.925 622 HA SER 78 HA SER 78 -8.895 -5.625 8.243 623 1HB SER 78 HB2 SER 78 -11.263 -5.740 7.621 624 2HB SER 78 HB1 SER 78 -11.192 -7.503 7.638 625 HG SER 78 HG SER 78 -11.248 -7.495 9.753 626 H GLU 79 HN GLU 79 -7.903 -6.551 9.988 627 HA GLU 79 HA GLU 79 -7.940 -9.298 10.603 628 1HB GLU 79 HB2 GLU 79 -6.562 -9.379 8.519 629 2HB GLU 79 HB1 GLU 79 -5.359 -8.381 9.322 630 1HG GLU 79 HG2 GLU 79 -5.042 -10.152 11.000 631 2HG GLU 79 HG1 GLU 79 -6.212 -11.152 10.140 632 H GLU 80 HN GLU 80 -6.296 -9.889 12.301 633 HA GLU 80 HA GLU 80 -5.265 -9.548 14.281 634 1HB GLU 80 HB2 GLU 80 -4.637 -6.872 13.035 635 2HB GLU 80 HB1 GLU 80 -4.040 -7.363 14.612 636 1HG GLU 80 HG2 GLU 80 -3.504 -8.818 12.033 637 2HG GLU 80 HG1 GLU 80 -2.398 -7.694 12.821 638 H ALA 81 HN ALA 81 -5.192 -7.662 16.153 639 HA ALA 81 HA ALA 81 -7.696 -7.639 17.296 640 1HB ALA 81 HB1 ALA 81 -5.951 -7.168 18.752 641 2HB ALA 81 HB2 ALA 81 -6.794 -5.624 18.627 642 3HB ALA 81 HB3 ALA 81 -5.302 -5.890 17.724 643 H LYS 82 HN LYS 82 -6.235 -4.551 16.249 644 HA LYS 82 HA LYS 82 -8.840 -3.851 15.074 645 1HB LYS 82 HB2 LYS 82 -7.110 -2.072 16.803 646 2HB LYS 82 HB1 LYS 82 -8.565 -1.558 15.961 647 1HG LYS 82 HG2 LYS 82 -9.887 -3.126 17.291 648 2HG LYS 82 HG1 LYS 82 -8.425 -3.633 18.139 649 1HD LYS 82 HD2 LYS 82 -8.117 -1.350 18.970 650 2HD LYS 82 HD1 LYS 82 -9.579 -0.843 18.122 651 1HE LYS 82 HE2 LYS 82 -9.430 -2.896 20.328 652 2HE LYS 82 HE1 LYS 82 -10.013 -1.240 20.495 653 1HZ LYS 82 HZ1 LYS 82 -11.882 -2.668 20.264 654 2HZ LYS 82 HZ2 LYS 82 -11.237 -3.415 18.891 655 3HZ LYS 82 HZ3 LYS 82 -11.736 -1.801 18.818 656 H LYS 83 HN LYS 83 -6.811 -4.857 13.527 657 HA LYS 83 HA LYS 83 -5.651 -2.463 12.260 658 1HB LYS 83 HB2 LYS 83 -4.175 -4.388 13.151 659 2HB LYS 83 HB1 LYS 83 -4.756 -5.291 11.759 660 1HG LYS 83 HG2 LYS 83 -3.800 -3.683 10.252 661 2HG LYS 83 HG1 LYS 83 -3.354 -2.637 11.599 662 1HD LYS 83 HD2 LYS 83 -1.430 -3.913 10.775 663 2HD LYS 83 HD1 LYS 83 -1.829 -4.338 12.441 664 1HE LYS 83 HE2 LYS 83 -3.038 -6.317 11.621 665 2HE LYS 83 HE1 LYS 83 -2.576 -5.901 9.973 666 1HZ LYS 83 HZ1 LYS 83 -0.577 -6.358 12.107 667 2HZ LYS 83 HZ2 LYS 83 -0.327 -6.316 10.435 668 3HZ LYS 83 HZ3 LYS 83 -1.163 -7.611 11.132 669 H LYS 84 HN LYS 84 -6.322 -1.912 10.255 670 HA LYS 84 HA LYS 84 -7.370 -3.884 8.441 671 1HB LYS 84 HB2 LYS 84 -9.603 -3.043 8.238 672 2HB LYS 84 HB1 LYS 84 -9.315 -3.411 9.931 673 1HG LYS 84 HG2 LYS 84 -9.070 -0.642 8.787 674 2HG LYS 84 HG1 LYS 84 -10.566 -1.286 9.460 675 1HD LYS 84 HD2 LYS 84 -7.952 -1.027 10.947 676 2HD LYS 84 HD1 LYS 84 -9.316 0.081 11.080 677 1HE LYS 84 HE2 LYS 84 -10.717 -1.830 11.836 678 2HE LYS 84 HE1 LYS 84 -9.269 -2.836 11.839 679 1HZ LYS 84 HZ1 LYS 84 -8.338 -1.014 13.372 680 2HZ LYS 84 HZ2 LYS 84 -9.429 -2.133 14.018 681 3HZ LYS 84 HZ3 LYS 84 -9.956 -0.580 13.605 682 H VAL 85 HN VAL 85 -7.376 -3.218 6.330 683 HA VAL 85 HA VAL 85 -6.730 -0.405 5.792 684 HB VAL 85 HB VAL 85 -4.923 -0.941 4.340 685 1HG1 VAL 85 HG11 VAL 85 -4.437 -0.933 6.765 686 2HG1 VAL 85 HG12 VAL 85 -3.325 -1.941 5.840 687 3HG1 VAL 85 HG13 VAL 85 -4.619 -2.687 6.777 688 1HG2 VAL 85 HG21 VAL 85 -5.287 -3.884 4.840 689 2HG2 VAL 85 HG22 VAL 85 -4.251 -3.094 3.655 690 3HG2 VAL 85 HG23 VAL 85 -5.999 -3.067 3.449 691 H GLU 86 HN GLU 86 -7.712 0.438 3.969 692 HA GLU 86 HA GLU 86 -9.524 -1.398 2.561 693 1HB GLU 86 HB2 GLU 86 -9.589 1.611 2.773 694 2HB GLU 86 HB1 GLU 86 -10.770 0.634 1.920 695 1HG GLU 86 HG2 GLU 86 -10.210 0.440 4.871 696 2HG GLU 86 HG1 GLU 86 -11.513 1.385 4.154 697 H VAL 87 HN VAL 87 -8.997 -2.051 0.576 698 HA VAL 87 HA VAL 87 -7.038 -0.554 -0.978 699 HB VAL 87 HB VAL 87 -8.423 -3.128 -1.745 700 1HG1 VAL 87 HG11 VAL 87 -6.301 -1.465 -2.947 701 2HG1 VAL 87 HG12 VAL 87 -7.476 -2.536 -3.709 702 3HG1 VAL 87 HG13 VAL 87 -6.028 -3.206 -2.958 703 1HG2 VAL 87 HG21 VAL 87 -7.166 -3.274 0.414 704 2HG2 VAL 87 HG22 VAL 87 -5.704 -2.853 -0.481 705 3HG2 VAL 87 HG23 VAL 87 -6.575 -4.340 -0.861 706 H LEU 88 HN LEU 88 -7.985 1.221 -1.749 707 HA LEU 88 HA LEU 88 -10.600 1.114 -3.008 708 1HB LEU 88 HB2 LEU 88 -8.767 3.488 -2.684 709 2HB LEU 88 HB1 LEU 88 -10.491 3.510 -3.007 710 HG LEU 88 HG LEU 88 -9.273 2.462 -0.455 711 1HD1 LEU 88 HD11 LEU 88 -9.763 4.508 0.577 712 2HD1 LEU 88 HD12 LEU 88 -10.708 5.074 -0.799 713 3HD1 LEU 88 HD13 LEU 88 -8.954 4.937 -0.928 714 1HD2 LEU 88 HD21 LEU 88 -11.368 2.023 0.271 715 2HD2 LEU 88 HD22 LEU 88 -11.687 1.855 -1.456 716 3HD2 LEU 88 HD23 LEU 88 -12.079 3.363 -0.628 717 H ASP 89 HN ASP 89 -10.175 3.253 -4.850 718 HA ASP 89 HA ASP 89 -9.704 3.615 -7.030 719 1HB ASP 89 HB2 ASP 89 -7.372 3.592 -5.961 720 2HB ASP 89 HB1 ASP 89 -7.202 1.992 -6.667 721 H THR 90 HN THR 90 -7.886 1.302 -8.364 722 HA THR 90 HA THR 90 -10.179 -0.481 -8.846 723 HB THR 90 HB THR 90 -8.101 0.462 -10.832 724 HG1 THR 90 HG1 THR 90 -10.900 0.900 -10.732 725 1HG2 THR 90 HG21 THR 90 -9.805 -0.668 -12.440 726 2HG2 THR 90 HG22 THR 90 -10.184 -1.653 -11.027 727 3HG2 THR 90 HG23 THR 90 -8.540 -1.622 -11.665 728 H ASP 91 HN ASP 91 -9.782 -2.427 -8.023 729 HA ASP 91 HA ASP 91 -7.012 -3.342 -7.820 730 1HB ASP 91 HB2 ASP 91 -7.917 -5.112 -6.346 731 2HB ASP 91 HB1 ASP 91 -8.312 -3.495 -5.772 732 H TYR 92 HN TYR 92 -8.635 -3.291 -10.335 733 HA TYR 92 HA TYR 92 -8.655 -6.156 -10.958 734 1HB TYR 92 HB2 TYR 92 -10.097 -3.807 -12.148 735 2HB TYR 92 HB1 TYR 92 -9.858 -5.269 -13.097 736 HD1 TYR 92 HD1 TYR 92 -10.505 -5.134 -9.450 737 HD2 TYR 92 HD2 TYR 92 -12.094 -5.988 -13.299 738 HE1 TYR 92 HE1 TYR 92 -12.483 -6.141 -8.399 739 HE2 TYR 92 HE2 TYR 92 -14.081 -6.995 -12.261 740 HH TYR 92 HH TYR 92 -14.267 -8.029 -9.276 741 H LYS 93 HN LYS 93 -8.458 -3.940 -13.611 742 HA LYS 93 HA LYS 93 -5.585 -4.504 -13.897 743 1HB LYS 93 HB2 LYS 93 -7.027 -6.000 -15.312 744 2HB LYS 93 HB1 LYS 93 -7.575 -4.569 -16.163 745 1HG LYS 93 HG2 LYS 93 -4.679 -5.349 -15.975 746 2HG LYS 93 HG1 LYS 93 -5.739 -5.906 -17.266 747 1HD LYS 93 HD2 LYS 93 -5.270 -2.989 -16.654 748 2HD LYS 93 HD1 LYS 93 -4.306 -3.906 -17.803 749 1HE LYS 93 HE2 LYS 93 -5.967 -2.752 -19.043 750 2HE LYS 93 HE1 LYS 93 -6.416 -4.453 -19.021 751 1HZ LYS 93 HZ1 LYS 93 -7.553 -2.845 -16.895 752 2HZ LYS 93 HZ2 LYS 93 -8.273 -4.031 -17.862 753 3HZ LYS 93 HZ3 LYS 93 -8.089 -2.458 -18.452 754 H SER 94 HN SER 94 -4.831 -2.518 -13.428 755 HA SER 94 HA SER 94 -4.500 -0.557 -15.245 756 1HB SER 94 HB2 SER 94 -6.125 1.236 -14.574 757 2HB SER 94 HB1 SER 94 -6.883 -0.128 -15.391 758 HG SER 94 HG SER 94 -7.162 -0.900 -13.064 759 H TYR 95 HN TYR 95 -5.885 0.605 -12.265 760 HA TYR 95 HA TYR 95 -3.305 0.606 -10.909 761 1HB TYR 95 HB2 TYR 95 -3.723 3.109 -10.392 762 2HB TYR 95 HB1 TYR 95 -3.064 2.681 -11.968 763 HD1 TYR 95 HD1 TYR 95 -6.369 3.263 -10.311 764 HD2 TYR 95 HD2 TYR 95 -4.039 3.591 -13.850 765 HE1 TYR 95 HE1 TYR 95 -8.228 4.429 -11.413 766 HE2 TYR 95 HE2 TYR 95 -5.891 4.764 -14.966 767 HH TYR 95 HH TYR 95 -8.394 4.902 -14.724 768 H ALA 96 HN ALA 96 -3.462 0.454 -8.736 769 HA ALA 96 HA ALA 96 -6.126 0.781 -7.526 770 1HB ALA 96 HB1 ALA 96 -4.289 -1.328 -6.496 771 2HB ALA 96 HB2 ALA 96 -5.249 -1.657 -7.935 772 3HB ALA 96 HB3 ALA 96 -6.048 -1.234 -6.424 773 H VAL 97 HN VAL 97 -6.173 1.482 -5.379 774 HA VAL 97 HA VAL 97 -3.591 2.299 -4.241 775 HB VAL 97 HB VAL 97 -4.395 4.412 -3.580 776 1HG1 VAL 97 HG11 VAL 97 -5.722 4.929 -6.002 777 2HG1 VAL 97 HG12 VAL 97 -4.566 3.642 -6.334 778 3HG1 VAL 97 HG13 VAL 97 -4.011 5.158 -5.634 779 1HG2 VAL 97 HG21 VAL 97 -7.078 3.241 -4.056 780 2HG2 VAL 97 HG22 VAL 97 -6.885 4.977 -4.301 781 3HG2 VAL 97 HG23 VAL 97 -6.504 4.254 -2.738 782 H ILE 98 HN ILE 98 -3.360 1.888 -2.074 783 HA ILE 98 HA ILE 98 -5.749 1.023 -0.605 784 HB ILE 98 HB ILE 98 -4.949 -1.066 -1.186 785 1HG1 ILE 98 HG12 ILE 98 -3.900 -2.065 0.795 786 2HG1 ILE 98 HG11 ILE 98 -3.464 -0.464 1.379 787 1HG2 ILE 98 HG21 ILE 98 -2.864 -0.174 -2.241 788 2HG2 ILE 98 HG22 ILE 98 -2.693 -1.733 -1.439 789 3HG2 ILE 98 HG23 ILE 98 -2.101 -0.270 -0.654 790 1HD1 ILE 98 HD11 ILE 98 -5.792 0.108 1.641 791 2HD1 ILE 98 HD12 ILE 98 -5.430 -1.385 2.501 792 3HD1 ILE 98 HD13 ILE 98 -6.269 -1.444 0.956 793 H TYR 99 HN TYR 99 -5.949 2.180 1.172 794 HA TYR 99 HA TYR 99 -3.564 3.305 2.435 795 1HB TYR 99 HB2 TYR 99 -4.959 4.885 3.515 796 2HB TYR 99 HB1 TYR 99 -5.575 4.768 1.875 797 HD1 TYR 99 HD1 TYR 99 -6.167 3.219 5.237 798 HD2 TYR 99 HD2 TYR 99 -7.854 4.654 1.603 799 HE1 TYR 99 HE1 TYR 99 -8.419 2.803 6.127 800 HE2 TYR 99 HE2 TYR 99 -10.112 4.242 2.486 801 HH TYR 99 HH TYR 99 -11.251 3.978 4.580 802 H ALA 100 HN ALA 100 -3.126 2.956 4.655 803 HA ALA 100 HA ALA 100 -4.640 0.736 5.854 804 1HB ALA 100 HB1 ALA 100 -2.516 -0.223 6.664 805 2HB ALA 100 HB2 ALA 100 -1.641 0.989 5.732 806 3HB ALA 100 HB3 ALA 100 -2.636 -0.207 4.904 807 H THR 101 HN THR 101 -5.085 0.867 7.943 808 HA THR 101 HA THR 101 -3.706 2.844 9.609 809 HB THR 101 HB THR 101 -5.873 3.499 10.628 810 HG1 THR 101 HG1 THR 101 -7.015 2.034 8.487 811 1HG2 THR 101 HG21 THR 101 -5.894 5.210 9.240 812 2HG2 THR 101 HG22 THR 101 -6.732 4.228 8.038 813 3HG2 THR 101 HG23 THR 101 -4.969 4.280 8.059 814 H ARG 102 HN ARG 102 -2.739 1.606 11.076 815 HA ARG 102 HA ARG 102 -4.038 -0.845 11.979 816 1HB ARG 102 HB2 ARG 102 -1.256 0.153 12.597 817 2HB ARG 102 HB1 ARG 102 -1.884 -1.463 12.886 818 1HG ARG 102 HG2 ARG 102 -2.146 -1.758 10.444 819 2HG ARG 102 HG1 ARG 102 -1.408 -0.174 10.208 820 1HD ARG 102 HD2 ARG 102 -0.113 -2.526 11.579 821 2HD ARG 102 HD1 ARG 102 0.210 -1.999 9.927 822 HE ARG 102 HE ARG 102 0.638 0.168 11.638 823 1HH1 ARG 102 HH11 ARG 102 2.015 -2.962 10.949 824 2HH1 ARG 102 HH12 ARG 102 3.618 -2.497 11.408 825 1HH2 ARG 102 HH21 ARG 102 2.745 0.783 12.244 826 2HH2 ARG 102 HH22 ARG 102 4.033 -0.370 12.144 827 H VAL 103 HN VAL 103 -4.543 -1.309 14.082 828 HA VAL 103 HA VAL 103 -4.090 0.754 16.098 829 HB VAL 103 HB VAL 103 -6.805 -0.486 15.669 830 1HG1 VAL 103 HG11 VAL 103 -7.302 1.541 17.289 831 2HG1 VAL 103 HG12 VAL 103 -5.624 1.262 17.756 832 3HG1 VAL 103 HG13 VAL 103 -6.808 -0.037 17.904 833 1HG2 VAL 103 HG21 VAL 103 -5.868 2.321 15.095 834 2HG2 VAL 103 HG22 VAL 103 -7.531 1.745 14.976 835 3HG2 VAL 103 HG23 VAL 103 -6.295 1.103 13.893 836 H LYS 104 HN LYS 104 -3.368 -0.065 17.916 837 HA LYS 104 HA LYS 104 -4.241 -2.613 18.944 838 1HB LYS 104 HB2 LYS 104 -2.574 -3.372 17.344 839 2HB LYS 104 HB1 LYS 104 -1.394 -2.245 17.995 840 1HG LYS 104 HG2 LYS 104 -1.407 -3.463 20.117 841 2HG LYS 104 HG1 LYS 104 -2.579 -4.601 19.449 842 1HD LYS 104 HD2 LYS 104 -0.970 -5.252 17.725 843 2HD LYS 104 HD1 LYS 104 0.199 -4.102 18.376 844 1HE LYS 104 HE2 LYS 104 0.671 -6.381 19.123 845 2HE LYS 104 HE1 LYS 104 0.255 -5.331 20.478 846 1HZ LYS 104 HZ1 LYS 104 -1.623 -6.470 20.895 847 2HZ LYS 104 HZ2 LYS 104 -0.829 -7.724 20.085 848 3HZ LYS 104 HZ3 LYS 104 -1.956 -6.768 19.262 849 H ASP 105 HN ASP 105 -4.046 -2.684 21.129 850 HA ASP 105 HA ASP 105 -3.760 -1.885 23.246 851 1HB ASP 105 HB2 ASP 105 -1.034 -1.185 22.132 852 2HB ASP 105 HB1 ASP 105 -1.447 -1.239 23.843 853 H GLY 106 HN GLY 106 -4.924 -0.082 21.308 854 1HA GLY 106 HA2 GLY 106 -5.709 2.076 21.335 855 2HA GLY 106 HA1 GLY 106 -4.866 2.298 22.859 856 H ARG 107 HN ARG 107 -3.619 1.549 19.603 857 HA ARG 107 HA ARG 107 -2.245 4.152 19.615 858 1HB ARG 107 HB2 ARG 107 -0.170 3.217 18.979 859 2HB ARG 107 HB1 ARG 107 -0.732 2.223 20.315 860 1HG ARG 107 HG2 ARG 107 -1.660 0.662 18.507 861 2HG ARG 107 HG1 ARG 107 -0.632 1.563 17.398 862 1HD ARG 107 HD2 ARG 107 0.291 0.119 19.878 863 2HD ARG 107 HD1 ARG 107 0.486 -0.449 18.221 864 HE ARG 107 HE ARG 107 1.637 2.084 18.398 865 1HH1 ARG 107 HH11 ARG 107 2.142 -1.125 19.673 866 2HH1 ARG 107 HH12 ARG 107 3.856 -0.931 19.825 867 1HH2 ARG 107 HH21 ARG 107 3.889 2.344 18.594 868 2HH2 ARG 107 HH22 ARG 107 4.850 1.042 19.212 869 H THR 108 HN THR 108 -2.322 5.216 17.698 870 HA THR 108 HA THR 108 -3.538 3.774 15.435 871 HB THR 108 HB THR 108 -3.628 6.723 16.096 872 HG1 THR 108 HG1 THR 108 -5.246 6.125 17.266 873 1HG2 THR 108 HG21 THR 108 -5.153 5.259 13.960 874 2HG2 THR 108 HG22 THR 108 -3.731 6.259 13.662 875 3HG2 THR 108 HG23 THR 108 -5.198 6.985 14.320 876 H LEU 109 HN LEU 109 -2.579 3.749 13.486 877 HA LEU 109 HA LEU 109 -0.323 5.535 12.950 878 1HB LEU 109 HB2 LEU 109 -0.199 2.536 12.615 879 2HB LEU 109 HB1 LEU 109 1.024 3.667 12.074 880 HG LEU 109 HG LEU 109 1.341 4.329 14.487 881 1HD1 LEU 109 HD11 LEU 109 -0.891 2.541 14.790 882 2HD1 LEU 109 HD12 LEU 109 -0.140 3.611 15.974 883 3HD1 LEU 109 HD13 LEU 109 0.485 1.979 15.739 884 1HD2 LEU 109 HD21 LEU 109 2.716 2.662 13.119 885 2HD2 LEU 109 HD22 LEU 109 1.878 1.412 14.039 886 3HD2 LEU 109 HD23 LEU 109 2.872 2.605 14.875 887 H HIS 110 HN HIS 110 -0.296 6.246 10.872 888 HA HIS 110 HA HIS 110 -2.246 4.992 9.053 889 1HB HIS 110 HB2 HIS 110 -1.121 7.786 9.027 890 2HB HIS 110 HB1 HIS 110 -2.311 7.156 7.892 891 HD1 HIS 110 HD1 HIS 110 -2.062 7.346 11.694 892 HD2 HIS 110 HD2 HIS 110 -4.785 7.961 8.615 893 HE1 HIS 110 HE1 HIS 110 -4.189 8.082 12.815 894 HE2 HIS 110 HE2 HIS 110 -5.802 8.514 10.929 895 H MET 111 HN MET 111 -1.659 4.298 7.063 896 HA MET 111 HA MET 111 0.867 4.999 5.874 897 1HB MET 111 HB2 MET 111 0.410 2.102 6.612 898 2HB MET 111 HB1 MET 111 1.826 2.785 5.826 899 1HG MET 111 HG2 MET 111 2.340 4.045 7.862 900 2HG MET 111 HG1 MET 111 0.932 3.334 8.647 901 1HE MET 111 HE1 MET 111 3.686 3.174 10.069 902 2HE MET 111 HE2 MET 111 3.775 1.474 10.527 903 3HE MET 111 HE3 MET 111 2.254 2.350 10.686 904 H MET 112 HN MET 112 0.475 5.155 3.774 905 HA MET 112 HA MET 112 -1.716 3.574 2.619 906 1HB MET 112 HB2 MET 112 -0.659 6.299 2.053 907 2HB MET 112 HB1 MET 112 -1.411 5.404 0.749 908 1HG MET 112 HG2 MET 112 -3.443 5.194 2.080 909 2HG MET 112 HG1 MET 112 -2.687 6.112 3.378 910 1HE MET 112 HE1 MET 112 -5.635 7.756 1.464 911 2HE MET 112 HE2 MET 112 -4.935 8.532 2.885 912 3HE MET 112 HE3 MET 112 -5.127 6.779 2.842 913 H ARG 113 HN ARG 113 -1.485 2.622 0.624 914 HA ARG 113 HA ARG 113 1.161 2.558 -0.590 915 1HB ARG 113 HB2 ARG 113 1.218 0.680 0.935 916 2HB ARG 113 HB1 ARG 113 -0.344 0.115 0.360 917 1HG ARG 113 HG2 ARG 113 0.533 -0.632 -1.660 918 2HG ARG 113 HG1 ARG 113 1.991 0.343 -1.493 919 1HD ARG 113 HD2 ARG 113 1.263 -1.999 0.261 920 2HD ARG 113 HD1 ARG 113 2.386 -2.066 -1.096 921 HE ARG 113 HE ARG 113 3.206 -0.039 0.664 922 1HH1 ARG 113 HH11 ARG 113 2.976 -3.517 0.520 923 2HH1 ARG 113 HH12 ARG 113 4.309 -3.775 1.596 924 1HH2 ARG 113 HH21 ARG 113 4.962 -0.376 2.075 925 2HH2 ARG 113 HH22 ARG 113 5.436 -1.992 2.480 926 H LEU 114 HN LEU 114 1.058 2.499 -2.769 927 HA LEU 114 HA LEU 114 -1.615 2.139 -3.954 928 1HB LEU 114 HB2 LEU 114 -0.632 4.426 -4.062 929 2HB LEU 114 HB1 LEU 114 0.693 3.777 -5.006 930 HG LEU 114 HG LEU 114 -2.198 3.713 -5.875 931 1HD1 LEU 114 HD11 LEU 114 -0.096 5.489 -7.046 932 2HD1 LEU 114 HD12 LEU 114 -1.018 6.001 -5.632 933 3HD1 LEU 114 HD13 LEU 114 -1.852 5.622 -7.139 934 1HD2 LEU 114 HD21 LEU 114 -0.919 3.428 -8.134 935 2HD2 LEU 114 HD22 LEU 114 -1.197 2.034 -7.090 936 3HD2 LEU 114 HD23 LEU 114 0.377 2.830 -7.098 937 H TYR 115 HN TYR 115 -1.854 0.381 -5.138 938 HA TYR 115 HA TYR 115 0.533 -0.875 -6.288 939 1HB TYR 115 HB2 TYR 115 -2.190 -1.996 -5.638 940 2HB TYR 115 HB1 TYR 115 -0.963 -2.887 -6.528 941 HD1 TYR 115 HD1 TYR 115 1.392 -3.015 -5.310 942 HD2 TYR 115 HD2 TYR 115 -2.312 -2.287 -3.347 943 HE1 TYR 115 HE1 TYR 115 2.360 -3.819 -3.198 944 HE2 TYR 115 HE2 TYR 115 -1.350 -3.087 -1.228 945 HH TYR 115 HH TYR 115 0.460 -4.508 -0.450 946 H SER 116 HN SER 116 0.863 -0.802 -8.400 947 HA SER 116 HA SER 116 -1.440 -0.297 -10.168 948 1HB SER 116 HB2 SER 116 -0.048 1.728 -9.997 949 2HB SER 116 HB1 SER 116 1.371 0.797 -10.478 950 HG SER 116 HG SER 116 0.751 0.910 -12.486 951 H ARG 117 HN ARG 117 -1.705 -1.750 -11.757 952 HA ARG 117 HA ARG 117 0.115 -3.962 -11.939 953 1HB ARG 117 HB2 ARG 117 -2.518 -3.279 -13.152 954 2HB ARG 117 HB1 ARG 117 -1.535 -4.509 -13.937 955 1HG ARG 117 HG2 ARG 117 -2.101 -6.026 -12.427 956 2HG ARG 117 HG1 ARG 117 -1.635 -4.962 -11.100 957 1HD ARG 117 HD2 ARG 117 -4.278 -4.948 -12.554 958 2HD ARG 117 HD1 ARG 117 -3.986 -5.595 -10.940 959 HE ARG 117 HE ARG 117 -4.496 -2.904 -11.590 960 1HH1 ARG 117 HH11 ARG 117 -2.532 -4.869 -9.481 961 2HH1 ARG 117 HH12 ARG 117 -2.290 -3.605 -8.324 962 1HH2 ARG 117 HH21 ARG 117 -4.180 -1.249 -10.075 963 2HH2 ARG 117 HH22 ARG 117 -3.232 -1.549 -8.658 964 H SER 118 HN SER 118 -0.637 -1.165 -13.934 965 HA SER 118 HA SER 118 1.609 -1.942 -15.673 966 1HB SER 118 HB2 SER 118 -0.899 -0.449 -16.477 967 2HB SER 118 HB1 SER 118 0.468 -0.799 -17.535 968 HG SER 118 HG SER 118 -0.159 -2.816 -17.700 969 HA PRO 119 HA PRO 119 3.829 1.697 -14.518 970 1HB PRO 119 HB2 PRO 119 4.200 1.978 -17.474 971 2HB PRO 119 HB1 PRO 119 5.401 2.060 -16.179 972 1HG PRO 119 HG2 PRO 119 5.174 -0.122 -17.686 973 2HG PRO 119 HG1 PRO 119 5.505 -0.243 -15.949 974 1HD PRO 119 HD2 PRO 119 2.997 -0.803 -17.441 975 2HD PRO 119 HD1 PRO 119 3.611 -1.533 -15.946 976 H GLU 120 HN GLU 120 1.423 1.770 -17.054 977 HA GLU 120 HA GLU 120 1.212 4.553 -17.399 978 1HB GLU 120 HB2 GLU 120 0.325 2.953 -19.007 979 2HB GLU 120 HB1 GLU 120 -0.831 2.370 -17.822 980 1HG GLU 120 HG2 GLU 120 -1.853 3.842 -19.477 981 2HG GLU 120 HG1 GLU 120 -1.989 4.486 -17.845 982 H VAL 121 HN VAL 121 1.409 4.809 -14.864 983 HA VAL 121 HA VAL 121 -0.990 4.495 -13.357 984 HB VAL 121 HB VAL 121 1.387 6.278 -12.785 985 1HG1 VAL 121 HG11 VAL 121 -0.570 6.987 -11.531 986 2HG1 VAL 121 HG12 VAL 121 0.592 6.212 -10.454 987 3HG1 VAL 121 HG13 VAL 121 -0.843 5.334 -10.981 988 1HG2 VAL 121 HG21 VAL 121 0.813 3.399 -12.286 989 2HG2 VAL 121 HG22 VAL 121 1.728 4.301 -11.078 990 3HG2 VAL 121 HG23 VAL 121 2.325 4.186 -12.734 991 H SER 122 HN SER 122 -2.718 5.473 -14.266 992 HA SER 122 HA SER 122 -2.793 7.932 -15.568 993 1HB SER 122 HB2 SER 122 -4.599 6.248 -15.678 994 2HB SER 122 HB1 SER 122 -5.010 6.603 -14.000 995 HG SER 122 HG SER 122 -5.493 8.076 -16.301 996 HA PRO 123 HA PRO 123 -2.442 11.128 -12.535 997 1HB PRO 123 HB2 PRO 123 -4.607 12.693 -13.375 998 2HB PRO 123 HB1 PRO 123 -2.952 12.814 -13.979 999 1HG PRO 123 HG2 PRO 123 -5.299 11.391 -15.147 1000 2HG PRO 123 HG1 PRO 123 -4.002 12.281 -15.967 1001 1HD PRO 123 HD2 PRO 123 -4.025 9.615 -15.941 1002 2HD PRO 123 HD1 PRO 123 -2.501 10.511 -15.770 1003 H ALA 124 HN ALA 124 -5.583 9.685 -13.221 1004 HA ALA 124 HA ALA 124 -6.962 10.646 -10.970 1005 1HB ALA 124 HB1 ALA 124 -8.176 8.262 -11.442 1006 2HB ALA 124 HB2 ALA 124 -7.394 8.565 -12.994 1007 3HB ALA 124 HB3 ALA 124 -8.515 9.749 -12.325 1008 H ALA 125 HN ALA 125 -5.357 7.517 -11.508 1009 HA ALA 125 HA ALA 125 -5.829 6.367 -9.047 1010 1HB ALA 125 HB1 ALA 125 -3.152 5.776 -9.949 1011 2HB ALA 125 HB2 ALA 125 -4.297 5.772 -11.289 1012 3HB ALA 125 HB3 ALA 125 -4.578 4.740 -9.888 1013 H THR 126 HN THR 126 -3.087 8.409 -9.998 1014 HA THR 126 HA THR 126 -1.939 8.401 -7.385 1015 HB THR 126 HB THR 126 -1.412 10.200 -9.746 1016 HG1 THR 126 HG1 THR 126 -0.014 7.910 -8.830 1017 1HG2 THR 126 HG21 THR 126 -0.045 9.924 -7.116 1018 2HG2 THR 126 HG22 THR 126 -0.391 11.369 -8.066 1019 3HG2 THR 126 HG23 THR 126 0.899 10.275 -8.563 1020 H ALA 127 HN ALA 127 -3.678 10.884 -9.268 1021 HA ALA 127 HA ALA 127 -3.650 12.804 -7.183 1022 1HB ALA 127 HB1 ALA 127 -5.658 12.773 -9.408 1023 2HB ALA 127 HB2 ALA 127 -3.970 13.208 -9.678 1024 3HB ALA 127 HB3 ALA 127 -4.959 14.159 -8.570 1025 H ILE 128 HN ILE 128 -6.262 10.672 -8.380 1026 HA ILE 128 HA ILE 128 -8.192 11.508 -6.550 1027 HB ILE 128 HB ILE 128 -7.939 8.769 -7.803 1028 1HG1 ILE 128 HG12 ILE 128 -9.615 11.162 -8.608 1029 2HG1 ILE 128 HG11 ILE 128 -8.134 10.655 -9.411 1030 1HG2 ILE 128 HG21 ILE 128 -9.670 8.144 -6.560 1031 2HG2 ILE 128 HG22 ILE 128 -10.628 9.460 -7.240 1032 3HG2 ILE 128 HG23 ILE 128 -9.691 9.718 -5.769 1033 1HD1 ILE 128 HD11 ILE 128 -9.810 9.789 -10.749 1034 2HD1 ILE 128 HD12 ILE 128 -10.805 9.319 -9.370 1035 3HD1 ILE 128 HD13 ILE 128 -9.339 8.415 -9.750 1036 H PHE 129 HN PHE 129 -5.671 9.032 -6.227 1037 HA PHE 129 HA PHE 129 -6.610 8.017 -3.754 1038 1HB PHE 129 HB2 PHE 129 -4.931 6.834 -5.147 1039 2HB PHE 129 HB1 PHE 129 -3.758 8.094 -4.778 1040 HD1 PHE 129 HD1 PHE 129 -6.192 6.594 -2.423 1041 HD2 PHE 129 HD2 PHE 129 -2.118 6.833 -3.639 1042 HE1 PHE 129 HE1 PHE 129 -5.520 5.361 -0.403 1043 HE2 PHE 129 HE2 PHE 129 -1.442 5.598 -1.618 1044 HZ PHE 129 HZ PHE 129 -3.145 4.862 0.001 1045 H ARG 130 HN ARG 130 -4.315 10.548 -4.625 1046 HA ARG 130 HA ARG 130 -3.620 11.276 -1.975 1047 1HB ARG 130 HB2 ARG 130 -2.206 11.869 -3.876 1048 2HB ARG 130 HB1 ARG 130 -3.499 12.840 -4.562 1049 1HG ARG 130 HG2 ARG 130 -3.361 14.378 -2.681 1050 2HG ARG 130 HG1 ARG 130 -2.084 13.396 -1.961 1051 1HD ARG 130 HD2 ARG 130 -1.190 15.355 -3.154 1052 2HD ARG 130 HD1 ARG 130 -0.635 13.838 -3.859 1053 HE ARG 130 HE ARG 130 -1.635 14.465 -5.803 1054 1HH1 ARG 130 HH11 ARG 130 -3.146 16.236 -3.201 1055 2HH1 ARG 130 HH12 ARG 130 -4.217 17.102 -4.249 1056 1HH2 ARG 130 HH21 ARG 130 -3.044 15.604 -7.178 1057 2HH2 ARG 130 HH22 ARG 130 -4.160 16.744 -6.504 1058 H LYS 131 HN LYS 131 -5.959 12.508 -4.325 1059 HA LYS 131 HA LYS 131 -6.992 14.614 -2.756 1060 1HB LYS 131 HB2 LYS 131 -7.358 14.397 -5.203 1061 2HB LYS 131 HB1 LYS 131 -8.375 12.995 -4.908 1062 1HG LYS 131 HG2 LYS 131 -9.961 14.384 -3.687 1063 2HG LYS 131 HG1 LYS 131 -8.937 15.795 -3.952 1064 1HD LYS 131 HD2 LYS 131 -10.756 15.779 -5.554 1065 2HD LYS 131 HD1 LYS 131 -9.220 15.520 -6.384 1066 1HE LYS 131 HE2 LYS 131 -9.662 13.112 -6.441 1067 2HE LYS 131 HE1 LYS 131 -11.196 13.374 -5.612 1068 1HZ LYS 131 HZ1 LYS 131 -11.428 13.136 -8.038 1069 2HZ LYS 131 HZ2 LYS 131 -10.500 14.533 -8.256 1070 3HZ LYS 131 HZ3 LYS 131 -11.997 14.628 -7.475 1071 H LEU 132 HN LEU 132 -7.940 11.260 -3.228 1072 HA LEU 132 HA LEU 132 -10.202 11.249 -1.552 1073 1HB LEU 132 HB2 LEU 132 -9.709 9.507 -3.224 1074 2HB LEU 132 HB1 LEU 132 -8.332 8.988 -2.273 1075 HG LEU 132 HG LEU 132 -9.797 8.246 -0.483 1076 1HD1 LEU 132 HD11 LEU 132 -12.241 8.272 -0.791 1077 2HD1 LEU 132 HD12 LEU 132 -12.029 9.245 -2.247 1078 3HD1 LEU 132 HD13 LEU 132 -11.559 9.895 -0.676 1079 1HD2 LEU 132 HD21 LEU 132 -11.181 6.577 -1.932 1080 2HD2 LEU 132 HD22 LEU 132 -9.419 6.504 -1.945 1081 3HD2 LEU 132 HD23 LEU 132 -10.279 7.287 -3.269 1082 H ALA 133 HN ALA 133 -6.773 10.784 -0.990 1083 HA ALA 133 HA ALA 133 -6.851 9.803 1.631 1084 1HB ALA 133 HB1 ALA 133 -4.570 11.195 1.693 1085 2HB ALA 133 HB2 ALA 133 -4.844 11.195 -0.049 1086 3HB ALA 133 HB3 ALA 133 -4.729 9.669 0.823 1087 H GLY 134 HN GLY 134 -6.888 13.102 0.362 1088 1HA GLY 134 HA2 GLY 134 -6.758 14.431 2.852 1089 2HA GLY 134 HA1 GLY 134 -7.364 15.118 1.354 1090 H GLU 135 HN GLU 135 -9.463 13.206 0.964 1091 HA GLU 135 HA GLU 135 -11.605 14.429 2.158 1092 1HB GLU 135 HB2 GLU 135 -11.434 11.525 1.339 1093 2HB GLU 135 HB1 GLU 135 -12.916 12.443 1.569 1094 1HG GLU 135 HG2 GLU 135 -10.805 12.946 -0.514 1095 2HG GLU 135 HG1 GLU 135 -12.404 12.251 -0.775 1096 H ARG 136 HN ARG 136 -9.626 11.833 3.408 1097 HA ARG 136 HA ARG 136 -11.302 11.159 5.600 1098 1HB ARG 136 HB2 ARG 136 -8.356 10.705 5.113 1099 2HB ARG 136 HB1 ARG 136 -9.211 10.085 6.517 1100 1HG ARG 136 HG2 ARG 136 -8.969 8.369 4.828 1101 2HG ARG 136 HG1 ARG 136 -10.668 8.777 5.059 1102 1HD ARG 136 HD2 ARG 136 -10.619 10.166 3.061 1103 2HD ARG 136 HD1 ARG 136 -8.907 9.814 2.838 1104 HE ARG 136 HE ARG 136 -9.525 7.875 1.823 1105 1HH1 ARG 136 HH11 ARG 136 -12.159 8.915 3.864 1106 2HH1 ARG 136 HH12 ARG 136 -13.200 7.614 3.394 1107 1HH2 ARG 136 HH21 ARG 136 -10.898 6.168 1.200 1108 2HH2 ARG 136 HH22 ARG 136 -12.486 6.057 1.881 1109 H ASN 137 HN ASN 137 -8.561 13.348 5.187 1110 HA ASN 137 HA ASN 137 -9.439 15.068 7.243 1111 1HB ASN 137 HB2 ASN 137 -7.551 14.740 8.827 1112 2HB ASN 137 HB1 ASN 137 -8.640 13.357 8.756 1113 1HD2 ASN 137 HD21 ASN 137 -5.562 14.073 9.109 1114 2HD2 ASN 137 HD22 ASN 137 -4.809 12.735 8.317 1115 H TYR 138 HN TYR 138 -6.596 13.927 5.428 1116 HA TYR 138 HA TYR 138 -6.216 16.310 4.036 1117 1HB TYR 138 HB2 TYR 138 -5.658 17.066 6.436 1118 2HB TYR 138 HB1 TYR 138 -4.189 16.118 6.249 1119 HD1 TYR 138 HD1 TYR 138 -6.009 18.309 3.850 1120 HD2 TYR 138 HD2 TYR 138 -2.419 17.615 6.026 1121 HE1 TYR 138 HE1 TYR 138 -4.952 20.205 2.692 1122 HE2 TYR 138 HE2 TYR 138 -1.354 19.508 4.873 1123 HH TYR 138 HH TYR 138 -2.566 21.819 3.608 1124 H THR 139 HN THR 139 -4.195 16.318 2.757 1125 HA THR 139 HA THR 139 -3.316 13.586 2.317 1126 HB THR 139 HB THR 139 -3.907 14.847 0.346 1127 HG1 THR 139 HG1 THR 139 -2.144 13.376 0.199 1128 1HG2 THR 139 HG21 THR 139 -3.008 17.086 1.450 1129 2HG2 THR 139 HG22 THR 139 -3.113 16.867 -0.297 1130 3HG2 THR 139 HG23 THR 139 -1.572 16.647 0.531 1131 H ASP 140 HN ASP 140 -1.647 16.738 2.835 1132 HA ASP 140 HA ASP 140 0.911 15.608 3.085 1133 1HB ASP 140 HB2 ASP 140 -0.127 18.140 4.385 1134 2HB ASP 140 HB1 ASP 140 1.569 17.703 4.205 1135 H GLU 141 HN GLU 141 -1.673 16.063 5.401 1136 HA GLU 141 HA GLU 141 -0.313 15.485 7.779 1137 1HB GLU 141 HB2 GLU 141 -2.687 16.251 7.650 1138 2HB GLU 141 HB1 GLU 141 -3.136 14.665 7.048 1139 1HG GLU 141 HG2 GLU 141 -3.668 14.721 9.344 1140 2HG GLU 141 HG1 GLU 141 -2.236 13.705 9.174 1141 H MET 142 HN MET 142 -1.411 13.532 5.153 1142 HA MET 142 HA MET 142 -0.038 11.197 6.252 1143 1HB MET 142 HB2 MET 142 -2.621 10.797 4.781 1144 2HB MET 142 HB1 MET 142 -1.807 9.725 5.910 1145 1HG MET 142 HG2 MET 142 -2.458 11.196 7.762 1146 2HG MET 142 HG1 MET 142 -3.292 12.244 6.620 1147 1HE MET 142 HE1 MET 142 -6.215 10.004 5.359 1148 2HE MET 142 HE2 MET 142 -4.635 10.163 4.592 1149 3HE MET 142 HE3 MET 142 -5.430 11.581 5.276 1150 H VAL 143 HN VAL 143 1.541 12.114 4.701 1151 HA VAL 143 HA VAL 143 0.922 11.314 1.927 1152 HB VAL 143 HB VAL 143 1.038 13.759 2.101 1153 1HG1 VAL 143 HG11 VAL 143 3.912 13.420 2.951 1154 2HG1 VAL 143 HG12 VAL 143 2.600 13.717 4.090 1155 3HG1 VAL 143 HG13 VAL 143 2.976 14.914 2.853 1156 1HG2 VAL 143 HG21 VAL 143 2.142 13.984 0.136 1157 2HG2 VAL 143 HG22 VAL 143 2.239 12.228 0.219 1158 3HG2 VAL 143 HG23 VAL 143 3.603 13.208 0.750 1159 H ALA 144 HN ALA 144 2.601 10.522 0.659 1160 HA ALA 144 HA ALA 144 5.270 10.210 1.551 1161 1HB ALA 144 HB1 ALA 144 3.551 8.265 2.564 1162 2HB ALA 144 HB2 ALA 144 5.310 8.206 2.510 1163 3HB ALA 144 HB3 ALA 144 4.367 7.492 1.207 1164 H MET 145 HN MET 145 6.566 9.929 -0.201 1165 HA MET 145 HA MET 145 5.281 9.040 -2.700 1166 1HB MET 145 HB2 MET 145 6.641 10.738 -3.899 1167 2HB MET 145 HB1 MET 145 5.440 11.432 -2.819 1168 1HG MET 145 HG2 MET 145 7.216 11.779 -1.134 1169 2HG MET 145 HG1 MET 145 8.395 11.178 -2.299 1170 1HE MET 145 HE1 MET 145 7.182 13.343 -5.224 1171 2HE MET 145 HE2 MET 145 8.043 11.891 -4.713 1172 3HE MET 145 HE3 MET 145 8.909 13.419 -4.873 1173 H LEU 146 HN LEU 146 6.424 7.749 -4.038 1174 HA LEU 146 HA LEU 146 8.313 6.010 -3.284 1175 1HB LEU 146 HB2 LEU 146 7.173 6.073 -5.497 1176 2HB LEU 146 HB1 LEU 146 8.273 7.339 -5.996 1177 HG LEU 146 HG LEU 146 9.109 4.527 -5.262 1178 1HD1 LEU 146 HD11 LEU 146 9.578 5.288 -7.998 1179 2HD1 LEU 146 HD12 LEU 146 7.864 5.414 -7.603 1180 3HD1 LEU 146 HD13 LEU 146 8.719 3.892 -7.350 1181 1HD2 LEU 146 HD21 LEU 146 11.053 5.653 -4.921 1182 2HD2 LEU 146 HD22 LEU 146 10.596 6.992 -5.974 1183 3HD2 LEU 146 HD23 LEU 146 11.160 5.473 -6.671 1184 HA PRO 147 HA PRO 147 11.960 8.527 -2.663 1185 1HB PRO 147 HB2 PRO 147 13.494 6.612 -1.568 1186 2HB PRO 147 HB1 PRO 147 12.150 7.348 -0.688 1187 1HG PRO 147 HG2 PRO 147 12.336 4.680 -1.974 1188 2HG PRO 147 HG1 PRO 147 11.424 5.181 -0.542 1189 1HD PRO 147 HD2 PRO 147 10.409 4.832 -3.139 1190 2HD PRO 147 HD1 PRO 147 9.581 5.603 -1.774 1191 H ARG 148 HN ARG 148 13.142 9.066 -4.380 1192 HA ARG 148 HA ARG 148 14.250 6.936 -6.067 1193 1HB ARG 148 HB2 ARG 148 14.655 8.989 -7.638 1194 2HB ARG 148 HB1 ARG 148 13.057 8.270 -7.509 1195 1HG ARG 148 HG2 ARG 148 12.916 10.685 -7.486 1196 2HG ARG 148 HG1 ARG 148 12.392 10.021 -5.939 1197 1HD ARG 148 HD2 ARG 148 13.765 11.944 -5.530 1198 2HD ARG 148 HD1 ARG 148 14.647 10.504 -5.028 1199 HE ARG 148 HE ARG 148 15.342 11.105 -7.675 1200 1HH1 ARG 148 HH11 ARG 148 15.730 12.405 -4.463 1201 2HH1 ARG 148 HH12 ARG 148 17.237 13.179 -4.821 1202 1HH2 ARG 148 HH21 ARG 148 17.326 12.122 -8.152 1203 2HH2 ARG 148 HH22 ARG 148 18.143 13.019 -6.917 1204 H GLN 149 HN GLN 149 15.800 6.817 -4.095 1205 HA GLN 149 HA GLN 149 18.267 8.038 -4.944 1206 1HB GLN 149 HB2 GLN 149 17.146 8.703 -2.221 1207 2HB GLN 149 HB1 GLN 149 18.776 9.073 -2.760 1208 1HG GLN 149 HG2 GLN 149 17.812 10.485 -4.546 1209 2HG GLN 149 HG1 GLN 149 16.213 10.181 -3.868 1210 1HE2 GLN 149 HE21 GLN 149 15.498 11.718 -2.598 1211 2HE2 GLN 149 HE22 GLN 149 16.459 12.768 -1.620 1212 H GLU 150 HN GLU 150 20.078 6.978 -4.219 1213 HA GLU 150 HA GLU 150 19.623 4.368 -3.067 1214 1HB GLU 150 HB2 GLU 150 22.070 4.051 -3.415 1215 2HB GLU 150 HB1 GLU 150 21.188 4.457 -4.880 1216 1HG GLU 150 HG2 GLU 150 21.936 6.805 -4.612 1217 2HG GLU 150 HG1 GLU 150 22.915 6.292 -3.237 1218 H GLU 151 HN GLU 151 18.831 5.921 -1.163 1219 HA GLU 151 HA GLU 151 20.453 5.323 1.043 1220 1HB GLU 151 HB2 GLU 151 21.202 7.507 1.755 1221 2HB GLU 151 HB1 GLU 151 21.821 7.199 0.139 1222 1HG GLU 151 HG2 GLU 151 20.007 8.574 -0.792 1223 2HG GLU 151 HG1 GLU 151 19.463 8.921 0.848 1224 H CYS 152 HN CYS 152 19.376 5.690 3.000 1225 HA CYS 152 HA CYS 152 16.617 5.703 2.972 1226 1HB CYS 152 HB2 CYS 152 18.388 6.636 5.239 1227 2HB CYS 152 HB1 CYS 152 16.725 6.084 5.389 1228 H THR 153 HN THR 153 16.106 7.479 1.497 1229 HA THR 153 HA THR 153 15.442 9.916 2.907 1230 HB THR 153 HB THR 153 17.774 10.342 2.142 1231 HG1 THR 153 HG1 THR 153 16.521 12.143 2.263 1232 1HG2 THR 153 HG21 THR 153 17.703 8.971 0.076 1233 2HG2 THR 153 HG22 THR 153 18.305 10.606 -0.178 1234 3HG2 THR 153 HG23 THR 153 16.658 10.189 -0.649 1235 H VAL 154 HN VAL 154 13.926 11.246 1.729 1236 HA VAL 154 HA VAL 154 12.936 10.213 -0.800 1237 HB VAL 154 HB VAL 154 11.693 8.926 0.888 1238 1HG1 VAL 154 HG11 VAL 154 11.193 9.934 2.812 1239 2HG1 VAL 154 HG12 VAL 154 9.872 10.719 1.950 1240 3HG1 VAL 154 HG13 VAL 154 11.423 11.539 2.121 1241 1HG2 VAL 154 HG21 VAL 154 10.143 10.949 -0.711 1242 2HG2 VAL 154 HG22 VAL 154 9.399 9.571 0.098 1243 3HG2 VAL 154 HG23 VAL 154 10.587 9.307 -1.178 1244 H ASP 155 HN ASP 155 11.863 11.713 -2.047 1245 HA ASP 155 HA ASP 155 12.413 14.415 -1.659 1246 1HB ASP 155 HB2 ASP 155 11.901 13.460 -3.864 1247 2HB ASP 155 HB1 ASP 155 10.236 13.175 -3.364 1248 H GLU 156 HN GLU 156 11.344 16.098 -0.760 1249 HA GLU 156 HA GLU 156 8.611 16.172 -0.129 1250 1HB GLU 156 HB2 GLU 156 8.715 15.974 2.326 1251 2HB GLU 156 HB1 GLU 156 9.133 14.467 1.524 1252 1HG GLU 156 HG2 GLU 156 11.501 14.923 1.890 1253 2HG GLU 156 HG1 GLU 156 11.086 16.440 2.686 1254 H VAL 157 HN VAL 157 10.295 17.939 -1.325 1255 HA VAL 157 HA VAL 157 9.973 20.268 0.341 1256 HB VAL 157 HB VAL 157 12.311 21.029 0.147 1257 1HG1 VAL 157 HG11 VAL 157 13.173 19.781 1.962 1258 2HG1 VAL 157 HG12 VAL 157 12.241 18.352 1.518 1259 3HG1 VAL 157 HG13 VAL 157 11.420 19.777 2.154 1260 1HG2 VAL 157 HG21 VAL 157 13.363 18.340 -0.400 1261 2HG2 VAL 157 HG22 VAL 157 13.933 19.917 -0.947 1262 3HG2 VAL 157 HG23 VAL 157 12.588 19.131 -1.772 Start of MODEL 10 1 1H MET 1 HT1 MET 1 -15.363 -4.025 -19.313 2 2H MET 1 HT2 MET 1 -14.014 -4.324 -18.338 3 3H MET 1 HT3 MET 1 -14.120 -2.879 -19.209 4 HA MET 1 HA MET 1 -14.724 -2.149 -17.157 5 1HB MET 1 HB2 MET 1 -17.283 -3.150 -18.437 6 2HB MET 1 HB1 MET 1 -17.209 -1.936 -17.169 7 1HG MET 1 HG2 MET 1 -17.483 -0.751 -19.165 8 2HG MET 1 HG1 MET 1 -15.787 -0.562 -18.730 9 1HE MET 1 HE1 MET 1 -18.191 -2.866 -20.294 10 2HE MET 1 HE2 MET 1 -17.075 -4.014 -21.035 11 3HE MET 1 HE3 MET 1 -17.829 -2.757 -22.016 12 H THR 2 HN THR 2 -17.348 -3.161 -15.915 13 HA THR 2 HA THR 2 -16.214 -4.704 -13.879 14 HB THR 2 HB THR 2 -18.540 -5.119 -13.156 15 HG1 THR 2 HG1 THR 2 -19.939 -5.235 -14.704 16 1HG2 THR 2 HG21 THR 2 -18.967 -2.376 -13.915 17 2HG2 THR 2 HG22 THR 2 -17.320 -2.635 -13.339 18 3HG2 THR 2 HG23 THR 2 -18.691 -3.078 -12.321 19 H VAL 3 HN VAL 3 -15.979 -6.844 -13.553 20 HA VAL 3 HA VAL 3 -17.438 -8.887 -14.780 21 HB VAL 3 HB VAL 3 -16.339 -8.162 -16.849 22 1HG1 VAL 3 HG11 VAL 3 -13.893 -8.462 -17.097 23 2HG1 VAL 3 HG12 VAL 3 -13.784 -8.759 -15.362 24 3HG1 VAL 3 HG13 VAL 3 -14.323 -7.188 -15.956 25 1HG2 VAL 3 HG21 VAL 3 -16.889 -10.521 -16.574 26 2HG2 VAL 3 HG22 VAL 3 -15.318 -10.812 -15.827 27 3HG2 VAL 3 HG23 VAL 3 -15.413 -10.330 -17.520 28 HA PRO 4 HA PRO 4 -15.575 -11.033 -11.377 29 1HB PRO 4 HB2 PRO 4 -15.948 -13.407 -13.163 30 2HB PRO 4 HB1 PRO 4 -16.427 -13.182 -11.477 31 1HG PRO 4 HG2 PRO 4 -18.235 -13.044 -13.400 32 2HG PRO 4 HG1 PRO 4 -18.279 -11.892 -12.051 33 1HD PRO 4 HD2 PRO 4 -17.323 -11.490 -14.858 34 2HD PRO 4 HD1 PRO 4 -18.229 -10.384 -13.804 35 H ASP 5 HN ASP 5 -14.410 -13.625 -13.210 36 HA ASP 5 HA ASP 5 -12.352 -14.298 -13.880 37 1HB ASP 5 HB2 ASP 5 -11.831 -11.331 -14.192 38 2HB ASP 5 HB1 ASP 5 -10.792 -12.613 -14.803 39 H ARG 6 HN ARG 6 -10.827 -15.119 -12.604 40 HA ARG 6 HA ARG 6 -10.388 -14.153 -9.989 41 1HB ARG 6 HB2 ARG 6 -8.627 -15.875 -9.858 42 2HB ARG 6 HB1 ARG 6 -10.133 -16.511 -10.506 43 1HG ARG 6 HG2 ARG 6 -9.204 -16.347 -12.776 44 2HG ARG 6 HG1 ARG 6 -7.683 -15.764 -12.093 45 1HD ARG 6 HD2 ARG 6 -7.455 -17.852 -10.832 46 2HD ARG 6 HD1 ARG 6 -8.970 -18.432 -11.519 47 HE ARG 6 HE ARG 6 -7.241 -17.767 -13.618 48 1HH1 ARG 6 HH11 ARG 6 -7.526 -20.114 -11.051 49 2HH1 ARG 6 HH12 ARG 6 -6.666 -21.347 -11.910 50 1HH2 ARG 6 HH21 ARG 6 -6.105 -19.393 -14.753 51 2HH2 ARG 6 HH22 ARG 6 -5.859 -20.938 -14.010 52 H SER 7 HN SER 7 -8.730 -13.672 -13.022 53 HA SER 7 HA SER 7 -6.254 -12.759 -12.262 54 1HB SER 7 HB2 SER 7 -6.954 -13.013 -14.609 55 2HB SER 7 HB1 SER 7 -8.013 -11.612 -14.447 56 HG SER 7 HG SER 7 -6.340 -10.320 -14.577 57 H GLU 8 HN GLU 8 -9.336 -11.118 -12.029 58 HA GLU 8 HA GLU 8 -8.720 -8.493 -11.751 59 1HB GLU 8 HB2 GLU 8 -10.633 -8.260 -10.292 60 2HB GLU 8 HB1 GLU 8 -10.995 -9.458 -11.529 61 1HG GLU 8 HG2 GLU 8 -10.508 -11.243 -9.919 62 2HG GLU 8 HG1 GLU 8 -10.198 -10.027 -8.685 63 H ILE 9 HN ILE 9 -8.108 -11.042 -9.428 64 HA ILE 9 HA ILE 9 -6.441 -9.172 -7.901 65 HB ILE 9 HB ILE 9 -8.376 -11.180 -6.745 66 1HG1 ILE 9 HG12 ILE 9 -9.294 -8.959 -7.326 67 2HG1 ILE 9 HG11 ILE 9 -9.309 -9.249 -5.590 68 1HG2 ILE 9 HG21 ILE 9 -7.100 -11.426 -4.946 69 2HG2 ILE 9 HG22 ILE 9 -7.068 -9.680 -4.710 70 3HG2 ILE 9 HG23 ILE 9 -5.841 -10.454 -5.707 71 1HD1 ILE 9 HD11 ILE 9 -8.388 -7.228 -5.441 72 2HD1 ILE 9 HD12 ILE 9 -7.919 -7.219 -7.139 73 3HD1 ILE 9 HD13 ILE 9 -6.897 -8.022 -5.949 74 H ALA 10 HN ALA 10 -5.238 -10.525 -9.773 75 HA ALA 10 HA ALA 10 -3.517 -12.325 -8.332 76 1HB ALA 10 HB1 ALA 10 -4.172 -13.751 -10.720 77 2HB ALA 10 HB2 ALA 10 -5.646 -13.449 -9.804 78 3HB ALA 10 HB3 ALA 10 -4.293 -14.283 -9.041 79 H GLY 11 HN GLY 11 -1.576 -11.585 -8.864 80 1HA GLY 11 HA2 GLY 11 -0.293 -11.750 -11.233 81 2HA GLY 11 HA1 GLY 11 -1.156 -10.230 -11.407 82 H LYS 12 HN LYS 12 0.512 -8.803 -11.375 83 HA LYS 12 HA LYS 12 2.288 -8.891 -9.032 84 1HB LYS 12 HB2 LYS 12 2.780 -7.744 -11.779 85 2HB LYS 12 HB1 LYS 12 3.864 -7.523 -10.414 86 1HG LYS 12 HG2 LYS 12 4.760 -9.270 -11.723 87 2HG LYS 12 HG1 LYS 12 4.060 -10.022 -10.290 88 1HD LYS 12 HD2 LYS 12 2.110 -10.693 -11.545 89 2HD LYS 12 HD1 LYS 12 2.684 -9.825 -12.969 90 1HE LYS 12 HE2 LYS 12 4.031 -12.186 -11.660 91 2HE LYS 12 HE1 LYS 12 3.093 -12.229 -13.152 92 1HZ LYS 12 HZ1 LYS 12 5.197 -12.051 -13.974 93 2HZ LYS 12 HZ2 LYS 12 5.770 -11.139 -12.670 94 3HZ LYS 12 HZ3 LYS 12 4.811 -10.407 -13.856 95 H TRP 13 HN TRP 13 2.255 -7.299 -7.631 96 HA TRP 13 HA TRP 13 0.837 -4.793 -8.278 97 1HB TRP 13 HB2 TRP 13 1.121 -6.327 -5.686 98 2HB TRP 13 HB1 TRP 13 0.529 -4.679 -5.750 99 HD1 TRP 13 HD1 TRP 13 -0.658 -7.066 -8.465 100 HE1 TRP 13 HE1 TRP 13 -3.148 -7.585 -8.074 101 HE3 TRP 13 HE3 TRP 13 -1.218 -4.919 -3.864 102 HZ2 TRP 13 HZ2 TRP 13 -5.088 -7.149 -6.077 103 HZ3 TRP 13 HZ3 TRP 13 -3.420 -5.018 -2.777 104 HH2 TRP 13 HH2 TRP 13 -5.317 -6.110 -3.863 105 H TYR 14 HN TYR 14 2.125 -2.963 -8.250 106 HA TYR 14 HA TYR 14 4.725 -3.194 -6.860 107 1HB TYR 14 HB2 TYR 14 4.024 -1.476 -9.246 108 2HB TYR 14 HB1 TYR 14 5.594 -1.537 -8.457 109 HD1 TYR 14 HD1 TYR 14 7.191 -2.711 -9.594 110 HD2 TYR 14 HD2 TYR 14 3.148 -4.010 -9.859 111 HE1 TYR 14 HE1 TYR 14 7.878 -4.522 -11.107 112 HE2 TYR 14 HE2 TYR 14 3.825 -5.826 -11.369 113 HH TYR 14 HH TYR 14 6.847 -6.911 -11.706 114 H VAL 15 HN VAL 15 4.664 -2.118 -4.965 115 HA VAL 15 HA VAL 15 2.909 0.081 -4.493 116 HB VAL 15 HB VAL 15 3.957 -1.522 -2.735 117 1HG1 VAL 15 HG11 VAL 15 5.999 -0.926 -1.749 118 2HG1 VAL 15 HG12 VAL 15 6.052 0.627 -2.587 119 3HG1 VAL 15 HG13 VAL 15 6.306 -0.870 -3.484 120 1HG2 VAL 15 HG21 VAL 15 4.018 1.361 -1.927 121 2HG2 VAL 15 HG22 VAL 15 3.397 -0.033 -1.047 122 3HG2 VAL 15 HG23 VAL 15 2.509 0.596 -2.433 123 H VAL 16 HN VAL 16 3.204 2.181 -4.851 124 HA VAL 16 HA VAL 16 5.902 3.247 -5.201 125 HB VAL 16 HB VAL 16 5.026 2.595 -7.458 126 1HG1 VAL 16 HG11 VAL 16 2.635 3.282 -6.818 127 2HG1 VAL 16 HG12 VAL 16 3.190 3.625 -8.455 128 3HG1 VAL 16 HG13 VAL 16 3.140 4.915 -7.254 129 1HG2 VAL 16 HG21 VAL 16 6.710 4.159 -7.596 130 2HG2 VAL 16 HG22 VAL 16 5.775 5.399 -6.759 131 3HG2 VAL 16 HG23 VAL 16 5.393 4.984 -8.430 132 H ALA 17 HN ALA 17 2.418 4.000 -5.109 133 HA ALA 17 HA ALA 17 3.009 6.661 -4.039 134 1HB ALA 17 HB1 ALA 17 0.195 5.959 -4.339 135 2HB ALA 17 HB2 ALA 17 1.123 5.778 -5.828 136 3HB ALA 17 HB3 ALA 17 1.097 7.328 -4.986 137 H LEU 18 HN LEU 18 2.455 7.316 -1.963 138 HA LEU 18 HA LEU 18 0.833 5.635 -0.264 139 1HB LEU 18 HB2 LEU 18 3.732 6.061 0.452 140 2HB LEU 18 HB1 LEU 18 2.534 5.274 1.449 141 HG LEU 18 HG LEU 18 2.345 3.586 -0.507 142 1HD1 LEU 18 HD11 LEU 18 3.761 3.728 -2.215 143 2HD1 LEU 18 HD12 LEU 18 5.141 3.932 -1.136 144 3HD1 LEU 18 HD13 LEU 18 4.193 5.334 -1.631 145 1HD2 LEU 18 HD21 LEU 18 4.468 3.862 1.555 146 2HD2 LEU 18 HD22 LEU 18 4.574 2.530 0.404 147 3HD2 LEU 18 HD23 LEU 18 3.153 2.693 1.437 148 H ALA 19 HN ALA 19 1.207 6.469 2.135 149 HA ALA 19 HA ALA 19 1.778 9.220 2.556 150 1HB ALA 19 HB1 ALA 19 -1.019 9.033 3.211 151 2HB ALA 19 HB2 ALA 19 -0.776 8.716 1.493 152 3HB ALA 19 HB3 ALA 19 -0.195 10.219 2.201 153 H SER 20 HN SER 20 2.632 9.063 4.643 154 HA SER 20 HA SER 20 1.125 7.276 6.460 155 1HB SER 20 HB2 SER 20 3.300 6.493 7.380 156 2HB SER 20 HB1 SER 20 3.023 6.035 5.699 157 HG SER 20 HG SER 20 4.498 8.323 6.482 158 H ASN 21 HN ASN 21 0.883 7.777 8.518 159 HA ASN 21 HA ASN 21 2.458 9.896 9.733 160 1HB ASN 21 HB2 ASN 21 0.240 10.778 10.770 161 2HB ASN 21 HB1 ASN 21 0.706 11.308 9.165 162 1HD2 ASN 21 HD21 ASN 21 -0.243 10.146 7.352 163 2HD2 ASN 21 HD22 ASN 21 -1.861 9.561 7.503 164 H THR 22 HN THR 22 3.237 9.103 11.507 165 HA THR 22 HA THR 22 1.676 7.883 13.545 166 HB THR 22 HB THR 22 3.455 6.120 11.849 167 HG1 THR 22 HG1 THR 22 1.638 5.091 11.333 168 1HG2 THR 22 HG21 THR 22 2.819 5.851 14.643 169 2HG2 THR 22 HG22 THR 22 3.900 4.896 13.629 170 3HG2 THR 22 HG23 THR 22 2.182 4.505 13.699 171 H GLU 23 HN GLU 23 4.983 7.640 12.240 172 HA GLU 23 HA GLU 23 6.093 9.215 14.371 173 1HB GLU 23 HB2 GLU 23 6.729 6.259 14.220 174 2HB GLU 23 HB1 GLU 23 7.631 7.425 15.175 175 1HG GLU 23 HG2 GLU 23 4.732 6.704 15.556 176 2HG GLU 23 HG1 GLU 23 6.080 6.140 16.537 177 H PHE 24 HN PHE 24 7.161 10.495 12.946 178 HA PHE 24 HA PHE 24 8.370 9.633 10.567 179 1HB PHE 24 HB2 PHE 24 9.462 11.839 10.530 180 2HB PHE 24 HB1 PHE 24 7.751 11.958 10.915 181 HD1 PHE 24 HD1 PHE 24 7.157 13.408 12.574 182 HD2 PHE 24 HD2 PHE 24 11.013 11.609 12.716 183 HE1 PHE 24 HE1 PHE 24 7.699 14.732 14.575 184 HE2 PHE 24 HE2 PHE 24 11.557 12.924 14.720 185 HZ PHE 24 HZ PHE 24 9.900 14.490 15.652 186 H PHE 25 HN PHE 25 9.544 9.666 13.839 187 HA PHE 25 HA PHE 25 12.288 9.665 13.437 188 1HB PHE 25 HB2 PHE 25 10.733 8.097 15.503 189 2HB PHE 25 HB1 PHE 25 12.461 8.421 15.563 190 HD1 PHE 25 HD1 PHE 25 13.289 10.437 16.428 191 HD2 PHE 25 HD2 PHE 25 9.123 10.010 15.670 192 HE1 PHE 25 HE1 PHE 25 12.855 12.524 17.656 193 HE2 PHE 25 HE2 PHE 25 8.683 12.099 16.890 194 HZ PHE 25 HZ PHE 25 10.550 13.359 17.887 195 H LEU 26 HN LEU 26 10.222 6.777 13.796 196 HA LEU 26 HA LEU 26 12.343 5.118 12.706 197 1HB LEU 26 HB2 LEU 26 9.605 4.388 13.744 198 2HB LEU 26 HB1 LEU 26 10.842 3.242 13.259 199 HG LEU 26 HG LEU 26 11.034 5.182 15.565 200 1HD1 LEU 26 HD11 LEU 26 11.157 2.975 16.841 201 2HD1 LEU 26 HD12 LEU 26 10.495 2.237 15.383 202 3HD1 LEU 26 HD13 LEU 26 9.579 3.479 16.236 203 1HD2 LEU 26 HD21 LEU 26 12.992 3.269 14.347 204 2HD2 LEU 26 HD22 LEU 26 13.084 3.707 16.053 205 3HD2 LEU 26 HD23 LEU 26 13.225 4.953 14.813 206 H ARG 27 HN ARG 27 9.036 6.072 11.871 207 HA ARG 27 HA ARG 27 8.661 4.449 9.662 208 1HB ARG 27 HB2 ARG 27 6.899 5.820 10.711 209 2HB ARG 27 HB1 ARG 27 7.642 7.265 10.045 210 1HG ARG 27 HG2 ARG 27 6.824 5.070 8.205 211 2HG ARG 27 HG1 ARG 27 5.601 6.155 8.865 212 1HD ARG 27 HD2 ARG 27 8.042 6.963 7.285 213 2HD ARG 27 HD1 ARG 27 6.381 6.946 6.703 214 HE ARG 27 HE ARG 27 6.514 8.554 8.993 215 1HH1 ARG 27 HH11 ARG 27 7.588 8.551 5.672 216 2HH1 ARG 27 HH12 ARG 27 7.602 10.277 5.546 217 1HH2 ARG 27 HH21 ARG 27 6.530 10.821 8.829 218 2HH2 ARG 27 HH22 ARG 27 7.002 11.568 7.339 219 H GLU 28 HN GLU 28 10.210 7.632 9.827 220 HA GLU 28 HA GLU 28 10.533 8.064 7.092 221 1HB GLU 28 HB2 GLU 28 10.931 9.793 8.776 222 2HB GLU 28 HB1 GLU 28 12.341 8.917 9.359 223 1HG GLU 28 HG2 GLU 28 13.443 9.245 7.212 224 2HG GLU 28 HG1 GLU 28 12.026 10.104 6.610 225 H LYS 29 HN LYS 29 12.832 6.585 9.380 226 HA LYS 29 HA LYS 29 14.666 5.900 7.281 227 1HB LYS 29 HB2 LYS 29 14.609 5.084 10.191 228 2HB LYS 29 HB1 LYS 29 15.940 4.780 9.082 229 1HG LYS 29 HG2 LYS 29 16.234 7.195 8.785 230 2HG LYS 29 HG1 LYS 29 14.919 7.486 9.923 231 1HD LYS 29 HD2 LYS 29 17.502 6.055 10.546 232 2HD LYS 29 HD1 LYS 29 17.116 7.719 10.987 233 1HE LYS 29 HE2 LYS 29 15.226 6.906 12.332 234 2HE LYS 29 HE1 LYS 29 15.656 5.247 11.913 235 1HZ LYS 29 HZ1 LYS 29 16.648 5.550 13.961 236 2HZ LYS 29 HZ2 LYS 29 17.098 7.149 13.642 237 3HZ LYS 29 HZ3 LYS 29 17.929 5.875 12.903 238 H ASP 30 HN ASP 30 12.238 4.177 9.167 239 HA ASP 30 HA ASP 30 12.949 1.574 8.337 240 1HB ASP 30 HB2 ASP 30 11.555 2.020 10.312 241 2HB ASP 30 HB1 ASP 30 10.262 2.600 9.267 242 H LYS 31 HN LYS 31 10.188 3.585 7.258 243 HA LYS 31 HA LYS 31 9.522 1.824 5.144 244 1HB LYS 31 HB2 LYS 31 8.699 4.654 5.766 245 2HB LYS 31 HB1 LYS 31 8.097 3.790 4.360 246 1HG LYS 31 HG2 LYS 31 6.557 3.713 6.275 247 2HG LYS 31 HG1 LYS 31 7.084 2.115 5.747 248 1HD LYS 31 HD2 LYS 31 8.701 2.028 7.561 249 2HD LYS 31 HD1 LYS 31 8.239 3.652 8.069 250 1HE LYS 31 HE2 LYS 31 6.401 1.264 8.004 251 2HE LYS 31 HE1 LYS 31 7.219 1.868 9.444 252 1HZ LYS 31 HZ1 LYS 31 5.464 3.620 7.842 253 2HZ LYS 31 HZ2 LYS 31 5.945 3.792 9.453 254 3HZ LYS 31 HZ3 LYS 31 4.828 2.596 9.029 255 H MET 32 HN MET 32 9.292 4.544 3.403 256 HA MET 32 HA MET 32 10.295 5.152 1.455 257 1HB MET 32 HB2 MET 32 12.662 5.922 1.722 258 2HB MET 32 HB1 MET 32 11.542 6.583 2.900 259 1HG MET 32 HG2 MET 32 12.355 5.110 4.599 260 2HG MET 32 HG1 MET 32 13.350 4.241 3.432 261 1HE MET 32 HE1 MET 32 16.200 6.221 2.580 262 2HE MET 32 HE2 MET 32 14.903 7.184 1.873 263 3HE MET 32 HE3 MET 32 14.796 5.425 1.872 264 H LYS 33 HN LYS 33 10.066 3.348 0.171 265 HA LYS 33 HA LYS 33 12.395 2.108 -0.790 266 1HB LYS 33 HB2 LYS 33 12.022 -0.195 0.031 267 2HB LYS 33 HB1 LYS 33 12.392 0.924 1.337 268 1HG LYS 33 HG2 LYS 33 9.973 1.102 1.818 269 2HG LYS 33 HG1 LYS 33 9.673 -0.124 0.585 270 1HD LYS 33 HD2 LYS 33 11.071 -1.705 1.843 271 2HD LYS 33 HD1 LYS 33 11.326 -0.478 3.085 272 1HE LYS 33 HE2 LYS 33 8.913 -0.417 3.512 273 2HE LYS 33 HE1 LYS 33 8.666 -1.653 2.279 274 1HZ LYS 33 HZ1 LYS 33 9.871 -1.910 4.948 275 2HZ LYS 33 HZ2 LYS 33 10.335 -2.982 3.724 276 3HZ LYS 33 HZ3 LYS 33 8.714 -2.889 4.194 277 H MET 34 HN MET 34 11.998 0.883 -2.668 278 HA MET 34 HA MET 34 9.318 1.199 -3.765 279 1HB MET 34 HB2 MET 34 11.310 1.657 -5.151 280 2HB MET 34 HB1 MET 34 11.830 -0.009 -4.956 281 1HG MET 34 HG2 MET 34 9.854 -0.774 -6.159 282 2HG MET 34 HG1 MET 34 9.316 0.896 -6.341 283 1HE MET 34 HE1 MET 34 9.429 0.750 -9.372 284 2HE MET 34 HE2 MET 34 9.272 -0.814 -8.572 285 3HE MET 34 HE3 MET 34 10.485 -0.584 -9.831 286 H ALA 35 HN ALA 35 8.112 -0.747 -4.717 287 HA ALA 35 HA ALA 35 9.085 -3.293 -3.717 288 1HB ALA 35 HB1 ALA 35 7.697 -1.894 -1.921 289 2HB ALA 35 HB2 ALA 35 7.741 -3.656 -1.978 290 3HB ALA 35 HB3 ALA 35 6.386 -2.785 -2.693 291 H MET 36 HN MET 36 8.326 -5.048 -4.589 292 HA MET 36 HA MET 36 6.243 -4.857 -6.669 293 1HB MET 36 HB2 MET 36 8.517 -6.859 -6.476 294 2HB MET 36 HB1 MET 36 7.376 -6.691 -7.806 295 1HG MET 36 HG2 MET 36 8.302 -4.566 -8.410 296 2HG MET 36 HG1 MET 36 9.342 -4.569 -6.987 297 1HE MET 36 HE1 MET 36 12.065 -6.728 -7.435 298 2HE MET 36 HE2 MET 36 10.818 -7.975 -7.480 299 3HE MET 36 HE3 MET 36 10.635 -6.581 -6.415 300 H ALA 37 HN ALA 37 4.707 -6.674 -6.699 301 HA ALA 37 HA ALA 37 4.929 -8.584 -4.520 302 1HB ALA 37 HB1 ALA 37 3.722 -6.260 -3.917 303 2HB ALA 37 HB2 ALA 37 3.334 -7.801 -3.154 304 3HB ALA 37 HB3 ALA 37 2.341 -7.201 -4.480 305 H ARG 38 HN ARG 38 3.514 -10.325 -4.595 306 HA ARG 38 HA ARG 38 2.000 -10.609 -7.103 307 1HB ARG 38 HB2 ARG 38 2.556 -13.041 -6.990 308 2HB ARG 38 HB1 ARG 38 3.959 -12.008 -7.232 309 1HG ARG 38 HG2 ARG 38 4.551 -12.209 -4.894 310 2HG ARG 38 HG1 ARG 38 3.111 -13.184 -4.593 311 1HD ARG 38 HD2 ARG 38 3.947 -14.888 -6.137 312 2HD ARG 38 HD1 ARG 38 5.387 -13.914 -6.431 313 HE ARG 38 HE ARG 38 5.165 -14.349 -3.680 314 1HH1 ARG 38 HH11 ARG 38 5.780 -16.170 -6.595 315 2HH1 ARG 38 HH12 ARG 38 6.755 -17.355 -5.793 316 1HH2 ARG 38 HH21 ARG 38 6.440 -15.896 -2.630 317 2HH2 ARG 38 HH22 ARG 38 7.130 -17.199 -3.538 318 H ILE 39 HN ILE 39 -0.119 -10.624 -6.653 319 HA ILE 39 HA ILE 39 -0.991 -11.548 -4.022 320 HB ILE 39 HB ILE 39 -1.763 -9.338 -4.757 321 1HG1 ILE 39 HG12 ILE 39 -4.045 -11.319 -4.603 322 2HG1 ILE 39 HG11 ILE 39 -3.104 -10.785 -3.213 323 1HG2 ILE 39 HG21 ILE 39 -3.213 -10.860 -6.919 324 2HG2 ILE 39 HG22 ILE 39 -1.881 -9.728 -7.149 325 3HG2 ILE 39 HG23 ILE 39 -3.435 -9.152 -6.545 326 1HD1 ILE 39 HD11 ILE 39 -3.827 -8.478 -3.644 327 2HD1 ILE 39 HD12 ILE 39 -5.175 -9.569 -3.327 328 3HD1 ILE 39 HD13 ILE 39 -4.823 -9.060 -4.978 329 H SER 40 HN SER 40 -2.424 -13.141 -3.661 330 HA SER 40 HA SER 40 -3.801 -14.544 -5.754 331 1HB SER 40 HB2 SER 40 -1.574 -15.539 -6.002 332 2HB SER 40 HB1 SER 40 -1.549 -15.941 -4.284 333 HG SER 40 HG SER 40 -3.448 -16.908 -6.159 334 H PHE 41 HN PHE 41 -5.371 -15.995 -4.940 335 HA PHE 41 HA PHE 41 -6.292 -15.344 -2.309 336 1HB PHE 41 HB2 PHE 41 -7.370 -17.374 -4.272 337 2HB PHE 41 HB1 PHE 41 -8.194 -16.803 -2.827 338 HD1 PHE 41 HD1 PHE 41 -6.690 -15.523 -5.989 339 HD2 PHE 41 HD2 PHE 41 -9.677 -15.053 -2.994 340 HE1 PHE 41 HE1 PHE 41 -7.692 -13.692 -7.284 341 HE2 PHE 41 HE2 PHE 41 -10.690 -13.224 -4.290 342 HZ PHE 41 HZ PHE 41 -9.700 -12.544 -6.438 343 H LEU 42 HN LEU 42 -6.064 -16.412 -0.451 344 HA LEU 42 HA LEU 42 -4.917 -19.123 -0.538 345 1HB LEU 42 HB2 LEU 42 -4.489 -16.905 1.452 346 2HB LEU 42 HB1 LEU 42 -4.100 -18.571 1.819 347 HG LEU 42 HG LEU 42 -2.128 -17.276 1.131 348 1HD1 LEU 42 HD11 LEU 42 -2.707 -19.244 -1.051 349 2HD1 LEU 42 HD12 LEU 42 -2.502 -19.768 0.621 350 3HD1 LEU 42 HD13 LEU 42 -1.191 -18.928 -0.207 351 1HD2 LEU 42 HD21 LEU 42 -2.890 -17.196 -1.698 352 2HD2 LEU 42 HD22 LEU 42 -2.005 -16.024 -0.724 353 3HD2 LEU 42 HD23 LEU 42 -3.765 -16.067 -0.666 354 H GLY 43 HN GLY 43 -5.935 -20.724 0.526 355 1HA GLY 43 HA2 GLY 43 -8.627 -20.605 1.104 356 2HA GLY 43 HA1 GLY 43 -7.546 -21.846 1.707 357 H GLU 44 HN GLU 44 -8.945 -21.922 3.538 358 HA GLU 44 HA GLU 44 -9.404 -21.557 5.729 359 1HB GLU 44 HB2 GLU 44 -7.115 -19.589 5.573 360 2HB GLU 44 HB1 GLU 44 -7.867 -20.160 7.055 361 1HG GLU 44 HG2 GLU 44 -7.136 -22.435 6.552 362 2HG GLU 44 HG1 GLU 44 -6.383 -21.861 5.063 363 H ASP 45 HN ASP 45 -8.359 -18.332 4.688 364 HA ASP 45 HA ASP 45 -10.685 -17.090 4.100 365 1HB ASP 45 HB2 ASP 45 -11.416 -16.011 6.220 366 2HB ASP 45 HB1 ASP 45 -11.653 -17.752 6.244 367 H GLU 46 HN GLU 46 -8.113 -16.757 3.340 368 HA GLU 46 HA GLU 46 -7.675 -13.976 3.968 369 1HB GLU 46 HB2 GLU 46 -5.624 -16.048 4.760 370 2HB GLU 46 HB1 GLU 46 -5.308 -14.323 4.683 371 1HG GLU 46 HG2 GLU 46 -6.984 -13.939 6.418 372 2HG GLU 46 HG1 GLU 46 -7.296 -15.672 6.495 373 H LEU 47 HN LEU 47 -6.682 -12.904 2.382 374 HA LEU 47 HA LEU 47 -5.592 -14.470 0.134 375 1HB LEU 47 HB2 LEU 47 -6.603 -11.622 0.038 376 2HB LEU 47 HB1 LEU 47 -6.230 -12.667 -1.320 377 HG LEU 47 HG LEU 47 -8.563 -12.918 0.577 378 1HD1 LEU 47 HD11 LEU 47 -8.402 -11.303 -1.531 379 2HD1 LEU 47 HD12 LEU 47 -9.890 -12.137 -1.081 380 3HD1 LEU 47 HD13 LEU 47 -8.866 -12.788 -2.362 381 1HD2 LEU 47 HD21 LEU 47 -7.496 -15.117 -0.104 382 2HD2 LEU 47 HD22 LEU 47 -7.997 -14.731 -1.749 383 3HD2 LEU 47 HD23 LEU 47 -9.206 -14.919 -0.480 384 H LYS 48 HN LYS 48 -3.424 -14.211 -0.265 385 HA LYS 48 HA LYS 48 -2.098 -12.068 1.243 386 1HB LYS 48 HB2 LYS 48 -1.566 -14.223 2.137 387 2HB LYS 48 HB1 LYS 48 -1.127 -14.826 0.552 388 1HG LYS 48 HG2 LYS 48 0.354 -12.506 1.694 389 2HG LYS 48 HG1 LYS 48 0.706 -14.131 2.271 390 1HD LYS 48 HD2 LYS 48 0.751 -13.377 -0.648 391 2HD LYS 48 HD1 LYS 48 2.166 -13.268 0.393 392 1HE LYS 48 HE2 LYS 48 2.370 -15.344 -0.662 393 2HE LYS 48 HE1 LYS 48 1.740 -15.722 0.938 394 1HZ LYS 48 HZ1 LYS 48 -0.242 -15.289 -1.140 395 2HZ LYS 48 HZ2 LYS 48 -0.203 -16.443 0.097 396 3HZ LYS 48 HZ3 LYS 48 0.707 -16.680 -1.308 397 H VAL 49 HN VAL 49 -0.351 -10.980 0.472 398 HA VAL 49 HA VAL 49 0.275 -11.231 -2.392 399 HB VAL 49 HB VAL 49 -1.206 -9.273 -2.074 400 1HG1 VAL 49 HG11 VAL 49 -0.534 -7.361 -0.769 401 2HG1 VAL 49 HG12 VAL 49 0.974 -8.149 -0.315 402 3HG1 VAL 49 HG13 VAL 49 -0.564 -8.783 0.270 403 1HG2 VAL 49 HG21 VAL 49 -0.094 -8.152 -3.650 404 2HG2 VAL 49 HG22 VAL 49 1.151 -9.387 -3.470 405 3HG2 VAL 49 HG23 VAL 49 1.287 -7.861 -2.597 406 H SER 50 HN SER 50 2.359 -11.806 -2.517 407 HA SER 50 HA SER 50 4.171 -11.248 -0.325 408 1HB SER 50 HB2 SER 50 4.123 -13.460 -1.493 409 2HB SER 50 HB1 SER 50 4.722 -12.658 -2.945 410 HG SER 50 HG SER 50 6.452 -11.916 -1.305 411 H TYR 51 HN TYR 51 4.669 -9.065 -0.349 412 HA TYR 51 HA TYR 51 5.666 -7.977 -2.863 413 1HB TYR 51 HB2 TYR 51 5.609 -5.766 -1.650 414 2HB TYR 51 HB1 TYR 51 4.052 -6.536 -1.902 415 HD1 TYR 51 HD1 TYR 51 6.722 -6.149 0.680 416 HD2 TYR 51 HD2 TYR 51 2.597 -6.789 -0.135 417 HE1 TYR 51 HE1 TYR 51 6.220 -5.944 3.078 418 HE2 TYR 51 HE2 TYR 51 2.084 -6.581 2.257 419 HH TYR 51 HH TYR 51 3.912 -5.218 4.419 420 H ALA 52 HN ALA 52 7.712 -7.645 -3.281 421 HA ALA 52 HA ALA 52 9.675 -7.938 -1.104 422 1HB ALA 52 HB1 ALA 52 9.953 -9.610 -2.831 423 2HB ALA 52 HB2 ALA 52 11.294 -8.471 -2.914 424 3HB ALA 52 HB3 ALA 52 9.975 -8.370 -4.080 425 H VAL 53 HN VAL 53 10.277 -5.988 -0.380 426 HA VAL 53 HA VAL 53 10.239 -3.682 -2.133 427 HB VAL 53 HB VAL 53 10.765 -2.386 -0.119 428 1HG1 VAL 53 HG11 VAL 53 8.710 -3.417 1.256 429 2HG1 VAL 53 HG12 VAL 53 8.476 -4.247 -0.282 430 3HG1 VAL 53 HG13 VAL 53 8.507 -2.485 -0.226 431 1HG2 VAL 53 HG21 VAL 53 11.424 -5.051 0.912 432 2HG2 VAL 53 HG22 VAL 53 10.483 -4.053 2.019 433 3HG2 VAL 53 HG23 VAL 53 12.025 -3.466 1.396 434 HA PRO 54 HA PRO 54 14.729 -4.118 -2.544 435 1HB PRO 54 HB2 PRO 54 14.805 -3.413 -5.169 436 2HB PRO 54 HB1 PRO 54 14.410 -5.040 -4.613 437 1HG PRO 54 HG2 PRO 54 12.689 -3.109 -5.903 438 2HG PRO 54 HG1 PRO 54 12.334 -4.788 -5.469 439 1HD PRO 54 HD2 PRO 54 11.668 -2.298 -4.037 440 2HD PRO 54 HD1 PRO 54 10.922 -3.903 -3.912 441 H LYS 55 HN LYS 55 16.443 -2.678 -3.273 442 HA LYS 55 HA LYS 55 16.140 -0.010 -4.023 443 1HB LYS 55 HB2 LYS 55 15.131 0.309 -1.809 444 2HB LYS 55 HB1 LYS 55 16.563 -0.381 -1.054 445 1HG LYS 55 HG2 LYS 55 16.708 1.983 -0.861 446 2HG LYS 55 HG1 LYS 55 17.899 1.466 -2.048 447 1HD LYS 55 HD2 LYS 55 16.361 2.079 -3.857 448 2HD LYS 55 HD1 LYS 55 15.181 2.623 -2.663 449 1HE LYS 55 HE2 LYS 55 16.794 4.292 -1.854 450 2HE LYS 55 HE1 LYS 55 17.947 3.756 -3.075 451 1HZ LYS 55 HZ1 LYS 55 16.830 4.797 -4.719 452 2HZ LYS 55 HZ2 LYS 55 16.292 5.780 -3.453 453 3HZ LYS 55 HZ3 LYS 55 15.307 4.532 -4.029 454 HA PRO 56 HA PRO 56 20.376 -2.030 -4.168 455 1HB PRO 56 HB2 PRO 56 20.818 -1.248 -6.769 456 2HB PRO 56 HB1 PRO 56 20.106 -2.797 -6.307 457 1HG PRO 56 HG2 PRO 56 18.756 -0.285 -7.209 458 2HG PRO 56 HG1 PRO 56 18.400 -1.968 -7.643 459 1HD PRO 56 HD2 PRO 56 16.917 -0.636 -5.843 460 2HD PRO 56 HD1 PRO 56 17.262 -2.369 -5.663 461 H ASN 57 HN ASN 57 22.309 -0.948 -3.932 462 HA ASN 57 HA ASN 57 23.778 0.785 -3.697 463 1HB ASN 57 HB2 ASN 57 21.793 2.399 -5.312 464 2HB ASN 57 HB1 ASN 57 23.446 2.868 -4.938 465 1HD2 ASN 57 HD21 ASN 57 24.781 2.603 -6.550 466 2HD2 ASN 57 HD22 ASN 57 24.694 1.375 -7.763 467 H GLY 58 HN GLY 58 20.392 1.851 -3.405 468 1HA GLY 58 HA2 GLY 58 20.763 3.835 -1.483 469 2HA GLY 58 HA1 GLY 58 19.286 2.906 -1.699 470 H CYS 59 HN CYS 59 18.729 1.443 -0.170 471 HA CYS 59 HA CYS 59 20.529 -0.007 1.404 472 1HB CYS 59 HB2 CYS 59 20.161 1.141 3.603 473 2HB CYS 59 HB1 CYS 59 21.165 2.035 2.467 474 H ARG 60 HN ARG 60 18.174 -0.684 0.054 475 HA ARG 60 HA ARG 60 16.705 -1.804 2.287 476 1HB ARG 60 HB2 ARG 60 15.322 0.008 0.316 477 2HB ARG 60 HB1 ARG 60 14.470 -1.139 1.333 478 1HG ARG 60 HG2 ARG 60 14.274 0.661 2.666 479 2HG ARG 60 HG1 ARG 60 15.866 0.138 3.215 480 1HD ARG 60 HD2 ARG 60 15.851 2.529 2.772 481 2HD ARG 60 HD1 ARG 60 16.912 1.696 1.640 482 HE ARG 60 HE ARG 60 14.386 1.910 0.473 483 1HH1 ARG 60 HH11 ARG 60 17.011 3.984 1.466 484 2HH1 ARG 60 HH12 ARG 60 16.703 5.166 0.240 485 1HH2 ARG 60 HH21 ARG 60 13.991 3.456 -1.141 486 2HH2 ARG 60 HH22 ARG 60 14.988 4.870 -1.236 487 H LYS 61 HN LYS 61 15.683 -3.642 1.916 488 HA LYS 61 HA LYS 61 14.888 -4.715 -0.552 489 1HB LYS 61 HB2 LYS 61 17.309 -4.896 -0.976 490 2HB LYS 61 HB1 LYS 61 17.501 -5.798 0.523 491 1HG LYS 61 HG2 LYS 61 16.095 -7.585 -0.361 492 2HG LYS 61 HG1 LYS 61 15.889 -6.682 -1.863 493 1HD LYS 61 HD2 LYS 61 18.315 -6.787 -2.238 494 2HD LYS 61 HD1 LYS 61 18.493 -7.724 -0.753 495 1HE LYS 61 HE2 LYS 61 16.898 -8.545 -3.177 496 2HE LYS 61 HE1 LYS 61 18.490 -9.160 -2.737 497 1HZ LYS 61 HZ1 LYS 61 17.152 -10.764 -1.860 498 2HZ LYS 61 HZ2 LYS 61 15.884 -9.701 -1.510 499 3HZ LYS 61 HZ3 LYS 61 17.256 -9.734 -0.521 500 H TRP 62 HN TRP 62 13.175 -5.925 0.183 501 HA TRP 62 HA TRP 62 13.646 -7.935 2.182 502 1HB TRP 62 HB2 TRP 62 13.438 -5.989 3.632 503 2HB TRP 62 HB1 TRP 62 11.892 -5.584 2.899 504 HD1 TRP 62 HD1 TRP 62 10.052 -6.091 4.591 505 HE1 TRP 62 HE1 TRP 62 9.513 -8.007 6.223 506 HE3 TRP 62 HE3 TRP 62 14.198 -8.991 3.840 507 HZ2 TRP 62 HZ2 TRP 62 10.690 -10.426 7.082 508 HZ3 TRP 62 HZ3 TRP 62 14.413 -11.090 5.106 509 HH2 TRP 62 HH2 TRP 62 12.696 -11.791 6.693 510 H GLU 63 HN GLU 63 12.178 -9.510 2.245 511 HA GLU 63 HA GLU 63 9.912 -9.326 0.383 512 1HB GLU 63 HB2 GLU 63 11.263 -11.773 1.554 513 2HB GLU 63 HB1 GLU 63 9.950 -11.787 0.383 514 1HG GLU 63 HG2 GLU 63 11.375 -10.702 -1.257 515 2HG GLU 63 HG1 GLU 63 12.690 -10.633 -0.086 516 H THR 64 HN THR 64 7.807 -9.957 1.116 517 HA THR 64 HA THR 64 7.504 -10.704 3.900 518 HB THR 64 HB THR 64 6.819 -7.990 2.857 519 HG1 THR 64 HG1 THR 64 7.781 -8.718 5.404 520 1HG2 THR 64 HG21 THR 64 5.546 -7.626 5.000 521 2HG2 THR 64 HG22 THR 64 5.428 -9.381 5.118 522 3HG2 THR 64 HG23 THR 64 4.717 -8.539 3.741 523 H THR 65 HN THR 65 5.672 -11.714 4.372 524 HA THR 65 HA THR 65 3.786 -12.225 2.190 525 HB THR 65 HB THR 65 4.290 -13.646 4.815 526 HG1 THR 65 HG1 THR 65 5.594 -14.840 3.707 527 1HG2 THR 65 HG21 THR 65 2.594 -14.720 2.599 528 2HG2 THR 65 HG22 THR 65 1.910 -13.792 3.934 529 3HG2 THR 65 HG23 THR 65 2.761 -15.300 4.258 530 H PHE 66 HN PHE 66 2.079 -10.891 2.176 531 HA PHE 66 HA PHE 66 0.973 -9.961 4.749 532 1HB PHE 66 HB2 PHE 66 1.863 -8.428 2.770 533 2HB PHE 66 HB1 PHE 66 0.250 -8.711 2.133 534 HD1 PHE 66 HD1 PHE 66 1.596 -8.031 5.547 535 HD2 PHE 66 HD2 PHE 66 -1.076 -6.875 2.445 536 HE1 PHE 66 HE1 PHE 66 0.742 -6.213 6.966 537 HE2 PHE 66 HE2 PHE 66 -1.940 -5.056 3.861 538 HZ PHE 66 HZ PHE 66 -1.029 -4.723 6.124 539 H LYS 67 HN LYS 67 -0.746 -11.192 5.350 540 HA LYS 67 HA LYS 67 -2.741 -11.814 3.277 541 1HB LYS 67 HB2 LYS 67 -3.046 -14.010 4.029 542 2HB LYS 67 HB1 LYS 67 -1.304 -13.795 4.026 543 1HG LYS 67 HG2 LYS 67 -3.096 -13.662 6.444 544 2HG LYS 67 HG1 LYS 67 -2.047 -15.007 5.995 545 1HD LYS 67 HD2 LYS 67 -0.104 -13.450 6.162 546 2HD LYS 67 HD1 LYS 67 -1.208 -12.223 6.788 547 1HE LYS 67 HE2 LYS 67 -0.641 -14.913 8.028 548 2HE LYS 67 HE1 LYS 67 -0.055 -13.354 8.607 549 1HZ LYS 67 HZ1 LYS 67 -1.881 -13.712 9.931 550 2HZ LYS 67 HZ2 LYS 67 -2.775 -14.467 8.710 551 3HZ LYS 67 HZ3 LYS 67 -2.566 -12.789 8.690 552 H LYS 68 HN LYS 68 -4.775 -11.288 3.724 553 HA LYS 68 HA LYS 68 -5.812 -11.215 6.394 554 1HB LYS 68 HB2 LYS 68 -5.619 -8.592 4.894 555 2HB LYS 68 HB1 LYS 68 -6.394 -8.844 6.447 556 1HG LYS 68 HG2 LYS 68 -4.177 -9.505 7.374 557 2HG LYS 68 HG1 LYS 68 -3.459 -9.031 5.834 558 1HD LYS 68 HD2 LYS 68 -4.075 -6.768 6.131 559 2HD LYS 68 HD1 LYS 68 -5.158 -7.159 7.465 560 1HE LYS 68 HE2 LYS 68 -3.004 -6.116 8.153 561 2HE LYS 68 HE1 LYS 68 -3.317 -7.686 8.890 562 1HZ LYS 68 HZ1 LYS 68 -1.760 -7.578 6.408 563 2HZ LYS 68 HZ2 LYS 68 -1.669 -8.680 7.688 564 3HZ LYS 68 HZ3 LYS 68 -1.005 -7.134 7.856 565 H THR 69 HN THR 69 -7.927 -9.219 5.502 566 HA THR 69 HA THR 69 -9.428 -11.108 3.821 567 HB THR 69 HB THR 69 -11.448 -10.123 4.735 568 HG1 THR 69 HG1 THR 69 -11.402 -8.204 5.537 569 1HG2 THR 69 HG21 THR 69 -9.516 -11.427 6.365 570 2HG2 THR 69 HG22 THR 69 -11.276 -11.485 6.460 571 3HG2 THR 69 HG23 THR 69 -10.387 -10.239 7.335 572 H SER 70 HN SER 70 -10.566 -10.422 2.033 573 HA SER 70 HA SER 70 -10.254 -7.634 1.166 574 1HB SER 70 HB2 SER 70 -8.463 -8.769 0.011 575 2HB SER 70 HB1 SER 70 -9.534 -10.091 -0.452 576 HG SER 70 HG SER 70 -10.538 -8.787 -1.895 577 H ASP 71 HN ASP 71 -12.498 -7.567 1.859 578 HA ASP 71 HA ASP 71 -14.309 -8.850 -0.094 579 1HB ASP 71 HB2 ASP 71 -14.592 -9.812 2.131 580 2HB ASP 71 HB1 ASP 71 -14.861 -8.210 2.811 581 H ASP 72 HN ASP 72 -16.397 -7.742 -0.410 582 HA ASP 72 HA ASP 72 -17.766 -5.806 -0.398 583 1HB ASP 72 HB2 ASP 72 -16.107 -4.608 1.110 584 2HB ASP 72 HB1 ASP 72 -15.246 -4.147 -0.354 585 H GLY 73 HN GLY 73 -18.215 -4.272 -2.219 586 1HA GLY 73 HA2 GLY 73 -17.899 -5.331 -4.700 587 2HA GLY 73 HA1 GLY 73 -18.008 -3.588 -4.444 588 H GLU 74 HN GLU 74 -15.729 -2.998 -3.188 589 HA GLU 74 HA GLU 74 -13.701 -3.520 -5.219 590 1HB GLU 74 HB2 GLU 74 -12.439 -1.706 -4.033 591 2HB GLU 74 HB1 GLU 74 -13.978 -1.192 -4.706 592 1HG GLU 74 HG2 GLU 74 -14.996 -1.405 -2.473 593 2HG GLU 74 HG1 GLU 74 -13.419 -1.839 -1.820 594 H VAL 75 HN VAL 75 -11.931 -2.763 -2.517 595 HA VAL 75 HA VAL 75 -12.025 -5.479 -1.439 596 HB VAL 75 HB VAL 75 -9.617 -4.264 -2.757 597 1HG1 VAL 75 HG11 VAL 75 -8.325 -6.175 -1.752 598 2HG1 VAL 75 HG12 VAL 75 -9.681 -6.412 -0.649 599 3HG1 VAL 75 HG13 VAL 75 -8.785 -4.899 -0.624 600 1HG2 VAL 75 HG21 VAL 75 -10.788 -5.622 -4.256 601 2HG2 VAL 75 HG22 VAL 75 -11.157 -6.826 -3.022 602 3HG2 VAL 75 HG23 VAL 75 -9.512 -6.670 -3.633 603 H TYR 76 HN TYR 76 -11.970 -5.461 0.695 604 HA TYR 76 HA TYR 76 -10.666 -3.193 2.050 605 1HB TYR 76 HB2 TYR 76 -13.131 -4.761 2.825 606 2HB TYR 76 HB1 TYR 76 -12.225 -3.813 3.999 607 HD1 TYR 76 HD1 TYR 76 -13.249 -3.116 0.459 608 HD2 TYR 76 HD2 TYR 76 -13.429 -1.924 4.541 609 HE1 TYR 76 HE1 TYR 76 -14.494 -1.096 -0.188 610 HE2 TYR 76 HE2 TYR 76 -14.677 0.095 3.902 611 HH TYR 76 HH TYR 76 -14.744 1.469 1.290 612 H TYR 77 HN TYR 77 -8.824 -3.763 2.961 613 HA TYR 77 HA TYR 77 -8.321 -6.569 3.589 614 1HB TYR 77 HB2 TYR 77 -6.781 -4.848 2.258 615 2HB TYR 77 HB1 TYR 77 -6.209 -4.500 3.878 616 HD1 TYR 77 HD1 TYR 77 -4.252 -5.589 4.442 617 HD2 TYR 77 HD2 TYR 77 -7.044 -7.571 1.917 618 HE1 TYR 77 HE1 TYR 77 -2.756 -7.537 4.318 619 HE2 TYR 77 HE2 TYR 77 -5.550 -9.519 1.785 620 HH TYR 77 HH TYR 77 -3.082 -9.969 2.056 621 H SER 78 HN SER 78 -8.445 -7.315 5.627 622 HA SER 78 HA SER 78 -7.665 -5.567 7.823 623 1HB SER 78 HB2 SER 78 -10.011 -4.965 7.514 624 2HB SER 78 HB1 SER 78 -10.478 -6.662 7.642 625 HG SER 78 HG SER 78 -10.159 -6.612 9.747 626 H GLU 79 HN GLU 79 -7.144 -6.624 9.758 627 HA GLU 79 HA GLU 79 -7.748 -9.376 10.186 628 1HB GLU 79 HB2 GLU 79 -5.380 -8.753 8.672 629 2HB GLU 79 HB1 GLU 79 -4.956 -9.571 10.169 630 1HG GLU 79 HG2 GLU 79 -6.930 -10.582 8.141 631 2HG GLU 79 HG1 GLU 79 -5.257 -11.114 8.291 632 H GLU 80 HN GLU 80 -7.616 -9.906 12.245 633 HA GLU 80 HA GLU 80 -7.465 -9.644 14.505 634 1HB GLU 80 HB2 GLU 80 -4.661 -9.319 13.504 635 2HB GLU 80 HB1 GLU 80 -5.005 -9.224 15.224 636 1HG GLU 80 HG2 GLU 80 -5.782 -11.559 13.499 637 2HG GLU 80 HG1 GLU 80 -4.258 -11.458 14.379 638 H ALA 81 HN ALA 81 -7.225 -8.270 16.320 639 HA ALA 81 HA ALA 81 -7.591 -5.472 15.753 640 1HB ALA 81 HB1 ALA 81 -8.266 -5.297 17.919 641 2HB ALA 81 HB2 ALA 81 -6.915 -6.256 18.521 642 3HB ALA 81 HB3 ALA 81 -8.332 -7.058 17.845 643 H LYS 82 HN LYS 82 -5.575 -5.489 14.496 644 HA LYS 82 HA LYS 82 -3.363 -4.517 16.065 645 1HB LYS 82 HB2 LYS 82 -3.150 -7.060 15.731 646 2HB LYS 82 HB1 LYS 82 -2.846 -6.689 14.044 647 1HG LYS 82 HG2 LYS 82 -1.194 -5.923 16.431 648 2HG LYS 82 HG1 LYS 82 -0.746 -6.984 15.097 649 1HD LYS 82 HD2 LYS 82 -0.937 -5.005 13.576 650 2HD LYS 82 HD1 LYS 82 -1.162 -4.003 15.010 651 1HE LYS 82 HE2 LYS 82 1.243 -5.722 14.419 652 2HE LYS 82 HE1 LYS 82 1.161 -3.969 14.256 653 1HZ LYS 82 HZ1 LYS 82 1.886 -5.384 16.500 654 2HZ LYS 82 HZ2 LYS 82 0.341 -4.792 16.849 655 3HZ LYS 82 HZ3 LYS 82 1.573 -3.723 16.407 656 H LYS 83 HN LYS 83 -4.668 -5.304 12.809 657 HA LYS 83 HA LYS 83 -3.998 -2.613 12.004 658 1HB LYS 83 HB2 LYS 83 -2.744 -3.290 9.977 659 2HB LYS 83 HB1 LYS 83 -1.896 -3.597 11.483 660 1HG LYS 83 HG2 LYS 83 -3.493 -5.780 10.234 661 2HG LYS 83 HG1 LYS 83 -1.904 -5.370 9.583 662 1HD LYS 83 HD2 LYS 83 -0.889 -5.734 11.752 663 2HD LYS 83 HD1 LYS 83 -2.469 -6.060 12.459 664 1HE LYS 83 HE2 LYS 83 -1.232 -7.677 10.240 665 2HE LYS 83 HE1 LYS 83 -1.134 -8.101 11.948 666 1HZ LYS 83 HZ1 LYS 83 -3.285 -8.742 12.006 667 2HZ LYS 83 HZ2 LYS 83 -3.028 -9.013 10.357 668 3HZ LYS 83 HZ3 LYS 83 -3.794 -7.596 10.871 669 H LYS 84 HN LYS 84 -5.558 -1.800 10.907 670 HA LYS 84 HA LYS 84 -7.352 -3.553 9.373 671 1HB LYS 84 HB2 LYS 84 -8.993 -1.702 9.525 672 2HB LYS 84 HB1 LYS 84 -8.520 -2.312 11.103 673 1HG LYS 84 HG2 LYS 84 -6.966 -0.408 11.336 674 2HG LYS 84 HG1 LYS 84 -7.548 0.214 9.790 675 1HD LYS 84 HD2 LYS 84 -9.811 0.370 10.702 676 2HD LYS 84 HD1 LYS 84 -9.232 -0.252 12.249 677 1HE LYS 84 HE2 LYS 84 -7.756 1.686 12.473 678 2HE LYS 84 HE1 LYS 84 -8.331 2.305 10.925 679 1HZ LYS 84 HZ1 LYS 84 -10.337 1.710 12.962 680 2HZ LYS 84 HZ2 LYS 84 -10.301 2.947 11.808 681 3HZ LYS 84 HZ3 LYS 84 -9.365 3.073 13.211 682 H VAL 85 HN VAL 85 -7.805 -3.051 7.206 683 HA VAL 85 HA VAL 85 -6.385 -0.788 6.007 684 HB VAL 85 HB VAL 85 -5.932 -3.663 5.223 685 1HG1 VAL 85 HG11 VAL 85 -5.984 -2.274 3.240 686 2HG1 VAL 85 HG12 VAL 85 -4.335 -2.790 3.587 687 3HG1 VAL 85 HG13 VAL 85 -4.845 -1.149 3.980 688 1HG2 VAL 85 HG21 VAL 85 -4.658 -3.212 7.146 689 2HG2 VAL 85 HG22 VAL 85 -4.195 -1.618 6.556 690 3HG2 VAL 85 HG23 VAL 85 -3.546 -3.062 5.785 691 H GLU 86 HN GLU 86 -6.923 -0.483 3.680 692 HA GLU 86 HA GLU 86 -9.296 -1.859 2.739 693 1HB GLU 86 HB2 GLU 86 -10.183 -0.079 4.169 694 2HB GLU 86 HB1 GLU 86 -9.293 1.116 3.236 695 1HG GLU 86 HG2 GLU 86 -10.593 0.533 1.252 696 2HG GLU 86 HG1 GLU 86 -11.490 -0.657 2.196 697 H VAL 87 HN VAL 87 -9.036 -2.269 0.667 698 HA VAL 87 HA VAL 87 -7.104 -0.753 -0.886 699 HB VAL 87 HB VAL 87 -8.694 -3.206 -1.632 700 1HG1 VAL 87 HG11 VAL 87 -6.620 -1.606 -3.066 701 2HG1 VAL 87 HG12 VAL 87 -8.119 -2.305 -3.679 702 3HG1 VAL 87 HG13 VAL 87 -6.735 -3.344 -3.339 703 1HG2 VAL 87 HG21 VAL 87 -5.774 -3.303 -1.190 704 2HG2 VAL 87 HG22 VAL 87 -7.009 -4.514 -0.860 705 3HG2 VAL 87 HG23 VAL 87 -6.796 -3.152 0.240 706 H LEU 88 HN LEU 88 -7.760 1.023 -1.814 707 HA LEU 88 HA LEU 88 -10.515 1.325 -2.753 708 1HB LEU 88 HB2 LEU 88 -8.304 3.354 -2.428 709 2HB LEU 88 HB1 LEU 88 -9.953 3.720 -2.892 710 HG LEU 88 HG LEU 88 -9.086 2.578 -0.236 711 1HD1 LEU 88 HD11 LEU 88 -10.397 5.059 0.023 712 2HD1 LEU 88 HD12 LEU 88 -9.171 5.255 -1.230 713 3HD1 LEU 88 HD13 LEU 88 -8.713 4.676 0.370 714 1HD2 LEU 88 HD21 LEU 88 -11.194 1.821 -0.184 715 2HD2 LEU 88 HD22 LEU 88 -11.688 2.812 -1.557 716 3HD2 LEU 88 HD23 LEU 88 -11.634 3.510 0.062 717 H ASP 89 HN ASP 89 -10.192 3.292 -4.645 718 HA ASP 89 HA ASP 89 -9.921 3.636 -6.857 719 1HB ASP 89 HB2 ASP 89 -7.502 3.677 -6.095 720 2HB ASP 89 HB1 ASP 89 -7.383 2.023 -6.678 721 H THR 90 HN THR 90 -8.179 1.172 -8.183 722 HA THR 90 HA THR 90 -10.422 -0.684 -8.356 723 HB THR 90 HB THR 90 -9.129 0.610 -10.762 724 HG1 THR 90 HG1 THR 90 -11.767 0.745 -9.732 725 1HG2 THR 90 HG21 THR 90 -11.250 -0.665 -11.772 726 2HG2 THR 90 HG22 THR 90 -10.801 -1.797 -10.496 727 3HG2 THR 90 HG23 THR 90 -9.627 -1.352 -11.734 728 H ASP 91 HN ASP 91 -9.270 -2.313 -7.389 729 HA ASP 91 HA ASP 91 -6.663 -3.041 -8.464 730 1HB ASP 91 HB2 ASP 91 -6.594 -4.688 -6.646 731 2HB ASP 91 HB1 ASP 91 -6.970 -3.084 -6.024 732 H TYR 92 HN TYR 92 -9.007 -3.291 -10.155 733 HA TYR 92 HA TYR 92 -8.945 -6.201 -10.597 734 1HB TYR 92 HB2 TYR 92 -11.293 -4.382 -11.162 735 2HB TYR 92 HB1 TYR 92 -11.241 -6.126 -11.376 736 HD1 TYR 92 HD1 TYR 92 -12.348 -7.356 -9.793 737 HD2 TYR 92 HD2 TYR 92 -10.597 -3.656 -8.631 738 HE1 TYR 92 HE1 TYR 92 -13.238 -7.654 -7.522 739 HE2 TYR 92 HE2 TYR 92 -11.478 -3.949 -6.354 740 HH TYR 92 HH TYR 92 -13.809 -5.655 -5.496 741 H LYS 93 HN LYS 93 -7.922 -3.331 -11.801 742 HA LYS 93 HA LYS 93 -8.175 -4.285 -14.572 743 1HB LYS 93 HB2 LYS 93 -9.551 -2.314 -14.277 744 2HB LYS 93 HB1 LYS 93 -8.197 -1.430 -13.588 745 1HG LYS 93 HG2 LYS 93 -7.020 -1.547 -15.716 746 2HG LYS 93 HG1 LYS 93 -8.355 -2.468 -16.410 747 1HD LYS 93 HD2 LYS 93 -9.856 -0.570 -16.035 748 2HD LYS 93 HD1 LYS 93 -8.519 0.349 -15.338 749 1HE LYS 93 HE2 LYS 93 -7.320 0.214 -17.467 750 2HE LYS 93 HE1 LYS 93 -8.654 -0.706 -18.161 751 1HZ LYS 93 HZ1 LYS 93 -8.538 1.809 -18.575 752 2HZ LYS 93 HZ2 LYS 93 -9.128 1.960 -16.997 753 3HZ LYS 93 HZ3 LYS 93 -10.032 1.130 -18.161 754 H SER 94 HN SER 94 -6.301 -1.464 -13.622 755 HA SER 94 HA SER 94 -3.831 -3.008 -13.967 756 1HB SER 94 HB2 SER 94 -2.919 -1.231 -15.427 757 2HB SER 94 HB1 SER 94 -4.329 -2.019 -16.134 758 HG SER 94 HG SER 94 -4.056 0.492 -15.921 759 H TYR 95 HN TYR 95 -5.466 -0.298 -12.510 760 HA TYR 95 HA TYR 95 -3.095 0.119 -10.829 761 1HB TYR 95 HB2 TYR 95 -3.624 2.574 -10.836 762 2HB TYR 95 HB1 TYR 95 -3.047 1.941 -12.373 763 HD1 TYR 95 HD1 TYR 95 -4.258 2.340 -14.320 764 HD2 TYR 95 HD2 TYR 95 -6.198 2.783 -10.559 765 HE1 TYR 95 HE1 TYR 95 -6.235 3.263 -15.455 766 HE2 TYR 95 HE2 TYR 95 -8.182 3.704 -11.685 767 HH TYR 95 HH TYR 95 -8.172 4.757 -14.867 768 H ALA 96 HN ALA 96 -3.467 0.211 -8.696 769 HA ALA 96 HA ALA 96 -6.166 0.784 -7.708 770 1HB ALA 96 HB1 ALA 96 -4.967 -1.457 -6.284 771 2HB ALA 96 HB2 ALA 96 -5.316 -1.822 -7.972 772 3HB ALA 96 HB3 ALA 96 -6.603 -1.261 -6.911 773 H VAL 97 HN VAL 97 -6.243 1.547 -5.592 774 HA VAL 97 HA VAL 97 -3.630 2.100 -4.357 775 HB VAL 97 HB VAL 97 -4.326 4.256 -3.677 776 1HG1 VAL 97 HG11 VAL 97 -5.602 4.604 -6.254 777 2HG1 VAL 97 HG12 VAL 97 -4.183 3.565 -6.358 778 3HG1 VAL 97 HG13 VAL 97 -4.038 5.186 -5.683 779 1HG2 VAL 97 HG21 VAL 97 -6.467 4.286 -2.926 780 2HG2 VAL 97 HG22 VAL 97 -7.049 3.231 -4.213 781 3HG2 VAL 97 HG23 VAL 97 -6.769 4.941 -4.536 782 H ILE 98 HN ILE 98 -3.413 1.373 -2.343 783 HA ILE 98 HA ILE 98 -5.832 0.838 -0.757 784 HB ILE 98 HB ILE 98 -5.153 -1.289 -1.632 785 1HG1 ILE 98 HG12 ILE 98 -5.772 -1.114 0.825 786 2HG1 ILE 98 HG11 ILE 98 -4.873 -2.553 0.363 787 1HG2 ILE 98 HG21 ILE 98 -2.548 -0.210 -1.492 788 2HG2 ILE 98 HG22 ILE 98 -3.063 -1.743 -2.196 789 3HG2 ILE 98 HG23 ILE 98 -2.563 -1.672 -0.508 790 1HD1 ILE 98 HD11 ILE 98 -2.918 -0.734 1.104 791 2HD1 ILE 98 HD12 ILE 98 -3.508 -2.102 2.041 792 3HD1 ILE 98 HD13 ILE 98 -4.215 -0.505 2.275 793 H TYR 99 HN TYR 99 -5.754 1.864 1.159 794 HA TYR 99 HA TYR 99 -3.123 2.708 2.121 795 1HB TYR 99 HB2 TYR 99 -4.271 4.323 3.521 796 2HB TYR 99 HB1 TYR 99 -4.833 4.473 1.861 797 HD1 TYR 99 HD1 TYR 99 -7.103 4.590 1.464 798 HD2 TYR 99 HD2 TYR 99 -5.751 2.794 5.074 799 HE1 TYR 99 HE1 TYR 99 -9.430 4.393 2.231 800 HE2 TYR 99 HE2 TYR 99 -8.075 2.583 5.848 801 HH TYR 99 HH TYR 99 -10.775 3.246 3.761 802 H ALA 100 HN ALA 100 -2.194 1.827 3.819 803 HA ALA 100 HA ALA 100 -3.681 -0.191 5.327 804 1HB ALA 100 HB1 ALA 100 -1.404 -0.602 4.175 805 2HB ALA 100 HB2 ALA 100 -1.655 -1.222 5.807 806 3HB ALA 100 HB3 ALA 100 -0.730 0.259 5.559 807 H THR 101 HN THR 101 -4.070 -0.030 7.477 808 HA THR 101 HA THR 101 -2.831 2.155 8.983 809 HB THR 101 HB THR 101 -5.079 2.677 9.976 810 HG1 THR 101 HG1 THR 101 -5.883 0.546 8.926 811 1HG2 THR 101 HG21 THR 101 -4.064 3.524 7.501 812 2HG2 THR 101 HG22 THR 101 -5.201 4.360 8.558 813 3HG2 THR 101 HG23 THR 101 -5.798 3.290 7.290 814 H ARG 102 HN ARG 102 -2.274 1.590 11.022 815 HA ARG 102 HA ARG 102 -2.793 -1.142 11.811 816 1HB ARG 102 HB2 ARG 102 -1.110 0.994 13.120 817 2HB ARG 102 HB1 ARG 102 -1.223 -0.673 13.667 818 1HG ARG 102 HG2 ARG 102 -0.431 -1.341 11.355 819 2HG ARG 102 HG1 ARG 102 -0.046 0.362 11.106 820 1HD ARG 102 HD2 ARG 102 1.038 -1.371 13.323 821 2HD ARG 102 HD1 ARG 102 1.900 -0.952 11.844 822 HE ARG 102 HE ARG 102 1.104 1.418 13.087 823 1HH1 ARG 102 HH11 ARG 102 3.262 -1.265 13.653 824 2HH1 ARG 102 HH12 ARG 102 4.388 -0.329 14.578 825 1HH2 ARG 102 HH21 ARG 102 2.591 2.654 14.304 826 2HH2 ARG 102 HH22 ARG 102 4.006 1.894 14.948 827 H VAL 103 HN VAL 103 -3.957 -1.828 13.523 828 HA VAL 103 HA VAL 103 -5.297 0.125 15.236 829 HB VAL 103 HB VAL 103 -6.872 -0.292 13.409 830 1HG1 VAL 103 HG11 VAL 103 -7.540 -3.032 13.976 831 2HG1 VAL 103 HG12 VAL 103 -5.849 -2.897 13.495 832 3HG1 VAL 103 HG13 VAL 103 -7.117 -2.276 12.441 833 1HG2 VAL 103 HG21 VAL 103 -8.117 -1.891 15.558 834 2HG2 VAL 103 HG22 VAL 103 -8.678 -0.418 14.766 835 3HG2 VAL 103 HG23 VAL 103 -7.455 -0.326 16.033 836 H LYS 104 HN LYS 104 -4.488 -0.504 17.141 837 HA LYS 104 HA LYS 104 -5.139 -3.166 18.108 838 1HB LYS 104 HB2 LYS 104 -2.880 -3.620 18.921 839 2HB LYS 104 HB1 LYS 104 -2.877 -3.437 17.176 840 1HG LYS 104 HG2 LYS 104 -2.050 -1.147 17.419 841 2HG LYS 104 HG1 LYS 104 -2.026 -1.354 19.171 842 1HD LYS 104 HD2 LYS 104 -0.440 -2.980 17.182 843 2HD LYS 104 HD1 LYS 104 0.198 -1.679 18.190 844 1HE LYS 104 HE2 LYS 104 -0.419 -2.959 20.197 845 2HE LYS 104 HE1 LYS 104 -1.008 -4.265 19.170 846 1HZ LYS 104 HZ1 LYS 104 1.071 -4.947 18.691 847 2HZ LYS 104 HZ2 LYS 104 1.448 -4.190 20.156 848 3HZ LYS 104 HZ3 LYS 104 1.723 -3.385 18.694 849 H ASP 105 HN ASP 105 -5.666 -3.134 20.253 850 HA ASP 105 HA ASP 105 -6.239 -2.225 22.267 851 1HB ASP 105 HB2 ASP 105 -3.610 -0.755 21.921 852 2HB ASP 105 HB1 ASP 105 -4.463 -1.002 23.441 853 H GLY 106 HN GLY 106 -4.990 0.693 22.727 854 1HA GLY 106 HA2 GLY 106 -7.257 2.049 21.424 855 2HA GLY 106 HA1 GLY 106 -6.512 2.566 22.931 856 H ARG 107 HN ARG 107 -5.056 1.639 19.818 857 HA ARG 107 HA ARG 107 -4.145 4.391 19.439 858 1HB ARG 107 HB2 ARG 107 -1.843 3.736 19.071 859 2HB ARG 107 HB1 ARG 107 -2.347 3.217 20.671 860 1HG ARG 107 HG2 ARG 107 -2.788 0.948 19.633 861 2HG ARG 107 HG1 ARG 107 -1.918 1.540 18.220 862 1HD ARG 107 HD2 ARG 107 -0.850 1.336 21.035 863 2HD ARG 107 HD1 ARG 107 -0.433 0.288 19.681 864 HE ARG 107 HE ARG 107 0.148 2.912 18.941 865 1HH1 ARG 107 HH11 ARG 107 1.230 0.529 21.253 866 2HH1 ARG 107 HH12 ARG 107 2.849 1.139 21.315 867 1HH2 ARG 107 HH21 ARG 107 2.277 3.717 19.019 868 2HH2 ARG 107 HH22 ARG 107 3.445 2.953 20.045 869 H THR 108 HN THR 108 -4.152 5.023 17.368 870 HA THR 108 HA THR 108 -4.546 2.961 15.301 871 HB THR 108 HB THR 108 -5.866 5.672 15.511 872 HG1 THR 108 HG1 THR 108 -6.900 4.231 16.825 873 1HG2 THR 108 HG21 THR 108 -5.420 5.084 13.171 874 2HG2 THR 108 HG22 THR 108 -7.142 5.094 13.553 875 3HG2 THR 108 HG23 THR 108 -6.278 3.562 13.408 876 H LEU 109 HN LEU 109 -3.597 3.279 13.310 877 HA LEU 109 HA LEU 109 -1.839 5.615 13.004 878 1HB LEU 109 HB2 LEU 109 -1.053 2.770 12.371 879 2HB LEU 109 HB1 LEU 109 -0.062 4.195 12.133 880 HG LEU 109 HG LEU 109 0.718 3.070 14.088 881 1HD1 LEU 109 HD11 LEU 109 -0.729 5.125 15.556 882 2HD1 LEU 109 HD12 LEU 109 -0.032 5.707 14.044 883 3HD1 LEU 109 HD13 LEU 109 0.999 4.946 15.256 884 1HD2 LEU 109 HD21 LEU 109 -0.581 1.945 15.502 885 2HD2 LEU 109 HD22 LEU 109 -1.927 2.296 14.419 886 3HD2 LEU 109 HD23 LEU 109 -1.603 3.352 15.793 887 H HIS 110 HN HIS 110 -1.618 6.379 10.902 888 HA HIS 110 HA HIS 110 -3.310 4.994 8.921 889 1HB HIS 110 HB2 HIS 110 -2.793 7.953 9.184 890 2HB HIS 110 HB1 HIS 110 -3.770 7.196 7.932 891 HD1 HIS 110 HD1 HIS 110 -3.741 7.046 11.742 892 HD2 HIS 110 HD2 HIS 110 -6.376 7.425 8.552 893 HE1 HIS 110 HE1 HIS 110 -6.026 7.214 12.776 894 HE2 HIS 110 HE2 HIS 110 -7.599 7.513 10.830 895 H MET 111 HN MET 111 -2.572 4.621 6.931 896 HA MET 111 HA MET 111 -0.249 5.912 5.873 897 1HB MET 111 HB2 MET 111 -0.102 2.972 6.556 898 2HB MET 111 HB1 MET 111 1.067 3.835 5.567 899 1HG MET 111 HG2 MET 111 1.584 5.283 7.486 900 2HG MET 111 HG1 MET 111 0.460 4.347 8.468 901 1HE MET 111 HE1 MET 111 4.267 2.531 6.600 902 2HE MET 111 HE2 MET 111 3.776 4.208 6.356 903 3HE MET 111 HE3 MET 111 2.809 2.897 5.679 904 H MET 112 HN MET 112 -0.289 5.882 3.686 905 HA MET 112 HA MET 112 -2.439 4.358 2.421 906 1HB MET 112 HB2 MET 112 -0.987 6.870 1.657 907 2HB MET 112 HB1 MET 112 -1.907 5.961 0.471 908 1HG MET 112 HG2 MET 112 -3.213 7.789 1.370 909 2HG MET 112 HG1 MET 112 -3.922 6.237 1.805 910 1HE MET 112 HE1 MET 112 -5.056 7.985 4.837 911 2HE MET 112 HE2 MET 112 -5.307 7.830 3.098 912 3HE MET 112 HE3 MET 112 -4.505 9.258 3.750 913 H ARG 113 HN ARG 113 -2.080 3.145 0.561 914 HA ARG 113 HA ARG 113 0.689 2.739 -0.283 915 1HB ARG 113 HB2 ARG 113 -0.336 1.029 1.519 916 2HB ARG 113 HB1 ARG 113 -0.972 0.291 0.057 917 1HG ARG 113 HG2 ARG 113 1.220 -0.053 -0.813 918 2HG ARG 113 HG1 ARG 113 1.942 0.895 0.493 919 1HD ARG 113 HD2 ARG 113 0.942 -0.786 2.094 920 2HD ARG 113 HD1 ARG 113 0.567 -1.776 0.684 921 HE ARG 113 HE ARG 113 3.270 -1.133 0.566 922 1HH1 ARG 113 HH11 ARG 113 1.099 -2.968 2.593 923 2HH1 ARG 113 HH12 ARG 113 2.327 -4.067 3.125 924 1HH2 ARG 113 HH21 ARG 113 4.882 -2.569 1.266 925 2HH2 ARG 113 HH22 ARG 113 4.477 -3.837 2.374 926 H LEU 114 HN LEU 114 0.857 2.207 -2.475 927 HA LEU 114 HA LEU 114 -1.650 1.756 -3.926 928 1HB LEU 114 HB2 LEU 114 -1.139 4.200 -3.864 929 2HB LEU 114 HB1 LEU 114 0.366 3.868 -4.697 930 HG LEU 114 HG LEU 114 -2.368 3.286 -5.837 931 1HD1 LEU 114 HD11 LEU 114 -0.628 5.452 -6.879 932 2HD1 LEU 114 HD12 LEU 114 -1.538 5.758 -5.399 933 3HD1 LEU 114 HD13 LEU 114 -2.385 5.310 -6.879 934 1HD2 LEU 114 HD21 LEU 114 -0.770 3.440 -7.957 935 2HD2 LEU 114 HD22 LEU 114 -1.043 1.929 -7.088 936 3HD2 LEU 114 HD23 LEU 114 0.412 2.877 -6.777 937 H TYR 115 HN TYR 115 -1.387 -0.007 -5.101 938 HA TYR 115 HA TYR 115 1.304 -0.657 -6.065 939 1HB TYR 115 HB2 TYR 115 -1.118 -2.431 -5.744 940 2HB TYR 115 HB1 TYR 115 0.443 -2.953 -6.364 941 HD1 TYR 115 HD1 TYR 115 2.043 -3.788 -4.893 942 HD2 TYR 115 HD2 TYR 115 -1.133 -1.410 -3.356 943 HE1 TYR 115 HE1 TYR 115 2.773 -4.306 -2.606 944 HE2 TYR 115 HE2 TYR 115 -0.407 -1.918 -1.061 945 HH TYR 115 HH TYR 115 2.579 -3.601 -0.405 946 H SER 116 HN SER 116 1.765 -0.408 -8.125 947 HA SER 116 HA SER 116 -0.453 -0.193 -10.041 948 1HB SER 116 HB2 SER 116 1.126 1.045 -11.481 949 2HB SER 116 HB1 SER 116 0.943 1.822 -9.908 950 HG SER 116 HG SER 116 3.141 1.647 -10.602 951 H ARG 117 HN ARG 117 -0.688 -1.726 -11.527 952 HA ARG 117 HA ARG 117 1.055 -3.988 -11.569 953 1HB ARG 117 HB2 ARG 117 -1.502 -3.219 -12.848 954 2HB ARG 117 HB1 ARG 117 -0.538 -4.421 -13.694 955 1HG ARG 117 HG2 ARG 117 -0.818 -5.993 -12.074 956 2HG ARG 117 HG1 ARG 117 -0.978 -4.799 -10.787 957 1HD ARG 117 HD2 ARG 117 -3.059 -5.337 -12.905 958 2HD ARG 117 HD1 ARG 117 -3.084 -6.022 -11.280 959 HE ARG 117 HE ARG 117 -3.995 -3.474 -12.012 960 1HH1 ARG 117 HH11 ARG 117 -2.208 -5.077 -9.477 961 2HH1 ARG 117 HH12 ARG 117 -2.530 -3.846 -8.303 962 1HH2 ARG 117 HH21 ARG 117 -4.424 -1.863 -10.461 963 2HH2 ARG 117 HH22 ARG 117 -3.775 -2.021 -8.864 964 H SER 118 HN SER 118 0.554 -1.192 -13.617 965 HA SER 118 HA SER 118 2.904 -2.018 -15.183 966 1HB SER 118 HB2 SER 118 0.441 -0.608 -16.241 967 2HB SER 118 HB1 SER 118 1.899 -0.952 -17.170 968 HG SER 118 HG SER 118 1.475 -3.219 -16.622 969 HA PRO 119 HA PRO 119 4.889 1.709 -13.880 970 1HB PRO 119 HB2 PRO 119 5.630 1.895 -16.773 971 2HB PRO 119 HB1 PRO 119 6.651 2.057 -15.338 972 1HG PRO 119 HG2 PRO 119 6.669 -0.186 -16.773 973 2HG PRO 119 HG1 PRO 119 6.774 -0.233 -15.004 974 1HD PRO 119 HD2 PRO 119 4.493 -0.914 -16.784 975 2HD PRO 119 HD1 PRO 119 4.924 -1.573 -15.194 976 H GLU 120 HN GLU 120 3.133 1.789 -16.964 977 HA GLU 120 HA GLU 120 2.771 4.597 -17.031 978 1HB GLU 120 HB2 GLU 120 2.612 3.222 -19.041 979 2HB GLU 120 HB1 GLU 120 1.211 2.391 -18.384 980 1HG GLU 120 HG2 GLU 120 -0.062 4.471 -18.449 981 2HG GLU 120 HG1 GLU 120 1.347 5.314 -19.090 982 H VAL 121 HN VAL 121 2.121 4.646 -14.636 983 HA VAL 121 HA VAL 121 -0.423 3.757 -13.821 984 HB VAL 121 HB VAL 121 1.128 6.131 -12.768 985 1HG1 VAL 121 HG11 VAL 121 -0.171 5.740 -10.696 986 2HG1 VAL 121 HG12 VAL 121 -1.132 4.539 -11.557 987 3HG1 VAL 121 HG13 VAL 121 -1.179 6.229 -12.058 988 1HG2 VAL 121 HG21 VAL 121 1.202 3.202 -12.108 989 2HG2 VAL 121 HG22 VAL 121 1.747 4.432 -10.968 990 3HG2 VAL 121 HG23 VAL 121 2.540 4.269 -12.535 991 H SER 122 HN SER 122 -2.380 4.430 -14.365 992 HA SER 122 HA SER 122 -2.834 6.528 -16.188 993 1HB SER 122 HB2 SER 122 -4.338 4.584 -15.954 994 2HB SER 122 HB1 SER 122 -4.810 5.153 -14.351 995 HG SER 122 HG SER 122 -5.519 7.112 -15.455 996 HA PRO 123 HA PRO 123 -2.940 10.204 -13.733 997 1HB PRO 123 HB2 PRO 123 -5.213 11.373 -14.860 998 2HB PRO 123 HB1 PRO 123 -3.562 11.545 -15.463 999 1HG PRO 123 HG2 PRO 123 -5.738 9.726 -16.381 1000 2HG PRO 123 HG1 PRO 123 -4.508 10.577 -17.333 1001 1HD PRO 123 HD2 PRO 123 -4.304 7.958 -16.824 1002 2HD PRO 123 HD1 PRO 123 -2.868 9.004 -16.847 1003 H ALA 124 HN ALA 124 -5.965 8.443 -14.248 1004 HA ALA 124 HA ALA 124 -7.441 9.588 -12.153 1005 1HB ALA 124 HB1 ALA 124 -7.664 6.954 -13.580 1006 2HB ALA 124 HB2 ALA 124 -8.669 8.392 -13.758 1007 3HB ALA 124 HB3 ALA 124 -8.771 7.421 -12.289 1008 H ALA 125 HN ALA 125 -5.572 6.565 -12.265 1009 HA ALA 125 HA ALA 125 -6.060 5.640 -9.719 1010 1HB ALA 125 HB1 ALA 125 -4.433 4.897 -11.789 1011 2HB ALA 125 HB2 ALA 125 -4.529 4.100 -10.219 1012 3HB ALA 125 HB3 ALA 125 -3.276 5.303 -10.519 1013 H THR 126 HN THR 126 -3.441 7.812 -10.743 1014 HA THR 126 HA THR 126 -2.522 8.218 -8.064 1015 HB THR 126 HB THR 126 -1.915 9.737 -10.595 1016 HG1 THR 126 HG1 THR 126 -0.382 7.754 -9.278 1017 1HG2 THR 126 HG21 THR 126 -1.374 10.980 -8.505 1018 2HG2 THR 126 HG22 THR 126 0.009 10.614 -9.533 1019 3HG2 THR 126 HG23 THR 126 -0.280 9.663 -8.077 1020 H ALA 127 HN ALA 127 -4.343 10.232 -10.388 1021 HA ALA 127 HA ALA 127 -4.588 12.449 -8.639 1022 1HB ALA 127 HB1 ALA 127 -5.978 13.424 -10.252 1023 2HB ALA 127 HB2 ALA 127 -6.497 11.857 -10.871 1024 3HB ALA 127 HB3 ALA 127 -4.854 12.419 -11.172 1025 H ILE 128 HN ILE 128 -6.973 9.945 -9.580 1026 HA ILE 128 HA ILE 128 -9.013 10.850 -7.932 1027 HB ILE 128 HB ILE 128 -8.482 7.994 -8.764 1028 1HG1 ILE 128 HG12 ILE 128 -10.099 10.254 -9.947 1029 2HG1 ILE 128 HG11 ILE 128 -8.836 9.302 -10.715 1030 1HG2 ILE 128 HG21 ILE 128 -11.002 9.220 -7.644 1031 2HG2 ILE 128 HG22 ILE 128 -9.930 8.117 -6.784 1032 3HG2 ILE 128 HG23 ILE 128 -10.813 7.557 -8.204 1033 1HD1 ILE 128 HD11 ILE 128 -11.701 8.744 -10.399 1034 2HD1 ILE 128 HD12 ILE 128 -10.625 7.369 -10.148 1035 3HD1 ILE 128 HD13 ILE 128 -10.575 8.261 -11.668 1036 H PHE 129 HN PHE 129 -6.333 8.626 -7.165 1037 HA PHE 129 HA PHE 129 -7.249 7.958 -4.587 1038 1HB PHE 129 HB2 PHE 129 -5.348 6.798 -5.707 1039 2HB PHE 129 HB1 PHE 129 -4.362 8.236 -5.467 1040 HD1 PHE 129 HD1 PHE 129 -6.776 6.744 -3.077 1041 HD2 PHE 129 HD2 PHE 129 -2.684 7.430 -4.031 1042 HE1 PHE 129 HE1 PHE 129 -6.121 5.924 -0.851 1043 HE2 PHE 129 HE2 PHE 129 -2.024 6.610 -1.805 1044 HZ PHE 129 HZ PHE 129 -3.745 5.857 -0.213 1045 H ARG 130 HN ARG 130 -5.283 10.622 -5.798 1046 HA ARG 130 HA ARG 130 -4.815 11.866 -3.294 1047 1HB ARG 130 HB2 ARG 130 -3.440 12.431 -5.219 1048 2HB ARG 130 HB1 ARG 130 -4.851 12.983 -6.110 1049 1HG ARG 130 HG2 ARG 130 -3.526 14.847 -5.273 1050 2HG ARG 130 HG1 ARG 130 -5.137 14.828 -4.557 1051 1HD ARG 130 HD2 ARG 130 -3.441 15.333 -2.887 1052 2HD ARG 130 HD1 ARG 130 -4.242 13.804 -2.539 1053 HE ARG 130 HE ARG 130 -2.206 12.807 -2.669 1054 1HH1 ARG 130 HH11 ARG 130 -2.058 15.754 -4.530 1055 2HH1 ARG 130 HH12 ARG 130 -0.392 15.551 -4.950 1056 1HH2 ARG 130 HH21 ARG 130 -0.011 12.548 -3.202 1057 2HH2 ARG 130 HH22 ARG 130 0.773 13.732 -4.194 1058 H LYS 131 HN LYS 131 -7.272 12.180 -5.801 1059 HA LYS 131 HA LYS 131 -8.728 14.328 -4.727 1060 1HB LYS 131 HB2 LYS 131 -9.047 13.441 -7.021 1061 2HB LYS 131 HB1 LYS 131 -9.745 11.978 -6.342 1062 1HG LYS 131 HG2 LYS 131 -11.557 13.341 -5.362 1063 2HG LYS 131 HG1 LYS 131 -10.878 14.761 -6.158 1064 1HD LYS 131 HD2 LYS 131 -11.916 12.277 -7.524 1065 2HD LYS 131 HD1 LYS 131 -12.725 13.843 -7.455 1066 1HE LYS 131 HE2 LYS 131 -10.858 14.852 -8.684 1067 2HE LYS 131 HE1 LYS 131 -10.068 13.278 -8.767 1068 1HZ LYS 131 HZ1 LYS 131 -11.728 12.452 -10.178 1069 2HZ LYS 131 HZ2 LYS 131 -11.390 13.996 -10.780 1070 3HZ LYS 131 HZ3 LYS 131 -12.782 13.735 -9.855 1071 H LEU 132 HN LEU 132 -9.030 10.829 -4.335 1072 HA LEU 132 HA LEU 132 -11.222 10.853 -2.560 1073 1HB LEU 132 HB2 LEU 132 -10.379 8.869 -3.846 1074 2HB LEU 132 HB1 LEU 132 -9.016 8.798 -2.747 1075 HG LEU 132 HG LEU 132 -11.893 8.502 -1.882 1076 1HD1 LEU 132 HD11 LEU 132 -9.818 6.476 -2.659 1077 2HD1 LEU 132 HD12 LEU 132 -11.480 6.627 -3.229 1078 3HD1 LEU 132 HD13 LEU 132 -11.159 6.078 -1.584 1079 1HD2 LEU 132 HD21 LEU 132 -10.396 7.307 0.010 1080 2HD2 LEU 132 HD22 LEU 132 -10.899 8.995 0.086 1081 3HD2 LEU 132 HD23 LEU 132 -9.289 8.581 -0.500 1082 H ALA 133 HN ALA 133 -7.730 10.960 -2.119 1083 HA ALA 133 HA ALA 133 -7.666 10.759 0.687 1084 1HB ALA 133 HB1 ALA 133 -5.480 12.187 0.289 1085 2HB ALA 133 HB2 ALA 133 -5.802 11.782 -1.398 1086 3HB ALA 133 HB3 ALA 133 -5.575 10.498 -0.212 1087 H GLY 134 HN GLY 134 -7.980 13.522 -1.504 1088 1HA GLY 134 HA2 GLY 134 -7.809 15.592 0.356 1089 2HA GLY 134 HA1 GLY 134 -8.733 15.663 -1.137 1090 H GLU 135 HN GLU 135 -10.655 13.732 -0.675 1091 HA GLU 135 HA GLU 135 -12.591 15.097 0.797 1092 1HB GLU 135 HB2 GLU 135 -12.496 12.128 0.214 1093 2HB GLU 135 HB1 GLU 135 -13.931 13.053 0.639 1094 1HG GLU 135 HG2 GLU 135 -12.280 13.397 -1.855 1095 2HG GLU 135 HG1 GLU 135 -13.842 12.588 -1.741 1096 H ARG 136 HN ARG 136 -10.392 12.511 1.671 1097 HA ARG 136 HA ARG 136 -11.397 12.192 4.335 1098 1HB ARG 136 HB2 ARG 136 -8.791 11.275 3.103 1099 2HB ARG 136 HB1 ARG 136 -9.417 10.757 4.662 1100 1HG ARG 136 HG2 ARG 136 -10.695 10.253 1.982 1101 2HG ARG 136 HG1 ARG 136 -9.814 9.076 2.958 1102 1HD ARG 136 HD2 ARG 136 -12.354 10.491 3.758 1103 2HD ARG 136 HD1 ARG 136 -12.238 8.822 3.205 1104 HE ARG 136 HE ARG 136 -10.533 9.139 5.395 1105 1HH1 ARG 136 HH11 ARG 136 -13.952 9.181 4.688 1106 2HH1 ARG 136 HH12 ARG 136 -14.411 8.634 6.265 1107 1HH2 ARG 136 HH21 ARG 136 -11.133 8.416 7.465 1108 2HH2 ARG 136 HH22 ARG 136 -12.809 8.200 7.844 1109 H ASN 137 HN ASN 137 -9.065 14.214 2.759 1110 HA ASN 137 HA ASN 137 -7.959 16.068 3.497 1111 1HB ASN 137 HB2 ASN 137 -9.838 16.482 5.051 1112 2HB ASN 137 HB1 ASN 137 -9.077 15.423 6.234 1113 1HD2 ASN 137 HD21 ASN 137 -8.047 16.447 7.757 1114 2HD2 ASN 137 HD22 ASN 137 -7.229 17.961 7.605 1115 H TYR 138 HN TYR 138 -6.484 13.928 3.057 1116 HA TYR 138 HA TYR 138 -4.472 14.100 5.166 1117 1HB TYR 138 HB2 TYR 138 -5.675 11.557 4.088 1118 2HB TYR 138 HB1 TYR 138 -4.054 11.576 4.773 1119 HD1 TYR 138 HD1 TYR 138 -6.518 10.022 5.784 1120 HD2 TYR 138 HD2 TYR 138 -4.838 13.774 6.897 1121 HE1 TYR 138 HE1 TYR 138 -7.476 9.783 8.039 1122 HE2 TYR 138 HE2 TYR 138 -5.793 13.544 9.145 1123 HH TYR 138 HH TYR 138 -6.604 11.056 10.554 1124 H THR 139 HN THR 139 -4.636 15.354 2.572 1125 HA THR 139 HA THR 139 -2.661 13.915 0.981 1126 HB THR 139 HB THR 139 -4.412 14.907 -0.313 1127 HG1 THR 139 HG1 THR 139 -2.101 15.195 -0.964 1128 1HG2 THR 139 HG21 THR 139 -4.704 16.853 1.509 1129 2HG2 THR 139 HG22 THR 139 -5.291 16.975 -0.148 1130 3HG2 THR 139 HG23 THR 139 -3.754 17.711 0.301 1131 H ASP 140 HN ASP 140 -2.977 17.147 2.445 1132 HA ASP 140 HA ASP 140 -0.131 17.622 2.226 1133 1HB ASP 140 HB2 ASP 140 -2.381 19.226 3.445 1134 2HB ASP 140 HB1 ASP 140 -0.697 19.733 3.527 1135 H GLU 141 HN GLU 141 -2.409 16.478 4.531 1136 HA GLU 141 HA GLU 141 -1.309 16.822 6.987 1137 1HB GLU 141 HB2 GLU 141 -3.394 15.629 6.635 1138 2HB GLU 141 HB1 GLU 141 -2.554 14.319 5.819 1139 1HG GLU 141 HG2 GLU 141 -3.032 13.504 7.949 1140 2HG GLU 141 HG1 GLU 141 -1.328 13.949 8.002 1141 H MET 142 HN MET 142 -0.789 13.630 5.572 1142 HA MET 142 HA MET 142 2.088 13.928 5.843 1143 1HB MET 142 HB2 MET 142 0.430 12.081 7.502 1144 2HB MET 142 HB1 MET 142 2.002 11.542 6.952 1145 1HG MET 142 HG2 MET 142 2.367 12.409 9.086 1146 2HG MET 142 HG1 MET 142 2.955 13.641 7.979 1147 1HE MET 142 HE1 MET 142 2.196 14.471 11.221 1148 2HE MET 142 HE2 MET 142 1.798 16.075 10.608 1149 3HE MET 142 HE3 MET 142 3.130 15.166 9.895 1150 H VAL 143 HN VAL 143 2.937 13.196 4.028 1151 HA VAL 143 HA VAL 143 1.463 11.177 2.473 1152 HB VAL 143 HB VAL 143 1.801 13.397 1.398 1153 1HG1 VAL 143 HG11 VAL 143 4.380 13.192 2.452 1154 2HG1 VAL 143 HG12 VAL 143 3.757 14.461 1.398 1155 3HG1 VAL 143 HG13 VAL 143 4.585 13.068 0.704 1156 1HG2 VAL 143 HG21 VAL 143 2.268 12.581 -0.736 1157 2HG2 VAL 143 HG22 VAL 143 1.737 11.139 0.129 1158 3HG2 VAL 143 HG23 VAL 143 3.459 11.424 -0.140 1159 H ALA 144 HN ALA 144 3.034 10.002 0.908 1160 HA ALA 144 HA ALA 144 5.648 9.389 1.849 1161 1HB ALA 144 HB1 ALA 144 5.196 6.972 2.252 1162 2HB ALA 144 HB2 ALA 144 3.471 7.326 2.190 1163 3HB ALA 144 HB3 ALA 144 4.471 8.039 3.454 1164 H MET 145 HN MET 145 6.655 9.404 -0.044 1165 HA MET 145 HA MET 145 5.409 7.977 -2.303 1166 1HB MET 145 HB2 MET 145 6.489 9.576 -3.819 1167 2HB MET 145 HB1 MET 145 5.370 10.377 -2.726 1168 1HG MET 145 HG2 MET 145 7.262 11.077 -1.331 1169 2HG MET 145 HG1 MET 145 8.368 10.296 -2.460 1170 1HE MET 145 HE1 MET 145 5.843 14.044 -3.248 1171 2HE MET 145 HE2 MET 145 5.616 12.855 -1.965 1172 3HE MET 145 HE3 MET 145 5.107 12.483 -3.612 1173 H LEU 146 HN LEU 146 6.755 6.864 -3.720 1174 HA LEU 146 HA LEU 146 8.856 5.430 -2.631 1175 1HB LEU 146 HB2 LEU 146 7.552 4.838 -4.676 1176 2HB LEU 146 HB1 LEU 146 8.436 6.068 -5.554 1177 HG LEU 146 HG LEU 146 9.704 3.639 -4.282 1178 1HD1 LEU 146 HD11 LEU 146 10.009 3.005 -6.737 1179 2HD1 LEU 146 HD12 LEU 146 8.737 4.180 -7.071 1180 3HD1 LEU 146 HD13 LEU 146 8.405 2.792 -6.035 1181 1HD2 LEU 146 HD21 LEU 146 11.491 4.407 -6.063 1182 2HD2 LEU 146 HD22 LEU 146 11.456 5.099 -4.442 1183 3HD2 LEU 146 HD23 LEU 146 10.744 5.982 -5.793 1184 HA PRO 147 HA PRO 147 12.084 8.523 -2.459 1185 1HB PRO 147 HB2 PRO 147 14.171 6.698 -2.282 1186 2HB PRO 147 HB1 PRO 147 13.254 7.338 -0.917 1187 1HG PRO 147 HG2 PRO 147 12.964 4.740 -2.346 1188 2HG PRO 147 HG1 PRO 147 12.775 5.105 -0.622 1189 1HD PRO 147 HD2 PRO 147 10.661 4.721 -2.236 1190 2HD PRO 147 HD1 PRO 147 10.619 5.881 -0.892 1191 H ARG 148 HN ARG 148 12.905 9.567 -4.129 1192 HA ARG 148 HA ARG 148 13.485 8.086 -6.574 1193 1HB ARG 148 HB2 ARG 148 13.640 10.476 -7.533 1194 2HB ARG 148 HB1 ARG 148 12.064 9.832 -7.103 1195 1HG ARG 148 HG2 ARG 148 12.352 12.165 -6.411 1196 2HG ARG 148 HG1 ARG 148 12.067 11.090 -5.043 1197 1HD ARG 148 HD2 ARG 148 14.417 11.086 -4.506 1198 2HD ARG 148 HD1 ARG 148 14.782 12.047 -5.937 1199 HE ARG 148 HE ARG 148 13.935 13.019 -3.419 1200 1HH1 ARG 148 HH11 ARG 148 13.585 13.594 -6.844 1201 2HH1 ARG 148 HH12 ARG 148 13.186 15.268 -6.648 1202 1HH2 ARG 148 HH21 ARG 148 13.415 15.219 -3.161 1203 2HH2 ARG 148 HH22 ARG 148 13.091 16.191 -4.557 1204 H GLN 149 HN GLN 149 15.197 9.281 -3.957 1205 HA GLN 149 HA GLN 149 17.548 10.009 -5.499 1206 1HB GLN 149 HB2 GLN 149 17.077 9.909 -2.525 1207 2HB GLN 149 HB1 GLN 149 18.589 10.403 -3.272 1208 1HG GLN 149 HG2 GLN 149 17.346 12.207 -4.442 1209 2HG GLN 149 HG1 GLN 149 15.920 11.759 -3.508 1210 1HE2 GLN 149 HE21 GLN 149 15.588 13.033 -1.858 1211 2HE2 GLN 149 HE22 GLN 149 16.797 13.790 -0.884 1212 H GLU 150 HN GLU 150 19.572 8.998 -5.293 1213 HA GLU 150 HA GLU 150 19.356 6.116 -4.931 1214 1HB GLU 150 HB2 GLU 150 21.516 7.817 -6.170 1215 2HB GLU 150 HB1 GLU 150 21.555 6.059 -6.080 1216 1HG GLU 150 HG2 GLU 150 19.476 5.972 -7.395 1217 2HG GLU 150 HG1 GLU 150 19.518 7.729 -7.539 1218 H GLU 151 HN GLU 151 19.209 6.620 -2.542 1219 HA GLU 151 HA GLU 151 21.588 5.800 -1.292 1220 1HB GLU 151 HB2 GLU 151 21.772 7.882 0.238 1221 2HB GLU 151 HB1 GLU 151 22.513 7.928 -1.355 1222 1HG GLU 151 HG2 GLU 151 20.613 9.181 -2.216 1223 2HG GLU 151 HG1 GLU 151 19.845 9.123 -0.631 1224 H CYS 152 HN CYS 152 19.927 7.951 0.790 1225 HA CYS 152 HA CYS 152 17.894 6.022 1.534 1226 1HB CYS 152 HB2 CYS 152 20.007 6.915 3.507 1227 2HB CYS 152 HB1 CYS 152 18.637 5.866 3.855 1228 H THR 153 HN THR 153 16.674 7.842 0.694 1229 HA THR 153 HA THR 153 15.833 9.615 2.805 1230 HB THR 153 HB THR 153 17.701 10.887 1.949 1231 HG1 THR 153 HG1 THR 153 15.333 11.991 0.857 1232 1HG2 THR 153 HG21 THR 153 16.457 11.052 -0.761 1233 2HG2 THR 153 HG22 THR 153 17.574 9.748 -0.362 1234 3HG2 THR 153 HG23 THR 153 18.106 11.425 -0.257 1235 H VAL 154 HN VAL 154 13.828 10.676 2.354 1236 HA VAL 154 HA VAL 154 12.501 10.078 -0.165 1237 HB VAL 154 HB VAL 154 12.075 8.137 1.397 1238 1HG1 VAL 154 HG11 VAL 154 9.979 9.575 2.840 1239 2HG1 VAL 154 HG12 VAL 154 11.613 10.069 3.285 1240 3HG1 VAL 154 HG13 VAL 154 11.137 8.379 3.417 1241 1HG2 VAL 154 HG21 VAL 154 9.706 7.995 0.833 1242 2HG2 VAL 154 HG22 VAL 154 10.645 8.626 -0.519 1243 3HG2 VAL 154 HG23 VAL 154 9.680 9.721 0.471 1244 H ASP 155 HN ASP 155 10.701 11.413 -0.599 1245 HA ASP 155 HA ASP 155 10.815 14.019 0.354 1246 1HB ASP 155 HB2 ASP 155 9.742 13.373 -1.777 1247 2HB ASP 155 HB1 ASP 155 8.418 12.637 -0.877 1248 H GLU 156 HN GLU 156 9.580 15.225 1.792 1249 HA GLU 156 HA GLU 156 7.683 13.823 3.517 1250 1HB GLU 156 HB2 GLU 156 10.356 14.632 4.317 1251 2HB GLU 156 HB1 GLU 156 9.128 15.419 5.299 1252 1HG GLU 156 HG2 GLU 156 9.863 13.360 6.330 1253 2HG GLU 156 HG1 GLU 156 8.171 13.245 5.854 1254 H VAL 157 HN VAL 157 5.983 15.049 4.073 1255 HA VAL 157 HA VAL 157 4.536 16.804 4.128 1256 HB VAL 157 HB VAL 157 6.999 18.507 4.526 1257 1HG1 VAL 157 HG11 VAL 157 5.053 19.644 6.008 1258 2HG1 VAL 157 HG12 VAL 157 4.099 18.993 4.675 1259 3HG1 VAL 157 HG13 VAL 157 5.425 20.109 4.348 1260 1HG2 VAL 157 HG21 VAL 157 6.881 18.107 6.839 1261 2HG2 VAL 157 HG22 VAL 157 6.740 16.516 6.090 1262 3HG2 VAL 157 HG23 VAL 157 5.303 17.329 6.709 Start of MODEL 11 1 1H MET 1 HT1 MET 1 -23.457 -21.095 -13.571 2 2H MET 1 HT2 MET 1 -23.406 -21.413 -15.231 3 3H MET 1 HT3 MET 1 -24.844 -20.882 -14.517 4 HA MET 1 HA MET 1 -23.853 -19.068 -15.696 5 1HB MET 1 HB2 MET 1 -23.540 -18.839 -12.695 6 2HB MET 1 HB1 MET 1 -23.675 -17.484 -13.807 7 1HG MET 1 HG2 MET 1 -25.915 -18.224 -14.438 8 2HG MET 1 HG1 MET 1 -25.779 -19.581 -13.322 9 1HE MET 1 HE1 MET 1 -24.441 -15.935 -12.782 10 2HE MET 1 HE2 MET 1 -25.801 -15.172 -11.957 11 3HE MET 1 HE3 MET 1 -25.954 -15.659 -13.645 12 H THR 2 HN THR 2 -22.075 -18.077 -16.466 13 HA THR 2 HA THR 2 -19.542 -19.242 -16.168 14 HB THR 2 HB THR 2 -20.170 -17.997 -18.164 15 HG1 THR 2 HG1 THR 2 -18.259 -16.811 -18.379 16 1HG2 THR 2 HG21 THR 2 -20.261 -15.582 -18.216 17 2HG2 THR 2 HG22 THR 2 -20.045 -15.516 -16.467 18 3HG2 THR 2 HG23 THR 2 -21.509 -16.225 -17.147 19 H VAL 3 HN VAL 3 -17.883 -18.896 -14.821 20 HA VAL 3 HA VAL 3 -18.290 -17.276 -12.494 21 HB VAL 3 HB VAL 3 -16.081 -18.077 -11.779 22 1HG1 VAL 3 HG11 VAL 3 -17.599 -19.615 -11.078 23 2HG1 VAL 3 HG12 VAL 3 -16.692 -20.638 -12.192 24 3HG1 VAL 3 HG13 VAL 3 -18.216 -19.911 -12.703 25 1HG2 VAL 3 HG21 VAL 3 -15.020 -18.065 -14.012 26 2HG2 VAL 3 HG22 VAL 3 -15.971 -19.485 -14.445 27 3HG2 VAL 3 HG23 VAL 3 -14.779 -19.585 -13.150 28 HA PRO 4 HA PRO 4 -16.579 -13.429 -13.904 29 1HB PRO 4 HB2 PRO 4 -15.539 -13.236 -11.122 30 2HB PRO 4 HB1 PRO 4 -16.523 -12.089 -12.039 31 1HG PRO 4 HG2 PRO 4 -17.613 -13.567 -10.115 32 2HG PRO 4 HG1 PRO 4 -18.494 -13.242 -11.620 33 1HD PRO 4 HD2 PRO 4 -17.075 -15.725 -10.750 34 2HD PRO 4 HD1 PRO 4 -18.595 -15.549 -11.652 35 H ASP 5 HN ASP 5 -14.642 -12.683 -14.661 36 HA ASP 5 HA ASP 5 -12.474 -14.414 -14.909 37 1HB ASP 5 HB2 ASP 5 -12.870 -12.557 -16.455 38 2HB ASP 5 HB1 ASP 5 -12.522 -11.398 -15.176 39 H ARG 6 HN ARG 6 -10.868 -14.958 -13.585 40 HA ARG 6 HA ARG 6 -10.684 -13.909 -10.956 41 1HB ARG 6 HB2 ARG 6 -8.893 -15.752 -12.535 42 2HB ARG 6 HB1 ARG 6 -8.565 -15.306 -10.868 43 1HG ARG 6 HG2 ARG 6 -9.655 -17.475 -11.016 44 2HG ARG 6 HG1 ARG 6 -10.666 -16.309 -10.164 45 1HD ARG 6 HD2 ARG 6 -11.991 -15.973 -12.185 46 2HD ARG 6 HD1 ARG 6 -10.960 -17.103 -13.062 47 HE ARG 6 HE ARG 6 -12.196 -18.797 -12.179 48 1HH1 ARG 6 HH11 ARG 6 -12.573 -16.005 -10.118 49 2HH1 ARG 6 HH12 ARG 6 -13.717 -16.777 -9.073 50 1HH2 ARG 6 HH21 ARG 6 -13.705 -19.809 -10.804 51 2HH2 ARG 6 HH22 ARG 6 -14.360 -18.932 -9.462 52 H SER 7 HN SER 7 -9.005 -13.280 -13.951 53 HA SER 7 HA SER 7 -6.725 -11.977 -13.110 54 1HB SER 7 HB2 SER 7 -7.206 -12.454 -15.470 55 2HB SER 7 HB1 SER 7 -8.499 -11.253 -15.459 56 HG SER 7 HG SER 7 -5.822 -10.909 -15.751 57 H GLU 8 HN GLU 8 -10.033 -10.860 -13.095 58 HA GLU 8 HA GLU 8 -9.861 -8.150 -12.966 59 1HB GLU 8 HB2 GLU 8 -11.867 -8.172 -11.611 60 2HB GLU 8 HB1 GLU 8 -11.954 -9.465 -12.801 61 1HG GLU 8 HG2 GLU 8 -11.169 -11.039 -11.026 62 2HG GLU 8 HG1 GLU 8 -11.335 -9.721 -9.874 63 H ILE 9 HN ILE 9 -8.843 -10.441 -10.557 64 HA ILE 9 HA ILE 9 -7.526 -8.292 -9.093 65 HB ILE 9 HB ILE 9 -9.272 -10.368 -7.751 66 1HG1 ILE 9 HG12 ILE 9 -10.525 -8.479 -8.745 67 2HG1 ILE 9 HG11 ILE 9 -10.609 -8.479 -6.988 68 1HG2 ILE 9 HG21 ILE 9 -7.679 -8.166 -6.452 69 2HG2 ILE 9 HG22 ILE 9 -7.158 -9.847 -6.529 70 3HG2 ILE 9 HG23 ILE 9 -8.624 -9.418 -5.653 71 1HD1 ILE 9 HD11 ILE 9 -8.417 -6.887 -8.082 72 2HD1 ILE 9 HD12 ILE 9 -9.591 -6.499 -6.827 73 3HD1 ILE 9 HD13 ILE 9 -10.027 -6.324 -8.526 74 H ALA 10 HN ALA 10 -6.051 -9.646 -10.686 75 HA ALA 10 HA ALA 10 -4.366 -11.265 -9.006 76 1HB ALA 10 HB1 ALA 10 -4.718 -13.326 -9.825 77 2HB ALA 10 HB2 ALA 10 -4.985 -12.736 -11.466 78 3HB ALA 10 HB3 ALA 10 -6.292 -12.680 -10.284 79 H GLY 11 HN GLY 11 -2.317 -10.811 -9.507 80 1HA GLY 11 HA2 GLY 11 -0.989 -10.916 -11.840 81 2HA GLY 11 HA1 GLY 11 -1.762 -9.344 -11.963 82 H LYS 12 HN LYS 12 0.275 -8.321 -12.011 83 HA LYS 12 HA LYS 12 1.610 -8.240 -9.386 84 1HB LYS 12 HB2 LYS 12 2.885 -7.964 -12.111 85 2HB LYS 12 HB1 LYS 12 3.719 -7.751 -10.580 86 1HG LYS 12 HG2 LYS 12 3.264 -10.089 -10.014 87 2HG LYS 12 HG1 LYS 12 2.450 -10.297 -11.567 88 1HD LYS 12 HD2 LYS 12 5.345 -9.533 -11.177 89 2HD LYS 12 HD1 LYS 12 4.754 -11.129 -11.643 90 1HE LYS 12 HE2 LYS 12 3.784 -10.157 -13.681 91 2HE LYS 12 HE1 LYS 12 4.413 -8.577 -13.217 92 1HZ LYS 12 HZ1 LYS 12 6.649 -9.435 -13.375 93 2HZ LYS 12 HZ2 LYS 12 5.835 -9.707 -14.833 94 3HZ LYS 12 HZ3 LYS 12 6.073 -10.982 -13.748 95 H TRP 13 HN TRP 13 1.919 -6.323 -8.487 96 HA TRP 13 HA TRP 13 1.943 -3.901 -10.043 97 1HB TRP 13 HB2 TRP 13 0.219 -2.910 -8.323 98 2HB TRP 13 HB1 TRP 13 -0.327 -3.722 -9.779 99 HD1 TRP 13 HD1 TRP 13 -1.996 -5.666 -9.456 100 HE1 TRP 13 HE1 TRP 13 -3.010 -6.868 -7.417 101 HE3 TRP 13 HE3 TRP 13 0.999 -3.754 -5.828 102 HZ2 TRP 13 HZ2 TRP 13 -2.592 -6.967 -4.624 103 HZ3 TRP 13 HZ3 TRP 13 0.636 -4.431 -3.492 104 HH2 TRP 13 HH2 TRP 13 -1.125 -6.014 -2.907 105 H TYR 14 HN TYR 14 3.330 -2.461 -9.211 106 HA TYR 14 HA TYR 14 4.502 -3.131 -6.609 107 1HB TYR 14 HB2 TYR 14 6.482 -1.821 -7.472 108 2HB TYR 14 HB1 TYR 14 6.108 -3.306 -8.336 109 HD1 TYR 14 HD1 TYR 14 5.900 -3.279 -10.635 110 HD2 TYR 14 HD2 TYR 14 5.539 0.378 -8.493 111 HE1 TYR 14 HE1 TYR 14 5.850 -2.048 -12.762 112 HE2 TYR 14 HE2 TYR 14 5.484 1.619 -10.615 113 HH TYR 14 HH TYR 14 4.759 0.917 -13.147 114 H VAL 15 HN VAL 15 4.631 -1.790 -4.955 115 HA VAL 15 HA VAL 15 3.045 0.563 -4.881 116 HB VAL 15 HB VAL 15 3.354 -0.825 -2.885 117 1HG1 VAL 15 HG11 VAL 15 5.349 -1.209 -1.841 118 2HG1 VAL 15 HG12 VAL 15 6.072 0.286 -2.439 119 3HG1 VAL 15 HG13 VAL 15 5.893 -1.100 -3.512 120 1HG2 VAL 15 HG21 VAL 15 2.655 1.418 -2.494 121 2HG2 VAL 15 HG22 VAL 15 4.302 2.024 -2.676 122 3HG2 VAL 15 HG23 VAL 15 3.872 1.031 -1.282 123 H VAL 16 HN VAL 16 3.544 2.623 -5.076 124 HA VAL 16 HA VAL 16 6.351 3.457 -5.184 125 HB VAL 16 HB VAL 16 5.249 2.988 -7.501 126 1HG1 VAL 16 HG11 VAL 16 3.207 4.356 -6.911 127 2HG1 VAL 16 HG12 VAL 16 3.949 4.698 -8.473 128 3HG1 VAL 16 HG13 VAL 16 4.222 5.784 -7.112 129 1HG2 VAL 16 HG21 VAL 16 7.131 4.968 -6.582 130 2HG2 VAL 16 HG22 VAL 16 6.346 5.466 -8.079 131 3HG2 VAL 16 HG23 VAL 16 7.195 3.922 -7.996 132 H ALA 17 HN ALA 17 2.939 4.428 -5.060 133 HA ALA 17 HA ALA 17 3.692 6.993 -3.849 134 1HB ALA 17 HB1 ALA 17 1.793 6.351 -5.746 135 2HB ALA 17 HB2 ALA 17 1.900 7.865 -4.852 136 3HB ALA 17 HB3 ALA 17 0.848 6.572 -4.273 137 H LEU 18 HN LEU 18 3.147 7.538 -1.768 138 HA LEU 18 HA LEU 18 1.274 5.957 -0.278 139 1HB LEU 18 HB2 LEU 18 3.134 5.617 1.556 140 2HB LEU 18 HB1 LEU 18 2.848 4.438 0.297 141 HG LEU 18 HG LEU 18 5.010 6.538 0.125 142 1HD1 LEU 18 HD11 LEU 18 6.362 4.276 0.560 143 2HD1 LEU 18 HD12 LEU 18 4.919 3.924 1.510 144 3HD1 LEU 18 HD13 LEU 18 5.877 5.362 1.863 145 1HD2 LEU 18 HD21 LEU 18 4.113 4.265 -1.547 146 2HD2 LEU 18 HD22 LEU 18 5.853 4.507 -1.383 147 3HD2 LEU 18 HD23 LEU 18 4.838 5.802 -2.016 148 H ALA 19 HN ALA 19 1.638 6.617 2.232 149 HA ALA 19 HA ALA 19 2.445 9.264 2.775 150 1HB ALA 19 HB1 ALA 19 -0.114 8.986 1.525 151 2HB ALA 19 HB2 ALA 19 0.717 10.455 2.029 152 3HB ALA 19 HB3 ALA 19 -0.320 9.597 3.167 153 H SER 20 HN SER 20 2.857 9.266 4.953 154 HA SER 20 HA SER 20 0.928 8.045 6.721 155 1HB SER 20 HB2 SER 20 2.572 6.464 7.728 156 2HB SER 20 HB1 SER 20 2.091 6.052 6.081 157 HG SER 20 HG SER 20 4.041 6.946 5.352 158 H ASN 21 HN ASN 21 1.018 8.641 8.766 159 HA ASN 21 HA ASN 21 3.320 10.059 9.840 160 1HB ASN 21 HB2 ASN 21 0.551 11.238 9.667 161 2HB ASN 21 HB1 ASN 21 1.739 11.796 10.826 162 1HD2 ASN 21 HD21 ASN 21 3.678 11.093 8.376 163 2HD2 ASN 21 HD22 ASN 21 3.629 12.568 7.487 164 H THR 22 HN THR 22 3.589 9.660 11.968 165 HA THR 22 HA THR 22 1.661 9.050 13.865 166 HB THR 22 HB THR 22 1.145 7.069 12.545 167 HG1 THR 22 HG1 THR 22 1.709 5.457 14.148 168 1HG2 THR 22 HG21 THR 22 3.967 6.929 12.153 169 2HG2 THR 22 HG22 THR 22 2.681 6.012 11.369 170 3HG2 THR 22 HG23 THR 22 3.393 5.426 12.873 171 H GLU 23 HN GLU 23 3.197 6.907 15.196 172 HA GLU 23 HA GLU 23 5.131 8.541 16.481 173 1HB GLU 23 HB2 GLU 23 3.907 6.758 17.657 174 2HB GLU 23 HB1 GLU 23 4.698 5.551 16.654 175 1HG GLU 23 HG2 GLU 23 6.269 7.437 18.371 176 2HG GLU 23 HG1 GLU 23 5.595 5.941 19.012 177 H PHE 24 HN PHE 24 5.211 6.197 13.909 178 HA PHE 24 HA PHE 24 8.082 5.934 13.893 179 1HB PHE 24 HB2 PHE 24 5.972 5.042 11.919 180 2HB PHE 24 HB1 PHE 24 7.684 4.674 11.769 181 HD1 PHE 24 HD1 PHE 24 5.192 4.483 14.567 182 HD2 PHE 24 HD2 PHE 24 8.134 2.495 12.220 183 HE1 PHE 24 HE1 PHE 24 4.872 2.446 15.900 184 HE2 PHE 24 HE2 PHE 24 7.817 0.452 13.551 185 HZ PHE 24 HZ PHE 24 6.183 0.425 15.393 186 H PHE 25 HN PHE 25 6.417 8.566 13.268 187 HA PHE 25 HA PHE 25 6.704 9.444 10.724 188 1HB PHE 25 HB2 PHE 25 5.739 10.806 12.506 189 2HB PHE 25 HB1 PHE 25 7.330 11.019 13.227 190 HD1 PHE 25 HD1 PHE 25 7.794 13.276 13.071 191 HD2 PHE 25 HD2 PHE 25 6.268 11.232 9.664 192 HE1 PHE 25 HE1 PHE 25 8.140 15.296 11.709 193 HE2 PHE 25 HE2 PHE 25 6.613 13.248 8.296 194 HZ PHE 25 HZ PHE 25 7.550 15.284 9.319 195 H LEU 26 HN LEU 26 9.296 9.303 13.138 196 HA LEU 26 HA LEU 26 11.248 10.516 11.454 197 1HB LEU 26 HB2 LEU 26 11.521 8.842 13.945 198 2HB LEU 26 HB1 LEU 26 12.872 9.613 13.138 199 HG LEU 26 HG LEU 26 12.190 10.942 15.035 200 1HD1 LEU 26 HD11 LEU 26 11.263 12.315 12.522 201 2HD1 LEU 26 HD12 LEU 26 12.956 12.058 12.942 202 3HD1 LEU 26 HD13 LEU 26 11.936 13.063 13.971 203 1HD2 LEU 26 HD21 LEU 26 9.797 10.092 14.965 204 2HD2 LEU 26 HD22 LEU 26 9.504 11.335 13.748 205 3HD2 LEU 26 HD23 LEU 26 10.023 11.792 15.371 206 H ARG 27 HN ARG 27 10.594 7.145 12.372 207 HA ARG 27 HA ARG 27 12.681 6.048 10.811 208 1HB ARG 27 HB2 ARG 27 10.173 4.838 11.967 209 2HB ARG 27 HB1 ARG 27 11.378 3.896 11.097 210 1HG ARG 27 HG2 ARG 27 13.066 4.482 12.723 211 2HG ARG 27 HG1 ARG 27 11.922 5.526 13.568 212 1HD ARG 27 HD2 ARG 27 11.539 2.563 13.180 213 2HD ARG 27 HD1 ARG 27 12.264 3.284 14.617 214 HE ARG 27 HE ARG 27 9.767 4.482 14.135 215 1HH1 ARG 27 HH11 ARG 27 11.131 1.440 15.161 216 2HH1 ARG 27 HH12 ARG 27 9.767 1.014 16.138 217 1HH2 ARG 27 HH21 ARG 27 7.975 3.929 15.426 218 2HH2 ARG 27 HH22 ARG 27 7.976 2.428 16.290 219 H GLU 28 HN GLU 28 9.289 6.724 10.132 220 HA GLU 28 HA GLU 28 9.066 5.344 7.715 221 1HB GLU 28 HB2 GLU 28 7.704 7.879 8.639 222 2HB GLU 28 HB1 GLU 28 7.243 6.984 7.196 223 1HG GLU 28 HG2 GLU 28 6.695 5.045 8.546 224 2HG GLU 28 HG1 GLU 28 7.208 5.893 10.001 225 H LYS 29 HN LYS 29 10.152 8.666 8.366 226 HA LYS 29 HA LYS 29 10.589 9.278 5.615 227 1HB LYS 29 HB2 LYS 29 11.781 11.272 6.461 228 2HB LYS 29 HB1 LYS 29 10.194 11.072 7.186 229 1HG LYS 29 HG2 LYS 29 11.186 10.209 9.212 230 2HG LYS 29 HG1 LYS 29 12.791 10.282 8.484 231 1HD LYS 29 HD2 LYS 29 12.491 12.183 9.939 232 2HD LYS 29 HD1 LYS 29 12.538 12.736 8.265 233 1HE LYS 29 HE2 LYS 29 9.978 12.222 9.765 234 2HE LYS 29 HE1 LYS 29 10.777 13.792 9.734 235 1HZ LYS 29 HZ1 LYS 29 9.125 12.564 7.760 236 2HZ LYS 29 HZ2 LYS 29 10.607 13.049 7.105 237 3HZ LYS 29 HZ3 LYS 29 9.623 14.175 7.894 238 H ASP 30 HN ASP 30 12.666 8.177 8.262 239 HA ASP 30 HA ASP 30 15.094 8.322 6.806 240 1HB ASP 30 HB2 ASP 30 15.033 8.232 9.264 241 2HB ASP 30 HB1 ASP 30 14.394 6.593 9.190 242 H LYS 31 HN LYS 31 12.972 5.567 7.583 243 HA LYS 31 HA LYS 31 14.449 3.683 6.081 244 1HB LYS 31 HB2 LYS 31 11.571 3.616 7.004 245 2HB LYS 31 HB1 LYS 31 12.438 2.242 6.330 246 1HG LYS 31 HG2 LYS 31 14.026 2.333 8.184 247 2HG LYS 31 HG1 LYS 31 13.155 3.711 8.860 248 1HD LYS 31 HD2 LYS 31 11.148 2.322 9.091 249 2HD LYS 31 HD1 LYS 31 12.028 0.945 8.423 250 1HE LYS 31 HE2 LYS 31 13.598 1.041 10.295 251 2HE LYS 31 HE1 LYS 31 12.724 2.422 10.959 252 1HZ LYS 31 HZ1 LYS 31 11.602 -0.301 10.568 253 2HZ LYS 31 HZ2 LYS 31 10.776 1.023 11.222 254 3HZ LYS 31 HZ3 LYS 31 12.094 0.357 12.047 255 H MET 32 HN MET 32 11.206 3.433 5.088 256 HA MET 32 HA MET 32 10.149 3.658 3.095 257 1HB MET 32 HB2 MET 32 10.674 6.063 3.369 258 2HB MET 32 HB1 MET 32 12.199 5.809 2.532 259 1HG MET 32 HG2 MET 32 10.532 6.761 1.051 260 2HG MET 32 HG1 MET 32 11.004 5.147 0.522 261 1HE MET 32 HE1 MET 32 7.716 5.654 3.397 262 2HE MET 32 HE2 MET 32 7.323 6.875 2.188 263 3HE MET 32 HE3 MET 32 8.901 6.890 2.974 264 H LYS 33 HN LYS 33 10.237 2.703 1.095 265 HA LYS 33 HA LYS 33 12.653 2.244 -0.339 266 1HB LYS 33 HB2 LYS 33 12.872 -0.142 -0.041 267 2HB LYS 33 HB1 LYS 33 12.955 0.637 1.532 268 1HG LYS 33 HG2 LYS 33 10.504 -0.695 0.400 269 2HG LYS 33 HG1 LYS 33 11.629 -1.438 1.538 270 1HD LYS 33 HD2 LYS 33 11.133 0.401 3.137 271 2HD LYS 33 HD1 LYS 33 9.913 0.998 2.011 272 1HE LYS 33 HE2 LYS 33 8.903 -0.365 3.763 273 2HE LYS 33 HE1 LYS 33 8.706 -1.109 2.177 274 1HZ LYS 33 HZ1 LYS 33 9.556 -2.447 4.284 275 2HZ LYS 33 HZ2 LYS 33 11.051 -1.897 3.717 276 3HZ LYS 33 HZ3 LYS 33 10.055 -2.823 2.711 277 H MET 34 HN MET 34 12.289 1.004 -2.337 278 HA MET 34 HA MET 34 9.620 1.467 -3.354 279 1HB MET 34 HB2 MET 34 11.619 1.872 -4.743 280 2HB MET 34 HB1 MET 34 12.033 0.168 -4.642 281 1HG MET 34 HG2 MET 34 10.003 -0.409 -5.853 282 2HG MET 34 HG1 MET 34 9.559 1.296 -5.932 283 1HE MET 34 HE1 MET 34 9.193 0.099 -8.173 284 2HE MET 34 HE2 MET 34 10.465 -0.414 -9.280 285 3HE MET 34 HE3 MET 34 9.932 1.266 -9.270 286 H ALA 35 HN ALA 35 8.372 -0.378 -4.504 287 HA ALA 35 HA ALA 35 9.136 -3.025 -3.669 288 1HB ALA 35 HB1 ALA 35 7.652 -1.507 -1.843 289 2HB ALA 35 HB2 ALA 35 8.091 -3.210 -1.752 290 3HB ALA 35 HB3 ALA 35 6.563 -2.737 -2.487 291 H MET 36 HN MET 36 8.224 -4.628 -4.736 292 HA MET 36 HA MET 36 6.067 -4.013 -6.638 293 1HB MET 36 HB2 MET 36 8.186 -6.151 -6.899 294 2HB MET 36 HB1 MET 36 7.003 -5.687 -8.116 295 1HG MET 36 HG2 MET 36 8.053 -3.518 -8.353 296 2HG MET 36 HG1 MET 36 9.203 -3.917 -7.079 297 1HE MET 36 HE1 MET 36 8.538 -6.838 -10.147 298 2HE MET 36 HE2 MET 36 8.786 -5.490 -11.257 299 3HE MET 36 HE3 MET 36 7.538 -5.391 -10.015 300 H ALA 37 HN ALA 37 4.252 -5.393 -6.631 301 HA ALA 37 HA ALA 37 4.421 -7.744 -4.872 302 1HB ALA 37 HB1 ALA 37 1.907 -6.348 -4.539 303 2HB ALA 37 HB2 ALA 37 3.293 -5.373 -4.051 304 3HB ALA 37 HB3 ALA 37 3.030 -6.962 -3.330 305 H ARG 38 HN ARG 38 2.892 -9.356 -5.157 306 HA ARG 38 HA ARG 38 1.298 -9.198 -7.632 307 1HB ARG 38 HB2 ARG 38 3.177 -10.744 -7.911 308 2HB ARG 38 HB1 ARG 38 2.705 -11.605 -6.453 309 1HG ARG 38 HG2 ARG 38 0.566 -12.201 -7.558 310 2HG ARG 38 HG1 ARG 38 1.167 -11.443 -9.032 311 1HD ARG 38 HD2 ARG 38 2.420 -13.775 -7.594 312 2HD ARG 38 HD1 ARG 38 1.502 -13.850 -9.098 313 HE ARG 38 HE ARG 38 3.620 -12.049 -9.430 314 1HH1 ARG 38 HH11 ARG 38 3.078 -15.469 -8.999 315 2HH1 ARG 38 HH12 ARG 38 4.511 -15.929 -9.855 316 1HH2 ARG 38 HH21 ARG 38 5.501 -12.650 -10.555 317 2HH2 ARG 38 HH22 ARG 38 5.888 -14.329 -10.739 318 H ILE 39 HN ILE 39 -0.843 -9.502 -7.368 319 HA ILE 39 HA ILE 39 -1.813 -10.221 -4.717 320 HB ILE 39 HB ILE 39 -2.703 -8.220 -5.963 321 1HG1 ILE 39 HG12 ILE 39 -4.778 -10.290 -5.224 322 2HG1 ILE 39 HG11 ILE 39 -3.868 -9.340 -4.054 323 1HG2 ILE 39 HG21 ILE 39 -4.187 -8.439 -7.762 324 2HG2 ILE 39 HG22 ILE 39 -4.332 -10.181 -7.534 325 3HG2 ILE 39 HG23 ILE 39 -2.832 -9.497 -8.158 326 1HD1 ILE 39 HD11 ILE 39 -5.053 -7.457 -4.458 327 2HD1 ILE 39 HD12 ILE 39 -6.281 -8.646 -4.889 328 3HD1 ILE 39 HD13 ILE 39 -5.334 -7.858 -6.151 329 H SER 40 HN SER 40 -2.885 -12.025 -4.201 330 HA SER 40 HA SER 40 -4.096 -13.745 -6.161 331 1HB SER 40 HB2 SER 40 -1.735 -14.416 -6.379 332 2HB SER 40 HB1 SER 40 -1.665 -14.737 -4.647 333 HG SER 40 HG SER 40 -2.793 -16.528 -4.915 334 H PHE 41 HN PHE 41 -5.588 -15.131 -5.257 335 HA PHE 41 HA PHE 41 -6.298 -14.594 -2.509 336 1HB PHE 41 HB2 PHE 41 -7.628 -16.269 -4.644 337 2HB PHE 41 HB1 PHE 41 -8.283 -16.033 -3.029 338 HD1 PHE 41 HD1 PHE 41 -10.104 -14.662 -3.079 339 HD2 PHE 41 HD2 PHE 41 -6.781 -13.721 -5.568 340 HE1 PHE 41 HE1 PHE 41 -11.246 -12.617 -3.831 341 HE2 PHE 41 HE2 PHE 41 -7.916 -11.679 -6.316 342 HZ PHE 41 HZ PHE 41 -10.150 -11.122 -5.452 343 H LEU 42 HN LEU 42 -6.071 -15.886 -0.782 344 HA LEU 42 HA LEU 42 -4.913 -18.559 -1.211 345 1HB LEU 42 HB2 LEU 42 -3.478 -16.903 -0.012 346 2HB LEU 42 HB1 LEU 42 -4.686 -16.815 1.247 347 HG LEU 42 HG LEU 42 -3.181 -19.325 0.518 348 1HD1 LEU 42 HD11 LEU 42 -1.661 -18.892 2.182 349 2HD1 LEU 42 HD12 LEU 42 -2.748 -17.799 3.039 350 3HD1 LEU 42 HD13 LEU 42 -1.946 -17.264 1.563 351 1HD2 LEU 42 HD21 LEU 42 -5.384 -18.703 2.368 352 2HD2 LEU 42 HD22 LEU 42 -4.063 -19.648 3.056 353 3HD2 LEU 42 HD23 LEU 42 -4.919 -20.234 1.630 354 H GLY 43 HN GLY 43 -5.932 -20.303 -0.408 355 1HA GLY 43 HA2 GLY 43 -8.632 -20.310 0.126 356 2HA GLY 43 HA1 GLY 43 -7.540 -21.600 0.589 357 H GLU 44 HN GLU 44 -9.017 -21.919 2.347 358 HA GLU 44 HA GLU 44 -9.544 -21.850 4.552 359 1HB GLU 44 HB2 GLU 44 -7.238 -19.904 4.723 360 2HB GLU 44 HB1 GLU 44 -8.042 -20.647 6.098 361 1HG GLU 44 HG2 GLU 44 -7.325 -22.850 5.328 362 2HG GLU 44 HG1 GLU 44 -6.518 -22.102 3.949 363 H ASP 45 HN ASP 45 -8.451 -18.513 4.063 364 HA ASP 45 HA ASP 45 -10.786 -17.206 3.582 365 1HB ASP 45 HB2 ASP 45 -11.533 -16.416 5.824 366 2HB ASP 45 HB1 ASP 45 -11.776 -18.143 5.604 367 H GLU 46 HN GLU 46 -8.171 -16.816 2.938 368 HA GLU 46 HA GLU 46 -7.758 -14.118 3.894 369 1HB GLU 46 HB2 GLU 46 -5.772 -16.312 4.482 370 2HB GLU 46 HB1 GLU 46 -5.353 -14.607 4.513 371 1HG GLU 46 HG2 GLU 46 -6.975 -14.228 6.286 372 2HG GLU 46 HG1 GLU 46 -7.426 -15.932 6.242 373 H LEU 47 HN LEU 47 -6.763 -12.872 2.452 374 HA LEU 47 HA LEU 47 -5.726 -14.164 0.022 375 1HB LEU 47 HB2 LEU 47 -6.623 -11.295 0.334 376 2HB LEU 47 HB1 LEU 47 -6.283 -12.146 -1.162 377 HG LEU 47 HG LEU 47 -8.623 -12.571 0.690 378 1HD1 LEU 47 HD11 LEU 47 -8.717 -11.976 -2.240 379 2HD1 LEU 47 HD12 LEU 47 -8.554 -10.684 -1.053 380 3HD1 LEU 47 HD13 LEU 47 -9.962 -11.744 -1.013 381 1HD2 LEU 47 HD21 LEU 47 -8.077 -14.127 -1.822 382 2HD2 LEU 47 HD22 LEU 47 -9.319 -14.416 -0.604 383 3HD2 LEU 47 HD23 LEU 47 -7.624 -14.711 -0.221 384 H LYS 48 HN LYS 48 -3.704 -13.247 -0.880 385 HA LYS 48 HA LYS 48 -2.249 -11.548 0.991 386 1HB LYS 48 HB2 LYS 48 -0.399 -13.050 1.250 387 2HB LYS 48 HB1 LYS 48 -1.874 -13.889 1.696 388 1HG LYS 48 HG2 LYS 48 -0.749 -15.482 0.486 389 2HG LYS 48 HG1 LYS 48 -1.818 -14.783 -0.730 390 1HD LYS 48 HD2 LYS 48 -0.009 -13.428 -1.594 391 2HD LYS 48 HD1 LYS 48 1.058 -13.973 -0.301 392 1HE LYS 48 HE2 LYS 48 1.523 -15.141 -2.391 393 2HE LYS 48 HE1 LYS 48 0.936 -16.252 -1.155 394 1HZ LYS 48 HZ1 LYS 48 -0.637 -16.880 -2.557 395 2HZ LYS 48 HZ2 LYS 48 -0.124 -15.755 -3.710 396 3HZ LYS 48 HZ3 LYS 48 -1.281 -15.316 -2.557 397 H VAL 49 HN VAL 49 -0.407 -10.547 0.226 398 HA VAL 49 HA VAL 49 0.082 -10.708 -2.669 399 HB VAL 49 HB VAL 49 -1.288 -8.720 -2.251 400 1HG1 VAL 49 HG11 VAL 49 0.158 -8.549 0.128 401 2HG1 VAL 49 HG12 VAL 49 -1.052 -7.414 -0.466 402 3HG1 VAL 49 HG13 VAL 49 0.656 -7.144 -0.812 403 1HG2 VAL 49 HG21 VAL 49 0.807 -7.052 -2.826 404 2HG2 VAL 49 HG22 VAL 49 -0.065 -8.046 -3.993 405 3HG2 VAL 49 HG23 VAL 49 1.439 -8.633 -3.288 406 H SER 50 HN SER 50 2.154 -11.235 -2.996 407 HA SER 50 HA SER 50 4.082 -10.776 -0.849 408 1HB SER 50 HB2 SER 50 4.379 -12.262 -3.471 409 2HB SER 50 HB1 SER 50 5.579 -12.209 -2.183 410 HG SER 50 HG SER 50 2.932 -13.158 -1.817 411 H TYR 51 HN TYR 51 5.087 -8.832 -0.832 412 HA TYR 51 HA TYR 51 5.776 -7.697 -3.443 413 1HB TYR 51 HB2 TYR 51 6.053 -5.523 -1.961 414 2HB TYR 51 HB1 TYR 51 4.511 -5.994 -2.634 415 HD1 TYR 51 HD1 TYR 51 2.874 -5.303 -1.191 416 HD2 TYR 51 HD2 TYR 51 6.337 -7.179 0.413 417 HE1 TYR 51 HE1 TYR 51 1.879 -5.206 1.052 418 HE2 TYR 51 HE2 TYR 51 5.348 -7.093 2.660 419 HH TYR 51 HH TYR 51 3.563 -5.559 3.821 420 H ALA 52 HN ALA 52 7.788 -7.245 -3.976 421 HA ALA 52 HA ALA 52 9.903 -7.885 -2.042 422 1HB ALA 52 HB1 ALA 52 9.898 -7.753 -5.056 423 2HB ALA 52 HB2 ALA 52 10.087 -9.181 -4.038 424 3HB ALA 52 HB3 ALA 52 11.359 -7.962 -4.097 425 H VAL 53 HN VAL 53 10.609 -6.134 -0.981 426 HA VAL 53 HA VAL 53 10.521 -3.527 -2.245 427 HB VAL 53 HB VAL 53 11.089 -2.613 -0.076 428 1HG1 VAL 53 HG11 VAL 53 8.853 -4.484 -0.432 429 2HG1 VAL 53 HG12 VAL 53 8.853 -2.785 0.040 430 3HG1 VAL 53 HG13 VAL 53 9.199 -4.033 1.238 431 1HG2 VAL 53 HG21 VAL 53 12.451 -3.813 1.223 432 2HG2 VAL 53 HG22 VAL 53 12.015 -5.323 0.427 433 3HG2 VAL 53 HG23 VAL 53 11.010 -4.693 1.732 434 HA PRO 54 HA PRO 54 14.957 -3.940 -2.989 435 1HB PRO 54 HB2 PRO 54 14.878 -2.461 -5.317 436 2HB PRO 54 HB1 PRO 54 14.602 -4.200 -5.223 437 1HG PRO 54 HG2 PRO 54 12.718 -2.168 -5.913 438 2HG PRO 54 HG1 PRO 54 12.428 -3.907 -5.756 439 1HD PRO 54 HD2 PRO 54 11.926 -1.721 -3.815 440 2HD PRO 54 HD1 PRO 54 11.095 -3.281 -4.001 441 H LYS 55 HN LYS 55 16.610 -2.624 -2.504 442 HA LYS 55 HA LYS 55 16.736 0.158 -2.835 443 1HB LYS 55 HB2 LYS 55 15.796 -0.799 -0.159 444 2HB LYS 55 HB1 LYS 55 16.893 0.570 -0.233 445 1HG LYS 55 HG2 LYS 55 14.145 0.370 -1.430 446 2HG LYS 55 HG1 LYS 55 14.678 1.409 -0.114 447 1HD LYS 55 HD2 LYS 55 16.221 2.538 -1.704 448 2HD LYS 55 HD1 LYS 55 15.522 1.572 -3.004 449 1HE LYS 55 HE2 LYS 55 13.312 2.527 -2.484 450 2HE LYS 55 HE1 LYS 55 14.059 3.537 -1.249 451 1HZ LYS 55 HZ1 LYS 55 15.021 3.625 -4.032 452 2HZ LYS 55 HZ2 LYS 55 15.139 4.805 -2.825 453 3HZ LYS 55 HZ3 LYS 55 13.655 4.510 -3.576 454 HA PRO 56 HA PRO 56 20.608 -2.594 -2.455 455 1HB PRO 56 HB2 PRO 56 21.230 -0.232 -4.198 456 2HB PRO 56 HB1 PRO 56 21.828 -1.892 -4.308 457 1HG PRO 56 HG2 PRO 56 19.840 -1.016 -5.879 458 2HG PRO 56 HG1 PRO 56 19.880 -2.676 -5.263 459 1HD PRO 56 HD2 PRO 56 18.088 -0.458 -4.540 460 2HD PRO 56 HD1 PRO 56 17.878 -2.202 -4.297 461 H ASN 57 HN ASN 57 22.369 -2.229 -1.199 462 HA ASN 57 HA ASN 57 23.819 -1.233 0.243 463 1HB ASN 57 HB2 ASN 57 24.007 0.558 -1.474 464 2HB ASN 57 HB1 ASN 57 22.658 1.392 -0.718 465 1HD2 ASN 57 HD21 ASN 57 24.612 -0.143 1.586 466 2HD2 ASN 57 HD22 ASN 57 25.536 1.230 2.061 467 H GLY 58 HN GLY 58 23.443 -1.494 2.325 468 1HA GLY 58 HA2 GLY 58 22.566 -1.252 4.426 469 2HA GLY 58 HA1 GLY 58 21.852 0.251 3.871 470 H CYS 59 HN CYS 59 19.918 -0.238 2.251 471 HA CYS 59 HA CYS 59 18.019 -1.701 3.839 472 1HB CYS 59 HB2 CYS 59 17.738 -0.095 1.301 473 2HB CYS 59 HB1 CYS 59 16.383 -0.856 2.126 474 H ARG 60 HN ARG 60 19.397 -2.058 0.577 475 HA ARG 60 HA ARG 60 19.441 -3.817 -0.871 476 1HB ARG 60 HB2 ARG 60 19.012 -5.294 1.725 477 2HB ARG 60 HB1 ARG 60 19.248 -6.124 0.197 478 1HG ARG 60 HG2 ARG 60 21.307 -5.991 1.488 479 2HG ARG 60 HG1 ARG 60 21.440 -5.130 -0.044 480 1HD ARG 60 HD2 ARG 60 21.135 -3.013 1.068 481 2HD ARG 60 HD1 ARG 60 20.834 -3.824 2.605 482 HE ARG 60 HE ARG 60 23.358 -3.189 1.491 483 1HH1 ARG 60 HH11 ARG 60 21.713 -5.636 3.358 484 2HH1 ARG 60 HH12 ARG 60 23.162 -6.215 4.108 485 1HH2 ARG 60 HH21 ARG 60 25.263 -3.945 2.480 486 2HH2 ARG 60 HH22 ARG 60 25.177 -5.254 3.612 487 H LYS 61 HN LYS 61 17.934 -6.241 -0.871 488 HA LYS 61 HA LYS 61 15.261 -5.169 -1.437 489 1HB LYS 61 HB2 LYS 61 16.520 -7.703 -2.485 490 2HB LYS 61 HB1 LYS 61 15.009 -6.984 -3.022 491 1HG LYS 61 HG2 LYS 61 16.281 -5.016 -3.815 492 2HG LYS 61 HG1 LYS 61 17.772 -5.843 -3.371 493 1HD LYS 61 HD2 LYS 61 15.744 -6.872 -5.354 494 2HD LYS 61 HD1 LYS 61 17.234 -6.031 -5.778 495 1HE LYS 61 HE2 LYS 61 17.691 -8.333 -6.023 496 2HE LYS 61 HE1 LYS 61 18.467 -7.841 -4.519 497 1HZ LYS 61 HZ1 LYS 61 15.793 -8.749 -4.093 498 2HZ LYS 61 HZ2 LYS 61 17.233 -9.268 -3.372 499 3HZ LYS 61 HZ3 LYS 61 16.739 -9.933 -4.846 500 H TRP 62 HN TRP 62 13.387 -6.292 -0.701 501 HA TRP 62 HA TRP 62 13.774 -8.699 0.874 502 1HB TRP 62 HB2 TRP 62 14.242 -6.953 2.521 503 2HB TRP 62 HB1 TRP 62 12.692 -6.195 2.175 504 HD1 TRP 62 HD1 TRP 62 13.416 -9.945 2.861 505 HE1 TRP 62 HE1 TRP 62 11.952 -10.687 4.843 506 HE3 TRP 62 HE3 TRP 62 11.268 -5.449 4.016 507 HZ2 TRP 62 HZ2 TRP 62 10.130 -9.524 6.656 508 HZ3 TRP 62 HZ3 TRP 62 9.674 -5.352 5.888 509 HH2 TRP 62 HH2 TRP 62 9.117 -7.348 7.179 510 H GLU 63 HN GLU 63 12.104 -10.032 0.754 511 HA GLU 63 HA GLU 63 9.597 -9.016 -0.397 512 1HB GLU 63 HB2 GLU 63 10.729 -10.739 -1.727 513 2HB GLU 63 HB1 GLU 63 10.710 -11.829 -0.347 514 1HG GLU 63 HG2 GLU 63 8.280 -11.880 -0.401 515 2HG GLU 63 HG1 GLU 63 8.279 -10.752 -1.757 516 H THR 64 HN THR 64 7.615 -9.490 0.570 517 HA THR 64 HA THR 64 7.559 -11.120 2.971 518 HB THR 64 HB THR 64 6.976 -8.158 3.032 519 HG1 THR 64 HG1 THR 64 8.785 -9.758 4.514 520 1HG2 THR 64 HG21 THR 64 5.288 -9.439 4.324 521 2HG2 THR 64 HG22 THR 64 6.291 -8.369 5.305 522 3HG2 THR 64 HG23 THR 64 6.603 -10.104 5.291 523 H THR 65 HN THR 65 5.651 -12.091 3.272 524 HA THR 65 HA THR 65 3.526 -11.517 1.362 525 HB THR 65 HB THR 65 3.923 -13.802 3.304 526 HG1 THR 65 HG1 THR 65 4.911 -14.735 1.719 527 1HG2 THR 65 HG21 THR 65 2.193 -14.876 1.693 528 2HG2 THR 65 HG22 THR 65 1.690 -13.206 1.429 529 3HG2 THR 65 HG23 THR 65 1.651 -13.894 3.053 530 H PHE 66 HN PHE 66 1.859 -10.294 1.890 531 HA PHE 66 HA PHE 66 1.133 -10.000 4.734 532 1HB PHE 66 HB2 PHE 66 1.946 -7.992 3.240 533 2HB PHE 66 HB1 PHE 66 0.311 -8.054 2.599 534 HD1 PHE 66 HD1 PHE 66 1.319 -8.695 6.108 535 HD2 PHE 66 HD2 PHE 66 -0.521 -6.008 3.366 536 HE1 PHE 66 HE1 PHE 66 0.557 -7.305 7.987 537 HE2 PHE 66 HE2 PHE 66 -1.287 -4.615 5.242 538 HZ PHE 66 HZ PHE 66 -0.749 -5.262 7.556 539 H LYS 67 HN LYS 67 -0.941 -10.601 5.329 540 HA LYS 67 HA LYS 67 -2.930 -10.927 3.220 541 1HB LYS 67 HB2 LYS 67 -3.415 -13.230 3.807 542 2HB LYS 67 HB1 LYS 67 -1.734 -13.061 3.329 543 1HG LYS 67 HG2 LYS 67 -1.086 -13.030 5.705 544 2HG LYS 67 HG1 LYS 67 -2.776 -13.300 6.141 545 1HD LYS 67 HD2 LYS 67 -2.760 -15.408 4.896 546 2HD LYS 67 HD1 LYS 67 -1.073 -15.137 4.456 547 1HE LYS 67 HE2 LYS 67 -0.484 -15.149 6.855 548 2HE LYS 67 HE1 LYS 67 -2.165 -15.512 7.241 549 1HZ LYS 67 HZ1 LYS 67 -1.755 -17.480 5.602 550 2HZ LYS 67 HZ2 LYS 67 -1.260 -17.593 7.215 551 3HZ LYS 67 HZ3 LYS 67 -0.131 -17.229 6.010 552 H LYS 68 HN LYS 68 -5.047 -10.939 3.849 553 HA LYS 68 HA LYS 68 -5.858 -10.993 6.606 554 1HB LYS 68 HB2 LYS 68 -6.323 -8.417 5.100 555 2HB LYS 68 HB1 LYS 68 -6.668 -8.751 6.786 556 1HG LYS 68 HG2 LYS 68 -4.265 -8.892 7.242 557 2HG LYS 68 HG1 LYS 68 -3.939 -8.506 5.548 558 1HD LYS 68 HD2 LYS 68 -5.391 -6.426 5.957 559 2HD LYS 68 HD1 LYS 68 -5.163 -6.772 7.670 560 1HE LYS 68 HE2 LYS 68 -2.770 -6.610 7.429 561 2HE LYS 68 HE1 LYS 68 -2.933 -6.407 5.685 562 1HZ LYS 68 HZ1 LYS 68 -4.220 -4.353 6.167 563 2HZ LYS 68 HZ2 LYS 68 -2.598 -4.275 6.637 564 3HZ LYS 68 HZ3 LYS 68 -3.803 -4.517 7.796 565 H THR 69 HN THR 69 -8.284 -9.318 5.869 566 HA THR 69 HA THR 69 -9.641 -11.370 4.254 567 HB THR 69 HB THR 69 -10.514 -11.034 6.547 568 HG1 THR 69 HG1 THR 69 -12.599 -11.044 5.916 569 1HG2 THR 69 HG21 THR 69 -10.813 -9.042 7.439 570 2HG2 THR 69 HG22 THR 69 -11.977 -8.636 6.178 571 3HG2 THR 69 HG23 THR 69 -10.264 -8.284 5.943 572 H SER 70 HN SER 70 -11.291 -10.637 2.709 573 HA SER 70 HA SER 70 -10.916 -7.872 1.810 574 1HB SER 70 HB2 SER 70 -10.785 -10.305 0.041 575 2HB SER 70 HB1 SER 70 -10.815 -8.641 -0.541 576 HG SER 70 HG SER 70 -8.801 -10.013 0.865 577 H ASP 71 HN ASP 71 -12.680 -6.834 1.081 578 HA ASP 71 HA ASP 71 -15.235 -8.266 1.210 579 1HB ASP 71 HB2 ASP 71 -15.002 -6.244 2.587 580 2HB ASP 71 HB1 ASP 71 -14.648 -5.295 1.148 581 H ASP 72 HN ASP 72 -16.836 -8.026 -0.433 582 HA ASP 72 HA ASP 72 -15.831 -8.188 -3.076 583 1HB ASP 72 HB2 ASP 72 -18.684 -7.871 -2.126 584 2HB ASP 72 HB1 ASP 72 -18.193 -8.379 -3.737 585 H GLY 73 HN GLY 73 -17.708 -6.843 -4.653 586 1HA GLY 73 HA2 GLY 73 -18.125 -4.813 -5.658 587 2HA GLY 73 HA1 GLY 73 -17.918 -4.070 -4.077 588 H GLU 74 HN GLU 74 -15.518 -4.156 -3.350 589 HA GLU 74 HA GLU 74 -13.715 -3.531 -5.576 590 1HB GLU 74 HB2 GLU 74 -13.978 -1.909 -3.029 591 2HB GLU 74 HB1 GLU 74 -12.826 -1.614 -4.324 592 1HG GLU 74 HG2 GLU 74 -14.542 -0.039 -4.611 593 2HG GLU 74 HG1 GLU 74 -14.804 -1.267 -5.847 594 H VAL 75 HN VAL 75 -11.805 -2.763 -3.103 595 HA VAL 75 HA VAL 75 -11.482 -5.510 -2.128 596 HB VAL 75 HB VAL 75 -9.306 -3.922 -3.477 597 1HG1 VAL 75 HG11 VAL 75 -8.481 -4.928 -1.366 598 2HG1 VAL 75 HG12 VAL 75 -7.736 -5.632 -2.799 599 3HG1 VAL 75 HG13 VAL 75 -9.008 -6.507 -1.946 600 1HG2 VAL 75 HG21 VAL 75 -9.232 -6.445 -4.474 601 2HG2 VAL 75 HG22 VAL 75 -10.107 -5.103 -5.208 602 3HG2 VAL 75 HG23 VAL 75 -10.956 -6.248 -4.167 603 H TYR 76 HN TYR 76 -12.020 -5.045 -0.060 604 HA TYR 76 HA TYR 76 -10.466 -2.965 1.323 605 1HB TYR 76 HB2 TYR 76 -13.106 -4.268 1.956 606 2HB TYR 76 HB1 TYR 76 -12.203 -3.362 3.165 607 HD1 TYR 76 HD1 TYR 76 -12.736 -2.632 -0.466 608 HD2 TYR 76 HD2 TYR 76 -13.426 -1.449 3.563 609 HE1 TYR 76 HE1 TYR 76 -13.760 -0.541 -1.260 610 HE2 TYR 76 HE2 TYR 76 -14.453 0.641 2.780 611 HH TYR 76 HH TYR 76 -14.139 2.075 0.412 612 H TYR 77 HN TYR 77 -9.005 -3.507 2.804 613 HA TYR 77 HA TYR 77 -8.733 -6.351 3.473 614 1HB TYR 77 HB2 TYR 77 -6.884 -4.438 2.586 615 2HB TYR 77 HB1 TYR 77 -6.479 -4.744 4.270 616 HD1 TYR 77 HD1 TYR 77 -7.765 -7.039 1.619 617 HD2 TYR 77 HD2 TYR 77 -4.568 -6.066 4.259 618 HE1 TYR 77 HE1 TYR 77 -6.577 -9.080 0.929 619 HE2 TYR 77 HE2 TYR 77 -3.382 -8.109 3.579 620 HH TYR 77 HH TYR 77 -3.924 -9.744 0.930 621 H SER 78 HN SER 78 -8.535 -7.057 5.567 622 HA SER 78 HA SER 78 -8.351 -5.227 7.775 623 1HB SER 78 HB2 SER 78 -10.972 -6.671 7.313 624 2HB SER 78 HB1 SER 78 -10.553 -5.762 8.764 625 HG SER 78 HG SER 78 -11.787 -4.738 6.859 626 H GLU 79 HN GLU 79 -7.659 -6.241 9.643 627 HA GLU 79 HA GLU 79 -8.029 -9.053 10.054 628 1HB GLU 79 HB2 GLU 79 -5.774 -8.252 8.547 629 2HB GLU 79 HB1 GLU 79 -5.186 -8.770 10.121 630 1HG GLU 79 HG2 GLU 79 -6.941 -10.379 8.287 631 2HG GLU 79 HG1 GLU 79 -5.206 -10.596 8.505 632 H GLU 80 HN GLU 80 -8.182 -9.411 12.125 633 HA GLU 80 HA GLU 80 -8.085 -9.226 14.379 634 1HB GLU 80 HB2 GLU 80 -5.387 -7.998 13.779 635 2HB GLU 80 HB1 GLU 80 -5.937 -8.460 15.381 636 1HG GLU 80 HG2 GLU 80 -6.096 -10.793 14.646 637 2HG GLU 80 HG1 GLU 80 -5.522 -10.319 13.046 638 H ALA 81 HN ALA 81 -6.405 -6.320 13.320 639 HA ALA 81 HA ALA 81 -8.292 -4.390 13.495 640 1HB ALA 81 HB1 ALA 81 -7.622 -5.378 16.163 641 2HB ALA 81 HB2 ALA 81 -8.946 -4.333 15.648 642 3HB ALA 81 HB3 ALA 81 -7.359 -3.643 15.992 643 H LYS 82 HN LYS 82 -5.273 -4.746 15.326 644 HA LYS 82 HA LYS 82 -3.946 -2.482 14.812 645 1HB LYS 82 HB2 LYS 82 -1.847 -3.755 14.905 646 2HB LYS 82 HB1 LYS 82 -2.992 -4.304 16.120 647 1HG LYS 82 HG2 LYS 82 -3.573 -6.218 14.742 648 2HG LYS 82 HG1 LYS 82 -2.468 -5.659 13.486 649 1HD LYS 82 HD2 LYS 82 -0.578 -5.940 14.971 650 2HD LYS 82 HD1 LYS 82 -1.652 -6.373 16.302 651 1HE LYS 82 HE2 LYS 82 -0.629 -8.359 15.331 652 2HE LYS 82 HE1 LYS 82 -2.373 -8.361 15.075 653 1HZ LYS 82 HZ1 LYS 82 -1.708 -8.883 12.993 654 2HZ LYS 82 HZ2 LYS 82 -0.210 -8.112 13.136 655 3HZ LYS 82 HZ3 LYS 82 -1.603 -7.203 12.837 656 H LYS 83 HN LYS 83 -4.526 -5.078 12.471 657 HA LYS 83 HA LYS 83 -3.183 -3.392 10.459 658 1HB LYS 83 HB2 LYS 83 -3.456 -6.388 10.618 659 2HB LYS 83 HB1 LYS 83 -2.976 -5.559 9.145 660 1HG LYS 83 HG2 LYS 83 -1.037 -4.626 10.280 661 2HG LYS 83 HG1 LYS 83 -1.523 -5.417 11.778 662 1HD LYS 83 HD2 LYS 83 -1.185 -7.586 10.815 663 2HD LYS 83 HD1 LYS 83 -0.917 -6.887 9.218 664 1HE LYS 83 HE2 LYS 83 1.192 -7.539 10.267 665 2HE LYS 83 HE1 LYS 83 1.109 -5.796 10.018 666 1HZ LYS 83 HZ1 LYS 83 1.606 -5.590 12.155 667 2HZ LYS 83 HZ2 LYS 83 1.431 -7.248 12.438 668 3HZ LYS 83 HZ3 LYS 83 0.086 -6.229 12.537 669 H LYS 84 HN LYS 84 -4.512 -2.380 9.171 670 HA LYS 84 HA LYS 84 -6.711 -3.751 7.898 671 1HB LYS 84 HB2 LYS 84 -7.201 -1.373 9.702 672 2HB LYS 84 HB1 LYS 84 -8.372 -1.998 8.549 673 1HG LYS 84 HG2 LYS 84 -8.428 -4.122 9.740 674 2HG LYS 84 HG1 LYS 84 -7.231 -3.516 10.886 675 1HD LYS 84 HD2 LYS 84 -9.488 -3.370 11.808 676 2HD LYS 84 HD1 LYS 84 -8.784 -1.766 11.591 677 1HE LYS 84 HE2 LYS 84 -11.113 -1.809 10.869 678 2HE LYS 84 HE1 LYS 84 -10.034 -1.493 9.511 679 1HZ LYS 84 HZ1 LYS 84 -10.813 -4.265 10.055 680 2HZ LYS 84 HZ2 LYS 84 -10.463 -3.514 8.581 681 3HZ LYS 84 HZ3 LYS 84 -11.952 -3.242 9.334 682 H VAL 85 HN VAL 85 -6.705 -3.132 5.840 683 HA VAL 85 HA VAL 85 -6.001 -0.372 5.153 684 HB VAL 85 HB VAL 85 -4.415 -0.994 3.477 685 1HG1 VAL 85 HG11 VAL 85 -3.317 -2.850 5.433 686 2HG1 VAL 85 HG12 VAL 85 -3.940 -1.370 6.155 687 3HG1 VAL 85 HG13 VAL 85 -2.717 -1.288 4.889 688 1HG2 VAL 85 HG21 VAL 85 -3.891 -3.176 2.778 689 2HG2 VAL 85 HG22 VAL 85 -5.648 -3.135 2.857 690 3HG2 VAL 85 HG23 VAL 85 -4.728 -3.907 4.145 691 H GLU 86 HN GLU 86 -7.104 0.416 3.339 692 HA GLU 86 HA GLU 86 -9.029 -1.478 2.158 693 1HB GLU 86 HB2 GLU 86 -9.223 1.517 2.496 694 2HB GLU 86 HB1 GLU 86 -10.394 0.545 1.616 695 1HG GLU 86 HG2 GLU 86 -10.794 -0.742 3.710 696 2HG GLU 86 HG1 GLU 86 -9.748 0.401 4.551 697 H VAL 87 HN VAL 87 -8.619 -2.090 0.148 698 HA VAL 87 HA VAL 87 -6.809 -0.548 -1.516 699 HB VAL 87 HB VAL 87 -8.230 -3.077 -2.320 700 1HG1 VAL 87 HG11 VAL 87 -6.046 -1.443 -3.419 701 2HG1 VAL 87 HG12 VAL 87 -7.214 -2.479 -4.236 702 3HG1 VAL 87 HG13 VAL 87 -5.797 -3.186 -3.460 703 1HG2 VAL 87 HG21 VAL 87 -6.550 -4.406 -1.371 704 2HG2 VAL 87 HG22 VAL 87 -6.982 -3.255 -0.107 705 3HG2 VAL 87 HG23 VAL 87 -5.512 -3.017 -1.053 706 H LEU 88 HN LEU 88 -7.599 1.117 -2.541 707 HA LEU 88 HA LEU 88 -10.288 0.977 -3.724 708 1HB LEU 88 HB2 LEU 88 -8.698 3.472 -3.139 709 2HB LEU 88 HB1 LEU 88 -10.408 3.351 -3.503 710 HG LEU 88 HG LEU 88 -9.082 2.359 -0.979 711 1HD1 LEU 88 HD11 LEU 88 -10.235 4.190 0.114 712 2HD1 LEU 88 HD12 LEU 88 -10.907 4.715 -1.430 713 3HD1 LEU 88 HD13 LEU 88 -9.168 4.805 -1.147 714 1HD2 LEU 88 HD21 LEU 88 -11.349 1.362 -2.088 715 2HD2 LEU 88 HD22 LEU 88 -11.999 2.667 -1.096 716 3HD2 LEU 88 HD23 LEU 88 -11.017 1.403 -0.356 717 H ASP 89 HN ASP 89 -9.685 3.442 -5.286 718 HA ASP 89 HA ASP 89 -9.069 3.987 -7.393 719 1HB ASP 89 HB2 ASP 89 -6.827 3.883 -6.204 720 2HB ASP 89 HB1 ASP 89 -6.616 2.293 -6.926 721 H THR 90 HN THR 90 -7.151 1.657 -8.673 722 HA THR 90 HA THR 90 -9.440 0.038 -9.561 723 HB THR 90 HB THR 90 -7.115 0.992 -11.246 724 HG1 THR 90 HG1 THR 90 -9.829 1.748 -11.109 725 1HG2 THR 90 HG21 THR 90 -9.025 0.091 -12.970 726 2HG2 THR 90 HG22 THR 90 -9.074 -1.115 -11.683 727 3HG2 THR 90 HG23 THR 90 -7.557 -0.775 -12.517 728 H ASP 91 HN ASP 91 -9.183 -1.943 -8.764 729 HA ASP 91 HA ASP 91 -6.483 -3.003 -8.388 730 1HB ASP 91 HB2 ASP 91 -8.152 -3.126 -6.525 731 2HB ASP 91 HB1 ASP 91 -9.118 -4.210 -7.521 732 H TYR 92 HN TYR 92 -7.725 -2.708 -11.028 733 HA TYR 92 HA TYR 92 -7.820 -5.529 -11.840 734 1HB TYR 92 HB2 TYR 92 -9.156 -3.107 -13.055 735 2HB TYR 92 HB1 TYR 92 -9.011 -4.637 -13.909 736 HD1 TYR 92 HD1 TYR 92 -11.077 -5.638 -14.025 737 HD2 TYR 92 HD2 TYR 92 -9.918 -3.800 -10.368 738 HE1 TYR 92 HE1 TYR 92 -13.148 -6.439 -12.973 739 HE2 TYR 92 HE2 TYR 92 -11.983 -4.601 -9.304 740 HH TYR 92 HH TYR 92 -14.255 -5.298 -9.989 741 H LYS 93 HN LYS 93 -7.560 -3.213 -14.376 742 HA LYS 93 HA LYS 93 -4.666 -3.729 -14.573 743 1HB LYS 93 HB2 LYS 93 -6.055 -5.070 -16.170 744 2HB LYS 93 HB1 LYS 93 -6.602 -3.561 -16.887 745 1HG LYS 93 HG2 LYS 93 -3.726 -4.450 -16.767 746 2HG LYS 93 HG1 LYS 93 -4.792 -4.688 -18.150 747 1HD LYS 93 HD2 LYS 93 -5.094 -2.213 -18.267 748 2HD LYS 93 HD1 LYS 93 -3.895 -2.053 -16.983 749 1HE LYS 93 HE2 LYS 93 -3.407 -3.342 -19.660 750 2HE LYS 93 HE1 LYS 93 -2.924 -1.708 -19.209 751 1HZ LYS 93 HZ1 LYS 93 -1.143 -3.405 -19.013 752 2HZ LYS 93 HZ2 LYS 93 -2.025 -4.141 -17.772 753 3HZ LYS 93 HZ3 LYS 93 -1.446 -2.563 -17.577 754 H SER 94 HN SER 94 -4.006 -1.758 -13.802 755 HA SER 94 HA SER 94 -3.580 0.352 -15.461 756 1HB SER 94 HB2 SER 94 -5.231 2.078 -14.675 757 2HB SER 94 HB1 SER 94 -5.962 0.791 -15.632 758 HG SER 94 HG SER 94 -6.829 1.537 -13.381 759 H TYR 95 HN TYR 95 -5.060 1.015 -12.340 760 HA TYR 95 HA TYR 95 -2.538 0.937 -10.934 761 1HB TYR 95 HB2 TYR 95 -2.937 3.429 -10.234 762 2HB TYR 95 HB1 TYR 95 -2.115 3.068 -11.748 763 HD1 TYR 95 HD1 TYR 95 -2.759 4.292 -13.575 764 HD2 TYR 95 HD2 TYR 95 -5.630 3.557 -10.529 765 HE1 TYR 95 HE1 TYR 95 -4.405 5.638 -14.807 766 HE2 TYR 95 HE2 TYR 95 -7.284 4.899 -11.750 767 HH TYR 95 HH TYR 95 -6.765 5.956 -14.984 768 H ALA 96 HN ALA 96 -2.804 0.563 -8.806 769 HA ALA 96 HA ALA 96 -5.524 0.864 -7.707 770 1HB ALA 96 HB1 ALA 96 -3.904 -1.502 -7.961 771 2HB ALA 96 HB2 ALA 96 -5.577 -1.345 -7.431 772 3HB ALA 96 HB3 ALA 96 -4.262 -1.181 -6.266 773 H VAL 97 HN VAL 97 -5.714 1.493 -5.545 774 HA VAL 97 HA VAL 97 -3.203 2.314 -4.251 775 HB VAL 97 HB VAL 97 -4.139 4.352 -3.481 776 1HG1 VAL 97 HG11 VAL 97 -3.529 5.145 -5.468 777 2HG1 VAL 97 HG12 VAL 97 -5.228 5.063 -5.928 778 3HG1 VAL 97 HG13 VAL 97 -4.145 3.724 -6.309 779 1HG2 VAL 97 HG21 VAL 97 -6.313 4.027 -2.841 780 2HG2 VAL 97 HG22 VAL 97 -6.732 3.150 -4.312 781 3HG2 VAL 97 HG23 VAL 97 -6.565 4.904 -4.352 782 H ILE 98 HN ILE 98 -2.951 1.673 -2.227 783 HA ILE 98 HA ILE 98 -5.290 0.718 -0.715 784 HB ILE 98 HB ILE 98 -4.224 -1.249 -1.550 785 1HG1 ILE 98 HG12 ILE 98 -3.369 -2.331 0.527 786 2HG1 ILE 98 HG11 ILE 98 -3.364 -0.752 1.305 787 1HG2 ILE 98 HG21 ILE 98 -1.626 -1.275 -0.526 788 2HG2 ILE 98 HG22 ILE 98 -1.830 0.309 -1.275 789 3HG2 ILE 98 HG23 ILE 98 -2.118 -1.155 -2.215 790 1HD1 ILE 98 HD11 ILE 98 -5.914 -1.170 0.158 791 2HD1 ILE 98 HD12 ILE 98 -5.482 -1.021 1.859 792 3HD1 ILE 98 HD13 ILE 98 -5.479 -2.604 1.080 793 H TYR 99 HN TYR 99 -5.457 1.950 1.097 794 HA TYR 99 HA TYR 99 -2.982 3.064 2.202 795 1HB TYR 99 HB2 TYR 99 -4.318 4.706 3.344 796 2HB TYR 99 HB1 TYR 99 -4.813 4.653 1.659 797 HD1 TYR 99 HD1 TYR 99 -7.062 4.706 1.213 798 HD2 TYR 99 HD2 TYR 99 -5.771 3.100 4.936 799 HE1 TYR 99 HE1 TYR 99 -9.405 4.454 1.913 800 HE2 TYR 99 HE2 TYR 99 -8.111 2.835 5.641 801 HH TYR 99 HH TYR 99 -10.704 4.278 3.970 802 H ALA 100 HN ALA 100 -2.255 2.601 4.208 803 HA ALA 100 HA ALA 100 -3.631 0.414 5.563 804 1HB ALA 100 HB1 ALA 100 -1.163 0.329 4.851 805 2HB ALA 100 HB2 ALA 100 -1.596 -0.248 6.459 806 3HB ALA 100 HB3 ALA 100 -0.879 1.350 6.261 807 H THR 101 HN THR 101 -4.448 0.517 7.522 808 HA THR 101 HA THR 101 -3.935 2.893 9.168 809 HB THR 101 HB THR 101 -6.314 2.913 9.841 810 HG1 THR 101 HG1 THR 101 -7.777 1.609 8.860 811 1HG2 THR 101 HG21 THR 101 -5.613 3.330 6.982 812 2HG2 THR 101 HG22 THR 101 -6.076 4.501 8.217 813 3HG2 THR 101 HG23 THR 101 -7.297 3.457 7.490 814 H ARG 102 HN ARG 102 -3.271 2.347 11.140 815 HA ARG 102 HA ARG 102 -3.629 -0.436 11.971 816 1HB ARG 102 HB2 ARG 102 -1.670 1.644 12.937 817 2HB ARG 102 HB1 ARG 102 -1.766 -0.003 13.538 818 1HG ARG 102 HG2 ARG 102 -1.209 -0.847 11.313 819 2HG ARG 102 HG1 ARG 102 -1.102 0.812 10.718 820 1HD ARG 102 HD2 ARG 102 0.715 1.271 12.263 821 2HD ARG 102 HD1 ARG 102 0.582 -0.355 12.930 822 HE ARG 102 HE ARG 102 1.017 -0.578 10.181 823 1HH1 ARG 102 HH11 ARG 102 2.692 0.515 13.040 824 2HH1 ARG 102 HH12 ARG 102 4.264 0.143 12.414 825 1HH2 ARG 102 HH21 ARG 102 3.080 -1.065 9.354 826 2HH2 ARG 102 HH22 ARG 102 4.484 -0.755 10.320 827 H VAL 103 HN VAL 103 -4.504 -1.025 13.865 828 HA VAL 103 HA VAL 103 -5.282 1.001 15.797 829 HB VAL 103 HB VAL 103 -7.248 0.948 14.399 830 1HG1 VAL 103 HG11 VAL 103 -6.862 -1.252 13.375 831 2HG1 VAL 103 HG12 VAL 103 -8.512 -1.065 13.965 832 3HG1 VAL 103 HG13 VAL 103 -7.351 -2.024 14.882 833 1HG2 VAL 103 HG21 VAL 103 -7.721 -0.622 16.931 834 2HG2 VAL 103 HG22 VAL 103 -8.928 0.307 16.042 835 3HG2 VAL 103 HG23 VAL 103 -7.576 1.131 16.820 836 H LYS 104 HN LYS 104 -4.435 0.293 17.594 837 HA LYS 104 HA LYS 104 -5.108 -2.301 18.647 838 1HB LYS 104 HB2 LYS 104 -2.809 -3.091 18.907 839 2HB LYS 104 HB1 LYS 104 -3.206 -2.869 17.211 840 1HG LYS 104 HG2 LYS 104 -2.016 -0.720 17.225 841 2HG LYS 104 HG1 LYS 104 -1.579 -0.993 18.913 842 1HD LYS 104 HD2 LYS 104 -0.378 -3.028 18.273 843 2HD LYS 104 HD1 LYS 104 -0.822 -2.763 16.587 844 1HE LYS 104 HE2 LYS 104 1.436 -2.009 16.933 845 2HE LYS 104 HE1 LYS 104 0.401 -0.612 16.646 846 1HZ LYS 104 HZ1 LYS 104 1.326 0.205 18.484 847 2HZ LYS 104 HZ2 LYS 104 1.954 -1.291 18.961 848 3HZ LYS 104 HZ3 LYS 104 0.358 -0.884 19.346 849 H ASP 105 HN ASP 105 -5.033 -2.322 20.853 850 HA ASP 105 HA ASP 105 -4.998 -1.452 22.960 851 1HB ASP 105 HB2 ASP 105 -2.386 -0.275 21.980 852 2HB ASP 105 HB1 ASP 105 -2.875 -0.408 23.666 853 H GLY 106 HN GLY 106 -6.362 0.056 20.909 854 1HA GLY 106 HA2 GLY 106 -7.497 2.041 20.752 855 2HA GLY 106 HA1 GLY 106 -6.899 2.421 22.358 856 H ARG 107 HN ARG 107 -5.137 1.917 19.293 857 HA ARG 107 HA ARG 107 -4.342 4.745 19.373 858 1HB ARG 107 HB2 ARG 107 -2.042 4.286 19.128 859 2HB ARG 107 HB1 ARG 107 -2.584 3.213 20.409 860 1HG ARG 107 HG2 ARG 107 -2.843 1.465 18.537 861 2HG ARG 107 HG1 ARG 107 -1.832 2.554 17.592 862 1HD ARG 107 HD2 ARG 107 -1.114 1.371 20.270 863 2HD ARG 107 HD1 ARG 107 -0.504 0.830 18.708 864 HE ARG 107 HE ARG 107 0.066 3.540 18.918 865 1HH1 ARG 107 HH11 ARG 107 0.927 0.579 20.555 866 2HH1 ARG 107 HH12 ARG 107 2.500 1.142 21.011 867 1HH2 ARG 107 HH21 ARG 107 2.133 4.281 19.514 868 2HH2 ARG 107 HH22 ARG 107 3.186 3.247 20.420 869 H THR 108 HN THR 108 -4.251 5.719 17.409 870 HA THR 108 HA THR 108 -4.825 4.020 15.074 871 HB THR 108 HB THR 108 -6.633 5.550 15.605 872 HG1 THR 108 HG1 THR 108 -6.224 5.216 13.404 873 1HG2 THR 108 HG21 THR 108 -5.671 7.336 16.774 874 2HG2 THR 108 HG22 THR 108 -6.229 8.024 15.250 875 3HG2 THR 108 HG23 THR 108 -4.517 7.670 15.482 876 H LEU 109 HN LEU 109 -3.737 4.297 13.165 877 HA LEU 109 HA LEU 109 -1.567 6.273 13.055 878 1HB LEU 109 HB2 LEU 109 -1.247 3.367 12.295 879 2HB LEU 109 HB1 LEU 109 -0.027 4.612 12.145 880 HG LEU 109 HG LEU 109 -0.077 4.844 14.649 881 1HD1 LEU 109 HD11 LEU 109 -1.749 3.877 15.745 882 2HD1 LEU 109 HD12 LEU 109 -0.992 2.323 15.393 883 3HD1 LEU 109 HD13 LEU 109 -2.238 2.960 14.320 884 1HD2 LEU 109 HD21 LEU 109 1.371 3.215 13.065 885 2HD2 LEU 109 HD22 LEU 109 0.654 2.033 14.160 886 3HD2 LEU 109 HD23 LEU 109 1.616 3.364 14.805 887 H HIS 110 HN HIS 110 -1.306 7.188 11.028 888 HA HIS 110 HA HIS 110 -3.196 6.205 9.000 889 1HB HIS 110 HB2 HIS 110 -1.855 8.904 9.221 890 2HB HIS 110 HB1 HIS 110 -3.022 8.435 7.987 891 HD1 HIS 110 HD1 HIS 110 -5.350 7.380 9.291 892 HD2 HIS 110 HD2 HIS 110 -3.084 10.320 11.160 893 HE1 HIS 110 HE1 HIS 110 -6.873 8.413 11.005 894 HE2 HIS 110 HE2 HIS 110 -5.487 10.203 12.112 895 H MET 111 HN MET 111 -2.570 5.500 7.061 896 HA MET 111 HA MET 111 0.055 6.059 6.019 897 1HB MET 111 HB2 MET 111 -0.684 3.217 6.713 898 2HB MET 111 HB1 MET 111 0.762 3.722 5.854 899 1HG MET 111 HG2 MET 111 1.446 4.997 7.858 900 2HG MET 111 HG1 MET 111 0.048 4.349 8.707 901 1HE MET 111 HE1 MET 111 -0.512 1.914 8.140 902 2HE MET 111 HE2 MET 111 0.353 1.056 9.411 903 3HE MET 111 HE3 MET 111 0.662 0.667 7.719 904 H MET 112 HN MET 112 0.196 5.761 3.848 905 HA MET 112 HA MET 112 -2.123 4.600 2.477 906 1HB MET 112 HB2 MET 112 -0.875 7.277 2.112 907 2HB MET 112 HB1 MET 112 -1.396 6.430 0.665 908 1HG MET 112 HG2 MET 112 -3.640 6.158 1.842 909 2HG MET 112 HG1 MET 112 -3.051 7.369 2.974 910 1HE MET 112 HE1 MET 112 -1.673 9.846 0.740 911 2HE MET 112 HE2 MET 112 -2.128 9.465 2.402 912 3HE MET 112 HE3 MET 112 -3.117 10.568 1.445 913 H ARG 113 HN ARG 113 -1.702 3.388 0.702 914 HA ARG 113 HA ARG 113 1.078 3.197 -0.214 915 1HB ARG 113 HB2 ARG 113 0.411 1.407 1.515 916 2HB ARG 113 HB1 ARG 113 -0.613 0.745 0.251 917 1HG ARG 113 HG2 ARG 113 1.304 0.374 -1.164 918 2HG ARG 113 HG1 ARG 113 2.361 1.132 0.032 919 1HD ARG 113 HD2 ARG 113 0.762 -1.400 0.386 920 2HD ARG 113 HD1 ARG 113 2.510 -1.273 0.208 921 HE ARG 113 HE ARG 113 1.755 0.269 2.409 922 1HH1 ARG 113 HH11 ARG 113 1.802 -3.084 1.439 923 2HH1 ARG 113 HH12 ARG 113 2.011 -3.679 3.051 924 1HH2 ARG 113 HH21 ARG 113 2.031 -0.514 4.536 925 2HH2 ARG 113 HH22 ARG 113 2.141 -2.221 4.810 926 H LEU 114 HN LEU 114 1.273 2.802 -2.419 927 HA LEU 114 HA LEU 114 -1.170 2.232 -3.931 928 1HB LEU 114 HB2 LEU 114 -0.953 4.693 -3.695 929 2HB LEU 114 HB1 LEU 114 0.612 4.608 -4.473 930 HG LEU 114 HG LEU 114 -2.012 3.873 -5.777 931 1HD1 LEU 114 HD11 LEU 114 -2.100 5.951 -6.721 932 2HD1 LEU 114 HD12 LEU 114 -0.359 6.204 -6.594 933 3HD1 LEU 114 HD13 LEU 114 -1.378 6.356 -5.163 934 1HD2 LEU 114 HD21 LEU 114 -0.395 4.219 -7.830 935 2HD2 LEU 114 HD22 LEU 114 -0.520 2.661 -7.012 936 3HD2 LEU 114 HD23 LEU 114 0.827 3.741 -6.652 937 H TYR 115 HN TYR 115 -0.716 0.611 -5.254 938 HA TYR 115 HA TYR 115 2.015 0.364 -6.305 939 1HB TYR 115 HB2 TYR 115 -0.150 -1.741 -6.237 940 2HB TYR 115 HB1 TYR 115 1.517 -1.977 -6.733 941 HD1 TYR 115 HD1 TYR 115 -0.393 -0.780 -3.736 942 HD2 TYR 115 HD2 TYR 115 2.929 -2.981 -5.229 943 HE1 TYR 115 HE1 TYR 115 0.157 -1.501 -1.449 944 HE2 TYR 115 HE2 TYR 115 3.490 -3.701 -2.950 945 HH TYR 115 HH TYR 115 1.525 -3.715 -0.498 946 H SER 116 HN SER 116 2.354 0.765 -8.411 947 HA SER 116 HA SER 116 0.023 1.146 -10.135 948 1HB SER 116 HB2 SER 116 1.662 2.166 -11.718 949 2HB SER 116 HB1 SER 116 1.628 2.967 -10.148 950 HG SER 116 HG SER 116 3.622 2.392 -9.828 951 H ARG 117 HN ARG 117 -0.535 -0.244 -11.696 952 HA ARG 117 HA ARG 117 0.910 -2.722 -11.942 953 1HB ARG 117 HB2 ARG 117 -1.577 -1.674 -13.297 954 2HB ARG 117 HB1 ARG 117 -0.929 -3.291 -13.548 955 1HG ARG 117 HG2 ARG 117 -1.504 -4.000 -11.446 956 2HG ARG 117 HG1 ARG 117 -1.482 -2.371 -10.770 957 1HD ARG 117 HD2 ARG 117 -3.533 -1.832 -11.940 958 2HD ARG 117 HD1 ARG 117 -3.542 -3.421 -12.704 959 HE ARG 117 HE ARG 117 -4.460 -2.778 -10.092 960 1HH1 ARG 117 HH11 ARG 117 -2.986 -5.303 -11.997 961 2HH1 ARG 117 HH12 ARG 117 -3.501 -6.572 -10.937 962 1HH2 ARG 117 HH21 ARG 117 -5.134 -4.443 -8.700 963 2HH2 ARG 117 HH22 ARG 117 -4.720 -6.085 -9.068 964 H SER 118 HN SER 118 0.363 0.134 -13.901 965 HA SER 118 HA SER 118 2.437 -0.821 -15.752 966 1HB SER 118 HB2 SER 118 -0.079 0.695 -16.493 967 2HB SER 118 HB1 SER 118 1.230 0.289 -17.604 968 HG SER 118 HG SER 118 0.782 -1.909 -17.223 969 HA PRO 119 HA PRO 119 4.795 2.795 -14.846 970 1HB PRO 119 HB2 PRO 119 4.910 3.058 -17.826 971 2HB PRO 119 HB1 PRO 119 6.217 3.154 -16.640 972 1HG PRO 119 HG2 PRO 119 5.857 0.951 -18.094 973 2HG PRO 119 HG1 PRO 119 6.340 0.853 -16.391 974 1HD PRO 119 HD2 PRO 119 3.718 0.261 -17.652 975 2HD PRO 119 HD1 PRO 119 4.451 -0.425 -16.189 976 H GLU 120 HN GLU 120 2.215 2.939 -17.224 977 HA GLU 120 HA GLU 120 2.027 5.746 -17.436 978 1HB GLU 120 HB2 GLU 120 1.077 4.223 -19.095 979 2HB GLU 120 HB1 GLU 120 -0.063 3.616 -17.905 980 1HG GLU 120 HG2 GLU 120 -1.125 5.169 -19.435 981 2HG GLU 120 HG1 GLU 120 -1.135 5.794 -17.790 982 H VAL 121 HN VAL 121 2.311 5.869 -14.906 983 HA VAL 121 HA VAL 121 -0.031 5.490 -13.324 984 HB VAL 121 HB VAL 121 2.371 7.240 -12.753 985 1HG1 VAL 121 HG11 VAL 121 1.538 6.647 -10.334 986 2HG1 VAL 121 HG12 VAL 121 -0.015 6.449 -11.144 987 3HG1 VAL 121 HG13 VAL 121 0.828 7.996 -11.221 988 1HG2 VAL 121 HG21 VAL 121 2.886 5.223 -11.218 989 2HG2 VAL 121 HG22 VAL 121 3.240 5.093 -12.941 990 3HG2 VAL 121 HG23 VAL 121 1.788 4.341 -12.279 991 H SER 122 HN SER 122 -1.742 6.513 -14.312 992 HA SER 122 HA SER 122 -1.749 9.140 -15.296 993 1HB SER 122 HB2 SER 122 -3.454 7.503 -15.916 994 2HB SER 122 HB1 SER 122 -4.051 7.478 -14.259 995 HG SER 122 HG SER 122 -5.211 8.867 -15.785 996 HA PRO 123 HA PRO 123 -1.909 11.876 -11.838 997 1HB PRO 123 HB2 PRO 123 -4.037 13.477 -12.697 998 2HB PRO 123 HB1 PRO 123 -2.334 13.728 -13.096 999 1HG PRO 123 HG2 PRO 123 -4.482 12.404 -14.690 1000 2HG PRO 123 HG1 PRO 123 -3.155 13.444 -15.239 1001 1HD PRO 123 HD2 PRO 123 -3.045 10.803 -15.576 1002 2HD PRO 123 HD1 PRO 123 -1.594 11.721 -15.117 1003 H ALA 124 HN ALA 124 -4.857 10.386 -13.047 1004 HA ALA 124 HA ALA 124 -6.559 11.010 -10.913 1005 1HB ALA 124 HB1 ALA 124 -6.697 9.435 -13.255 1006 2HB ALA 124 HB2 ALA 124 -8.017 9.942 -12.203 1007 3HB ALA 124 HB3 ALA 124 -7.194 8.410 -11.908 1008 H ALA 125 HN ALA 125 -4.660 8.058 -11.495 1009 HA ALA 125 HA ALA 125 -5.297 6.677 -9.193 1010 1HB ALA 125 HB1 ALA 125 -2.484 6.427 -9.936 1011 2HB ALA 125 HB2 ALA 125 -3.593 6.287 -11.301 1012 3HB ALA 125 HB3 ALA 125 -3.764 5.215 -9.911 1013 H THR 126 HN THR 126 -2.621 8.958 -9.698 1014 HA THR 126 HA THR 126 -1.754 8.807 -6.980 1015 HB THR 126 HB THR 126 -1.114 10.834 -9.117 1016 HG1 THR 126 HG1 THR 126 0.137 9.342 -9.847 1017 1HG2 THR 126 HG21 THR 126 0.468 10.211 -6.640 1018 2HG2 THR 126 HG22 THR 126 -0.607 11.600 -6.802 1019 3HG2 THR 126 HG23 THR 126 0.801 11.449 -7.853 1020 H ALA 127 HN ALA 127 -3.476 11.317 -8.832 1021 HA ALA 127 HA ALA 127 -3.789 13.067 -6.625 1022 1HB ALA 127 HB1 ALA 127 -4.971 14.462 -8.041 1023 2HB ALA 127 HB2 ALA 127 -5.626 13.121 -8.979 1024 3HB ALA 127 HB3 ALA 127 -3.931 13.569 -9.154 1025 H ILE 128 HN ILE 128 -6.093 10.835 -8.200 1026 HA ILE 128 HA ILE 128 -8.271 11.414 -6.565 1027 HB ILE 128 HB ILE 128 -7.633 8.778 -7.900 1028 1HG1 ILE 128 HG12 ILE 128 -9.425 11.050 -8.788 1029 2HG1 ILE 128 HG11 ILE 128 -7.820 10.731 -9.428 1030 1HG2 ILE 128 HG21 ILE 128 -10.225 8.636 -7.784 1031 2HG2 ILE 128 HG22 ILE 128 -10.045 9.771 -6.448 1032 3HG2 ILE 128 HG23 ILE 128 -9.263 8.191 -6.374 1033 1HD1 ILE 128 HD11 ILE 128 -10.152 8.836 -9.590 1034 2HD1 ILE 128 HD12 ILE 128 -8.557 8.609 -10.307 1035 3HD1 ILE 128 HD13 ILE 128 -9.606 9.902 -10.886 1036 H PHE 129 HN PHE 129 -5.764 8.899 -6.147 1037 HA PHE 129 HA PHE 129 -6.797 7.744 -3.827 1038 1HB PHE 129 HB2 PHE 129 -4.882 6.792 -5.041 1039 2HB PHE 129 HB1 PHE 129 -3.887 8.158 -4.560 1040 HD1 PHE 129 HD1 PHE 129 -2.208 6.911 -3.422 1041 HD2 PHE 129 HD2 PHE 129 -6.302 6.489 -2.332 1042 HE1 PHE 129 HE1 PHE 129 -1.538 5.715 -1.377 1043 HE2 PHE 129 HE2 PHE 129 -5.637 5.294 -0.287 1044 HZ PHE 129 HZ PHE 129 -3.253 4.907 0.193 1045 H ARG 130 HN ARG 130 -4.657 10.508 -4.251 1046 HA ARG 130 HA ARG 130 -4.416 11.120 -1.483 1047 1HB ARG 130 HB2 ARG 130 -2.756 11.906 -3.090 1048 2HB ARG 130 HB1 ARG 130 -3.987 12.805 -3.962 1049 1HG ARG 130 HG2 ARG 130 -4.298 14.258 -2.016 1050 2HG ARG 130 HG1 ARG 130 -3.041 13.363 -1.159 1051 1HD ARG 130 HD2 ARG 130 -2.201 15.458 -2.140 1052 2HD ARG 130 HD1 ARG 130 -1.393 14.034 -2.795 1053 HE ARG 130 HE ARG 130 -3.565 14.711 -4.445 1054 1HH1 ARG 130 HH11 ARG 130 -0.402 15.886 -3.549 1055 2HH1 ARG 130 HH12 ARG 130 -0.135 16.685 -5.062 1056 1HH2 ARG 130 HH21 ARG 130 -3.215 15.757 -6.431 1057 2HH2 ARG 130 HH22 ARG 130 -1.732 16.612 -6.698 1058 H LYS 131 HN LYS 131 -6.558 12.044 -4.091 1059 HA LYS 131 HA LYS 131 -7.923 14.162 -2.859 1060 1HB LYS 131 HB2 LYS 131 -8.037 13.540 -5.287 1061 2HB LYS 131 HB1 LYS 131 -9.049 12.176 -4.839 1062 1HG LYS 131 HG2 LYS 131 -10.764 13.661 -4.016 1063 2HG LYS 131 HG1 LYS 131 -9.736 15.061 -4.324 1064 1HD LYS 131 HD2 LYS 131 -11.384 14.812 -6.094 1065 2HD LYS 131 HD1 LYS 131 -9.758 14.542 -6.723 1066 1HE LYS 131 HE2 LYS 131 -11.307 12.901 -7.620 1067 2HE LYS 131 HE1 LYS 131 -10.110 12.124 -6.585 1068 1HZ LYS 131 HZ1 LYS 131 -12.398 11.315 -6.232 1069 2HZ LYS 131 HZ2 LYS 131 -12.852 12.859 -5.713 1070 3HZ LYS 131 HZ3 LYS 131 -11.713 11.973 -4.831 1071 H LEU 132 HN LEU 132 -8.616 10.679 -2.974 1072 HA LEU 132 HA LEU 132 -10.958 10.747 -1.416 1073 1HB LEU 132 HB2 LEU 132 -8.942 8.616 -2.034 1074 2HB LEU 132 HB1 LEU 132 -10.194 8.314 -0.845 1075 HG LEU 132 HG LEU 132 -11.916 8.740 -2.556 1076 1HD1 LEU 132 HD11 LEU 132 -9.697 8.799 -4.574 1077 2HD1 LEU 132 HD12 LEU 132 -10.429 10.264 -3.923 1078 3HD1 LEU 132 HD13 LEU 132 -11.413 9.113 -4.824 1079 1HD2 LEU 132 HD21 LEU 132 -11.003 6.763 -4.119 1080 2HD2 LEU 132 HD22 LEU 132 -11.636 6.500 -2.494 1081 3HD2 LEU 132 HD23 LEU 132 -9.895 6.599 -2.756 1082 H ALA 133 HN ALA 133 -7.550 10.405 -0.585 1083 HA ALA 133 HA ALA 133 -7.868 9.979 2.179 1084 1HB ALA 133 HB1 ALA 133 -5.646 10.890 0.420 1085 2HB ALA 133 HB2 ALA 133 -5.728 9.512 1.517 1086 3HB ALA 133 HB3 ALA 133 -5.488 11.136 2.160 1087 H GLY 134 HN GLY 134 -7.576 12.911 0.226 1088 1HA GLY 134 HA2 GLY 134 -7.406 14.787 2.301 1089 2HA GLY 134 HA1 GLY 134 -8.040 15.111 0.695 1090 H GLU 135 HN GLU 135 -10.154 13.117 0.934 1091 HA GLU 135 HA GLU 135 -12.259 14.678 1.790 1092 1HB GLU 135 HB2 GLU 135 -12.158 11.654 1.806 1093 2HB GLU 135 HB1 GLU 135 -13.612 12.643 1.749 1094 1HG GLU 135 HG2 GLU 135 -12.854 13.547 -0.428 1095 2HG GLU 135 HG1 GLU 135 -11.489 12.435 -0.371 1096 H ARG 136 HN ARG 136 -10.173 12.595 3.644 1097 HA ARG 136 HA ARG 136 -11.756 12.359 5.970 1098 1HB ARG 136 HB2 ARG 136 -9.818 10.915 5.484 1099 2HB ARG 136 HB1 ARG 136 -8.747 12.292 5.702 1100 1HG ARG 136 HG2 ARG 136 -9.387 12.456 8.032 1101 2HG ARG 136 HG1 ARG 136 -10.531 11.129 7.829 1102 1HD ARG 136 HD2 ARG 136 -8.484 10.338 8.868 1103 2HD ARG 136 HD1 ARG 136 -8.682 9.623 7.271 1104 HE ARG 136 HE ARG 136 -6.605 11.431 8.131 1105 1HH1 ARG 136 HH11 ARG 136 -8.233 9.977 5.402 1106 2HH1 ARG 136 HH12 ARG 136 -6.985 10.399 4.280 1107 1HH2 ARG 136 HH21 ARG 136 -4.959 11.956 6.656 1108 2HH2 ARG 136 HH22 ARG 136 -5.127 11.515 4.990 1109 H ASN 137 HN ASN 137 -9.099 14.584 5.154 1110 HA ASN 137 HA ASN 137 -10.251 16.797 6.430 1111 1HB ASN 137 HB2 ASN 137 -8.767 16.999 8.399 1112 2HB ASN 137 HB1 ASN 137 -9.824 15.593 8.506 1113 1HD2 ASN 137 HD21 ASN 137 -6.818 16.597 9.129 1114 2HD2 ASN 137 HD22 ASN 137 -5.950 15.111 8.976 1115 H TYR 138 HN TYR 138 -7.130 15.233 5.815 1116 HA TYR 138 HA TYR 138 -6.324 17.061 3.849 1117 1HB TYR 138 HB2 TYR 138 -6.205 18.460 6.037 1118 2HB TYR 138 HB1 TYR 138 -4.784 17.483 6.401 1119 HD1 TYR 138 HD1 TYR 138 -5.922 18.834 3.130 1120 HD2 TYR 138 HD2 TYR 138 -2.990 18.976 6.208 1121 HE1 TYR 138 HE1 TYR 138 -4.555 20.334 1.745 1122 HE2 TYR 138 HE2 TYR 138 -1.612 20.478 4.829 1123 HH TYR 138 HH TYR 138 -1.330 21.007 2.399 1124 H THR 139 HN THR 139 -4.777 16.065 2.686 1125 HA THR 139 HA THR 139 -3.876 13.512 3.451 1126 HB THR 139 HB THR 139 -2.500 13.559 1.433 1127 HG1 THR 139 HG1 THR 139 -2.090 15.367 0.360 1128 1HG2 THR 139 HG21 THR 139 -4.795 14.921 0.309 1129 2HG2 THR 139 HG22 THR 139 -5.233 13.683 1.488 1130 3HG2 THR 139 HG23 THR 139 -4.239 13.263 0.098 1131 H ASP 140 HN ASP 140 -2.514 16.700 3.914 1132 HA ASP 140 HA ASP 140 0.162 16.052 4.309 1133 1HB ASP 140 HB2 ASP 140 -0.774 18.393 4.424 1134 2HB ASP 140 HB1 ASP 140 -1.372 18.009 6.038 1135 H GLU 141 HN GLU 141 -2.646 15.400 6.251 1136 HA GLU 141 HA GLU 141 -1.611 14.803 8.738 1137 1HB GLU 141 HB2 GLU 141 -3.991 14.744 8.196 1138 2HB GLU 141 HB1 GLU 141 -3.745 13.347 7.168 1139 1HG GLU 141 HG2 GLU 141 -4.661 12.509 9.123 1140 2HG GLU 141 HG1 GLU 141 -2.938 12.152 9.256 1141 H MET 142 HN MET 142 -1.145 13.213 5.719 1142 HA MET 142 HA MET 142 0.862 11.464 6.814 1143 1HB MET 142 HB2 MET 142 -0.131 9.441 5.731 1144 2HB MET 142 HB1 MET 142 -1.028 10.014 7.132 1145 1HG MET 142 HG2 MET 142 -2.642 11.099 5.649 1146 2HG MET 142 HG1 MET 142 -1.732 10.525 4.252 1147 1HE MET 142 HE1 MET 142 -4.220 10.128 3.822 1148 2HE MET 142 HE2 MET 142 -5.239 9.286 4.990 1149 3HE MET 142 HE3 MET 142 -4.579 8.415 3.608 1150 H VAL 143 HN VAL 143 2.516 11.676 5.432 1151 HA VAL 143 HA VAL 143 1.930 11.819 2.556 1152 HB VAL 143 HB VAL 143 3.990 13.562 3.902 1153 1HG1 VAL 143 HG11 VAL 143 3.517 14.628 1.452 1154 2HG1 VAL 143 HG12 VAL 143 3.293 12.910 1.127 1155 3HG1 VAL 143 HG13 VAL 143 4.811 13.482 1.812 1156 1HG2 VAL 143 HG21 VAL 143 1.541 14.674 2.610 1157 2HG2 VAL 143 HG22 VAL 143 2.556 15.357 3.881 1158 3HG2 VAL 143 HG23 VAL 143 1.429 14.054 4.256 1159 H ALA 144 HN ALA 144 3.338 10.832 1.215 1160 HA ALA 144 HA ALA 144 5.988 10.111 1.928 1161 1HB ALA 144 HB1 ALA 144 4.193 8.379 3.006 1162 2HB ALA 144 HB2 ALA 144 5.850 7.966 2.573 1163 3HB ALA 144 HB3 ALA 144 4.533 7.611 1.459 1164 H MET 145 HN MET 145 7.173 9.729 0.127 1165 HA MET 145 HA MET 145 5.737 9.177 -2.383 1166 1HB MET 145 HB2 MET 145 7.180 10.804 -3.538 1167 2HB MET 145 HB1 MET 145 6.181 11.573 -2.312 1168 1HG MET 145 HG2 MET 145 8.091 11.596 -0.782 1169 2HG MET 145 HG1 MET 145 9.092 10.851 -2.026 1170 1HE MET 145 HE1 MET 145 6.446 14.020 -2.778 1171 2HE MET 145 HE2 MET 145 7.467 15.091 -1.819 1172 3HE MET 145 HE3 MET 145 6.791 13.634 -1.091 1173 H LEU 146 HN LEU 146 6.811 7.887 -3.853 1174 HA LEU 146 HA LEU 146 8.459 5.909 -3.176 1175 1HB LEU 146 HB2 LEU 146 7.523 6.234 -5.423 1176 2HB LEU 146 HB1 LEU 146 8.704 7.492 -5.731 1177 HG LEU 146 HG LEU 146 10.512 5.797 -5.466 1178 1HD1 LEU 146 HD11 LEU 146 10.143 3.678 -4.869 1179 2HD1 LEU 146 HD12 LEU 146 8.709 3.538 -5.885 1180 3HD1 LEU 146 HD13 LEU 146 8.587 4.267 -4.285 1181 1HD2 LEU 146 HD21 LEU 146 8.584 5.996 -7.628 1182 2HD2 LEU 146 HD22 LEU 146 9.405 4.435 -7.600 1183 3HD2 LEU 146 HD23 LEU 146 10.345 5.924 -7.684 1184 HA PRO 147 HA PRO 147 12.137 7.803 -1.512 1185 1HB PRO 147 HB2 PRO 147 13.680 5.501 -1.680 1186 2HB PRO 147 HB1 PRO 147 12.617 5.932 -0.341 1187 1HG PRO 147 HG2 PRO 147 12.099 4.114 -2.657 1188 2HG PRO 147 HG1 PRO 147 11.641 3.926 -0.956 1189 1HD PRO 147 HD2 PRO 147 9.867 4.692 -2.789 1190 2HD PRO 147 HD1 PRO 147 9.850 5.387 -1.152 1191 H ARG 148 HN ARG 148 12.078 8.927 -3.782 1192 HA ARG 148 HA ARG 148 13.039 9.316 -5.870 1193 1HB ARG 148 HB2 ARG 148 15.319 9.492 -3.890 1194 2HB ARG 148 HB1 ARG 148 15.324 10.218 -5.491 1195 1HG ARG 148 HG2 ARG 148 13.378 10.895 -3.297 1196 2HG ARG 148 HG1 ARG 148 14.816 11.826 -3.710 1197 1HD ARG 148 HD2 ARG 148 13.933 12.273 -5.919 1198 2HD ARG 148 HD1 ARG 148 12.535 11.247 -5.598 1199 HE ARG 148 HE ARG 148 12.592 13.196 -3.624 1200 1HH1 ARG 148 HH11 ARG 148 12.237 13.079 -7.097 1201 2HH1 ARG 148 HH12 ARG 148 11.203 14.467 -7.157 1202 1HH2 ARG 148 HH21 ARG 148 11.238 15.008 -3.705 1203 2HH2 ARG 148 HH22 ARG 148 10.635 15.562 -5.232 1204 H GLN 149 HN GLN 149 16.216 8.588 -5.618 1205 HA GLN 149 HA GLN 149 16.104 6.558 -7.585 1206 1HB GLN 149 HB2 GLN 149 17.933 8.195 -7.415 1207 2HB GLN 149 HB1 GLN 149 18.427 7.477 -5.890 1208 1HG GLN 149 HG2 GLN 149 19.054 5.438 -6.979 1209 2HG GLN 149 HG1 GLN 149 18.392 6.003 -8.513 1210 1HE2 GLN 149 HE21 GLN 149 21.176 5.491 -6.941 1211 2HE2 GLN 149 HE22 GLN 149 22.181 6.680 -7.692 1212 H GLU 150 HN GLU 150 17.371 4.475 -7.353 1213 HA GLU 150 HA GLU 150 16.154 2.823 -5.447 1214 1HB GLU 150 HB2 GLU 150 17.818 1.109 -6.178 1215 2HB GLU 150 HB1 GLU 150 16.914 1.856 -7.488 1216 1HG GLU 150 HG2 GLU 150 18.850 3.328 -7.931 1217 2HG GLU 150 HG1 GLU 150 19.747 2.473 -6.674 1218 H GLU 151 HN GLU 151 16.711 4.321 -3.616 1219 HA GLU 151 HA GLU 151 18.580 3.074 -1.904 1220 1HB GLU 151 HB2 GLU 151 20.107 4.990 -1.584 1221 2HB GLU 151 HB1 GLU 151 20.210 4.332 -3.210 1222 1HG GLU 151 HG2 GLU 151 18.931 6.140 -4.101 1223 2HG GLU 151 HG1 GLU 151 18.573 6.747 -2.488 1224 H CYS 152 HN CYS 152 17.809 3.315 0.112 1225 HA CYS 152 HA CYS 152 15.509 4.685 0.770 1226 1HB CYS 152 HB2 CYS 152 17.819 3.732 2.454 1227 2HB CYS 152 HB1 CYS 152 16.381 4.454 3.167 1228 H THR 153 HN THR 153 15.472 6.814 0.067 1229 HA THR 153 HA THR 153 16.513 8.765 1.874 1230 HB THR 153 HB THR 153 18.558 8.390 0.560 1231 HG1 THR 153 HG1 THR 153 17.360 10.871 -0.112 1232 1HG2 THR 153 HG21 THR 153 17.134 7.875 -1.592 1233 2HG2 THR 153 HG22 THR 153 18.756 8.553 -1.702 1234 3HG2 THR 153 HG23 THR 153 17.348 9.603 -1.861 1235 H VAL 154 HN VAL 154 13.988 8.523 1.487 1236 HA VAL 154 HA VAL 154 12.944 9.918 -0.777 1237 HB VAL 154 HB VAL 154 11.640 8.186 0.326 1238 1HG1 VAL 154 HG11 VAL 154 12.394 9.534 2.691 1239 2HG1 VAL 154 HG12 VAL 154 11.469 8.042 2.522 1240 3HG1 VAL 154 HG13 VAL 154 10.635 9.594 2.585 1241 1HG2 VAL 154 HG21 VAL 154 10.417 9.811 -0.928 1242 2HG2 VAL 154 HG22 VAL 154 10.427 10.941 0.425 1243 3HG2 VAL 154 HG23 VAL 154 9.500 9.444 0.533 1244 H ASP 155 HN ASP 155 14.107 11.927 -0.660 1245 HA ASP 155 HA ASP 155 14.113 13.703 1.480 1246 1HB ASP 155 HB2 ASP 155 14.595 15.448 -0.171 1247 2HB ASP 155 HB1 ASP 155 15.516 13.989 -0.514 1248 H GLU 156 HN GLU 156 12.919 15.622 1.885 1249 HA GLU 156 HA GLU 156 10.271 15.834 0.661 1250 1HB GLU 156 HB2 GLU 156 10.780 14.866 3.346 1251 2HB GLU 156 HB1 GLU 156 9.808 16.331 3.379 1252 1HG GLU 156 HG2 GLU 156 8.411 14.351 3.346 1253 2HG GLU 156 HG1 GLU 156 8.189 15.307 1.882 1254 H VAL 157 HN VAL 157 9.625 17.891 0.371 1255 HA VAL 157 HA VAL 157 9.694 20.164 0.286 1256 HB VAL 157 HB VAL 157 10.840 19.978 3.075 1257 1HG1 VAL 157 HG11 VAL 157 9.691 22.194 1.438 1258 2HG1 VAL 157 HG12 VAL 157 11.106 22.191 2.490 1259 3HG1 VAL 157 HG13 VAL 157 9.488 22.209 3.190 1260 1HG2 VAL 157 HG21 VAL 157 8.656 18.740 2.638 1261 2HG2 VAL 157 HG22 VAL 157 7.940 20.329 2.371 1262 3HG2 VAL 157 HG23 VAL 157 8.654 19.933 3.935 Start of MODEL 12 1 1H MET 1 HT1 MET 1 -15.633 -16.417 -21.701 2 2H MET 1 HT2 MET 1 -17.146 -16.994 -22.189 3 3H MET 1 HT3 MET 1 -15.738 -17.789 -22.686 4 HA MET 1 HA MET 1 -16.445 -19.152 -21.005 5 1HB MET 1 HB2 MET 1 -14.130 -18.432 -20.664 6 2HB MET 1 HB1 MET 1 -14.681 -17.056 -19.719 7 1HG MET 1 HG2 MET 1 -15.540 -18.531 -18.008 8 2HG MET 1 HG1 MET 1 -15.099 -19.941 -18.970 9 1HE MET 1 HE1 MET 1 -13.824 -16.630 -17.990 10 2HE MET 1 HE2 MET 1 -12.074 -16.829 -18.081 11 3HE MET 1 HE3 MET 1 -12.907 -17.042 -16.541 12 H THR 2 HN THR 2 -17.977 -19.571 -19.521 13 HA THR 2 HA THR 2 -19.912 -17.665 -18.856 14 HB THR 2 HB THR 2 -20.788 -19.374 -17.300 15 HG1 THR 2 HG1 THR 2 -18.462 -20.841 -17.984 16 1HG2 THR 2 HG21 THR 2 -21.264 -21.100 -18.848 17 2HG2 THR 2 HG22 THR 2 -19.834 -20.722 -19.807 18 3HG2 THR 2 HG23 THR 2 -21.187 -19.591 -19.756 19 H VAL 3 HN VAL 3 -17.325 -19.073 -16.860 20 HA VAL 3 HA VAL 3 -17.928 -17.429 -14.600 21 HB VAL 3 HB VAL 3 -16.864 -19.621 -14.325 22 1HG1 VAL 3 HG11 VAL 3 -15.480 -19.648 -16.319 23 2HG1 VAL 3 HG12 VAL 3 -14.491 -19.924 -14.885 24 3HG1 VAL 3 HG13 VAL 3 -14.485 -18.345 -15.670 25 1HG2 VAL 3 HG21 VAL 3 -15.124 -18.953 -12.723 26 2HG2 VAL 3 HG22 VAL 3 -16.576 -17.965 -12.572 27 3HG2 VAL 3 HG23 VAL 3 -15.152 -17.320 -13.388 28 HA PRO 4 HA PRO 4 -15.945 -13.634 -15.761 29 1HB PRO 4 HB2 PRO 4 -15.189 -13.589 -12.863 30 2HB PRO 4 HB1 PRO 4 -15.953 -12.334 -13.845 31 1HG PRO 4 HG2 PRO 4 -17.404 -13.744 -12.146 32 2HG PRO 4 HG1 PRO 4 -18.041 -13.373 -13.761 33 1HD PRO 4 HD2 PRO 4 -16.875 -15.929 -12.723 34 2HD PRO 4 HD1 PRO 4 -18.268 -15.679 -13.796 35 H ASP 5 HN ASP 5 -13.657 -13.586 -13.294 36 HA ASP 5 HA ASP 5 -11.695 -15.343 -14.298 37 1HB ASP 5 HB2 ASP 5 -11.694 -13.870 -16.232 38 2HB ASP 5 HB1 ASP 5 -11.496 -12.461 -15.197 39 H ARG 6 HN ARG 6 -10.604 -15.769 -12.491 40 HA ARG 6 HA ARG 6 -10.565 -14.019 -10.259 41 1HB ARG 6 HB2 ARG 6 -9.028 -15.653 -9.246 42 2HB ARG 6 HB1 ARG 6 -10.440 -16.428 -9.949 43 1HG ARG 6 HG2 ARG 6 -9.109 -17.049 -11.912 44 2HG ARG 6 HG1 ARG 6 -7.692 -16.297 -11.176 45 1HD ARG 6 HD2 ARG 6 -7.865 -17.854 -9.284 46 2HD ARG 6 HD1 ARG 6 -9.267 -18.608 -10.040 47 HE ARG 6 HE ARG 6 -7.830 -19.831 -11.305 48 1HH1 ARG 6 HH11 ARG 6 -6.141 -16.966 -10.240 49 2HH1 ARG 6 HH12 ARG 6 -4.644 -17.425 -10.979 50 1HH2 ARG 6 HH21 ARG 6 -5.861 -20.436 -12.270 51 2HH2 ARG 6 HH22 ARG 6 -4.484 -19.394 -12.129 52 H SER 7 HN SER 7 -8.357 -14.650 -12.891 53 HA SER 7 HA SER 7 -6.012 -13.530 -11.953 54 1HB SER 7 HB2 SER 7 -7.145 -13.381 -14.757 55 2HB SER 7 HB1 SER 7 -5.467 -13.069 -14.325 56 HG SER 7 HG SER 7 -6.758 -15.508 -13.713 57 H GLU 8 HN GLU 8 -8.949 -11.943 -12.976 58 HA GLU 8 HA GLU 8 -8.133 -9.412 -13.600 59 1HB GLU 8 HB2 GLU 8 -10.287 -8.617 -12.913 60 2HB GLU 8 HB1 GLU 8 -10.493 -10.231 -13.580 61 1HG GLU 8 HG2 GLU 8 -10.457 -11.089 -11.215 62 2HG GLU 8 HG1 GLU 8 -10.537 -9.408 -10.700 63 H ILE 9 HN ILE 9 -8.101 -10.941 -10.469 64 HA ILE 9 HA ILE 9 -6.814 -8.532 -9.374 65 HB ILE 9 HB ILE 9 -8.500 -10.370 -7.687 66 1HG1 ILE 9 HG12 ILE 9 -10.092 -9.426 -9.166 67 2HG1 ILE 9 HG11 ILE 9 -10.169 -8.460 -7.703 68 1HG2 ILE 9 HG21 ILE 9 -8.107 -7.587 -6.893 69 2HG2 ILE 9 HG22 ILE 9 -6.616 -8.523 -6.994 70 3HG2 ILE 9 HG23 ILE 9 -7.935 -9.071 -5.959 71 1HD1 ILE 9 HD11 ILE 9 -8.276 -7.244 -9.412 72 2HD1 ILE 9 HD12 ILE 9 -9.853 -6.638 -8.905 73 3HD1 ILE 9 HD13 ILE 9 -9.712 -7.613 -10.368 74 H ALA 10 HN ALA 10 -5.256 -10.385 -10.514 75 HA ALA 10 HA ALA 10 -3.776 -11.435 -8.258 76 1HB ALA 10 HB1 ALA 10 -4.122 -13.480 -10.341 77 2HB ALA 10 HB2 ALA 10 -5.546 -13.161 -9.352 78 3HB ALA 10 HB3 ALA 10 -4.032 -13.648 -8.587 79 H GLY 11 HN GLY 11 -1.719 -10.931 -8.593 80 1HA GLY 11 HA2 GLY 11 -0.072 -11.608 -10.620 81 2HA GLY 11 HA1 GLY 11 -0.846 -10.163 -11.250 82 H LYS 12 HN LYS 12 0.718 -8.677 -11.207 83 HA LYS 12 HA LYS 12 2.237 -8.342 -8.712 84 1HB LYS 12 HB2 LYS 12 2.928 -7.488 -11.521 85 2HB LYS 12 HB1 LYS 12 3.911 -7.168 -10.099 86 1HG LYS 12 HG2 LYS 12 4.186 -9.573 -9.753 87 2HG LYS 12 HG1 LYS 12 3.216 -9.884 -11.194 88 1HD LYS 12 HD2 LYS 12 5.832 -8.382 -11.113 89 2HD LYS 12 HD1 LYS 12 5.609 -10.039 -11.679 90 1HE LYS 12 HE2 LYS 12 4.374 -7.563 -12.882 91 2HE LYS 12 HE1 LYS 12 5.722 -8.481 -13.551 92 1HZ LYS 12 HZ1 LYS 12 3.905 -9.273 -14.711 93 2HZ LYS 12 HZ2 LYS 12 2.880 -9.242 -13.366 94 3HZ LYS 12 HZ3 LYS 12 4.076 -10.432 -13.490 95 H TRP 13 HN TRP 13 1.915 -6.643 -7.526 96 HA TRP 13 HA TRP 13 0.566 -4.279 -8.655 97 1HB TRP 13 HB2 TRP 13 0.626 -5.391 -5.837 98 2HB TRP 13 HB1 TRP 13 -0.042 -3.822 -6.249 99 HD1 TRP 13 HD1 TRP 13 -0.868 -6.384 -8.835 100 HE1 TRP 13 HE1 TRP 13 -3.316 -7.133 -8.573 101 HE3 TRP 13 HE3 TRP 13 -1.874 -4.309 -4.271 102 HZ2 TRP 13 HZ2 TRP 13 -5.391 -6.882 -6.691 103 HZ3 TRP 13 HZ3 TRP 13 -4.116 -4.614 -3.309 104 HH2 TRP 13 HH2 TRP 13 -5.839 -5.875 -4.496 105 H TYR 14 HN TYR 14 1.701 -2.344 -8.593 106 HA TYR 14 HA TYR 14 4.365 -2.462 -7.360 107 1HB TYR 14 HB2 TYR 14 3.245 -0.626 -9.480 108 2HB TYR 14 HB1 TYR 14 4.848 -0.449 -8.780 109 HD1 TYR 14 HD1 TYR 14 6.516 -1.143 -10.181 110 HD2 TYR 14 HD2 TYR 14 2.854 -3.308 -10.167 111 HE1 TYR 14 HE1 TYR 14 7.427 -2.682 -11.868 112 HE2 TYR 14 HE2 TYR 14 3.755 -4.854 -11.850 113 HH TYR 14 HH TYR 14 6.551 -4.220 -13.620 114 H VAL 15 HN VAL 15 4.436 -1.671 -5.339 115 HA VAL 15 HA VAL 15 2.695 0.494 -4.527 116 HB VAL 15 HB VAL 15 4.848 -0.996 -3.029 117 1HG1 VAL 15 HG11 VAL 15 4.106 0.135 -1.016 118 2HG1 VAL 15 HG12 VAL 15 2.911 1.046 -1.937 119 3HG1 VAL 15 HG13 VAL 15 4.630 1.327 -2.206 120 1HG2 VAL 15 HG21 VAL 15 2.717 -1.670 -1.705 121 2HG2 VAL 15 HG22 VAL 15 3.083 -2.471 -3.233 122 3HG2 VAL 15 HG23 VAL 15 1.872 -1.189 -3.175 123 H VAL 16 HN VAL 16 3.185 2.534 -5.057 124 HA VAL 16 HA VAL 16 5.997 3.385 -4.866 125 HB VAL 16 HB VAL 16 5.489 2.993 -7.221 126 1HG1 VAL 16 HG11 VAL 16 3.089 3.306 -7.190 127 2HG1 VAL 16 HG12 VAL 16 3.819 4.375 -8.386 128 3HG1 VAL 16 HG13 VAL 16 3.292 5.022 -6.836 129 1HG2 VAL 16 HG21 VAL 16 5.634 5.953 -6.676 130 2HG2 VAL 16 HG22 VAL 16 6.224 5.096 -8.101 131 3HG2 VAL 16 HG23 VAL 16 6.995 4.842 -6.537 132 H ALA 17 HN ALA 17 2.613 4.484 -5.082 133 HA ALA 17 HA ALA 17 3.364 7.057 -3.943 134 1HB ALA 17 HB1 ALA 17 1.347 6.197 -5.685 135 2HB ALA 17 HB2 ALA 17 1.615 7.825 -5.068 136 3HB ALA 17 HB3 ALA 17 0.527 6.729 -4.216 137 H LEU 18 HN LEU 18 3.309 7.475 -1.816 138 HA LEU 18 HA LEU 18 1.447 5.938 -0.129 139 1HB LEU 18 HB2 LEU 18 4.205 6.731 0.798 140 2HB LEU 18 HB1 LEU 18 3.069 5.672 1.602 141 HG LEU 18 HG LEU 18 4.876 4.362 0.732 142 1HD1 LEU 18 HD11 LEU 18 3.714 2.783 -0.675 143 2HD1 LEU 18 HD12 LEU 18 2.472 3.979 -1.028 144 3HD1 LEU 18 HD13 LEU 18 2.654 3.358 0.611 145 1HD2 LEU 18 HD21 LEU 18 5.844 4.589 -1.283 146 2HD2 LEU 18 HD22 LEU 18 5.152 6.208 -1.185 147 3HD2 LEU 18 HD23 LEU 18 4.323 4.947 -2.096 148 H ALA 19 HN ALA 19 1.295 7.123 2.148 149 HA ALA 19 HA ALA 19 1.929 9.872 2.226 150 1HB ALA 19 HB1 ALA 19 0.152 10.958 1.380 151 2HB ALA 19 HB2 ALA 19 -0.993 9.736 1.938 152 3HB ALA 19 HB3 ALA 19 -0.061 9.465 0.466 153 H SER 20 HN SER 20 2.266 10.144 4.314 154 HA SER 20 HA SER 20 1.469 10.575 6.478 155 1HB SER 20 HB2 SER 20 -0.528 8.351 6.059 156 2HB SER 20 HB1 SER 20 -0.385 9.350 7.493 157 HG SER 20 HG SER 20 -1.904 9.832 5.489 158 H ASN 21 HN ASN 21 1.865 9.516 8.480 159 HA ASN 21 HA ASN 21 2.914 6.859 8.545 160 1HB ASN 21 HB2 ASN 21 4.796 9.210 8.851 161 2HB ASN 21 HB1 ASN 21 5.209 7.540 9.211 162 1HD2 ASN 21 HD21 ASN 21 5.619 9.858 7.053 163 2HD2 ASN 21 HD22 ASN 21 5.803 8.935 5.605 164 H THR 22 HN THR 22 4.708 8.263 10.829 165 HA THR 22 HA THR 22 2.925 9.261 12.745 166 HB THR 22 HB THR 22 3.498 6.302 12.923 167 HG1 THR 22 HG1 THR 22 1.585 6.711 11.925 168 1HG2 THR 22 HG21 THR 22 3.971 7.265 15.121 169 2HG2 THR 22 HG22 THR 22 2.500 6.291 15.134 170 3HG2 THR 22 HG23 THR 22 2.391 8.050 15.109 171 H GLU 23 HN GLU 23 5.866 7.387 12.202 172 HA GLU 23 HA GLU 23 7.392 9.312 13.729 173 1HB GLU 23 HB2 GLU 23 6.687 7.735 15.469 174 2HB GLU 23 HB1 GLU 23 7.327 6.395 14.527 175 1HG GLU 23 HG2 GLU 23 8.834 6.993 16.326 176 2HG GLU 23 HG1 GLU 23 9.579 7.293 14.756 177 H PHE 24 HN PHE 24 9.240 9.674 12.706 178 HA PHE 24 HA PHE 24 9.947 8.325 10.347 179 1HB PHE 24 HB2 PHE 24 11.434 10.285 12.086 180 2HB PHE 24 HB1 PHE 24 12.139 9.622 10.617 181 HD1 PHE 24 HD1 PHE 24 8.657 10.775 11.329 182 HD2 PHE 24 HD2 PHE 24 12.237 11.346 9.099 183 HE1 PHE 24 HE1 PHE 24 7.545 12.515 10.001 184 HE2 PHE 24 HE2 PHE 24 11.129 13.091 7.766 185 HZ PHE 24 HZ PHE 24 8.780 13.678 8.216 186 H PHE 25 HN PHE 25 11.153 8.031 13.650 187 HA PHE 25 HA PHE 25 13.407 6.489 13.178 188 1HB PHE 25 HB2 PHE 25 12.868 7.456 15.363 189 2HB PHE 25 HB1 PHE 25 11.521 6.336 15.536 190 HD1 PHE 25 HD1 PHE 25 12.081 5.006 17.348 191 HD2 PHE 25 HD2 PHE 25 14.970 5.706 14.302 192 HE1 PHE 25 HE1 PHE 25 13.582 3.363 18.398 193 HE2 PHE 25 HE2 PHE 25 16.475 4.064 15.347 194 HZ PHE 25 HZ PHE 25 15.781 2.890 17.397 195 H LEU 26 HN LEU 26 10.082 5.344 13.799 196 HA LEU 26 HA LEU 26 10.906 2.610 13.275 197 1HB LEU 26 HB2 LEU 26 8.218 3.770 13.995 198 2HB LEU 26 HB1 LEU 26 8.545 2.058 13.805 199 HG LEU 26 HG LEU 26 10.182 2.207 15.675 200 1HD1 LEU 26 HD11 LEU 26 10.874 4.428 15.741 201 2HD1 LEU 26 HD12 LEU 26 9.837 4.271 17.159 202 3HD1 LEU 26 HD13 LEU 26 9.223 5.045 15.698 203 1HD2 LEU 26 HD21 LEU 26 8.577 1.846 17.245 204 2HD2 LEU 26 HD22 LEU 26 7.564 1.795 15.802 205 3HD2 LEU 26 HD23 LEU 26 7.639 3.264 16.776 206 H ARG 27 HN ARG 27 8.661 4.965 11.848 207 HA ARG 27 HA ARG 27 7.692 3.331 9.807 208 1HB ARG 27 HB2 ARG 27 8.002 6.332 9.823 209 2HB ARG 27 HB1 ARG 27 7.000 5.418 8.703 210 1HG ARG 27 HG2 ARG 27 6.646 5.498 11.692 211 2HG ARG 27 HG1 ARG 27 5.688 6.397 10.519 212 1HD ARG 27 HD2 ARG 27 4.851 4.350 9.562 213 2HD ARG 27 HD1 ARG 27 5.911 3.393 10.596 214 HE ARG 27 HE ARG 27 3.366 4.417 11.281 215 1HH1 ARG 27 HH11 ARG 27 6.535 3.810 12.616 216 2HH1 ARG 27 HH12 ARG 27 5.964 3.699 14.246 217 1HH2 ARG 27 HH21 ARG 27 2.615 4.271 13.429 218 2HH2 ARG 27 HH22 ARG 27 3.740 3.957 14.707 219 H GLU 28 HN GLU 28 10.610 5.329 9.892 220 HA GLU 28 HA GLU 28 11.269 5.446 7.232 221 1HB GLU 28 HB2 GLU 28 13.629 5.482 7.907 222 2HB GLU 28 HB1 GLU 28 12.643 6.493 8.952 223 1HG GLU 28 HG2 GLU 28 12.618 4.669 10.621 224 2HG GLU 28 HG1 GLU 28 13.698 3.746 9.579 225 H LYS 29 HN LYS 29 11.415 2.688 9.365 226 HA LYS 29 HA LYS 29 12.930 1.008 7.653 227 1HB LYS 29 HB2 LYS 29 11.007 0.270 9.866 228 2HB LYS 29 HB1 LYS 29 12.169 -0.818 9.121 229 1HG LYS 29 HG2 LYS 29 13.136 1.703 10.382 230 2HG LYS 29 HG1 LYS 29 12.691 0.336 11.402 231 1HD LYS 29 HD2 LYS 29 15.092 0.358 10.880 232 2HD LYS 29 HD1 LYS 29 14.291 -1.081 10.249 233 1HE LYS 29 HE2 LYS 29 14.263 -0.150 8.031 234 2HE LYS 29 HE1 LYS 29 14.898 1.385 8.623 235 1HZ LYS 29 HZ1 LYS 29 16.274 -1.169 8.212 236 2HZ LYS 29 HZ2 LYS 29 16.820 -0.163 9.456 237 3HZ LYS 29 HZ3 LYS 29 16.793 0.403 7.863 238 H ASP 30 HN ASP 30 9.486 1.663 7.979 239 HA ASP 30 HA ASP 30 8.548 -0.531 6.484 240 1HB ASP 30 HB2 ASP 30 7.084 0.866 7.893 241 2HB ASP 30 HB1 ASP 30 7.297 2.209 6.774 242 H LYS 31 HN LYS 31 8.782 2.870 5.401 243 HA LYS 31 HA LYS 31 8.865 1.938 2.629 244 1HB LYS 31 HB2 LYS 31 8.639 4.745 3.733 245 2HB LYS 31 HB1 LYS 31 8.500 4.293 2.040 246 1HG LYS 31 HG2 LYS 31 6.645 3.436 4.249 247 2HG LYS 31 HG1 LYS 31 6.317 4.681 3.042 248 1HD LYS 31 HD2 LYS 31 6.473 3.012 1.266 249 2HD LYS 31 HD1 LYS 31 6.834 1.764 2.460 250 1HE LYS 31 HE2 LYS 31 4.290 3.381 2.343 251 2HE LYS 31 HE1 LYS 31 4.477 1.738 1.735 252 1HZ LYS 31 HZ1 LYS 31 3.482 1.960 4.011 253 2HZ LYS 31 HZ2 LYS 31 4.997 2.471 4.559 254 3HZ LYS 31 HZ3 LYS 31 4.814 0.922 3.905 255 H MET 32 HN MET 32 11.137 1.412 4.186 256 HA MET 32 HA MET 32 13.178 3.319 3.964 257 1HB MET 32 HB2 MET 32 14.709 1.352 4.261 258 2HB MET 32 HB1 MET 32 13.458 1.514 5.484 259 1HG MET 32 HG2 MET 32 12.140 -0.212 4.374 260 2HG MET 32 HG1 MET 32 13.378 -0.368 3.136 261 1HE MET 32 HE1 MET 32 12.220 -2.721 4.589 262 2HE MET 32 HE2 MET 32 13.496 -3.648 5.377 263 3HE MET 32 HE3 MET 32 13.678 -3.151 3.694 264 H LYS 33 HN LYS 33 11.776 1.277 1.563 265 HA LYS 33 HA LYS 33 13.645 2.327 -0.413 266 1HB LYS 33 HB2 LYS 33 13.153 -0.646 -0.275 267 2HB LYS 33 HB1 LYS 33 14.331 0.211 -1.257 268 1HG LYS 33 HG2 LYS 33 15.620 0.776 0.698 269 2HG LYS 33 HG1 LYS 33 14.398 0.062 1.746 270 1HD LYS 33 HD2 LYS 33 14.851 -2.096 0.369 271 2HD LYS 33 HD1 LYS 33 16.357 -1.284 -0.065 272 1HE LYS 33 HE2 LYS 33 15.386 -2.013 2.688 273 2HE LYS 33 HE1 LYS 33 16.802 -2.637 1.843 274 1HZ LYS 33 HZ1 LYS 33 17.861 -1.087 3.043 275 2HZ LYS 33 HZ2 LYS 33 16.468 -0.170 3.319 276 3HZ LYS 33 HZ3 LYS 33 17.308 -0.011 1.860 277 H MET 34 HN MET 34 12.939 1.145 -2.679 278 HA MET 34 HA MET 34 10.324 2.083 -3.206 279 1HB MET 34 HB2 MET 34 12.037 0.164 -4.806 280 2HB MET 34 HB1 MET 34 10.580 0.950 -5.402 281 1HG MET 34 HG2 MET 34 11.632 3.129 -5.126 282 2HG MET 34 HG1 MET 34 13.088 2.353 -4.506 283 1HE MET 34 HE1 MET 34 13.089 4.396 -7.366 284 2HE MET 34 HE2 MET 34 14.560 3.504 -7.754 285 3HE MET 34 HE3 MET 34 14.188 3.905 -6.077 286 H ALA 35 HN ALA 35 8.377 0.750 -3.810 287 HA ALA 35 HA ALA 35 8.503 -1.844 -2.409 288 1HB ALA 35 HB1 ALA 35 6.315 0.210 -2.308 289 2HB ALA 35 HB2 ALA 35 7.382 -0.294 -0.997 290 3HB ALA 35 HB3 ALA 35 6.187 -1.418 -1.645 291 H MET 36 HN MET 36 7.882 -3.547 -3.437 292 HA MET 36 HA MET 36 6.236 -3.296 -5.872 293 1HB MET 36 HB2 MET 36 8.559 -4.153 -6.237 294 2HB MET 36 HB1 MET 36 8.204 -5.486 -5.149 295 1HG MET 36 HG2 MET 36 6.484 -6.290 -6.663 296 2HG MET 36 HG1 MET 36 6.784 -4.930 -7.744 297 1HE MET 36 HE1 MET 36 7.610 -8.386 -9.092 298 2HE MET 36 HE2 MET 36 7.988 -7.020 -10.142 299 3HE MET 36 HE3 MET 36 6.544 -6.981 -9.131 300 H ALA 37 HN ALA 37 4.851 -5.391 -6.215 301 HA ALA 37 HA ALA 37 4.231 -6.814 -3.778 302 1HB ALA 37 HB1 ALA 37 2.826 -5.234 -3.044 303 2HB ALA 37 HB2 ALA 37 1.717 -5.937 -4.220 304 3HB ALA 37 HB3 ALA 37 2.651 -4.502 -4.639 305 H ARG 38 HN ARG 38 2.660 -8.458 -3.984 306 HA ARG 38 HA ARG 38 1.734 -9.147 -6.660 307 1HB ARG 38 HB2 ARG 38 3.895 -10.246 -6.556 308 2HB ARG 38 HB1 ARG 38 3.511 -10.931 -4.984 309 1HG ARG 38 HG2 ARG 38 1.678 -12.216 -6.051 310 2HG ARG 38 HG1 ARG 38 2.219 -11.602 -7.613 311 1HD ARG 38 HD2 ARG 38 3.847 -13.260 -5.690 312 2HD ARG 38 HD1 ARG 38 3.118 -13.832 -7.189 313 HE ARG 38 HE ARG 38 5.597 -12.519 -6.930 314 1HH1 ARG 38 HH11 ARG 38 2.799 -12.668 -9.012 315 2HH1 ARG 38 HH12 ARG 38 3.650 -12.093 -10.405 316 1HH2 ARG 38 HH21 ARG 38 6.719 -11.772 -8.763 317 2HH2 ARG 38 HH22 ARG 38 5.876 -11.589 -10.266 318 H ILE 39 HN ILE 39 -0.392 -9.386 -6.333 319 HA ILE 39 HA ILE 39 -1.379 -10.314 -3.759 320 HB ILE 39 HB ILE 39 -2.484 -8.388 -4.718 321 1HG1 ILE 39 HG12 ILE 39 -4.279 -10.826 -4.803 322 2HG1 ILE 39 HG11 ILE 39 -3.817 -9.952 -3.346 323 1HG2 ILE 39 HG21 ILE 39 -3.893 -8.692 -6.779 324 2HG2 ILE 39 HG22 ILE 39 -3.032 -10.208 -7.044 325 3HG2 ILE 39 HG23 ILE 39 -2.149 -8.683 -7.044 326 1HD1 ILE 39 HD11 ILE 39 -5.069 -8.058 -3.974 327 2HD1 ILE 39 HD12 ILE 39 -6.101 -9.456 -4.272 328 3HD1 ILE 39 HD13 ILE 39 -5.288 -8.659 -5.617 329 H SER 40 HN SER 40 -2.626 -12.073 -3.386 330 HA SER 40 HA SER 40 -3.516 -13.879 -5.409 331 1HB SER 40 HB2 SER 40 -1.126 -14.478 -5.401 332 2HB SER 40 HB1 SER 40 -1.198 -14.752 -3.660 333 HG SER 40 HG SER 40 -1.649 -16.721 -4.273 334 H PHE 41 HN PHE 41 -5.227 -14.992 -4.627 335 HA PHE 41 HA PHE 41 -5.973 -14.568 -1.867 336 1HB PHE 41 HB2 PHE 41 -7.417 -15.939 -4.138 337 2HB PHE 41 HB1 PHE 41 -8.096 -15.685 -2.535 338 HD1 PHE 41 HD1 PHE 41 -9.695 -14.056 -2.540 339 HD2 PHE 41 HD2 PHE 41 -6.233 -13.514 -4.957 340 HE1 PHE 41 HE1 PHE 41 -10.526 -11.849 -3.239 341 HE2 PHE 41 HE2 PHE 41 -7.056 -11.310 -5.651 342 HZ PHE 41 HZ PHE 41 -9.206 -10.473 -4.796 343 H LEU 42 HN LEU 42 -5.629 -15.932 -0.230 344 HA LEU 42 HA LEU 42 -4.541 -18.559 -0.726 345 1HB LEU 42 HB2 LEU 42 -3.847 -17.034 1.178 346 2HB LEU 42 HB1 LEU 42 -5.385 -17.406 1.929 347 HG LEU 42 HG LEU 42 -4.762 -19.783 2.045 348 1HD1 LEU 42 HD11 LEU 42 -2.161 -20.089 1.703 349 2HD1 LEU 42 HD12 LEU 42 -2.401 -18.788 0.536 350 3HD1 LEU 42 HD13 LEU 42 -3.296 -20.298 0.368 351 1HD2 LEU 42 HD21 LEU 42 -3.066 -19.549 3.787 352 2HD2 LEU 42 HD22 LEU 42 -4.291 -18.287 3.922 353 3HD2 LEU 42 HD23 LEU 42 -2.713 -17.914 3.230 354 H GLY 43 HN GLY 43 -5.678 -20.299 -1.046 355 1HA GLY 43 HA2 GLY 43 -8.473 -20.436 -1.044 356 2HA GLY 43 HA1 GLY 43 -7.386 -21.807 -1.146 357 H GLU 44 HN GLU 44 -8.663 -19.523 1.243 358 HA GLU 44 HA GLU 44 -9.579 -21.662 2.923 359 1HB GLU 44 HB2 GLU 44 -7.356 -19.859 3.907 360 2HB GLU 44 HB1 GLU 44 -8.261 -20.989 4.905 361 1HG GLU 44 HG2 GLU 44 -7.399 -22.845 3.536 362 2HG GLU 44 HG1 GLU 44 -6.443 -21.688 2.610 363 H ASP 45 HN ASP 45 -8.575 -18.278 3.050 364 HA ASP 45 HA ASP 45 -10.939 -16.986 2.895 365 1HB ASP 45 HB2 ASP 45 -11.758 -18.297 4.829 366 2HB ASP 45 HB1 ASP 45 -10.428 -17.684 5.806 367 H GLU 46 HN GLU 46 -8.217 -16.566 2.324 368 HA GLU 46 HA GLU 46 -7.905 -13.923 3.445 369 1HB GLU 46 HB2 GLU 46 -5.828 -16.027 4.096 370 2HB GLU 46 HB1 GLU 46 -5.681 -14.311 4.436 371 1HG GLU 46 HG2 GLU 46 -7.573 -14.450 5.970 372 2HG GLU 46 HG1 GLU 46 -7.730 -16.168 5.617 373 H LEU 47 HN LEU 47 -7.033 -12.645 1.931 374 HA LEU 47 HA LEU 47 -5.454 -13.930 -0.191 375 1HB LEU 47 HB2 LEU 47 -6.104 -12.240 -1.714 376 2HB LEU 47 HB1 LEU 47 -7.563 -12.769 -0.907 377 HG LEU 47 HG LEU 47 -7.727 -10.430 -1.156 378 1HD1 LEU 47 HD11 LEU 47 -6.807 -10.694 1.683 379 2HD1 LEU 47 HD12 LEU 47 -8.300 -11.432 1.101 380 3HD1 LEU 47 HD13 LEU 47 -8.091 -9.683 1.022 381 1HD2 LEU 47 HD21 LEU 47 -6.003 -9.050 -1.267 382 2HD2 LEU 47 HD22 LEU 47 -4.944 -10.438 -1.020 383 3HD2 LEU 47 HD23 LEU 47 -5.476 -9.477 0.360 384 H LYS 48 HN LYS 48 -3.351 -13.494 -0.288 385 HA LYS 48 HA LYS 48 -2.367 -11.293 1.392 386 1HB LYS 48 HB2 LYS 48 -0.350 -12.548 1.736 387 2HB LYS 48 HB1 LYS 48 -1.723 -13.587 2.073 388 1HG LYS 48 HG2 LYS 48 -0.297 -14.972 0.903 389 2HG LYS 48 HG1 LYS 48 -1.419 -14.422 -0.340 390 1HD LYS 48 HD2 LYS 48 0.165 -12.925 -1.247 391 2HD LYS 48 HD1 LYS 48 1.204 -13.040 0.172 392 1HE LYS 48 HE2 LYS 48 2.126 -14.280 -1.718 393 2HE LYS 48 HE1 LYS 48 1.713 -15.357 -0.385 394 1HZ LYS 48 HZ1 LYS 48 0.576 -15.183 -3.045 395 2HZ LYS 48 HZ2 LYS 48 -0.543 -15.414 -1.799 396 3HZ LYS 48 HZ3 LYS 48 0.721 -16.515 -2.014 397 H VAL 49 HN VAL 49 -0.607 -10.059 0.760 398 HA VAL 49 HA VAL 49 -0.029 -10.084 -2.119 399 HB VAL 49 HB VAL 49 -1.477 -8.148 -1.464 400 1HG1 VAL 49 HG11 VAL 49 0.789 -6.741 -0.206 401 2HG1 VAL 49 HG12 VAL 49 -0.003 -7.973 0.777 402 3HG1 VAL 49 HG13 VAL 49 -0.938 -6.632 0.119 403 1HG2 VAL 49 HG21 VAL 49 -0.563 -7.193 -3.236 404 2HG2 VAL 49 HG22 VAL 49 0.890 -8.170 -3.024 405 3HG2 VAL 49 HG23 VAL 49 0.764 -6.592 -2.246 406 H SER 50 HN SER 50 2.032 -10.557 -2.463 407 HA SER 50 HA SER 50 3.950 -10.297 -0.293 408 1HB SER 50 HB2 SER 50 3.881 -12.386 -1.631 409 2HB SER 50 HB1 SER 50 4.308 -11.460 -3.070 410 HG SER 50 HG SER 50 5.881 -11.752 -0.724 411 H TYR 51 HN TYR 51 4.688 -8.247 -0.072 412 HA TYR 51 HA TYR 51 5.395 -6.826 -2.519 413 1HB TYR 51 HB2 TYR 51 5.734 -4.901 -0.709 414 2HB TYR 51 HB1 TYR 51 4.180 -5.255 -1.445 415 HD1 TYR 51 HD1 TYR 51 6.037 -6.885 1.384 416 HD2 TYR 51 HD2 TYR 51 2.540 -4.847 0.076 417 HE1 TYR 51 HE1 TYR 51 5.043 -7.163 3.615 418 HE2 TYR 51 HE2 TYR 51 1.538 -5.121 2.300 419 HH TYR 51 HH TYR 51 3.091 -5.688 4.946 420 H ALA 52 HN ALA 52 7.354 -6.672 -3.178 421 HA ALA 52 HA ALA 52 9.538 -7.201 -1.276 422 1HB ALA 52 HB1 ALA 52 9.510 -7.572 -4.272 423 2HB ALA 52 HB2 ALA 52 9.367 -8.854 -3.070 424 3HB ALA 52 HB3 ALA 52 10.863 -7.929 -3.199 425 H VAL 53 HN VAL 53 10.381 -5.338 -0.604 426 HA VAL 53 HA VAL 53 10.409 -3.021 -2.330 427 HB VAL 53 HB VAL 53 11.296 -1.807 -0.413 428 1HG1 VAL 53 HG11 VAL 53 9.044 -1.724 -0.190 429 2HG1 VAL 53 HG12 VAL 53 9.399 -2.652 1.267 430 3HG1 VAL 53 HG13 VAL 53 8.865 -3.478 -0.198 431 1HG2 VAL 53 HG21 VAL 53 11.369 -3.177 1.794 432 2HG2 VAL 53 HG22 VAL 53 12.758 -3.199 0.708 433 3HG2 VAL 53 HG23 VAL 53 11.627 -4.551 0.721 434 HA PRO 54 HA PRO 54 14.660 -4.034 -3.439 435 1HB PRO 54 HB2 PRO 54 14.560 -2.993 -5.911 436 2HB PRO 54 HB1 PRO 54 13.782 -4.528 -5.511 437 1HG PRO 54 HG2 PRO 54 12.571 -1.911 -6.087 438 2HG PRO 54 HG1 PRO 54 11.852 -3.525 -6.171 439 1HD PRO 54 HD2 PRO 54 11.643 -1.568 -4.052 440 2HD PRO 54 HD1 PRO 54 10.836 -3.141 -4.190 441 H LYS 55 HN LYS 55 16.562 -2.886 -3.792 442 HA LYS 55 HA LYS 55 16.928 -0.230 -4.399 443 1HB LYS 55 HB2 LYS 55 15.982 -0.595 -1.682 444 2HB LYS 55 HB1 LYS 55 17.560 0.175 -1.706 445 1HG LYS 55 HG2 LYS 55 15.127 1.131 -3.203 446 2HG LYS 55 HG1 LYS 55 15.734 1.802 -1.689 447 1HD LYS 55 HD2 LYS 55 17.835 2.399 -2.807 448 2HD LYS 55 HD1 LYS 55 17.213 1.738 -4.320 449 1HE LYS 55 HE2 LYS 55 15.397 3.379 -4.286 450 2HE LYS 55 HE1 LYS 55 16.020 4.038 -2.774 451 1HZ LYS 55 HZ1 LYS 55 16.925 5.453 -4.313 452 2HZ LYS 55 HZ2 LYS 55 17.126 4.253 -5.488 453 3HZ LYS 55 HZ3 LYS 55 18.177 4.324 -4.165 454 HA PRO 56 HA PRO 56 20.525 -3.266 -3.691 455 1HB PRO 56 HB2 PRO 56 21.350 -3.085 -6.325 456 2HB PRO 56 HB1 PRO 56 20.332 -4.373 -5.674 457 1HG PRO 56 HG2 PRO 56 19.545 -1.909 -7.175 458 2HG PRO 56 HG1 PRO 56 18.909 -3.560 -7.314 459 1HD PRO 56 HD2 PRO 56 17.566 -1.662 -5.989 460 2HD PRO 56 HD1 PRO 56 17.590 -3.344 -5.415 461 H ASN 57 HN ASN 57 20.369 -0.417 -5.833 462 HA ASN 57 HA ASN 57 23.080 0.337 -5.271 463 1HB ASN 57 HB2 ASN 57 21.976 0.858 -7.426 464 2HB ASN 57 HB1 ASN 57 20.862 1.926 -6.584 465 1HD2 ASN 57 HD21 ASN 57 23.944 2.069 -5.201 466 2HD2 ASN 57 HD22 ASN 57 24.499 3.491 -6.001 467 H GLY 58 HN GLY 58 22.004 0.050 -2.837 468 1HA GLY 58 HA2 GLY 58 22.442 2.517 -1.586 469 2HA GLY 58 HA1 GLY 58 20.707 2.277 -1.723 470 H CYS 59 HN CYS 59 20.524 -0.470 -1.321 471 HA CYS 59 HA CYS 59 21.893 -1.101 1.155 472 1HB CYS 59 HB2 CYS 59 18.885 -0.797 1.072 473 2HB CYS 59 HB1 CYS 59 19.802 -1.458 2.419 474 H ARG 60 HN ARG 60 18.857 -2.196 -0.377 475 HA ARG 60 HA ARG 60 19.800 -4.444 -1.676 476 1HB ARG 60 HB2 ARG 60 19.304 -6.268 -0.084 477 2HB ARG 60 HB1 ARG 60 20.609 -5.241 0.484 478 1HG ARG 60 HG2 ARG 60 19.070 -4.091 1.982 479 2HG ARG 60 HG1 ARG 60 17.747 -5.107 1.410 480 1HD ARG 60 HD2 ARG 60 18.624 -5.930 3.530 481 2HD ARG 60 HD1 ARG 60 18.908 -7.092 2.235 482 HE ARG 60 HE ARG 60 21.132 -6.892 2.655 483 1HH1 ARG 60 HH11 ARG 60 19.558 -4.005 3.827 484 2HH1 ARG 60 HH12 ARG 60 21.022 -3.297 4.419 485 1HH2 ARG 60 HH21 ARG 60 23.057 -5.964 3.439 486 2HH2 ARG 60 HH22 ARG 60 23.008 -4.409 4.201 487 H LYS 61 HN LYS 61 17.505 -6.104 -0.264 488 HA LYS 61 HA LYS 61 15.170 -4.614 -1.073 489 1HB LYS 61 HB2 LYS 61 14.399 -6.314 -2.673 490 2HB LYS 61 HB1 LYS 61 15.897 -5.563 -3.204 491 1HG LYS 61 HG2 LYS 61 17.153 -7.500 -2.400 492 2HG LYS 61 HG1 LYS 61 15.646 -8.254 -1.875 493 1HD LYS 61 HD2 LYS 61 14.842 -8.257 -4.185 494 2HD LYS 61 HD1 LYS 61 16.342 -7.492 -4.712 495 1HE LYS 61 HE2 LYS 61 17.605 -9.435 -3.924 496 2HE LYS 61 HE1 LYS 61 16.104 -10.200 -3.402 497 1HZ LYS 61 HZ1 LYS 61 16.982 -10.927 -5.618 498 2HZ LYS 61 HZ2 LYS 61 16.605 -9.387 -6.208 499 3HZ LYS 61 HZ3 LYS 61 15.376 -10.392 -5.624 500 H TRP 62 HN TRP 62 13.325 -5.307 -0.005 501 HA TRP 62 HA TRP 62 13.622 -7.766 1.602 502 1HB TRP 62 HB2 TRP 62 12.299 -5.197 2.491 503 2HB TRP 62 HB1 TRP 62 12.381 -6.686 3.424 504 HD1 TRP 62 HD1 TRP 62 15.148 -4.642 1.605 505 HE1 TRP 62 HE1 TRP 62 17.060 -4.255 3.282 506 HE3 TRP 62 HE3 TRP 62 13.117 -6.940 5.697 507 HZ2 TRP 62 HZ2 TRP 62 17.633 -4.846 5.981 508 HZ3 TRP 62 HZ3 TRP 62 14.414 -6.985 7.788 509 HH2 TRP 62 HH2 TRP 62 16.625 -5.959 7.925 510 H GLU 63 HN GLU 63 11.880 -9.101 1.799 511 HA GLU 63 HA GLU 63 9.389 -8.254 0.487 512 1HB GLU 63 HB2 GLU 63 9.129 -10.503 -0.463 513 2HB GLU 63 HB1 GLU 63 10.574 -9.705 -1.069 514 1HG GLU 63 HG2 GLU 63 11.932 -10.995 0.511 515 2HG GLU 63 HG1 GLU 63 10.474 -11.808 1.081 516 H THR 64 HN THR 64 7.510 -8.906 1.424 517 HA THR 64 HA THR 64 7.523 -10.851 3.571 518 HB THR 64 HB THR 64 6.807 -7.954 4.062 519 HG1 THR 64 HG1 THR 64 8.710 -7.871 4.901 520 1HG2 THR 64 HG21 THR 64 5.235 -9.527 5.180 521 2HG2 THR 64 HG22 THR 64 6.182 -8.529 6.283 522 3HG2 THR 64 HG23 THR 64 6.618 -10.218 6.027 523 H THR 65 HN THR 65 5.601 -11.863 3.786 524 HA THR 65 HA THR 65 3.501 -11.089 1.907 525 HB THR 65 HB THR 65 4.080 -13.640 3.409 526 HG1 THR 65 HG1 THR 65 3.967 -13.180 0.621 527 1HG2 THR 65 HG21 THR 65 1.953 -14.213 3.218 528 2HG2 THR 65 HG22 THR 65 2.229 -14.276 1.478 529 3HG2 THR 65 HG23 THR 65 1.578 -12.811 2.215 530 H PHE 66 HN PHE 66 1.699 -10.116 2.561 531 HA PHE 66 HA PHE 66 0.820 -10.520 5.351 532 1HB PHE 66 HB2 PHE 66 1.150 -7.999 3.815 533 2HB PHE 66 HB1 PHE 66 -0.285 -8.124 4.826 534 HD1 PHE 66 HD1 PHE 66 3.155 -9.423 5.447 535 HD2 PHE 66 HD2 PHE 66 0.107 -6.680 6.587 536 HE1 PHE 66 HE1 PHE 66 4.482 -8.770 7.413 537 HE2 PHE 66 HE2 PHE 66 1.431 -6.022 8.555 538 HZ PHE 66 HZ PHE 66 3.621 -7.068 8.969 539 H LYS 67 HN LYS 67 -1.276 -11.119 5.630 540 HA LYS 67 HA LYS 67 -3.051 -10.984 3.287 541 1HB LYS 67 HB2 LYS 67 -3.688 -13.217 3.452 542 2HB LYS 67 HB1 LYS 67 -1.959 -13.271 3.753 543 1HG LYS 67 HG2 LYS 67 -4.108 -13.352 5.855 544 2HG LYS 67 HG1 LYS 67 -3.181 -14.731 5.264 545 1HD LYS 67 HD2 LYS 67 -2.104 -12.330 6.738 546 2HD LYS 67 HD1 LYS 67 -2.271 -13.968 7.369 547 1HE LYS 67 HE2 LYS 67 -0.484 -13.107 5.097 548 2HE LYS 67 HE1 LYS 67 0.035 -13.524 6.730 549 1HZ LYS 67 HZ1 LYS 67 0.399 -15.469 5.593 550 2HZ LYS 67 HZ2 LYS 67 -0.951 -15.287 4.592 551 3HZ LYS 67 HZ3 LYS 67 -1.153 -15.748 6.207 552 H LYS 68 HN LYS 68 -5.241 -10.754 3.672 553 HA LYS 68 HA LYS 68 -6.232 -10.634 6.404 554 1HB LYS 68 HB2 LYS 68 -6.659 -8.235 4.646 555 2HB LYS 68 HB1 LYS 68 -6.903 -8.380 6.377 556 1HG LYS 68 HG2 LYS 68 -4.996 -7.112 6.269 557 2HG LYS 68 HG1 LYS 68 -4.334 -8.737 6.443 558 1HD LYS 68 HD2 LYS 68 -3.957 -8.864 4.042 559 2HD LYS 68 HD1 LYS 68 -4.695 -7.281 3.825 560 1HE LYS 68 HE2 LYS 68 -2.930 -6.276 5.188 561 2HE LYS 68 HE1 LYS 68 -2.195 -7.864 5.405 562 1HZ LYS 68 HZ1 LYS 68 -2.627 -6.662 2.733 563 2HZ LYS 68 HZ2 LYS 68 -1.642 -7.977 3.137 564 3HZ LYS 68 HZ3 LYS 68 -1.208 -6.416 3.622 565 H THR 69 HN THR 69 -8.664 -9.479 6.020 566 HA THR 69 HA THR 69 -9.887 -11.238 3.985 567 HB THR 69 HB THR 69 -11.957 -11.065 5.320 568 HG1 THR 69 HG1 THR 69 -11.870 -9.192 6.386 569 1HG2 THR 69 HG21 THR 69 -10.518 -11.833 7.594 570 2HG2 THR 69 HG22 THR 69 -9.559 -12.346 6.206 571 3HG2 THR 69 HG23 THR 69 -11.235 -12.874 6.364 572 H SER 70 HN SER 70 -11.027 -10.334 2.300 573 HA SER 70 HA SER 70 -11.700 -7.483 2.513 574 1HB SER 70 HB2 SER 70 -9.564 -7.668 1.302 575 2HB SER 70 HB1 SER 70 -10.327 -8.739 0.131 576 HG SER 70 HG SER 70 -10.297 -6.070 0.175 577 H ASP 71 HN ASP 71 -13.333 -6.697 1.173 578 HA ASP 71 HA ASP 71 -15.272 -8.743 0.350 579 1HB ASP 71 HB2 ASP 71 -16.055 -7.012 1.903 580 2HB ASP 71 HB1 ASP 71 -15.615 -5.764 0.743 581 H ASP 72 HN ASP 72 -16.543 -8.369 -1.649 582 HA ASP 72 HA ASP 72 -14.789 -7.842 -3.860 583 1HB ASP 72 HB2 ASP 72 -17.734 -8.532 -3.817 584 2HB ASP 72 HB1 ASP 72 -16.720 -8.500 -5.256 585 H GLY 73 HN GLY 73 -16.356 -6.716 -5.813 586 1HA GLY 73 HA2 GLY 73 -17.075 -4.693 -6.665 587 2HA GLY 73 HA1 GLY 73 -17.645 -4.294 -5.048 588 H GLU 74 HN GLU 74 -15.773 -3.910 -3.481 589 HA GLU 74 HA GLU 74 -13.621 -2.339 -4.724 590 1HB GLU 74 HB2 GLU 74 -13.816 -0.715 -2.892 591 2HB GLU 74 HB1 GLU 74 -15.333 -0.819 -3.777 592 1HG GLU 74 HG2 GLU 74 -16.263 -2.257 -2.052 593 2HG GLU 74 HG1 GLU 74 -14.741 -2.193 -1.167 594 H VAL 75 HN VAL 75 -11.561 -2.505 -3.486 595 HA VAL 75 HA VAL 75 -11.672 -4.897 -1.796 596 HB VAL 75 HB VAL 75 -9.322 -3.592 -3.131 597 1HG1 VAL 75 HG11 VAL 75 -9.430 -6.181 -1.581 598 2HG1 VAL 75 HG12 VAL 75 -8.706 -4.682 -0.999 599 3HG1 VAL 75 HG13 VAL 75 -8.018 -5.507 -2.396 600 1HG2 VAL 75 HG21 VAL 75 -10.331 -6.319 -3.749 601 2HG2 VAL 75 HG22 VAL 75 -9.434 -5.191 -4.761 602 3HG2 VAL 75 HG23 VAL 75 -11.145 -4.915 -4.438 603 H TYR 76 HN TYR 76 -11.795 -4.638 0.246 604 HA TYR 76 HA TYR 76 -10.039 -2.758 1.623 605 1HB TYR 76 HB2 TYR 76 -11.794 -1.949 3.070 606 2HB TYR 76 HB1 TYR 76 -12.298 -1.672 1.409 607 HD1 TYR 76 HD1 TYR 76 -14.446 -2.280 0.801 608 HD2 TYR 76 HD2 TYR 76 -12.640 -4.189 4.145 609 HE1 TYR 76 HE1 TYR 76 -16.564 -3.434 1.277 610 HE2 TYR 76 HE2 TYR 76 -14.747 -5.354 4.628 611 HH TYR 76 HH TYR 76 -17.388 -4.698 4.015 612 H TYR 77 HN TYR 77 -9.180 -3.684 3.483 613 HA TYR 77 HA TYR 77 -10.414 -6.175 4.374 614 1HB TYR 77 HB2 TYR 77 -8.343 -7.410 4.250 615 2HB TYR 77 HB1 TYR 77 -8.718 -6.734 2.671 616 HD1 TYR 77 HD1 TYR 77 -7.032 -5.659 1.499 617 HD2 TYR 77 HD2 TYR 77 -6.746 -5.920 5.737 618 HE1 TYR 77 HE1 TYR 77 -4.794 -4.641 1.406 619 HE2 TYR 77 HE2 TYR 77 -4.514 -4.899 5.655 620 HH TYR 77 HH TYR 77 -2.605 -4.796 3.696 621 H SER 78 HN SER 78 -10.111 -6.791 6.406 622 HA SER 78 HA SER 78 -8.816 -4.864 8.206 623 1HB SER 78 HB2 SER 78 -11.222 -5.136 8.586 624 2HB SER 78 HB1 SER 78 -11.014 -6.880 8.751 625 HG SER 78 HG SER 78 -9.706 -6.463 10.583 626 H GLU 79 HN GLU 79 -7.464 -5.636 9.881 627 HA GLU 79 HA GLU 79 -6.889 -8.429 10.169 628 1HB GLU 79 HB2 GLU 79 -4.545 -8.328 9.444 629 2HB GLU 79 HB1 GLU 79 -5.655 -8.019 8.116 630 1HG GLU 79 HG2 GLU 79 -5.194 -5.690 8.163 631 2HG GLU 79 HG1 GLU 79 -4.291 -5.838 9.669 632 H GLU 80 HN GLU 80 -5.146 -8.850 11.718 633 HA GLU 80 HA GLU 80 -4.242 -8.614 13.773 634 1HB GLU 80 HB2 GLU 80 -3.775 -5.836 12.696 635 2HB GLU 80 HB1 GLU 80 -3.082 -6.421 14.203 636 1HG GLU 80 HG2 GLU 80 -1.893 -8.163 13.012 637 2HG GLU 80 HG1 GLU 80 -2.638 -7.659 11.497 638 H ALA 81 HN ALA 81 -4.194 -6.652 15.682 639 HA ALA 81 HA ALA 81 -6.622 -6.919 16.959 640 1HB ALA 81 HB1 ALA 81 -5.866 -4.920 18.337 641 2HB ALA 81 HB2 ALA 81 -4.443 -4.886 17.299 642 3HB ALA 81 HB3 ALA 81 -4.784 -6.311 18.278 643 H LYS 82 HN LYS 82 -5.565 -3.649 16.011 644 HA LYS 82 HA LYS 82 -8.248 -3.246 14.879 645 1HB LYS 82 HB2 LYS 82 -8.130 -2.311 17.174 646 2HB LYS 82 HB1 LYS 82 -6.815 -1.268 16.657 647 1HG LYS 82 HG2 LYS 82 -8.274 -0.115 15.118 648 2HG LYS 82 HG1 LYS 82 -9.589 -1.233 15.481 649 1HD LYS 82 HD2 LYS 82 -8.286 0.618 17.473 650 2HD LYS 82 HD1 LYS 82 -9.818 0.927 16.658 651 1HE LYS 82 HE2 LYS 82 -10.736 -1.121 17.670 652 2HE LYS 82 HE1 LYS 82 -9.210 -1.370 18.516 653 1HZ LYS 82 HZ1 LYS 82 -11.197 0.781 18.921 654 2HZ LYS 82 HZ2 LYS 82 -9.608 0.927 19.481 655 3HZ LYS 82 HZ3 LYS 82 -10.594 -0.322 20.054 656 H LYS 83 HN LYS 83 -6.261 -3.863 13.221 657 HA LYS 83 HA LYS 83 -5.224 -1.329 12.171 658 1HB LYS 83 HB2 LYS 83 -4.489 -4.200 11.611 659 2HB LYS 83 HB1 LYS 83 -3.895 -2.860 10.641 660 1HG LYS 83 HG2 LYS 83 -2.240 -3.493 12.270 661 2HG LYS 83 HG1 LYS 83 -2.863 -1.890 12.646 662 1HD LYS 83 HD2 LYS 83 -4.237 -2.767 14.404 663 2HD LYS 83 HD1 LYS 83 -3.833 -4.423 13.954 664 1HE LYS 83 HE2 LYS 83 -1.451 -3.913 14.475 665 2HE LYS 83 HE1 LYS 83 -1.969 -2.336 15.071 666 1HZ LYS 83 HZ1 LYS 83 -3.309 -3.424 16.738 667 2HZ LYS 83 HZ2 LYS 83 -1.710 -3.963 16.855 668 3HZ LYS 83 HZ3 LYS 83 -2.883 -4.950 16.142 669 H LYS 84 HN LYS 84 -6.133 -0.409 10.463 670 HA LYS 84 HA LYS 84 -7.919 -2.050 8.797 671 1HB LYS 84 HB2 LYS 84 -8.242 0.853 9.568 672 2HB LYS 84 HB1 LYS 84 -9.285 -0.020 8.455 673 1HG LYS 84 HG2 LYS 84 -9.944 -1.534 10.260 674 2HG LYS 84 HG1 LYS 84 -8.905 -0.644 11.376 675 1HD LYS 84 HD2 LYS 84 -10.226 1.381 10.986 676 2HD LYS 84 HD1 LYS 84 -11.265 0.487 9.873 677 1HE LYS 84 HE2 LYS 84 -10.894 -0.098 12.809 678 2HE LYS 84 HE1 LYS 84 -12.290 0.698 12.084 679 1HZ LYS 84 HZ1 LYS 84 -13.045 -1.430 12.184 680 2HZ LYS 84 HZ2 LYS 84 -11.511 -2.121 12.009 681 3HZ LYS 84 HZ3 LYS 84 -12.312 -1.491 10.660 682 H VAL 85 HN VAL 85 -7.485 -2.117 6.725 683 HA VAL 85 HA VAL 85 -6.125 0.091 5.394 684 HB VAL 85 HB VAL 85 -5.103 -2.743 5.167 685 1HG1 VAL 85 HG11 VAL 85 -4.075 -2.052 3.334 686 2HG1 VAL 85 HG12 VAL 85 -3.249 -0.801 4.261 687 3HG1 VAL 85 HG13 VAL 85 -4.809 -0.459 3.513 688 1HG2 VAL 85 HG21 VAL 85 -3.014 -1.400 6.192 689 2HG2 VAL 85 HG22 VAL 85 -4.177 -2.287 7.176 690 3HG2 VAL 85 HG23 VAL 85 -4.340 -0.544 6.977 691 H GLU 86 HN GLU 86 -6.871 0.342 3.302 692 HA GLU 86 HA GLU 86 -8.332 -1.880 2.073 693 1HB GLU 86 HB2 GLU 86 -9.612 0.834 2.273 694 2HB GLU 86 HB1 GLU 86 -10.353 -0.692 1.813 695 1HG GLU 86 HG2 GLU 86 -10.169 -1.501 4.089 696 2HG GLU 86 HG1 GLU 86 -9.342 -0.019 4.567 697 H VAL 87 HN VAL 87 -8.174 -1.937 -0.108 698 HA VAL 87 HA VAL 87 -6.745 0.284 -1.370 699 HB VAL 87 HB VAL 87 -5.690 -1.884 -1.674 700 1HG1 VAL 87 HG11 VAL 87 -6.756 -3.762 -2.108 701 2HG1 VAL 87 HG12 VAL 87 -7.595 -3.053 -3.488 702 3HG1 VAL 87 HG13 VAL 87 -8.248 -2.866 -1.860 703 1HG2 VAL 87 HG21 VAL 87 -6.891 -1.135 -4.319 704 2HG2 VAL 87 HG22 VAL 87 -5.275 -1.756 -3.980 705 3HG2 VAL 87 HG23 VAL 87 -5.708 -0.115 -3.497 706 H LEU 88 HN LEU 88 -7.875 1.730 -2.307 707 HA LEU 88 HA LEU 88 -10.496 1.124 -3.459 708 1HB LEU 88 HB2 LEU 88 -9.353 3.884 -3.134 709 2HB LEU 88 HB1 LEU 88 -11.035 3.395 -3.194 710 HG LEU 88 HG LEU 88 -10.552 2.225 -0.936 711 1HD1 LEU 88 HD11 LEU 88 -8.053 3.678 -1.438 712 2HD1 LEU 88 HD12 LEU 88 -8.377 2.289 -0.403 713 3HD1 LEU 88 HD13 LEU 88 -8.746 3.915 0.166 714 1HD2 LEU 88 HD21 LEU 88 -11.900 4.332 -1.395 715 2HD2 LEU 88 HD22 LEU 88 -10.464 5.227 -0.897 716 3HD2 LEU 88 HD23 LEU 88 -11.259 4.133 0.235 717 H ASP 89 HN ASP 89 -10.164 3.718 -5.061 718 HA ASP 89 HA ASP 89 -9.647 4.274 -7.203 719 1HB ASP 89 HB2 ASP 89 -7.356 4.289 -6.090 720 2HB ASP 89 HB1 ASP 89 -7.102 2.695 -6.787 721 H THR 90 HN THR 90 -7.638 1.873 -8.351 722 HA THR 90 HA THR 90 -9.923 0.275 -9.290 723 HB THR 90 HB THR 90 -7.422 1.009 -10.826 724 HG1 THR 90 HG1 THR 90 -8.630 2.436 -11.842 725 1HG2 THR 90 HG21 THR 90 -9.270 0.050 -12.618 726 2HG2 THR 90 HG22 THR 90 -9.388 -1.072 -11.262 727 3HG2 THR 90 HG23 THR 90 -7.833 -0.796 -12.046 728 H ASP 91 HN ASP 91 -9.810 -1.562 -8.133 729 HA ASP 91 HA ASP 91 -7.233 -2.711 -7.466 730 1HB ASP 91 HB2 ASP 91 -8.552 -4.384 -6.209 731 2HB ASP 91 HB1 ASP 91 -8.924 -2.729 -5.735 732 H TYR 92 HN TYR 92 -8.563 -2.694 -10.273 733 HA TYR 92 HA TYR 92 -8.401 -5.578 -10.759 734 1HB TYR 92 HB2 TYR 92 -9.783 -3.357 -12.244 735 2HB TYR 92 HB1 TYR 92 -9.411 -4.880 -13.046 736 HD1 TYR 92 HD1 TYR 92 -10.530 -4.331 -9.529 737 HD2 TYR 92 HD2 TYR 92 -11.504 -5.853 -13.381 738 HE1 TYR 92 HE1 TYR 92 -12.576 -5.331 -8.610 739 HE2 TYR 92 HE2 TYR 92 -13.557 -6.853 -12.471 740 HH TYR 92 HH TYR 92 -14.101 -7.388 -9.330 741 H LYS 93 HN LYS 93 -7.985 -3.717 -13.596 742 HA LYS 93 HA LYS 93 -5.072 -4.146 -13.453 743 1HB LYS 93 HB2 LYS 93 -6.531 -5.618 -15.015 744 2HB LYS 93 HB1 LYS 93 -6.644 -4.180 -16.017 745 1HG LYS 93 HG2 LYS 93 -4.079 -5.544 -15.212 746 2HG LYS 93 HG1 LYS 93 -4.892 -5.721 -16.766 747 1HD LYS 93 HD2 LYS 93 -3.802 -3.139 -15.644 748 2HD LYS 93 HD1 LYS 93 -3.024 -4.135 -16.873 749 1HE LYS 93 HE2 LYS 93 -4.885 -3.779 -18.384 750 2HE LYS 93 HE1 LYS 93 -5.737 -2.851 -17.154 751 1HZ LYS 93 HZ1 LYS 93 -4.762 -1.247 -18.488 752 2HZ LYS 93 HZ2 LYS 93 -3.321 -2.112 -18.674 753 3HZ LYS 93 HZ3 LYS 93 -3.672 -1.364 -17.198 754 H SER 94 HN SER 94 -4.352 -2.107 -12.990 755 HA SER 94 HA SER 94 -3.924 -0.212 -14.895 756 1HB SER 94 HB2 SER 94 -6.553 0.242 -13.513 757 2HB SER 94 HB1 SER 94 -5.597 1.606 -14.089 758 HG SER 94 HG SER 94 -5.666 0.634 -16.179 759 H TYR 95 HN TYR 95 -5.396 0.626 -11.787 760 HA TYR 95 HA TYR 95 -2.924 0.757 -10.373 761 1HB TYR 95 HB2 TYR 95 -3.292 3.356 -10.009 762 2HB TYR 95 HB1 TYR 95 -2.317 2.748 -11.339 763 HD1 TYR 95 HD1 TYR 95 -2.553 4.128 -13.151 764 HD2 TYR 95 HD2 TYR 95 -6.030 3.164 -10.899 765 HE1 TYR 95 HE1 TYR 95 -3.934 5.381 -14.752 766 HE2 TYR 95 HE2 TYR 95 -7.420 4.410 -12.495 767 HH TYR 95 HH TYR 95 -6.351 5.358 -15.510 768 H ALA 96 HN ALA 96 -3.331 0.457 -8.287 769 HA ALA 96 HA ALA 96 -6.006 1.176 -7.275 770 1HB ALA 96 HB1 ALA 96 -4.435 -1.067 -6.078 771 2HB ALA 96 HB2 ALA 96 -5.350 -1.329 -7.562 772 3HB ALA 96 HB3 ALA 96 -6.179 -0.804 -6.101 773 H VAL 97 HN VAL 97 -6.149 2.136 -5.266 774 HA VAL 97 HA VAL 97 -3.578 2.835 -4.000 775 HB VAL 97 HB VAL 97 -4.440 4.965 -3.381 776 1HG1 VAL 97 HG11 VAL 97 -4.464 4.107 -6.141 777 2HG1 VAL 97 HG12 VAL 97 -3.833 5.592 -5.428 778 3HG1 VAL 97 HG13 VAL 97 -5.534 5.482 -5.884 779 1HG2 VAL 97 HG21 VAL 97 -6.841 5.544 -4.259 780 2HG2 VAL 97 HG22 VAL 97 -6.634 4.719 -2.715 781 3HG2 VAL 97 HG23 VAL 97 -7.078 3.800 -4.154 782 H ILE 98 HN ILE 98 -3.319 2.190 -1.948 783 HA ILE 98 HA ILE 98 -5.736 1.668 -0.363 784 HB ILE 98 HB ILE 98 -4.989 -0.488 -1.061 785 1HG1 ILE 98 HG12 ILE 98 -3.795 -0.362 1.671 786 2HG1 ILE 98 HG11 ILE 98 -5.493 0.040 1.473 787 1HG2 ILE 98 HG21 ILE 98 -2.429 -0.740 0.108 788 2HG2 ILE 98 HG22 ILE 98 -2.422 0.677 -0.942 789 3HG2 ILE 98 HG23 ILE 98 -2.889 -0.898 -1.586 790 1HD1 ILE 98 HD11 ILE 98 -5.520 -2.213 2.008 791 2HD1 ILE 98 HD12 ILE 98 -4.105 -2.568 1.016 792 3HD1 ILE 98 HD13 ILE 98 -5.655 -2.220 0.250 793 H TYR 99 HN TYR 99 -5.758 2.679 1.509 794 HA TYR 99 HA TYR 99 -3.220 3.718 2.537 795 1HB TYR 99 HB2 TYR 99 -4.563 5.285 3.862 796 2HB TYR 99 HB1 TYR 99 -4.957 5.404 2.152 797 HD1 TYR 99 HD1 TYR 99 -7.171 5.408 1.514 798 HD2 TYR 99 HD2 TYR 99 -6.122 3.692 5.262 799 HE1 TYR 99 HE1 TYR 99 -9.551 5.095 2.030 800 HE2 TYR 99 HE2 TYR 99 -8.503 3.369 5.787 801 HH TYR 99 HH TYR 99 -10.950 3.671 3.460 802 H ALA 100 HN ALA 100 -2.387 3.023 4.405 803 HA ALA 100 HA ALA 100 -3.894 0.950 5.832 804 1HB ALA 100 HB1 ALA 100 -0.933 1.497 5.916 805 2HB ALA 100 HB2 ALA 100 -1.709 0.311 4.871 806 3HB ALA 100 HB3 ALA 100 -1.775 0.118 6.622 807 H THR 101 HN THR 101 -4.601 1.270 7.810 808 HA THR 101 HA THR 101 -3.394 3.383 9.460 809 HB THR 101 HB THR 101 -5.652 3.946 10.308 810 HG1 THR 101 HG1 THR 101 -7.447 3.074 9.372 811 1HG2 THR 101 HG21 THR 101 -5.305 5.533 8.756 812 2HG2 THR 101 HG22 THR 101 -6.594 4.675 7.912 813 3HG2 THR 101 HG23 THR 101 -4.909 4.368 7.492 814 H ARG 102 HN ARG 102 -2.464 2.332 11.092 815 HA ARG 102 HA ARG 102 -3.699 -0.128 12.091 816 1HB ARG 102 HB2 ARG 102 -0.941 1.004 12.555 817 2HB ARG 102 HB1 ARG 102 -1.523 -0.528 13.188 818 1HG ARG 102 HG2 ARG 102 -1.810 -1.355 10.900 819 2HG ARG 102 HG1 ARG 102 -1.200 0.180 10.278 820 1HD ARG 102 HD2 ARG 102 0.551 -1.522 10.302 821 2HD ARG 102 HD1 ARG 102 0.928 -0.200 11.407 822 HE ARG 102 HE ARG 102 -0.398 -2.202 12.842 823 1HH1 ARG 102 HH11 ARG 102 2.637 -1.686 11.202 824 2HH1 ARG 102 HH12 ARG 102 3.515 -2.781 12.216 825 1HH2 ARG 102 HH21 ARG 102 0.753 -3.642 14.179 826 2HH2 ARG 102 HH22 ARG 102 2.445 -3.893 13.907 827 H VAL 103 HN VAL 103 -4.129 -0.495 14.247 828 HA VAL 103 HA VAL 103 -3.798 1.715 16.115 829 HB VAL 103 HB VAL 103 -6.475 0.374 15.757 830 1HG1 VAL 103 HG11 VAL 103 -7.218 2.249 17.246 831 2HG1 VAL 103 HG12 VAL 103 -5.516 2.613 17.522 832 3HG1 VAL 103 HG13 VAL 103 -6.175 1.053 18.016 833 1HG2 VAL 103 HG21 VAL 103 -6.240 1.733 13.850 834 2HG2 VAL 103 HG22 VAL 103 -5.449 3.018 14.764 835 3HG2 VAL 103 HG23 VAL 103 -7.169 2.702 14.995 836 H LYS 104 HN LYS 104 -3.129 1.033 18.009 837 HA LYS 104 HA LYS 104 -3.871 -1.515 19.148 838 1HB LYS 104 HB2 LYS 104 -2.069 -2.194 17.635 839 2HB LYS 104 HB1 LYS 104 -1.016 -0.964 18.317 840 1HG LYS 104 HG2 LYS 104 -1.118 -2.110 20.488 841 2HG LYS 104 HG1 LYS 104 -2.100 -3.377 19.749 842 1HD LYS 104 HD2 LYS 104 -0.276 -3.885 18.198 843 2HD LYS 104 HD1 LYS 104 0.701 -2.610 18.926 844 1HE LYS 104 HE2 LYS 104 0.636 -3.791 21.068 845 2HE LYS 104 HE1 LYS 104 -0.334 -5.067 20.333 846 1HZ LYS 104 HZ1 LYS 104 1.545 -5.421 18.762 847 2HZ LYS 104 HZ2 LYS 104 1.911 -5.790 20.371 848 3HZ LYS 104 HZ3 LYS 104 2.470 -4.348 19.688 849 H ASP 105 HN ASP 105 -3.811 -1.399 21.349 850 HA ASP 105 HA ASP 105 -3.614 -0.491 23.431 851 1HB ASP 105 HB2 ASP 105 -0.922 0.383 22.348 852 2HB ASP 105 HB1 ASP 105 -1.374 0.376 24.049 853 H GLY 106 HN GLY 106 -5.077 1.053 21.623 854 1HA GLY 106 HA2 GLY 106 -5.960 3.167 21.387 855 2HA GLY 106 HA1 GLY 106 -5.181 3.548 22.916 856 H ARG 107 HN ARG 107 -3.558 2.534 19.969 857 HA ARG 107 HA ARG 107 -2.303 5.203 19.800 858 1HB ARG 107 HB2 ARG 107 -0.744 3.338 20.440 859 2HB ARG 107 HB1 ARG 107 -1.118 2.559 18.908 860 1HG ARG 107 HG2 ARG 107 0.835 3.648 18.378 861 2HG ARG 107 HG1 ARG 107 -0.365 4.855 17.897 862 1HD ARG 107 HD2 ARG 107 -0.119 5.918 20.109 863 2HD ARG 107 HD1 ARG 107 1.158 4.761 20.498 864 HE ARG 107 HE ARG 107 2.593 6.027 19.260 865 1HH1 ARG 107 HH11 ARG 107 -0.668 6.852 18.334 866 2HH1 ARG 107 HH12 ARG 107 -0.180 8.110 17.249 867 1HH2 ARG 107 HH21 ARG 107 3.250 7.654 17.847 868 2HH2 ARG 107 HH22 ARG 107 2.067 8.572 16.977 869 H THR 108 HN THR 108 -2.337 6.207 17.815 870 HA THR 108 HA THR 108 -3.585 4.700 15.615 871 HB THR 108 HB THR 108 -5.134 6.342 16.587 872 HG1 THR 108 HG1 THR 108 -4.147 6.957 14.003 873 1HG2 THR 108 HG21 THR 108 -3.947 8.731 15.538 874 2HG2 THR 108 HG22 THR 108 -2.912 8.017 16.775 875 3HG2 THR 108 HG23 THR 108 -4.592 8.407 17.148 876 H LEU 109 HN LEU 109 -2.648 4.764 13.696 877 HA LEU 109 HA LEU 109 -0.620 6.777 13.113 878 1HB LEU 109 HB2 LEU 109 0.869 4.992 12.188 879 2HB LEU 109 HB1 LEU 109 0.734 5.011 13.933 880 HG LEU 109 HG LEU 109 -0.973 3.148 12.316 881 1HD1 LEU 109 HD11 LEU 109 1.485 1.994 13.390 882 2HD1 LEU 109 HD12 LEU 109 1.764 3.136 12.076 883 3HD1 LEU 109 HD13 LEU 109 0.707 1.749 11.827 884 1HD2 LEU 109 HD21 LEU 109 0.221 2.982 15.083 885 2HD2 LEU 109 HD22 LEU 109 -0.897 1.830 14.355 886 3HD2 LEU 109 HD23 LEU 109 -1.432 3.469 14.717 887 H HIS 110 HN HIS 110 -0.806 7.542 11.111 888 HA HIS 110 HA HIS 110 -2.544 6.067 9.250 889 1HB HIS 110 HB2 HIS 110 -1.954 9.023 9.387 890 2HB HIS 110 HB1 HIS 110 -2.996 8.246 8.199 891 HD1 HIS 110 HD1 HIS 110 -2.810 8.327 12.009 892 HD2 HIS 110 HD2 HIS 110 -5.582 8.443 8.916 893 HE1 HIS 110 HE1 HIS 110 -5.053 8.547 13.124 894 HE2 HIS 110 HE2 HIS 110 -6.715 8.634 11.233 895 H MET 111 HN MET 111 -1.906 5.601 7.247 896 HA MET 111 HA MET 111 0.340 6.824 5.981 897 1HB MET 111 HB2 MET 111 1.761 4.860 5.838 898 2HB MET 111 HB1 MET 111 1.500 5.299 7.522 899 1HG MET 111 HG2 MET 111 -0.139 3.532 7.758 900 2HG MET 111 HG1 MET 111 0.047 3.111 6.056 901 1HE MET 111 HE1 MET 111 3.436 2.690 9.152 902 2HE MET 111 HE2 MET 111 1.929 3.565 9.423 903 3HE MET 111 HE3 MET 111 3.128 4.200 8.295 904 H MET 112 HN MET 112 -0.088 6.854 3.907 905 HA MET 112 HA MET 112 -2.153 5.127 2.819 906 1HB MET 112 HB2 MET 112 -0.886 7.690 1.984 907 2HB MET 112 HB1 MET 112 -1.658 6.695 0.762 908 1HG MET 112 HG2 MET 112 -3.128 8.448 1.661 909 2HG MET 112 HG1 MET 112 -3.759 6.824 1.896 910 1HE MET 112 HE1 MET 112 -4.667 9.680 3.986 911 2HE MET 112 HE2 MET 112 -5.276 8.325 4.937 912 3HE MET 112 HE3 MET 112 -5.363 8.277 3.176 913 H ARG 113 HN ARG 113 -1.905 4.011 0.816 914 HA ARG 113 HA ARG 113 0.820 3.547 -0.106 915 1HB ARG 113 HB2 ARG 113 0.139 1.842 1.694 916 2HB ARG 113 HB1 ARG 113 -0.982 1.207 0.499 917 1HG ARG 113 HG2 ARG 113 0.822 0.652 -0.982 918 2HG ARG 113 HG1 ARG 113 1.988 1.431 0.088 919 1HD ARG 113 HD2 ARG 113 0.290 -0.956 0.814 920 2HD ARG 113 HD1 ARG 113 1.979 -1.027 0.315 921 HE ARG 113 HE ARG 113 1.750 0.721 2.497 922 1HH1 ARG 113 HH11 ARG 113 1.476 -2.678 1.760 923 2HH1 ARG 113 HH12 ARG 113 1.936 -3.189 3.350 924 1HH2 ARG 113 HH21 ARG 113 2.353 0.047 4.596 925 2HH2 ARG 113 HH22 ARG 113 2.433 -1.645 4.958 926 H LEU 114 HN LEU 114 0.939 2.963 -2.286 927 HA LEU 114 HA LEU 114 -1.625 2.791 -3.726 928 1HB LEU 114 HB2 LEU 114 -0.896 5.063 -3.920 929 2HB LEU 114 HB1 LEU 114 0.734 4.564 -4.313 930 HG LEU 114 HG LEU 114 -0.592 5.477 -6.231 931 1HD1 LEU 114 HD11 LEU 114 0.013 2.690 -6.992 932 2HD1 LEU 114 HD12 LEU 114 1.315 3.608 -6.238 933 3HD1 LEU 114 HD13 LEU 114 0.550 4.209 -7.708 934 1HD2 LEU 114 HD21 LEU 114 -1.981 3.035 -6.832 935 2HD2 LEU 114 HD22 LEU 114 -2.588 4.689 -6.766 936 3HD2 LEU 114 HD23 LEU 114 -2.537 3.709 -5.302 937 H TYR 115 HN TYR 115 -1.708 0.966 -4.847 938 HA TYR 115 HA TYR 115 0.800 -0.234 -5.796 939 1HB TYR 115 HB2 TYR 115 -1.935 -1.465 -5.411 940 2HB TYR 115 HB1 TYR 115 -0.537 -2.310 -6.053 941 HD1 TYR 115 HD1 TYR 115 0.443 -3.762 -4.545 942 HD2 TYR 115 HD2 TYR 115 -1.241 -0.144 -3.083 943 HE1 TYR 115 HE1 TYR 115 1.088 -4.399 -2.269 944 HE2 TYR 115 HE2 TYR 115 -0.592 -0.768 -0.801 945 HH TYR 115 HH TYR 115 0.479 -3.911 0.018 946 H SER 116 HN SER 116 1.281 0.153 -7.852 947 HA SER 116 HA SER 116 -0.877 0.659 -9.771 948 1HB SER 116 HB2 SER 116 0.905 2.352 -9.667 949 2HB SER 116 HB1 SER 116 2.110 1.114 -10.021 950 HG SER 116 HG SER 116 -0.030 1.889 -11.719 951 H ARG 117 HN ARG 117 -1.385 -0.797 -11.302 952 HA ARG 117 HA ARG 117 -0.036 -3.341 -11.285 953 1HB ARG 117 HB2 ARG 117 -2.372 -2.328 -12.909 954 2HB ARG 117 HB1 ARG 117 -1.747 -3.969 -13.002 955 1HG ARG 117 HG2 ARG 117 -3.556 -4.144 -11.561 956 2HG ARG 117 HG1 ARG 117 -2.167 -4.067 -10.477 957 1HD ARG 117 HD2 ARG 117 -2.581 -1.662 -10.156 958 2HD ARG 117 HD1 ARG 117 -3.994 -1.777 -11.199 959 HE ARG 117 HE ARG 117 -5.156 -2.736 -9.472 960 1HH1 ARG 117 HH11 ARG 117 -1.760 -2.637 -8.669 961 2HH1 ARG 117 HH12 ARG 117 -2.004 -3.181 -7.044 962 1HH2 ARG 117 HH21 ARG 117 -5.470 -3.480 -7.346 963 2HH2 ARG 117 HH22 ARG 117 -4.109 -3.665 -6.297 964 H SER 118 HN SER 118 -0.479 -0.694 -13.591 965 HA SER 118 HA SER 118 1.806 -1.757 -15.104 966 1HB SER 118 HB2 SER 118 -0.720 -0.580 -16.288 967 2HB SER 118 HB1 SER 118 0.714 -1.048 -17.202 968 HG SER 118 HG SER 118 0.301 -3.143 -16.813 969 HA PRO 119 HA PRO 119 3.884 2.104 -14.996 970 1HB PRO 119 HB2 PRO 119 3.667 2.124 -17.978 971 2HB PRO 119 HB1 PRO 119 5.081 2.389 -16.952 972 1HG PRO 119 HG2 PRO 119 4.724 0.064 -18.198 973 2HG PRO 119 HG1 PRO 119 5.382 0.126 -16.552 974 1HD PRO 119 HD2 PRO 119 2.679 -0.691 -17.483 975 2HD PRO 119 HD1 PRO 119 3.611 -1.256 -16.084 976 H GLU 120 HN GLU 120 0.942 1.817 -16.839 977 HA GLU 120 HA GLU 120 0.513 4.518 -17.479 978 1HB GLU 120 HB2 GLU 120 -1.384 2.213 -17.086 979 2HB GLU 120 HB1 GLU 120 -1.922 3.803 -17.605 980 1HG GLU 120 HG2 GLU 120 -1.670 2.339 -19.501 981 2HG GLU 120 HG1 GLU 120 -0.482 3.638 -19.577 982 H VAL 121 HN VAL 121 1.399 5.062 -15.096 983 HA VAL 121 HA VAL 121 -0.633 5.086 -13.055 984 HB VAL 121 HB VAL 121 2.035 6.510 -13.129 985 1HG1 VAL 121 HG11 VAL 121 -0.161 6.487 -11.193 986 2HG1 VAL 121 HG12 VAL 121 1.192 7.606 -11.360 987 3HG1 VAL 121 HG13 VAL 121 1.410 6.083 -10.499 988 1HG2 VAL 121 HG21 VAL 121 2.805 4.400 -13.012 989 2HG2 VAL 121 HG22 VAL 121 1.235 3.747 -12.544 990 3HG2 VAL 121 HG23 VAL 121 2.278 4.485 -11.330 991 H SER 122 HN SER 122 -2.095 6.186 -14.730 992 HA SER 122 HA SER 122 -1.858 8.799 -15.565 993 1HB SER 122 HB2 SER 122 -3.634 7.361 -16.360 994 2HB SER 122 HB1 SER 122 -4.345 7.288 -14.748 995 HG SER 122 HG SER 122 -4.910 9.005 -16.618 996 HA PRO 123 HA PRO 123 -2.104 11.673 -12.232 997 1HB PRO 123 HB2 PRO 123 -4.199 13.256 -13.247 998 2HB PRO 123 HB1 PRO 123 -2.475 13.499 -13.543 999 1HG PRO 123 HG2 PRO 123 -4.516 12.135 -15.236 1000 2HG PRO 123 HG1 PRO 123 -3.141 13.145 -15.725 1001 1HD PRO 123 HD2 PRO 123 -3.027 10.502 -15.980 1002 2HD PRO 123 HD1 PRO 123 -1.608 11.414 -15.421 1003 H ALA 124 HN ALA 124 -5.044 10.211 -13.495 1004 HA ALA 124 HA ALA 124 -6.815 10.915 -11.443 1005 1HB ALA 124 HB1 ALA 124 -6.773 9.004 -13.644 1006 2HB ALA 124 HB2 ALA 124 -8.107 9.959 -12.997 1007 3HB ALA 124 HB3 ALA 124 -7.673 8.424 -12.244 1008 H ALA 125 HN ALA 125 -4.810 8.017 -11.856 1009 HA ALA 125 HA ALA 125 -5.556 6.651 -9.570 1010 1HB ALA 125 HB1 ALA 125 -2.694 6.497 -10.152 1011 2HB ALA 125 HB2 ALA 125 -3.735 6.244 -11.554 1012 3HB ALA 125 HB3 ALA 125 -3.921 5.232 -10.121 1013 H THR 126 HN THR 126 -2.873 8.957 -9.969 1014 HA THR 126 HA THR 126 -2.203 8.916 -7.183 1015 HB THR 126 HB THR 126 -0.514 9.425 -8.857 1016 HG1 THR 126 HG1 THR 126 0.298 10.480 -7.256 1017 1HG2 THR 126 HG21 THR 126 -0.451 11.362 -10.182 1018 2HG2 THR 126 HG22 THR 126 -1.812 12.091 -9.329 1019 3HG2 THR 126 HG23 THR 126 -2.079 10.713 -10.396 1020 H ALA 127 HN ALA 127 -3.855 11.270 -9.262 1021 HA ALA 127 HA ALA 127 -4.309 13.157 -7.203 1022 1HB ALA 127 HB1 ALA 127 -4.330 13.500 -9.744 1023 2HB ALA 127 HB2 ALA 127 -5.485 14.404 -8.763 1024 3HB ALA 127 HB3 ALA 127 -6.008 12.973 -9.657 1025 H ILE 128 HN ILE 128 -6.500 10.772 -8.722 1026 HA ILE 128 HA ILE 128 -8.754 11.398 -7.218 1027 HB ILE 128 HB ILE 128 -7.973 8.692 -8.315 1028 1HG1 ILE 128 HG12 ILE 128 -9.835 10.812 -9.415 1029 2HG1 ILE 128 HG11 ILE 128 -8.202 10.514 -9.992 1030 1HG2 ILE 128 HG21 ILE 128 -9.722 7.864 -7.223 1031 2HG2 ILE 128 HG22 ILE 128 -10.766 8.924 -8.171 1032 3HG2 ILE 128 HG23 ILE 128 -10.150 9.458 -6.607 1033 1HD1 ILE 128 HD11 ILE 128 -9.619 9.439 -11.510 1034 2HD1 ILE 128 HD12 ILE 128 -10.608 8.743 -10.224 1035 3HD1 ILE 128 HD13 ILE 128 -8.967 8.155 -10.494 1036 H PHE 129 HN PHE 129 -6.098 9.141 -6.482 1037 HA PHE 129 HA PHE 129 -7.150 8.039 -4.146 1038 1HB PHE 129 HB2 PHE 129 -5.058 7.244 -5.173 1039 2HB PHE 129 HB1 PHE 129 -4.261 8.742 -4.722 1040 HD1 PHE 129 HD1 PHE 129 -2.528 7.602 -3.476 1041 HD2 PHE 129 HD2 PHE 129 -6.633 7.106 -2.466 1042 HE1 PHE 129 HE1 PHE 129 -1.874 6.612 -1.319 1043 HE2 PHE 129 HE2 PHE 129 -5.986 6.116 -0.310 1044 HZ PHE 129 HZ PHE 129 -3.605 5.866 0.264 1045 H ARG 130 HN ARG 130 -5.282 10.987 -4.649 1046 HA ARG 130 HA ARG 130 -5.351 11.828 -1.924 1047 1HB ARG 130 HB2 ARG 130 -3.618 12.651 -3.434 1048 2HB ARG 130 HB1 ARG 130 -4.833 13.361 -4.488 1049 1HG ARG 130 HG2 ARG 130 -3.765 15.062 -3.140 1050 2HG ARG 130 HG1 ARG 130 -5.467 14.912 -2.706 1051 1HD ARG 130 HD2 ARG 130 -4.048 15.138 -0.730 1052 2HD ARG 130 HD1 ARG 130 -4.880 13.584 -0.763 1053 HE ARG 130 HE ARG 130 -2.838 12.591 -0.735 1054 1HH1 ARG 130 HH11 ARG 130 -2.432 15.797 -2.047 1055 2HH1 ARG 130 HH12 ARG 130 -0.722 15.631 -2.253 1056 1HH2 ARG 130 HH21 ARG 130 -0.588 12.376 -0.988 1057 2HH2 ARG 130 HH22 ARG 130 0.327 13.689 -1.649 1058 H LYS 131 HN LYS 131 -7.305 12.300 -4.782 1059 HA LYS 131 HA LYS 131 -8.966 14.379 -3.907 1060 1HB LYS 131 HB2 LYS 131 -8.761 13.392 -6.254 1061 2HB LYS 131 HB1 LYS 131 -9.822 12.107 -5.697 1062 1HG LYS 131 HG2 LYS 131 -11.601 13.665 -5.299 1063 2HG LYS 131 HG1 LYS 131 -10.540 15.029 -5.656 1064 1HD LYS 131 HD2 LYS 131 -11.970 14.552 -7.562 1065 2HD LYS 131 HD1 LYS 131 -10.285 14.213 -7.960 1066 1HE LYS 131 HE2 LYS 131 -11.725 12.462 -8.819 1067 2HE LYS 131 HE1 LYS 131 -10.678 11.828 -7.550 1068 1HZ LYS 131 HZ1 LYS 131 -12.413 11.439 -6.190 1069 2HZ LYS 131 HZ2 LYS 131 -13.291 11.393 -7.634 1070 3HZ LYS 131 HZ3 LYS 131 -13.282 12.800 -6.696 1071 H LEU 132 HN LEU 132 -9.270 10.858 -3.657 1072 HA LEU 132 HA LEU 132 -11.756 10.785 -2.344 1073 1HB LEU 132 HB2 LEU 132 -9.418 8.879 -2.177 1074 2HB LEU 132 HB1 LEU 132 -11.015 8.542 -1.540 1075 HG LEU 132 HG LEU 132 -10.359 8.995 -4.455 1076 1HD1 LEU 132 HD11 LEU 132 -11.393 6.407 -3.510 1077 2HD1 LEU 132 HD12 LEU 132 -9.741 6.793 -3.027 1078 3HD1 LEU 132 HD13 LEU 132 -10.176 6.769 -4.735 1079 1HD2 LEU 132 HD21 LEU 132 -12.933 8.184 -3.107 1080 2HD2 LEU 132 HD22 LEU 132 -12.657 8.234 -4.848 1081 3HD2 LEU 132 HD23 LEU 132 -12.615 9.725 -3.906 1082 H ALA 133 HN ALA 133 -8.445 11.053 -1.194 1083 HA ALA 133 HA ALA 133 -9.006 10.937 1.574 1084 1HB ALA 133 HB1 ALA 133 -6.772 10.570 1.068 1085 2HB ALA 133 HB2 ALA 133 -6.750 12.220 1.687 1086 3HB ALA 133 HB3 ALA 133 -6.695 11.927 -0.052 1087 H GLY 134 HN GLY 134 -8.943 13.542 -0.791 1088 1HA GLY 134 HA2 GLY 134 -9.098 15.686 1.048 1089 2HA GLY 134 HA1 GLY 134 -9.547 15.757 -0.648 1090 H GLU 135 HN GLU 135 -11.631 14.016 -0.812 1091 HA GLU 135 HA GLU 135 -13.810 15.494 0.054 1092 1HB GLU 135 HB2 GLU 135 -13.719 12.532 -0.554 1093 2HB GLU 135 HB1 GLU 135 -15.179 13.512 -0.481 1094 1HG GLU 135 HG2 GLU 135 -12.920 13.844 -2.442 1095 2HG GLU 135 HG1 GLU 135 -14.487 13.109 -2.773 1096 H ARG 136 HN ARG 136 -12.228 12.722 1.568 1097 HA ARG 136 HA ARG 136 -14.068 12.588 3.754 1098 1HB ARG 136 HB2 ARG 136 -12.445 11.007 4.739 1099 2HB ARG 136 HB1 ARG 136 -12.868 10.592 3.085 1100 1HG ARG 136 HG2 ARG 136 -10.776 11.566 2.295 1101 2HG ARG 136 HG1 ARG 136 -10.350 12.001 3.950 1102 1HD ARG 136 HD2 ARG 136 -10.776 9.209 2.893 1103 2HD ARG 136 HD1 ARG 136 -9.222 9.952 3.265 1104 HE ARG 136 HE ARG 136 -10.810 10.057 5.560 1105 1HH1 ARG 136 HH11 ARG 136 -9.235 7.686 3.542 1106 2HH1 ARG 136 HH12 ARG 136 -9.014 6.551 4.831 1107 1HH2 ARG 136 HH21 ARG 136 -10.519 8.567 7.259 1108 2HH2 ARG 136 HH22 ARG 136 -9.743 7.051 6.942 1109 H ASN 137 HN ASN 137 -10.912 14.072 3.206 1110 HA ASN 137 HA ASN 137 -11.314 16.067 5.133 1111 1HB ASN 137 HB2 ASN 137 -11.053 14.333 6.794 1112 2HB ASN 137 HB1 ASN 137 -9.569 13.767 6.039 1113 1HD2 ASN 137 HD21 ASN 137 -7.824 14.330 7.084 1114 2HD2 ASN 137 HD22 ASN 137 -7.594 15.774 8.005 1115 H TYR 138 HN TYR 138 -8.125 14.715 5.170 1116 HA TYR 138 HA TYR 138 -6.998 15.646 2.833 1117 1HB TYR 138 HB2 TYR 138 -7.852 17.829 4.356 1118 2HB TYR 138 HB1 TYR 138 -6.127 17.718 4.692 1119 HD1 TYR 138 HD1 TYR 138 -8.188 17.194 1.618 1120 HD2 TYR 138 HD2 TYR 138 -4.956 19.272 3.441 1121 HE1 TYR 138 HE1 TYR 138 -7.717 18.315 -0.518 1122 HE2 TYR 138 HE2 TYR 138 -4.475 20.402 1.308 1123 HH TYR 138 HH TYR 138 -4.879 19.922 -1.164 1124 H THR 139 HN THR 139 -4.964 14.816 2.770 1125 HA THR 139 HA THR 139 -3.942 13.522 5.124 1126 HB THR 139 HB THR 139 -2.193 12.657 3.662 1127 HG1 THR 139 HG1 THR 139 -1.675 13.613 1.866 1128 1HG2 THR 139 HG21 THR 139 -3.460 11.430 2.090 1129 2HG2 THR 139 HG22 THR 139 -4.747 12.632 2.086 1130 3HG2 THR 139 HG23 THR 139 -4.477 11.642 3.519 1131 H ASP 140 HN ASP 140 -3.962 16.394 5.407 1132 HA ASP 140 HA ASP 140 -1.440 17.543 4.954 1133 1HB ASP 140 HB2 ASP 140 -3.427 18.881 5.509 1134 2HB ASP 140 HB1 ASP 140 -3.445 18.192 7.130 1135 H GLU 141 HN GLU 141 -2.670 15.482 7.474 1136 HA GLU 141 HA GLU 141 -0.933 15.748 9.554 1137 1HB GLU 141 HB2 GLU 141 -2.660 14.157 9.724 1138 2HB GLU 141 HB1 GLU 141 -2.132 13.296 8.285 1139 1HG GLU 141 HG2 GLU 141 -0.134 12.539 9.501 1140 2HG GLU 141 HG1 GLU 141 -0.731 13.351 10.951 1141 H MET 142 HN MET 142 -0.363 13.523 6.844 1142 HA MET 142 HA MET 142 2.380 14.231 6.627 1143 1HB MET 142 HB2 MET 142 2.646 12.870 8.604 1144 2HB MET 142 HB1 MET 142 1.696 11.571 7.902 1145 1HG MET 142 HG2 MET 142 4.061 11.043 7.836 1146 2HG MET 142 HG1 MET 142 3.426 11.230 6.202 1147 1HE MET 142 HE1 MET 142 6.770 12.606 5.315 1148 2HE MET 142 HE2 MET 142 5.724 11.191 5.431 1149 3HE MET 142 HE3 MET 142 6.840 11.572 6.742 1150 H VAL 143 HN VAL 143 3.210 13.571 4.727 1151 HA VAL 143 HA VAL 143 1.464 11.948 2.983 1152 HB VAL 143 HB VAL 143 3.341 14.178 2.154 1153 1HG1 VAL 143 HG11 VAL 143 3.140 12.926 0.253 1154 2HG1 VAL 143 HG12 VAL 143 1.741 13.985 0.078 1155 3HG1 VAL 143 HG13 VAL 143 1.530 12.341 0.678 1156 1HG2 VAL 143 HG21 VAL 143 1.208 15.434 1.679 1157 2HG2 VAL 143 HG22 VAL 143 1.587 15.207 3.385 1158 3HG2 VAL 143 HG23 VAL 143 0.365 14.196 2.617 1159 H ALA 144 HN ALA 144 2.981 11.208 0.931 1160 HA ALA 144 HA ALA 144 5.685 10.671 1.596 1161 1HB ALA 144 HB1 ALA 144 5.138 8.989 3.014 1162 2HB ALA 144 HB2 ALA 144 5.189 8.089 1.502 1163 3HB ALA 144 HB3 ALA 144 3.640 8.603 2.171 1164 H MET 145 HN MET 145 6.855 10.167 -0.180 1165 HA MET 145 HA MET 145 5.407 9.276 -2.568 1166 1HB MET 145 HB2 MET 145 7.445 11.509 -2.549 1167 2HB MET 145 HB1 MET 145 6.665 10.842 -3.975 1168 1HG MET 145 HG2 MET 145 4.512 11.635 -3.199 1169 2HG MET 145 HG1 MET 145 5.248 12.244 -1.719 1170 1HE MET 145 HE1 MET 145 3.757 14.073 -2.346 1171 2HE MET 145 HE2 MET 145 3.536 14.390 -4.066 1172 3HE MET 145 HE3 MET 145 4.417 15.543 -3.064 1173 H LEU 146 HN LEU 146 6.444 7.800 -3.786 1174 HA LEU 146 HA LEU 146 8.172 5.998 -3.003 1175 1HB LEU 146 HB2 LEU 146 7.231 6.135 -5.270 1176 2HB LEU 146 HB1 LEU 146 8.418 7.355 -5.687 1177 HG LEU 146 HG LEU 146 10.191 5.601 -5.146 1178 1HD1 LEU 146 HD11 LEU 146 8.125 4.169 -4.148 1179 2HD1 LEU 146 HD12 LEU 146 9.654 3.471 -4.683 1180 3HD1 LEU 146 HD13 LEU 146 8.260 3.477 -5.764 1181 1HD2 LEU 146 HD21 LEU 146 8.418 5.794 -7.485 1182 2HD2 LEU 146 HD22 LEU 146 9.393 4.327 -7.392 1183 3HD2 LEU 146 HD23 LEU 146 10.174 5.908 -7.375 1184 HA PRO 147 HA PRO 147 11.991 7.689 -1.524 1185 1HB PRO 147 HB2 PRO 147 13.093 5.342 -3.024 1186 2HB PRO 147 HB1 PRO 147 13.490 5.920 -1.401 1187 1HG PRO 147 HG2 PRO 147 11.875 3.839 -1.709 1188 2HG PRO 147 HG1 PRO 147 11.532 5.066 -0.475 1189 1HD PRO 147 HD2 PRO 147 10.194 4.583 -3.088 1190 2HD PRO 147 HD1 PRO 147 9.520 5.216 -1.572 1191 H ARG 148 HN ARG 148 13.418 9.113 -2.276 1192 HA ARG 148 HA ARG 148 14.276 9.044 -5.050 1193 1HB ARG 148 HB2 ARG 148 13.709 11.628 -5.056 1194 2HB ARG 148 HB1 ARG 148 12.527 10.428 -5.554 1195 1HG ARG 148 HG2 ARG 148 11.554 12.128 -4.101 1196 2HG ARG 148 HG1 ARG 148 11.470 10.523 -3.374 1197 1HD ARG 148 HD2 ARG 148 12.123 12.049 -1.671 1198 2HD ARG 148 HD1 ARG 148 13.540 11.090 -2.092 1199 HE ARG 148 HE ARG 148 13.574 13.425 -3.628 1200 1HH1 ARG 148 HH11 ARG 148 13.884 12.433 -0.297 1201 2HH1 ARG 148 HH12 ARG 148 14.875 13.783 0.146 1202 1HH2 ARG 148 HH21 ARG 148 14.874 15.210 -3.046 1203 2HH2 ARG 148 HH22 ARG 148 15.436 15.361 -1.415 1204 H GLN 149 HN GLN 149 16.024 8.432 -3.332 1205 HA GLN 149 HA GLN 149 17.780 10.739 -3.153 1206 1HB GLN 149 HB2 GLN 149 17.057 9.071 -0.742 1207 2HB GLN 149 HB1 GLN 149 18.409 10.193 -0.804 1208 1HG GLN 149 HG2 GLN 149 15.532 10.965 -1.208 1209 2HG GLN 149 HG1 GLN 149 16.413 11.109 0.314 1210 1HE2 GLN 149 HE21 GLN 149 17.114 13.068 0.699 1211 2HE2 GLN 149 HE22 GLN 149 17.630 14.224 -0.477 1212 H GLU 150 HN GLU 150 19.967 10.213 -3.041 1213 HA GLU 150 HA GLU 150 20.637 7.695 -4.213 1214 1HB GLU 150 HB2 GLU 150 22.386 9.954 -3.243 1215 2HB GLU 150 HB1 GLU 150 22.943 8.573 -4.183 1216 1HG GLU 150 HG2 GLU 150 21.378 9.230 -5.985 1217 2HG GLU 150 HG1 GLU 150 20.972 10.672 -5.057 1218 H GLU 151 HN GLU 151 19.579 6.700 -2.193 1219 HA GLU 151 HA GLU 151 21.475 5.202 -0.852 1220 1HB GLU 151 HB2 GLU 151 20.997 6.065 1.528 1221 2HB GLU 151 HB1 GLU 151 22.156 6.943 0.540 1222 1HG GLU 151 HG2 GLU 151 20.442 8.592 -0.007 1223 2HG GLU 151 HG1 GLU 151 19.283 7.720 0.995 1224 H CYS 152 HN CYS 152 19.099 5.917 1.475 1225 HA CYS 152 HA CYS 152 17.057 4.234 0.293 1226 1HB CYS 152 HB2 CYS 152 18.472 3.403 2.841 1227 2HB CYS 152 HB1 CYS 152 17.089 2.590 2.117 1228 H THR 153 HN THR 153 15.913 6.253 0.501 1229 HA THR 153 HA THR 153 14.546 6.490 3.039 1230 HB THR 153 HB THR 153 16.483 7.875 3.467 1231 HG1 THR 153 HG1 THR 153 14.254 9.514 2.845 1232 1HG2 THR 153 HG21 THR 153 16.834 9.953 2.109 1233 2HG2 THR 153 HG22 THR 153 15.780 9.241 0.886 1234 3HG2 THR 153 HG23 THR 153 17.292 8.445 1.320 1235 H VAL 154 HN VAL 154 12.529 7.393 2.867 1236 HA VAL 154 HA VAL 154 11.523 7.813 0.181 1237 HB VAL 154 HB VAL 154 10.285 6.437 1.864 1238 1HG1 VAL 154 HG11 VAL 154 9.556 7.238 3.821 1239 2HG1 VAL 154 HG12 VAL 154 9.036 8.765 3.113 1240 3HG1 VAL 154 HG13 VAL 154 10.724 8.533 3.567 1241 1HG2 VAL 154 HG21 VAL 154 9.219 7.378 -0.147 1242 2HG2 VAL 154 HG22 VAL 154 8.769 8.809 0.781 1243 3HG2 VAL 154 HG23 VAL 154 8.096 7.237 1.206 1244 H ASP 155 HN ASP 155 10.307 9.680 -0.465 1245 HA ASP 155 HA ASP 155 11.481 12.138 0.148 1246 1HB ASP 155 HB2 ASP 155 10.195 11.709 -1.922 1247 2HB ASP 155 HB1 ASP 155 8.710 11.648 -0.979 1248 H GLU 156 HN GLU 156 11.075 13.715 1.614 1249 HA GLU 156 HA GLU 156 8.672 14.088 3.008 1250 1HB GLU 156 HB2 GLU 156 9.292 13.276 5.241 1251 2HB GLU 156 HB1 GLU 156 9.204 11.960 4.079 1252 1HG GLU 156 HG2 GLU 156 11.640 11.986 3.871 1253 2HG GLU 156 HG1 GLU 156 11.721 13.293 5.051 1254 H VAL 157 HN VAL 157 8.680 16.014 4.058 1255 HA VAL 157 HA VAL 157 9.402 18.039 4.810 1256 HB VAL 157 HB VAL 157 12.072 16.685 5.223 1257 1HG1 VAL 157 HG11 VAL 157 10.988 19.348 5.880 1258 2HG1 VAL 157 HG12 VAL 157 12.650 18.837 5.587 1259 3HG1 VAL 157 HG13 VAL 157 11.903 18.545 7.157 1260 1HG2 VAL 157 HG21 VAL 157 11.165 16.629 7.651 1261 2HG2 VAL 157 HG22 VAL 157 10.640 15.393 6.508 1262 3HG2 VAL 157 HG23 VAL 157 9.583 16.755 6.883 Start of MODEL 13 1 1H MET 1 HT1 MET 1 -25.666 -8.243 -13.821 2 2H MET 1 HT2 MET 1 -24.569 -7.586 -14.930 3 3H MET 1 HT3 MET 1 -24.002 -8.421 -13.573 4 HA MET 1 HA MET 1 -25.466 -10.337 -14.589 5 1HB MET 1 HB2 MET 1 -24.638 -8.586 -16.910 6 2HB MET 1 HB1 MET 1 -25.109 -10.269 -17.088 7 1HG MET 1 HG2 MET 1 -26.987 -8.938 -17.639 8 2HG MET 1 HG1 MET 1 -27.311 -9.683 -16.076 9 1HE MET 1 HE1 MET 1 -24.926 -6.575 -16.721 10 2HE MET 1 HE2 MET 1 -26.104 -5.265 -16.643 11 3HE MET 1 HE3 MET 1 -26.192 -6.454 -17.943 12 H THR 2 HN THR 2 -24.208 -12.085 -14.685 13 HA THR 2 HA THR 2 -22.366 -13.382 -14.464 14 HB THR 2 HB THR 2 -22.324 -13.026 -16.888 15 HG1 THR 2 HG1 THR 2 -20.611 -14.196 -16.782 16 1HG2 THR 2 HG21 THR 2 -20.540 -11.473 -17.784 17 2HG2 THR 2 HG22 THR 2 -20.608 -10.661 -16.220 18 3HG2 THR 2 HG23 THR 2 -22.044 -10.729 -17.241 19 H VAL 3 HN VAL 3 -20.778 -13.551 -13.043 20 HA VAL 3 HA VAL 3 -19.791 -11.206 -11.726 21 HB VAL 3 HB VAL 3 -18.536 -12.761 -10.299 22 1HG1 VAL 3 HG11 VAL 3 -21.363 -13.692 -10.788 23 2HG1 VAL 3 HG12 VAL 3 -20.904 -12.283 -9.832 24 3HG1 VAL 3 HG13 VAL 3 -20.432 -13.898 -9.305 25 1HG2 VAL 3 HG21 VAL 3 -19.312 -15.283 -10.870 26 2HG2 VAL 3 HG22 VAL 3 -17.780 -14.584 -11.395 27 3HG2 VAL 3 HG23 VAL 3 -19.155 -14.622 -12.498 28 HA PRO 4 HA PRO 4 -16.187 -10.350 -14.170 29 1HB PRO 4 HB2 PRO 4 -14.988 -9.738 -11.494 30 2HB PRO 4 HB1 PRO 4 -15.000 -8.765 -12.969 31 1HG PRO 4 HG2 PRO 4 -16.623 -8.156 -10.975 32 2HG PRO 4 HG1 PRO 4 -17.211 -8.092 -12.648 33 1HD PRO 4 HD2 PRO 4 -17.683 -10.175 -10.550 34 2HD PRO 4 HD1 PRO 4 -18.809 -9.510 -11.752 35 H ASP 5 HN ASP 5 -13.875 -10.852 -11.802 36 HA ASP 5 HA ASP 5 -13.680 -13.666 -11.771 37 1HB ASP 5 HB2 ASP 5 -13.196 -13.389 -14.152 38 2HB ASP 5 HB1 ASP 5 -11.916 -12.240 -13.775 39 H ARG 6 HN ARG 6 -12.503 -14.155 -10.047 40 HA ARG 6 HA ARG 6 -11.121 -12.179 -8.567 41 1HB ARG 6 HB2 ARG 6 -11.067 -15.191 -8.309 42 2HB ARG 6 HB1 ARG 6 -10.424 -14.067 -7.120 43 1HG ARG 6 HG2 ARG 6 -13.304 -14.331 -7.958 44 2HG ARG 6 HG1 ARG 6 -12.596 -14.860 -6.431 45 1HD ARG 6 HD2 ARG 6 -12.051 -12.553 -5.868 46 2HD ARG 6 HD1 ARG 6 -12.699 -12.009 -7.413 47 HE ARG 6 HE ARG 6 -14.763 -12.031 -6.466 48 1HH1 ARG 6 HH11 ARG 6 -12.732 -14.211 -4.642 49 2HH1 ARG 6 HH12 ARG 6 -13.968 -14.595 -3.492 50 1HH2 ARG 6 HH21 ARG 6 -16.382 -12.533 -4.950 51 2HH2 ARG 6 HH22 ARG 6 -16.037 -13.641 -3.665 52 H SER 7 HN SER 7 -10.134 -14.584 -10.892 53 HA SER 7 HA SER 7 -7.422 -14.758 -10.450 54 1HB SER 7 HB2 SER 7 -8.869 -14.694 -13.108 55 2HB SER 7 HB1 SER 7 -7.217 -15.262 -12.870 56 HG SER 7 HG SER 7 -9.355 -16.699 -12.698 57 H GLU 8 HN GLU 8 -9.242 -12.144 -11.927 58 HA GLU 8 HA GLU 8 -7.272 -10.731 -13.235 59 1HB GLU 8 HB2 GLU 8 -8.626 -8.777 -12.977 60 2HB GLU 8 HB1 GLU 8 -9.720 -10.145 -13.114 61 1HG GLU 8 HG2 GLU 8 -9.858 -10.145 -10.603 62 2HG GLU 8 HG1 GLU 8 -8.985 -8.616 -10.635 63 H ILE 9 HN ILE 9 -8.076 -10.705 -9.799 64 HA ILE 9 HA ILE 9 -6.299 -8.733 -8.944 65 HB ILE 9 HB ILE 9 -7.631 -11.056 -7.619 66 1HG1 ILE 9 HG12 ILE 9 -8.802 -8.899 -8.045 67 2HG1 ILE 9 HG11 ILE 9 -8.729 -9.330 -6.339 68 1HG2 ILE 9 HG21 ILE 9 -5.800 -11.281 -6.296 69 2HG2 ILE 9 HG22 ILE 9 -6.575 -9.942 -5.451 70 3HG2 ILE 9 HG23 ILE 9 -5.255 -9.626 -6.576 71 1HD1 ILE 9 HD11 ILE 9 -8.304 -6.971 -6.643 72 2HD1 ILE 9 HD12 ILE 9 -6.977 -7.328 -7.747 73 3HD1 ILE 9 HD13 ILE 9 -6.855 -7.777 -6.046 74 H ALA 10 HN ALA 10 -5.828 -12.225 -9.331 75 HA ALA 10 HA ALA 10 -3.299 -12.476 -8.221 76 1HB ALA 10 HB1 ALA 10 -5.036 -14.150 -9.479 77 2HB ALA 10 HB2 ALA 10 -3.396 -14.582 -8.997 78 3HB ALA 10 HB3 ALA 10 -3.721 -14.064 -10.651 79 H GLY 11 HN GLY 11 -1.327 -11.728 -8.764 80 1HA GLY 11 HA2 GLY 11 -0.118 -11.661 -11.204 81 2HA GLY 11 HA1 GLY 11 -1.023 -10.158 -11.172 82 H LYS 12 HN LYS 12 0.766 -8.813 -11.176 83 HA LYS 12 HA LYS 12 2.409 -8.909 -8.731 84 1HB LYS 12 HB2 LYS 12 3.249 -8.001 -11.488 85 2HB LYS 12 HB1 LYS 12 4.232 -7.852 -10.039 86 1HG LYS 12 HG2 LYS 12 4.243 -10.293 -9.809 87 2HG LYS 12 HG1 LYS 12 3.297 -10.423 -11.294 88 1HD LYS 12 HD2 LYS 12 6.048 -9.206 -11.045 89 2HD LYS 12 HD1 LYS 12 5.675 -10.791 -11.725 90 1HE LYS 12 HE2 LYS 12 4.740 -8.130 -12.795 91 2HE LYS 12 HE1 LYS 12 6.013 -9.136 -13.485 92 1HZ LYS 12 HZ1 LYS 12 3.111 -9.702 -13.358 93 2HZ LYS 12 HZ2 LYS 12 4.250 -10.907 -13.693 94 3HZ LYS 12 HZ3 LYS 12 4.093 -9.580 -14.730 95 H TRP 13 HN TRP 13 2.114 -7.265 -7.441 96 HA TRP 13 HA TRP 13 1.019 -4.745 -8.495 97 1HB TRP 13 HB2 TRP 13 1.099 -5.802 -5.656 98 2HB TRP 13 HB1 TRP 13 0.343 -4.307 -6.172 99 HD1 TRP 13 HD1 TRP 13 -0.366 -7.100 -8.550 100 HE1 TRP 13 HE1 TRP 13 -2.760 -7.963 -8.183 101 HE3 TRP 13 HE3 TRP 13 -1.417 -4.726 -4.150 102 HZ2 TRP 13 HZ2 TRP 13 -4.821 -7.677 -6.284 103 HZ3 TRP 13 HZ3 TRP 13 -3.623 -5.077 -3.119 104 HH2 TRP 13 HH2 TRP 13 -5.291 -6.523 -4.167 105 H TYR 14 HN TYR 14 2.267 -2.909 -8.419 106 HA TYR 14 HA TYR 14 4.814 -3.093 -6.943 107 1HB TYR 14 HB2 TYR 14 5.207 -2.774 -9.313 108 2HB TYR 14 HB1 TYR 14 4.096 -1.409 -9.353 109 HD1 TYR 14 HD1 TYR 14 6.817 -2.235 -6.943 110 HD2 TYR 14 HD2 TYR 14 5.370 0.463 -9.897 111 HE1 TYR 14 HE1 TYR 14 8.666 -0.697 -6.435 112 HE2 TYR 14 HE2 TYR 14 7.218 2.008 -9.400 113 HH TYR 14 HH TYR 14 9.444 1.966 -8.420 114 H VAL 15 HN VAL 15 4.655 -2.103 -5.013 115 HA VAL 15 HA VAL 15 2.846 0.122 -4.658 116 HB VAL 15 HB VAL 15 2.993 -1.436 -2.838 117 1HG1 VAL 15 HG11 VAL 15 5.201 -2.316 -3.191 118 2HG1 VAL 15 HG12 VAL 15 5.063 -1.721 -1.537 119 3HG1 VAL 15 HG13 VAL 15 5.920 -0.769 -2.748 120 1HG2 VAL 15 HG21 VAL 15 2.604 0.910 -2.264 121 2HG2 VAL 15 HG22 VAL 15 4.340 1.149 -2.061 122 3HG2 VAL 15 HG23 VAL 15 3.464 0.063 -0.981 123 H VAL 16 HN VAL 16 3.369 2.084 -5.257 124 HA VAL 16 HA VAL 16 6.151 3.004 -4.939 125 HB VAL 16 HB VAL 16 5.397 2.371 -7.308 126 1HG1 VAL 16 HG11 VAL 16 3.954 3.700 -8.505 127 2HG1 VAL 16 HG12 VAL 16 4.167 5.085 -7.434 128 3HG1 VAL 16 HG13 VAL 16 3.195 3.710 -6.914 129 1HG2 VAL 16 HG21 VAL 16 7.127 3.580 -7.972 130 2HG2 VAL 16 HG22 VAL 16 7.161 4.276 -6.353 131 3HG2 VAL 16 HG23 VAL 16 6.284 5.094 -7.648 132 H ALA 17 HN ALA 17 2.729 3.903 -5.086 133 HA ALA 17 HA ALA 17 3.404 6.586 -4.104 134 1HB ALA 17 HB1 ALA 17 1.662 7.331 -5.272 135 2HB ALA 17 HB2 ALA 17 0.582 6.134 -4.557 136 3HB ALA 17 HB3 ALA 17 1.544 5.717 -5.974 137 H LEU 18 HN LEU 18 3.353 6.907 -1.951 138 HA LEU 18 HA LEU 18 1.292 5.506 -0.383 139 1HB LEU 18 HB2 LEU 18 4.014 5.975 0.776 140 2HB LEU 18 HB1 LEU 18 2.783 4.857 1.303 141 HG LEU 18 HG LEU 18 4.553 3.565 0.416 142 1HD1 LEU 18 HD11 LEU 18 2.048 3.698 -1.052 143 2HD1 LEU 18 HD12 LEU 18 2.897 2.313 -0.380 144 3HD1 LEU 18 HD13 LEU 18 3.361 2.952 -1.957 145 1HD2 LEU 18 HD21 LEU 18 4.483 4.815 -2.270 146 2HD2 LEU 18 HD22 LEU 18 5.815 4.043 -1.409 147 3HD2 LEU 18 HD23 LEU 18 5.315 5.678 -0.976 148 H ALA 19 HN ALA 19 1.066 6.631 1.881 149 HA ALA 19 HA ALA 19 2.071 9.263 2.127 150 1HB ALA 19 HB1 ALA 19 -0.749 9.737 1.780 151 2HB ALA 19 HB2 ALA 19 -0.020 9.076 0.318 152 3HB ALA 19 HB3 ALA 19 0.634 10.544 1.040 153 H SER 20 HN SER 20 2.297 9.467 4.218 154 HA SER 20 HA SER 20 1.402 9.924 6.343 155 1HB SER 20 HB2 SER 20 -0.735 7.878 5.760 156 2HB SER 20 HB1 SER 20 -0.596 8.842 7.227 157 HG SER 20 HG SER 20 -1.243 10.599 6.159 158 H ASN 21 HN ASN 21 1.600 8.734 8.369 159 HA ASN 21 HA ASN 21 2.523 6.010 8.243 160 1HB ASN 21 HB2 ASN 21 4.510 8.064 9.210 161 2HB ASN 21 HB1 ASN 21 4.790 6.370 8.814 162 1HD2 ASN 21 HD21 ASN 21 5.544 5.911 6.855 163 2HD2 ASN 21 HD22 ASN 21 5.607 7.005 5.522 164 H THR 22 HN THR 22 4.194 7.072 10.793 165 HA THR 22 HA THR 22 1.881 7.321 12.576 166 HB THR 22 HB THR 22 2.732 5.680 14.092 167 HG1 THR 22 HG1 THR 22 4.736 5.054 14.104 168 1HG2 THR 22 HG21 THR 22 2.314 3.765 12.967 169 2HG2 THR 22 HG22 THR 22 3.321 4.218 11.592 170 3HG2 THR 22 HG23 THR 22 1.715 4.922 11.781 171 H GLU 23 HN GLU 23 3.905 7.043 14.859 172 HA GLU 23 HA GLU 23 4.448 9.827 15.091 173 1HB GLU 23 HB2 GLU 23 5.246 7.493 16.829 174 2HB GLU 23 HB1 GLU 23 5.502 9.180 17.254 175 1HG GLU 23 HG2 GLU 23 3.091 9.561 17.175 176 2HG GLU 23 HG1 GLU 23 2.842 7.865 16.759 177 H PHE 24 HN PHE 24 6.994 7.662 16.110 178 HA PHE 24 HA PHE 24 8.945 9.283 14.781 179 1HB PHE 24 HB2 PHE 24 10.583 7.766 15.854 180 2HB PHE 24 HB1 PHE 24 9.420 8.433 16.994 181 HD1 PHE 24 HD1 PHE 24 8.502 7.010 18.531 182 HD2 PHE 24 HD2 PHE 24 9.839 5.424 14.814 183 HE1 PHE 24 HE1 PHE 24 7.954 4.740 19.305 184 HE2 PHE 24 HE2 PHE 24 9.287 3.154 15.579 185 HZ PHE 24 HZ PHE 24 8.344 2.809 17.828 186 H PHE 25 HN PHE 25 7.430 6.207 14.172 187 HA PHE 25 HA PHE 25 9.177 4.880 12.562 188 1HB PHE 25 HB2 PHE 25 6.883 4.116 13.166 189 2HB PHE 25 HB1 PHE 25 6.239 5.215 11.951 190 HD1 PHE 25 HD1 PHE 25 9.170 2.928 11.863 191 HD2 PHE 25 HD2 PHE 25 5.357 3.925 10.262 192 HE1 PHE 25 HE1 PHE 25 9.441 1.186 10.147 193 HE2 PHE 25 HE2 PHE 25 5.619 2.184 8.543 194 HZ PHE 25 HZ PHE 25 7.663 0.811 8.484 195 H LEU 26 HN LEU 26 7.223 7.683 11.663 196 HA LEU 26 HA LEU 26 7.646 7.658 8.913 197 1HB LEU 26 HB2 LEU 26 7.109 10.015 8.935 198 2HB LEU 26 HB1 LEU 26 6.052 9.147 10.030 199 HG LEU 26 HG LEU 26 7.685 9.897 11.880 200 1HD1 LEU 26 HD11 LEU 26 8.917 11.097 9.596 201 2HD1 LEU 26 HD12 LEU 26 9.454 11.082 11.276 202 3HD1 LEU 26 HD13 LEU 26 8.377 12.356 10.706 203 1HD2 LEU 26 HD21 LEU 26 6.200 11.512 12.397 204 2HD2 LEU 26 HD22 LEU 26 5.323 10.849 11.018 205 3HD2 LEU 26 HD23 LEU 26 6.328 12.284 10.817 206 H ARG 27 HN ARG 27 9.690 8.894 11.508 207 HA ARG 27 HA ARG 27 11.546 10.281 9.947 208 1HB ARG 27 HB2 ARG 27 11.436 10.429 12.405 209 2HB ARG 27 HB1 ARG 27 12.034 8.781 12.527 210 1HG ARG 27 HG2 ARG 27 13.794 10.413 12.943 211 2HG ARG 27 HG1 ARG 27 14.136 9.445 11.508 212 1HD ARG 27 HD2 ARG 27 14.652 11.796 11.120 213 2HD ARG 27 HD1 ARG 27 13.328 11.261 10.086 214 HE ARG 27 HE ARG 27 12.236 12.367 12.410 215 1HH1 ARG 27 HH11 ARG 27 14.053 13.373 9.605 216 2HH1 ARG 27 HH12 ARG 27 13.408 14.980 9.607 217 1HH2 ARG 27 HH21 ARG 27 11.386 14.485 12.414 218 2HH2 ARG 27 HH22 ARG 27 11.896 15.611 11.202 219 H GLU 28 HN GLU 28 11.483 6.880 10.954 220 HA GLU 28 HA GLU 28 13.899 6.279 9.500 221 1HB GLU 28 HB2 GLU 28 13.484 3.954 10.200 222 2HB GLU 28 HB1 GLU 28 13.438 5.073 11.554 223 1HG GLU 28 HG2 GLU 28 10.983 5.037 11.476 224 2HG GLU 28 HG1 GLU 28 11.059 3.870 10.156 225 H LYS 29 HN LYS 29 10.435 5.785 9.061 226 HA LYS 29 HA LYS 29 10.649 4.169 6.744 227 1HB LYS 29 HB2 LYS 29 8.629 4.237 8.161 228 2HB LYS 29 HB1 LYS 29 8.347 5.900 7.669 229 1HG LYS 29 HG2 LYS 29 6.911 4.790 6.286 230 2HG LYS 29 HG1 LYS 29 8.342 4.878 5.264 231 1HD LYS 29 HD2 LYS 29 7.468 2.517 6.930 232 2HD LYS 29 HD1 LYS 29 7.361 2.654 5.176 233 1HE LYS 29 HE2 LYS 29 9.846 2.877 5.117 234 2HE LYS 29 HE1 LYS 29 9.863 2.546 6.849 235 1HZ LYS 29 HZ1 LYS 29 9.327 0.375 6.540 236 2HZ LYS 29 HZ2 LYS 29 10.161 0.641 5.093 237 3HZ LYS 29 HZ3 LYS 29 8.470 0.654 5.108 238 H ASP 30 HN ASP 30 10.277 7.646 7.234 239 HA ASP 30 HA ASP 30 9.795 8.378 4.579 240 1HB ASP 30 HB2 ASP 30 9.479 9.899 6.488 241 2HB ASP 30 HB1 ASP 30 11.224 9.972 6.714 242 H LYS 31 HN LYS 31 12.873 8.031 6.323 243 HA LYS 31 HA LYS 31 14.571 9.023 4.355 244 1HB LYS 31 HB2 LYS 31 15.050 6.843 6.388 245 2HB LYS 31 HB1 LYS 31 16.316 7.557 5.399 246 1HG LYS 31 HG2 LYS 31 15.856 9.744 6.387 247 2HG LYS 31 HG1 LYS 31 14.591 9.022 7.383 248 1HD LYS 31 HD2 LYS 31 16.240 7.590 8.465 249 2HD LYS 31 HD1 LYS 31 17.512 8.264 7.443 250 1HE LYS 31 HE2 LYS 31 17.535 9.289 9.653 251 2HE LYS 31 HE1 LYS 31 17.123 10.473 8.412 252 1HZ LYS 31 HZ1 LYS 31 14.906 9.092 9.707 253 2HZ LYS 31 HZ2 LYS 31 15.028 10.699 9.193 254 3HZ LYS 31 HZ3 LYS 31 15.751 10.219 10.645 255 H MET 32 HN MET 32 13.690 8.309 2.342 256 HA MET 32 HA MET 32 13.676 7.012 0.474 257 1HB MET 32 HB2 MET 32 15.823 5.505 1.977 258 2HB MET 32 HB1 MET 32 15.418 5.239 0.289 259 1HG MET 32 HG2 MET 32 17.353 6.605 0.368 260 2HG MET 32 HG1 MET 32 16.007 7.609 -0.160 261 1HE MET 32 HE1 MET 32 17.384 9.803 0.313 262 2HE MET 32 HE2 MET 32 18.766 8.837 0.831 263 3HE MET 32 HE3 MET 32 18.182 10.155 1.846 264 H LYS 33 HN LYS 33 12.392 5.393 -0.281 265 HA LYS 33 HA LYS 33 11.983 2.939 1.062 266 1HB LYS 33 HB2 LYS 33 10.761 4.309 2.662 267 2HB LYS 33 HB1 LYS 33 9.788 4.993 1.366 268 1HG LYS 33 HG2 LYS 33 8.871 2.756 0.906 269 2HG LYS 33 HG1 LYS 33 9.805 2.117 2.259 270 1HD LYS 33 HD2 LYS 33 7.523 2.535 2.955 271 2HD LYS 33 HD1 LYS 33 8.615 3.653 3.772 272 1HE LYS 33 HE2 LYS 33 8.032 5.406 2.181 273 2HE LYS 33 HE1 LYS 33 6.970 4.289 1.325 274 1HZ LYS 33 HZ1 LYS 33 5.915 4.074 3.702 275 2HZ LYS 33 HZ2 LYS 33 5.472 5.331 2.661 276 3HZ LYS 33 HZ3 LYS 33 6.583 5.615 3.905 277 H MET 34 HN MET 34 11.448 1.526 -0.431 278 HA MET 34 HA MET 34 9.554 2.249 -2.547 279 1HB MET 34 HB2 MET 34 11.748 2.703 -3.516 280 2HB MET 34 HB1 MET 34 12.320 1.121 -3.026 281 1HG MET 34 HG2 MET 34 10.714 0.071 -4.542 282 2HG MET 34 HG1 MET 34 10.158 1.667 -5.045 283 1HE MET 34 HE1 MET 34 10.585 -0.111 -6.984 284 2HE MET 34 HE2 MET 34 12.151 -0.373 -7.753 285 3HE MET 34 HE3 MET 34 11.251 1.109 -8.071 286 H ALA 35 HN ALA 35 8.486 0.295 -3.466 287 HA ALA 35 HA ALA 35 9.327 -2.233 -2.367 288 1HB ALA 35 HB1 ALA 35 7.002 -2.539 -1.262 289 2HB ALA 35 HB2 ALA 35 7.010 -0.775 -1.213 290 3HB ALA 35 HB3 ALA 35 8.288 -1.682 -0.413 291 H MET 36 HN MET 36 8.447 -4.013 -3.231 292 HA MET 36 HA MET 36 6.577 -3.657 -5.481 293 1HB MET 36 HB2 MET 36 8.854 -4.164 -6.267 294 2HB MET 36 HB1 MET 36 8.894 -5.593 -5.246 295 1HG MET 36 HG2 MET 36 7.051 -6.559 -6.532 296 2HG MET 36 HG1 MET 36 7.039 -5.132 -7.568 297 1HE MET 36 HE1 MET 36 9.118 -7.989 -6.139 298 2HE MET 36 HE2 MET 36 10.458 -6.845 -6.218 299 3HE MET 36 HE3 MET 36 10.419 -8.234 -7.304 300 H ALA 37 HN ALA 37 5.252 -5.660 -5.927 301 HA ALA 37 HA ALA 37 5.118 -7.594 -3.784 302 1HB ALA 37 HB1 ALA 37 2.622 -6.018 -4.182 303 2HB ALA 37 HB2 ALA 37 3.879 -5.428 -3.094 304 3HB ALA 37 HB3 ALA 37 3.124 -6.996 -2.805 305 H ARG 38 HN ARG 38 3.739 -9.323 -4.111 306 HA ARG 38 HA ARG 38 2.455 -9.556 -6.741 307 1HB ARG 38 HB2 ARG 38 3.319 -11.826 -6.997 308 2HB ARG 38 HB1 ARG 38 4.653 -10.692 -6.843 309 1HG ARG 38 HG2 ARG 38 4.949 -11.324 -4.515 310 2HG ARG 38 HG1 ARG 38 3.583 -12.432 -4.630 311 1HD ARG 38 HD2 ARG 38 6.150 -12.626 -6.204 312 2HD ARG 38 HD1 ARG 38 5.726 -13.606 -4.804 313 HE ARG 38 HE ARG 38 4.334 -14.868 -6.131 314 1HH1 ARG 38 HH11 ARG 38 5.447 -12.090 -7.929 315 2HH1 ARG 38 HH12 ARG 38 4.726 -12.609 -9.414 316 1HH2 ARG 38 HH21 ARG 38 3.393 -15.552 -8.086 317 2HH2 ARG 38 HH22 ARG 38 3.561 -14.573 -9.505 318 H ILE 39 HN ILE 39 0.352 -10.080 -6.437 319 HA ILE 39 HA ILE 39 -0.414 -11.137 -3.824 320 HB ILE 39 HB ILE 39 -1.536 -9.102 -4.623 321 1HG1 ILE 39 HG12 ILE 39 -3.473 -11.418 -4.464 322 2HG1 ILE 39 HG11 ILE 39 -2.609 -10.782 -3.067 323 1HG2 ILE 39 HG21 ILE 39 -2.583 -10.924 -6.782 324 2HG2 ILE 39 HG22 ILE 39 -1.577 -9.490 -6.985 325 3HG2 ILE 39 HG23 ILE 39 -3.241 -9.329 -6.421 326 1HD1 ILE 39 HD11 ILE 39 -3.657 -8.593 -3.451 327 2HD1 ILE 39 HD12 ILE 39 -4.833 -9.872 -3.149 328 3HD1 ILE 39 HD13 ILE 39 -4.567 -9.287 -4.790 329 H SER 40 HN SER 40 -1.622 -12.916 -3.469 330 HA SER 40 HA SER 40 -2.594 -14.588 -5.609 331 1HB SER 40 HB2 SER 40 -0.251 -15.298 -5.541 332 2HB SER 40 HB1 SER 40 -0.368 -15.575 -3.802 333 HG SER 40 HG SER 40 -0.622 -17.488 -5.120 334 H PHE 41 HN PHE 41 -4.087 -16.141 -4.884 335 HA PHE 41 HA PHE 41 -5.295 -15.500 -2.341 336 1HB PHE 41 HB2 PHE 41 -6.114 -17.466 -4.488 337 2HB PHE 41 HB1 PHE 41 -7.070 -17.074 -3.065 338 HD1 PHE 41 HD1 PHE 41 -8.897 -15.829 -3.608 339 HD2 PHE 41 HD2 PHE 41 -5.228 -15.015 -5.606 340 HE1 PHE 41 HE1 PHE 41 -9.968 -13.979 -4.823 341 HE2 PHE 41 HE2 PHE 41 -6.291 -13.167 -6.819 342 HZ PHE 41 HZ PHE 41 -8.665 -12.645 -6.431 343 H LEU 42 HN LEU 42 -5.044 -16.563 -0.472 344 HA LEU 42 HA LEU 42 -3.434 -18.969 -0.394 345 1HB LEU 42 HB2 LEU 42 -3.259 -17.091 1.286 346 2HB LEU 42 HB1 LEU 42 -4.816 -17.595 1.910 347 HG LEU 42 HG LEU 42 -3.865 -19.792 2.503 348 1HD1 LEU 42 HD11 LEU 42 -2.125 -20.112 0.950 349 2HD1 LEU 42 HD12 LEU 42 -1.325 -19.909 2.510 350 3HD1 LEU 42 HD13 LEU 42 -1.368 -18.574 1.358 351 1HD2 LEU 42 HD21 LEU 42 -2.222 -18.855 4.249 352 2HD2 LEU 42 HD22 LEU 42 -3.892 -18.289 4.287 353 3HD2 LEU 42 HD23 LEU 42 -2.635 -17.278 3.576 354 H GLY 43 HN GLY 43 -4.271 -20.868 -0.723 355 1HA GLY 43 HA2 GLY 43 -6.995 -21.481 -0.892 356 2HA GLY 43 HA1 GLY 43 -5.690 -22.648 -0.819 357 H GLU 44 HN GLU 44 -7.593 -20.512 1.277 358 HA GLU 44 HA GLU 44 -8.229 -22.677 3.047 359 1HB GLU 44 HB2 GLU 44 -6.475 -20.430 4.065 360 2HB GLU 44 HB1 GLU 44 -7.249 -21.644 5.073 361 1HG GLU 44 HG2 GLU 44 -5.936 -23.385 3.913 362 2HG GLU 44 HG1 GLU 44 -5.113 -22.117 3.006 363 H ASP 45 HN ASP 45 -7.876 -19.173 2.989 364 HA ASP 45 HA ASP 45 -10.421 -18.356 2.584 365 1HB ASP 45 HB2 ASP 45 -11.324 -17.888 4.856 366 2HB ASP 45 HB1 ASP 45 -11.192 -19.610 4.534 367 H GLU 46 HN GLU 46 -7.811 -17.506 2.107 368 HA GLU 46 HA GLU 46 -8.003 -14.781 3.028 369 1HB GLU 46 HB2 GLU 46 -5.645 -16.466 3.894 370 2HB GLU 46 HB1 GLU 46 -5.748 -14.720 4.050 371 1HG GLU 46 HG2 GLU 46 -7.645 -14.966 5.565 372 2HG GLU 46 HG1 GLU 46 -7.538 -16.718 5.409 373 H LEU 47 HN LEU 47 -6.836 -13.357 1.798 374 HA LEU 47 HA LEU 47 -5.411 -14.534 -0.497 375 1HB LEU 47 HB2 LEU 47 -6.658 -11.788 -0.396 376 2HB LEU 47 HB1 LEU 47 -6.115 -12.672 -1.811 377 HG LEU 47 HG LEU 47 -8.565 -13.193 -0.138 378 1HD1 LEU 47 HD11 LEU 47 -9.091 -11.605 -1.742 379 2HD1 LEU 47 HD12 LEU 47 -9.565 -13.124 -2.503 380 3HD1 LEU 47 HD13 LEU 47 -8.050 -12.345 -2.958 381 1HD2 LEU 47 HD21 LEU 47 -7.194 -14.990 -2.108 382 2HD2 LEU 47 HD22 LEU 47 -8.929 -15.095 -1.809 383 3HD2 LEU 47 HD23 LEU 47 -7.788 -15.370 -0.494 384 H LYS 48 HN LYS 48 -3.269 -14.348 -0.276 385 HA LYS 48 HA LYS 48 -2.225 -12.114 1.300 386 1HB LYS 48 HB2 LYS 48 -0.231 -13.446 1.657 387 2HB LYS 48 HB1 LYS 48 -1.663 -14.355 2.105 388 1HG LYS 48 HG2 LYS 48 -0.367 -15.914 1.000 389 2HG LYS 48 HG1 LYS 48 -1.491 -15.380 -0.250 390 1HD LYS 48 HD2 LYS 48 0.178 -13.974 -1.237 391 2HD LYS 48 HD1 LYS 48 1.277 -14.241 0.115 392 1HE LYS 48 HE2 LYS 48 1.448 -16.597 -0.488 393 2HE LYS 48 HE1 LYS 48 0.320 -16.347 -1.820 394 1HZ LYS 48 HZ1 LYS 48 3.106 -15.434 -1.556 395 2HZ LYS 48 HZ2 LYS 48 2.038 -14.591 -2.561 396 3HZ LYS 48 HZ3 LYS 48 2.359 -16.225 -2.852 397 H VAL 49 HN VAL 49 -0.281 -11.065 0.714 398 HA VAL 49 HA VAL 49 0.404 -11.150 -2.135 399 HB VAL 49 HB VAL 49 -1.138 -9.265 -1.833 400 1HG1 VAL 49 HG11 VAL 49 -1.100 -7.873 -0.098 401 2HG1 VAL 49 HG12 VAL 49 0.632 -7.591 -0.251 402 3HG1 VAL 49 HG13 VAL 49 0.047 -8.994 0.640 403 1HG2 VAL 49 HG21 VAL 49 1.339 -9.175 -3.055 404 2HG2 VAL 49 HG22 VAL 49 1.281 -7.681 -2.121 405 3HG2 VAL 49 HG23 VAL 49 0.014 -8.039 -3.293 406 H SER 50 HN SER 50 2.471 -11.707 -2.204 407 HA SER 50 HA SER 50 4.257 -11.124 -0.005 408 1HB SER 50 HB2 SER 50 4.836 -12.410 -2.693 409 2HB SER 50 HB1 SER 50 5.924 -12.377 -1.305 410 HG SER 50 HG SER 50 3.343 -13.460 -1.022 411 H TYR 51 HN TYR 51 5.365 -9.255 0.131 412 HA TYR 51 HA TYR 51 5.904 -7.843 -2.385 413 1HB TYR 51 HB2 TYR 51 5.760 -5.714 -1.013 414 2HB TYR 51 HB1 TYR 51 4.247 -6.557 -1.302 415 HD1 TYR 51 HD1 TYR 51 6.954 -6.383 1.279 416 HD2 TYR 51 HD2 TYR 51 2.806 -6.839 0.457 417 HE1 TYR 51 HE1 TYR 51 6.484 -6.392 3.689 418 HE2 TYR 51 HE2 TYR 51 2.323 -6.844 2.867 419 HH TYR 51 HH TYR 51 3.375 -6.028 4.954 420 H ALA 52 HN ALA 52 7.899 -7.377 -2.858 421 HA ALA 52 HA ALA 52 9.981 -7.793 -0.831 422 1HB ALA 52 HB1 ALA 52 11.542 -7.924 -2.698 423 2HB ALA 52 HB2 ALA 52 10.255 -7.515 -3.831 424 3HB ALA 52 HB3 ALA 52 10.203 -9.042 -2.953 425 H VAL 53 HN VAL 53 10.322 -5.950 0.266 426 HA VAL 53 HA VAL 53 10.176 -3.422 -1.182 427 HB VAL 53 HB VAL 53 9.903 -2.345 0.956 428 1HG1 VAL 53 HG11 VAL 53 8.089 -4.637 1.344 429 2HG1 VAL 53 HG12 VAL 53 8.071 -3.901 -0.258 430 3HG1 VAL 53 HG13 VAL 53 7.730 -2.919 1.167 431 1HG2 VAL 53 HG21 VAL 53 11.108 -3.343 2.602 432 2HG2 VAL 53 HG22 VAL 53 10.809 -4.968 1.989 433 3HG2 VAL 53 HG23 VAL 53 9.565 -4.134 2.919 434 HA PRO 54 HA PRO 54 14.671 -3.197 -0.783 435 1HB PRO 54 HB2 PRO 54 15.029 -1.281 -2.627 436 2HB PRO 54 HB1 PRO 54 14.691 -2.951 -3.096 437 1HG PRO 54 HG2 PRO 54 12.835 -0.613 -2.954 438 2HG PRO 54 HG1 PRO 54 12.964 -1.862 -4.204 439 1HD PRO 54 HD2 PRO 54 11.080 -1.895 -2.231 440 2HD PRO 54 HD1 PRO 54 11.695 -3.353 -3.017 441 H LYS 55 HN LYS 55 15.564 -2.077 0.829 442 HA LYS 55 HA LYS 55 15.929 0.566 1.158 443 1HB LYS 55 HB2 LYS 55 13.645 1.156 1.236 444 2HB LYS 55 HB1 LYS 55 13.240 -0.196 2.284 445 1HG LYS 55 HG2 LYS 55 13.205 2.012 3.414 446 2HG LYS 55 HG1 LYS 55 14.308 0.850 4.153 447 1HD LYS 55 HD2 LYS 55 16.164 1.903 2.853 448 2HD LYS 55 HD1 LYS 55 15.022 3.143 2.331 449 1HE LYS 55 HE2 LYS 55 14.645 3.800 4.638 450 2HE LYS 55 HE1 LYS 55 15.715 2.516 5.198 451 1HZ LYS 55 HZ1 LYS 55 16.830 4.405 3.281 452 2HZ LYS 55 HZ2 LYS 55 17.553 3.667 4.620 453 3HZ LYS 55 HZ3 LYS 55 16.531 4.997 4.837 454 HA PRO 56 HA PRO 56 15.715 -1.743 5.689 455 1HB PRO 56 HB2 PRO 56 16.240 -4.302 4.230 456 2HB PRO 56 HB1 PRO 56 15.457 -4.043 5.792 457 1HG PRO 56 HG2 PRO 56 14.073 -4.481 3.499 458 2HG PRO 56 HG1 PRO 56 13.440 -3.519 4.844 459 1HD PRO 56 HD2 PRO 56 14.244 -2.664 2.184 460 2HD PRO 56 HD1 PRO 56 13.372 -1.757 3.432 461 H ASN 57 HN ASN 57 17.662 -1.864 6.744 462 HA ASN 57 HA ASN 57 19.914 -1.741 7.057 463 1HB ASN 57 HB2 ASN 57 19.984 -3.533 4.616 464 2HB ASN 57 HB1 ASN 57 21.336 -3.246 5.709 465 1HD2 ASN 57 HD21 ASN 57 21.649 -4.821 7.087 466 2HD2 ASN 57 HD22 ASN 57 20.434 -5.835 7.780 467 H GLY 58 HN GLY 58 18.853 0.430 5.865 468 1HA GLY 58 HA2 GLY 58 19.799 2.372 4.975 469 2HA GLY 58 HA1 GLY 58 21.095 1.403 4.291 470 H CYS 59 HN CYS 59 20.234 -0.199 2.530 471 HA CYS 59 HA CYS 59 17.991 0.774 0.994 472 1HB CYS 59 HB2 CYS 59 20.761 0.932 -0.226 473 2HB CYS 59 HB1 CYS 59 19.244 1.326 -1.023 474 H ARG 60 HN ARG 60 18.562 -1.708 2.225 475 HA ARG 60 HA ARG 60 19.432 -3.502 0.110 476 1HB ARG 60 HB2 ARG 60 19.978 -3.753 2.620 477 2HB ARG 60 HB1 ARG 60 18.342 -4.373 2.779 478 1HG ARG 60 HG2 ARG 60 19.886 -6.207 2.579 479 2HG ARG 60 HG1 ARG 60 18.882 -6.132 1.129 480 1HD ARG 60 HD2 ARG 60 20.678 -4.992 -0.065 481 2HD ARG 60 HD1 ARG 60 21.678 -5.031 1.385 482 HE ARG 60 HE ARG 60 20.918 -7.651 0.764 483 1HH1 ARG 60 HH11 ARG 60 22.897 -5.083 -0.526 484 2HH1 ARG 60 HH12 ARG 60 23.999 -6.158 -1.319 485 1HH2 ARG 60 HH21 ARG 60 22.369 -9.071 -0.280 486 2HH2 ARG 60 HH22 ARG 60 23.700 -8.422 -1.179 487 H LYS 61 HN LYS 61 17.237 -5.371 1.634 488 HA LYS 61 HA LYS 61 14.804 -4.468 0.405 489 1HB LYS 61 HB2 LYS 61 16.154 -6.944 -0.691 490 2HB LYS 61 HB1 LYS 61 14.544 -6.384 -1.107 491 1HG LYS 61 HG2 LYS 61 15.491 -4.381 -2.119 492 2HG LYS 61 HG1 LYS 61 17.110 -4.919 -1.679 493 1HD LYS 61 HD2 LYS 61 16.712 -5.433 -3.997 494 2HD LYS 61 HD1 LYS 61 16.784 -6.933 -3.073 495 1HE LYS 61 HE2 LYS 61 14.196 -5.562 -3.764 496 2HE LYS 61 HE1 LYS 61 14.951 -6.758 -4.814 497 1HZ LYS 61 HZ1 LYS 61 13.886 -8.281 -3.631 498 2HZ LYS 61 HZ2 LYS 61 13.390 -7.154 -2.472 499 3HZ LYS 61 HZ3 LYS 61 14.893 -7.915 -2.321 500 H TRP 62 HN TRP 62 12.996 -5.509 1.225 501 HA TRP 62 HA TRP 62 13.482 -7.824 2.977 502 1HB TRP 62 HB2 TRP 62 13.313 -5.867 4.430 503 2HB TRP 62 HB1 TRP 62 11.783 -5.421 3.685 504 HD1 TRP 62 HD1 TRP 62 9.983 -5.829 5.455 505 HE1 TRP 62 HE1 TRP 62 9.374 -7.743 7.063 506 HE3 TRP 62 HE3 TRP 62 13.922 -8.961 4.530 507 HZ2 TRP 62 HZ2 TRP 62 10.416 -10.246 7.836 508 HZ3 TRP 62 HZ3 TRP 62 14.038 -11.096 5.748 509 HH2 TRP 62 HH2 TRP 62 12.321 -11.723 7.367 510 H GLU 63 HN GLU 63 11.756 -9.296 3.165 511 HA GLU 63 HA GLU 63 9.485 -8.795 1.368 512 1HB GLU 63 HB2 GLU 63 9.551 -11.114 0.595 513 2HB GLU 63 HB1 GLU 63 11.041 -10.271 0.198 514 1HG GLU 63 HG2 GLU 63 10.684 -12.144 2.527 515 2HG GLU 63 HG1 GLU 63 11.397 -12.577 0.975 516 H THR 64 HN THR 64 7.518 -9.456 2.062 517 HA THR 64 HA THR 64 7.264 -11.241 4.330 518 HB THR 64 HB THR 64 6.351 -8.363 4.506 519 HG1 THR 64 HG1 THR 64 8.060 -8.055 5.665 520 1HG2 THR 64 HG21 THR 64 5.859 -10.706 6.298 521 2HG2 THR 64 HG22 THR 64 4.707 -9.532 5.663 522 3HG2 THR 64 HG23 THR 64 5.859 -9.051 6.909 523 H THR 65 HN THR 65 5.353 -12.308 4.327 524 HA THR 65 HA THR 65 3.522 -11.692 2.133 525 HB THR 65 HB THR 65 3.862 -14.147 3.863 526 HG1 THR 65 HG1 THR 65 5.066 -14.846 2.301 527 1HG2 THR 65 HG21 THR 65 1.681 -14.459 3.336 528 2HG2 THR 65 HG22 THR 65 2.433 -15.118 1.884 529 3HG2 THR 65 HG23 THR 65 1.773 -13.482 1.871 530 H PHE 66 HN PHE 66 1.703 -10.598 2.535 531 HA PHE 66 HA PHE 66 0.563 -10.737 5.254 532 1HB PHE 66 HB2 PHE 66 0.713 -8.548 3.236 533 2HB PHE 66 HB1 PHE 66 -0.711 -8.613 4.265 534 HD1 PHE 66 HD1 PHE 66 -0.307 -6.575 5.397 535 HD2 PHE 66 HD2 PHE 66 2.652 -9.637 5.400 536 HE1 PHE 66 HE1 PHE 66 0.907 -5.392 7.178 537 HE2 PHE 66 HE2 PHE 66 3.871 -8.455 7.185 538 HZ PHE 66 HZ PHE 66 2.999 -6.331 8.074 539 H LYS 67 HN LYS 67 -1.151 -12.025 5.413 540 HA LYS 67 HA LYS 67 -2.903 -12.344 3.071 541 1HB LYS 67 HB2 LYS 67 -3.394 -14.535 3.703 542 2HB LYS 67 HB1 LYS 67 -1.685 -14.387 4.066 543 1HG LYS 67 HG2 LYS 67 -3.859 -14.057 6.118 544 2HG LYS 67 HG1 LYS 67 -3.059 -15.587 5.776 545 1HD LYS 67 HD2 LYS 67 -1.583 -13.100 6.617 546 2HD LYS 67 HD1 LYS 67 -2.182 -14.299 7.755 547 1HE LYS 67 HE2 LYS 67 0.070 -14.860 7.393 548 2HE LYS 67 HE1 LYS 67 -0.858 -16.011 6.435 549 1HZ LYS 67 HZ1 LYS 67 -0.108 -13.619 5.010 550 2HZ LYS 67 HZ2 LYS 67 0.007 -15.239 4.541 551 3HZ LYS 67 HZ3 LYS 67 1.206 -14.554 5.518 552 H LYS 68 HN LYS 68 -5.192 -12.411 3.376 553 HA LYS 68 HA LYS 68 -6.451 -11.962 5.859 554 1HB LYS 68 HB2 LYS 68 -7.025 -9.588 5.638 555 2HB LYS 68 HB1 LYS 68 -5.288 -9.819 5.759 556 1HG LYS 68 HG2 LYS 68 -6.759 -9.422 3.167 557 2HG LYS 68 HG1 LYS 68 -5.983 -8.135 4.082 558 1HD LYS 68 HD2 LYS 68 -3.830 -9.378 3.882 559 2HD LYS 68 HD1 LYS 68 -4.651 -10.527 2.826 560 1HE LYS 68 HE2 LYS 68 -5.205 -8.691 1.288 561 2HE LYS 68 HE1 LYS 68 -4.327 -7.576 2.331 562 1HZ LYS 68 HZ1 LYS 68 -2.322 -8.397 1.687 563 2HZ LYS 68 HZ2 LYS 68 -3.191 -8.682 0.265 564 3HZ LYS 68 HZ3 LYS 68 -2.915 -9.946 1.354 565 H THR 69 HN THR 69 -8.592 -10.267 4.991 566 HA THR 69 HA THR 69 -9.742 -11.901 2.815 567 HB THR 69 HB THR 69 -11.933 -11.664 3.900 568 HG1 THR 69 HG1 THR 69 -12.020 -9.996 5.180 569 1HG2 THR 69 HG21 THR 69 -10.935 -12.684 6.277 570 2HG2 THR 69 HG22 THR 69 -9.742 -13.133 5.059 571 3HG2 THR 69 HG23 THR 69 -11.430 -13.596 4.850 572 H SER 70 HN SER 70 -11.362 -10.845 1.479 573 HA SER 70 HA SER 70 -11.290 -7.911 1.567 574 1HB SER 70 HB2 SER 70 -10.972 -7.832 -0.886 575 2HB SER 70 HB1 SER 70 -9.600 -8.569 -0.061 576 HG SER 70 HG SER 70 -11.139 -9.606 -1.972 577 H ASP 71 HN ASP 71 -13.131 -6.882 0.963 578 HA ASP 71 HA ASP 71 -15.488 -8.568 0.598 579 1HB ASP 71 HB2 ASP 71 -15.544 -6.817 2.319 580 2HB ASP 71 HB1 ASP 71 -15.277 -5.594 1.081 581 H ASP 72 HN ASP 72 -17.165 -7.952 -0.964 582 HA ASP 72 HA ASP 72 -16.053 -7.590 -3.575 583 1HB ASP 72 HB2 ASP 72 -18.379 -7.886 -4.348 584 2HB ASP 72 HB1 ASP 72 -17.916 -9.127 -3.191 585 H GLY 73 HN GLY 73 -18.247 -6.136 -4.787 586 1HA GLY 73 HA2 GLY 73 -18.856 -3.995 -5.357 587 2HA GLY 73 HA1 GLY 73 -18.609 -3.565 -3.670 588 H GLU 74 HN GLU 74 -16.216 -3.474 -3.061 589 HA GLU 74 HA GLU 74 -14.643 -2.198 -5.199 590 1HB GLU 74 HB2 GLU 74 -13.791 -0.598 -3.545 591 2HB GLU 74 HB1 GLU 74 -15.542 -0.493 -3.644 592 1HG GLU 74 HG2 GLU 74 -14.138 -2.124 -1.553 593 2HG GLU 74 HG1 GLU 74 -14.530 -0.421 -1.330 594 H VAL 75 HN VAL 75 -12.460 -1.874 -3.001 595 HA VAL 75 HA VAL 75 -11.981 -4.692 -2.456 596 HB VAL 75 HB VAL 75 -10.884 -4.576 -4.542 597 1HG1 VAL 75 HG11 VAL 75 -10.352 -1.846 -3.793 598 2HG1 VAL 75 HG12 VAL 75 -10.360 -2.595 -5.386 599 3HG1 VAL 75 HG13 VAL 75 -8.902 -2.639 -4.398 600 1HG2 VAL 75 HG21 VAL 75 -9.572 -5.278 -2.293 601 2HG2 VAL 75 HG22 VAL 75 -8.459 -4.079 -2.950 602 3HG2 VAL 75 HG23 VAL 75 -8.918 -5.479 -3.918 603 H TYR 76 HN TYR 76 -11.714 -4.728 -0.369 604 HA TYR 76 HA TYR 76 -9.714 -3.003 0.836 605 1HB TYR 76 HB2 TYR 76 -11.110 -2.207 2.606 606 2HB TYR 76 HB1 TYR 76 -11.933 -1.851 1.098 607 HD1 TYR 76 HD1 TYR 76 -14.205 -2.206 1.055 608 HD2 TYR 76 HD2 TYR 76 -11.829 -4.580 3.669 609 HE1 TYR 76 HE1 TYR 76 -16.244 -3.239 1.962 610 HE2 TYR 76 HE2 TYR 76 -13.859 -5.628 4.571 611 HH TYR 76 HH TYR 76 -16.981 -5.138 3.148 612 H TYR 77 HN TYR 77 -8.486 -4.063 2.240 613 HA TYR 77 HA TYR 77 -9.413 -6.730 3.028 614 1HB TYR 77 HB2 TYR 77 -7.282 -7.591 2.770 615 2HB TYR 77 HB1 TYR 77 -7.387 -6.449 1.450 616 HD1 TYR 77 HD1 TYR 77 -5.447 -5.303 1.024 617 HD2 TYR 77 HD2 TYR 77 -6.315 -6.335 5.066 618 HE1 TYR 77 HE1 TYR 77 -3.319 -4.297 1.739 619 HE2 TYR 77 HE2 TYR 77 -4.199 -5.317 5.785 620 HH TYR 77 HH TYR 77 -1.712 -4.740 3.940 621 H SER 78 HN SER 78 -9.061 -7.490 5.077 622 HA SER 78 HA SER 78 -7.900 -5.728 7.072 623 1HB SER 78 HB2 SER 78 -10.782 -6.654 7.216 624 2HB SER 78 HB1 SER 78 -9.915 -5.818 8.504 625 HG SER 78 HG SER 78 -11.215 -4.762 6.446 626 H GLU 79 HN GLU 79 -7.321 -6.807 8.999 627 HA GLU 79 HA GLU 79 -7.960 -9.583 9.371 628 1HB GLU 79 HB2 GLU 79 -5.672 -10.435 9.161 629 2HB GLU 79 HB1 GLU 79 -6.251 -9.777 7.635 630 1HG GLU 79 HG2 GLU 79 -4.999 -7.715 8.065 631 2HG GLU 79 HG1 GLU 79 -4.401 -8.411 9.570 632 H GLU 80 HN GLU 80 -7.895 -10.106 11.438 633 HA GLU 80 HA GLU 80 -7.625 -10.012 13.686 634 1HB GLU 80 HB2 GLU 80 -4.986 -8.760 12.902 635 2HB GLU 80 HB1 GLU 80 -5.398 -9.258 14.536 636 1HG GLU 80 HG2 GLU 80 -5.581 -11.562 13.820 637 2HG GLU 80 HG1 GLU 80 -5.273 -11.090 12.150 638 H ALA 81 HN ALA 81 -5.934 -7.055 12.803 639 HA ALA 81 HA ALA 81 -7.890 -5.162 13.234 640 1HB ALA 81 HB1 ALA 81 -8.239 -5.629 15.480 641 2HB ALA 81 HB2 ALA 81 -6.990 -4.387 15.576 642 3HB ALA 81 HB3 ALA 81 -6.557 -6.087 15.754 643 H LYS 82 HN LYS 82 -4.620 -5.690 14.498 644 HA LYS 82 HA LYS 82 -3.369 -3.351 14.058 645 1HB LYS 82 HB2 LYS 82 -2.194 -6.026 13.288 646 2HB LYS 82 HB1 LYS 82 -1.301 -4.580 13.734 647 1HG LYS 82 HG2 LYS 82 -2.230 -4.714 15.996 648 2HG LYS 82 HG1 LYS 82 -3.098 -6.181 15.545 649 1HD LYS 82 HD2 LYS 82 -0.101 -5.822 15.529 650 2HD LYS 82 HD1 LYS 82 -1.031 -6.700 16.744 651 1HE LYS 82 HE2 LYS 82 -1.795 -8.265 15.023 652 2HE LYS 82 HE1 LYS 82 -0.862 -7.388 13.812 653 1HZ LYS 82 HZ1 LYS 82 0.636 -8.981 14.330 654 2HZ LYS 82 HZ2 LYS 82 0.050 -9.206 15.900 655 3HZ LYS 82 HZ3 LYS 82 1.048 -7.886 15.553 656 H LYS 83 HN LYS 83 -4.374 -5.680 11.601 657 HA LYS 83 HA LYS 83 -3.405 -3.785 9.561 658 1HB LYS 83 HB2 LYS 83 -3.466 -6.770 9.585 659 2HB LYS 83 HB1 LYS 83 -3.621 -5.928 8.055 660 1HG LYS 83 HG2 LYS 83 -1.331 -6.501 8.364 661 2HG LYS 83 HG1 LYS 83 -1.489 -4.756 8.542 662 1HD LYS 83 HD2 LYS 83 -0.054 -5.392 10.276 663 2HD LYS 83 HD1 LYS 83 -1.619 -5.208 11.056 664 1HE LYS 83 HE2 LYS 83 -0.505 -7.839 10.105 665 2HE LYS 83 HE1 LYS 83 -0.339 -7.236 11.752 666 1HZ LYS 83 HZ1 LYS 83 -2.960 -7.031 11.435 667 2HZ LYS 83 HZ2 LYS 83 -2.212 -8.423 12.034 668 3HZ LYS 83 HZ3 LYS 83 -2.663 -8.341 10.407 669 H LYS 84 HN LYS 84 -5.002 -2.631 8.830 670 HA LYS 84 HA LYS 84 -7.385 -3.901 7.764 671 1HB LYS 84 HB2 LYS 84 -8.037 -3.338 10.075 672 2HB LYS 84 HB1 LYS 84 -7.528 -1.676 9.816 673 1HG LYS 84 HG2 LYS 84 -9.255 -1.408 8.112 674 2HG LYS 84 HG1 LYS 84 -9.766 -3.077 8.369 675 1HD LYS 84 HD2 LYS 84 -9.812 -0.878 10.435 676 2HD LYS 84 HD1 LYS 84 -11.212 -1.501 9.561 677 1HE LYS 84 HE2 LYS 84 -9.445 -3.069 11.437 678 2HE LYS 84 HE1 LYS 84 -11.063 -2.468 11.797 679 1HZ LYS 84 HZ1 LYS 84 -11.545 -3.852 9.585 680 2HZ LYS 84 HZ2 LYS 84 -11.636 -4.526 11.133 681 3HZ LYS 84 HZ3 LYS 84 -10.247 -4.750 10.195 682 H VAL 85 HN VAL 85 -7.682 -3.035 5.774 683 HA VAL 85 HA VAL 85 -7.052 -0.213 5.349 684 HB VAL 85 HB VAL 85 -5.488 -0.546 3.626 685 1HG1 VAL 85 HG11 VAL 85 -4.692 -2.725 5.524 686 2HG1 VAL 85 HG12 VAL 85 -4.728 -1.033 6.013 687 3HG1 VAL 85 HG13 VAL 85 -3.671 -1.547 4.701 688 1HG2 VAL 85 HG21 VAL 85 -6.777 -2.537 2.649 689 2HG2 VAL 85 HG22 VAL 85 -5.794 -3.527 3.719 690 3HG2 VAL 85 HG23 VAL 85 -5.023 -2.537 2.484 691 H GLU 86 HN GLU 86 -7.789 0.629 3.289 692 HA GLU 86 HA GLU 86 -9.854 -1.023 2.003 693 1HB GLU 86 HB2 GLU 86 -10.045 1.926 2.644 694 2HB GLU 86 HB1 GLU 86 -11.231 1.011 1.722 695 1HG GLU 86 HG2 GLU 86 -11.666 -0.388 3.686 696 2HG GLU 86 HG1 GLU 86 -10.495 0.554 4.606 697 H VAL 87 HN VAL 87 -9.204 -1.443 0.008 698 HA VAL 87 HA VAL 87 -7.407 0.352 -1.385 699 HB VAL 87 HB VAL 87 -8.571 -2.157 -2.556 700 1HG1 VAL 87 HG11 VAL 87 -6.628 -0.234 -3.388 701 2HG1 VAL 87 HG12 VAL 87 -7.279 -1.614 -4.268 702 3HG1 VAL 87 HG13 VAL 87 -5.871 -1.817 -3.228 703 1HG2 VAL 87 HG21 VAL 87 -6.013 -2.147 -1.004 704 2HG2 VAL 87 HG22 VAL 87 -6.975 -3.517 -1.545 705 3HG2 VAL 87 HG23 VAL 87 -7.556 -2.498 -0.230 706 H LEU 88 HN LEU 88 -7.960 1.813 -2.781 707 HA LEU 88 HA LEU 88 -10.671 1.797 -3.931 708 1HB LEU 88 HB2 LEU 88 -8.919 4.210 -3.481 709 2HB LEU 88 HB1 LEU 88 -10.634 4.183 -3.848 710 HG LEU 88 HG LEU 88 -9.461 3.127 -1.277 711 1HD1 LEU 88 HD11 LEU 88 -8.999 5.405 -1.169 712 2HD1 LEU 88 HD12 LEU 88 -10.557 5.253 -0.358 713 3HD1 LEU 88 HD13 LEU 88 -10.481 5.845 -2.017 714 1HD2 LEU 88 HD21 LEU 88 -12.016 3.747 -0.738 715 2HD2 LEU 88 HD22 LEU 88 -11.499 2.151 -1.281 716 3HD2 LEU 88 HD23 LEU 88 -12.169 3.302 -2.437 717 H ASP 89 HN ASP 89 -10.055 4.018 -5.709 718 HA ASP 89 HA ASP 89 -9.360 4.393 -7.834 719 1HB ASP 89 HB2 ASP 89 -7.151 4.408 -6.593 720 2HB ASP 89 HB1 ASP 89 -6.925 2.750 -7.135 721 H THR 90 HN THR 90 -7.402 1.913 -8.795 722 HA THR 90 HA THR 90 -9.644 0.175 -9.552 723 HB THR 90 HB THR 90 -7.434 1.107 -11.399 724 HG1 THR 90 HG1 THR 90 -8.781 2.603 -11.923 725 1HG2 THR 90 HG21 THR 90 -9.463 -1.025 -11.652 726 2HG2 THR 90 HG22 THR 90 -7.845 -0.903 -12.344 727 3HG2 THR 90 HG23 THR 90 -9.180 0.002 -13.058 728 H ASP 91 HN ASP 91 -9.228 -1.671 -8.517 729 HA ASP 91 HA ASP 91 -6.462 -2.565 -8.213 730 1HB ASP 91 HB2 ASP 91 -8.254 -2.538 -6.329 731 2HB ASP 91 HB1 ASP 91 -8.869 -3.991 -7.109 732 H TYR 92 HN TYR 92 -7.740 -2.641 -10.827 733 HA TYR 92 HA TYR 92 -7.943 -5.541 -11.255 734 1HB TYR 92 HB2 TYR 92 -9.170 -3.204 -12.668 735 2HB TYR 92 HB1 TYR 92 -8.946 -4.725 -13.525 736 HD1 TYR 92 HD1 TYR 92 -9.528 -5.177 -10.021 737 HD2 TYR 92 HD2 TYR 92 -11.489 -4.543 -13.742 738 HE1 TYR 92 HE1 TYR 92 -11.615 -6.023 -9.053 739 HE2 TYR 92 HE2 TYR 92 -13.587 -5.392 -12.781 740 HH TYR 92 HH TYR 92 -13.995 -5.904 -9.423 741 H LYS 93 HN LYS 93 -7.326 -3.288 -13.901 742 HA LYS 93 HA LYS 93 -4.540 -4.166 -13.956 743 1HB LYS 93 HB2 LYS 93 -4.587 -4.993 -16.160 744 2HB LYS 93 HB1 LYS 93 -5.960 -5.721 -15.347 745 1HG LYS 93 HG2 LYS 93 -5.976 -3.521 -17.396 746 2HG LYS 93 HG1 LYS 93 -6.660 -5.137 -17.522 747 1HD LYS 93 HD2 LYS 93 -8.284 -4.564 -15.759 748 2HD LYS 93 HD1 LYS 93 -7.621 -2.929 -15.712 749 1HE LYS 93 HE2 LYS 93 -9.643 -2.996 -17.069 750 2HE LYS 93 HE1 LYS 93 -8.236 -2.602 -18.054 751 1HZ LYS 93 HZ1 LYS 93 -8.288 -4.630 -19.101 752 2HZ LYS 93 HZ2 LYS 93 -9.941 -4.353 -18.877 753 3HZ LYS 93 HZ3 LYS 93 -9.112 -5.403 -17.841 754 H SER 94 HN SER 94 -4.122 -2.004 -13.315 755 HA SER 94 HA SER 94 -3.271 -0.339 -15.363 756 1HB SER 94 HB2 SER 94 -4.876 1.568 -15.124 757 2HB SER 94 HB1 SER 94 -5.599 0.138 -15.860 758 HG SER 94 HG SER 94 -6.907 1.090 -14.205 759 H TYR 95 HN TYR 95 -5.014 0.895 -12.565 760 HA TYR 95 HA TYR 95 -2.559 1.107 -11.026 761 1HB TYR 95 HB2 TYR 95 -3.153 3.590 -10.604 762 2HB TYR 95 HB1 TYR 95 -2.340 3.168 -12.106 763 HD1 TYR 95 HD1 TYR 95 -5.845 3.511 -10.808 764 HD2 TYR 95 HD2 TYR 95 -3.138 4.129 -14.028 765 HE1 TYR 95 HE1 TYR 95 -7.634 4.601 -12.090 766 HE2 TYR 95 HE2 TYR 95 -4.919 5.227 -15.321 767 HH TYR 95 HH TYR 95 -7.337 5.312 -15.422 768 H ALA 96 HN ALA 96 -2.907 0.893 -8.888 769 HA ALA 96 HA ALA 96 -5.673 1.171 -7.918 770 1HB ALA 96 HB1 ALA 96 -4.423 -1.256 -8.292 771 2HB ALA 96 HB2 ALA 96 -5.814 -0.957 -7.252 772 3HB ALA 96 HB3 ALA 96 -4.185 -0.942 -6.574 773 H VAL 97 HN VAL 97 -5.927 1.973 -5.859 774 HA VAL 97 HA VAL 97 -3.446 2.682 -4.439 775 HB VAL 97 HB VAL 97 -4.329 4.775 -3.775 776 1HG1 VAL 97 HG11 VAL 97 -4.121 4.082 -6.541 777 2HG1 VAL 97 HG12 VAL 97 -3.691 5.592 -5.738 778 3HG1 VAL 97 HG13 VAL 97 -5.328 5.349 -6.346 779 1HG2 VAL 97 HG21 VAL 97 -6.922 3.616 -4.614 780 2HG2 VAL 97 HG22 VAL 97 -6.709 5.353 -4.840 781 3HG2 VAL 97 HG23 VAL 97 -6.535 4.640 -3.236 782 H ILE 98 HN ILE 98 -3.349 2.112 -2.348 783 HA ILE 98 HA ILE 98 -5.843 1.328 -1.024 784 HB ILE 98 HB ILE 98 -4.998 -0.751 -1.683 785 1HG1 ILE 98 HG12 ILE 98 -4.413 -1.882 0.373 786 2HG1 ILE 98 HG11 ILE 98 -3.874 -0.370 1.098 787 1HG2 ILE 98 HG21 ILE 98 -2.270 -0.302 -0.578 788 2HG2 ILE 98 HG22 ILE 98 -2.676 0.306 -2.183 789 3HG2 ILE 98 HG23 ILE 98 -2.812 -1.415 -1.831 790 1HD1 ILE 98 HD11 ILE 98 -5.904 -0.104 1.919 791 2HD1 ILE 98 HD12 ILE 98 -6.477 -1.532 1.060 792 3HD1 ILE 98 HD13 ILE 98 -6.517 0.043 0.276 793 H TYR 99 HN TYR 99 -6.119 2.510 0.708 794 HA TYR 99 HA TYR 99 -3.877 3.754 2.065 795 1HB TYR 99 HB2 TYR 99 -5.795 5.149 1.765 796 2HB TYR 99 HB1 TYR 99 -6.872 3.914 2.404 797 HD1 TYR 99 HD1 TYR 99 -7.846 4.722 4.327 798 HD2 TYR 99 HD2 TYR 99 -3.689 5.365 3.723 799 HE1 TYR 99 HE1 TYR 99 -7.682 5.724 6.565 800 HE2 TYR 99 HE2 TYR 99 -3.510 6.369 5.960 801 HH TYR 99 HH TYR 99 -4.615 6.516 8.004 802 H ALA 100 HN ALA 100 -2.830 2.757 3.674 803 HA ALA 100 HA ALA 100 -4.172 0.541 5.028 804 1HB ALA 100 HB1 ALA 100 -1.811 0.473 3.871 805 2HB ALA 100 HB2 ALA 100 -2.144 -0.455 5.332 806 3HB ALA 100 HB3 ALA 100 -1.284 1.078 5.439 807 H THR 101 HN THR 101 -4.584 0.465 7.155 808 HA THR 101 HA THR 101 -3.551 2.600 8.878 809 HB THR 101 HB THR 101 -5.772 2.835 9.930 810 HG1 THR 101 HG1 THR 101 -6.609 1.121 7.833 811 1HG2 THR 101 HG21 THR 101 -6.281 4.482 8.550 812 2HG2 THR 101 HG22 THR 101 -6.699 3.351 7.263 813 3HG2 THR 101 HG23 THR 101 -5.029 3.880 7.464 814 H ARG 102 HN ARG 102 -2.821 1.892 10.793 815 HA ARG 102 HA ARG 102 -3.055 -0.944 11.376 816 1HB ARG 102 HB2 ARG 102 -1.458 1.162 12.830 817 2HB ARG 102 HB1 ARG 102 -1.325 -0.571 13.045 818 1HG ARG 102 HG2 ARG 102 -0.681 0.893 10.498 819 2HG ARG 102 HG1 ARG 102 0.502 0.395 11.707 820 1HD ARG 102 HD2 ARG 102 0.534 -1.257 10.010 821 2HD ARG 102 HD1 ARG 102 -0.316 -1.960 11.384 822 HE ARG 102 HE ARG 102 -2.116 -2.215 10.024 823 1HH1 ARG 102 HH11 ARG 102 -0.177 0.395 8.759 824 2HH1 ARG 102 HH12 ARG 102 -1.189 0.644 7.377 825 1HH2 ARG 102 HH21 ARG 102 -3.435 -1.899 8.200 826 2HH2 ARG 102 HH22 ARG 102 -3.033 -0.666 7.055 827 H VAL 103 HN VAL 103 -3.922 -1.824 13.233 828 HA VAL 103 HA VAL 103 -5.205 -0.008 15.139 829 HB VAL 103 HB VAL 103 -6.658 -2.357 13.914 830 1HG1 VAL 103 HG11 VAL 103 -8.595 -1.463 15.162 831 2HG1 VAL 103 HG12 VAL 103 -7.526 -0.284 15.922 832 3HG1 VAL 103 HG13 VAL 103 -7.290 -2.007 16.216 833 1HG2 VAL 103 HG21 VAL 103 -6.398 -0.431 12.367 834 2HG2 VAL 103 HG22 VAL 103 -7.213 0.585 13.556 835 3HG2 VAL 103 HG23 VAL 103 -8.075 -0.758 12.806 836 H LYS 104 HN LYS 104 -4.243 -0.480 16.980 837 HA LYS 104 HA LYS 104 -4.350 -3.199 18.008 838 1HB LYS 104 HB2 LYS 104 -2.170 -3.053 16.814 839 2HB LYS 104 HB1 LYS 104 -1.731 -1.690 17.831 840 1HG LYS 104 HG2 LYS 104 -0.682 -3.744 18.597 841 2HG LYS 104 HG1 LYS 104 -1.805 -3.113 19.801 842 1HD LYS 104 HD2 LYS 104 -3.491 -4.725 19.095 843 2HD LYS 104 HD1 LYS 104 -2.405 -5.331 17.844 844 1HE LYS 104 HE2 LYS 104 -1.919 -5.440 20.819 845 2HE LYS 104 HE1 LYS 104 -2.410 -6.792 19.802 846 1HZ LYS 104 HZ1 LYS 104 -0.041 -6.838 20.220 847 2HZ LYS 104 HZ2 LYS 104 0.139 -5.284 19.577 848 3HZ LYS 104 HZ3 LYS 104 -0.332 -6.563 18.576 849 H ASP 105 HN ASP 105 -4.882 -3.142 20.125 850 HA ASP 105 HA ASP 105 -5.537 -2.252 22.122 851 1HB ASP 105 HB2 ASP 105 -2.828 -0.929 21.848 852 2HB ASP 105 HB1 ASP 105 -3.753 -1.016 23.342 853 H GLY 106 HN GLY 106 -4.256 0.613 22.755 854 1HA GLY 106 HA2 GLY 106 -6.543 2.035 21.594 855 2HA GLY 106 HA1 GLY 106 -5.653 2.526 23.027 856 H ARG 107 HN ARG 107 -4.414 1.607 19.815 857 HA ARG 107 HA ARG 107 -3.624 4.386 19.400 858 1HB ARG 107 HB2 ARG 107 -1.347 3.726 18.707 859 2HB ARG 107 HB1 ARG 107 -1.658 3.438 20.410 860 1HG ARG 107 HG2 ARG 107 -2.085 1.191 18.522 861 2HG ARG 107 HG1 ARG 107 -0.428 1.674 18.887 862 1HD ARG 107 HD2 ARG 107 -0.967 1.472 21.306 863 2HD ARG 107 HD1 ARG 107 -2.550 0.840 20.862 864 HE ARG 107 HE ARG 107 -1.557 -1.182 20.518 865 1HH1 ARG 107 HH11 ARG 107 0.897 1.289 20.251 866 2HH1 ARG 107 HH12 ARG 107 2.186 0.157 20.010 867 1HH2 ARG 107 HH21 ARG 107 0.138 -2.670 20.211 868 2HH2 ARG 107 HH22 ARG 107 1.755 -2.092 19.988 869 H THR 108 HN THR 108 -3.700 5.074 17.375 870 HA THR 108 HA THR 108 -4.330 3.109 15.275 871 HB THR 108 HB THR 108 -6.287 4.437 15.839 872 HG1 THR 108 HG1 THR 108 -5.971 3.966 13.638 873 1HG2 THR 108 HG21 THR 108 -5.605 6.434 16.773 874 2HG2 THR 108 HG22 THR 108 -6.169 6.927 15.176 875 3HG2 THR 108 HG23 THR 108 -4.441 6.757 15.488 876 H LEU 109 HN LEU 109 -3.495 3.481 13.200 877 HA LEU 109 HA LEU 109 -1.469 5.600 12.991 878 1HB LEU 109 HB2 LEU 109 -1.129 2.743 12.089 879 2HB LEU 109 HB1 LEU 109 0.011 4.039 11.806 880 HG LEU 109 HG LEU 109 0.813 2.686 13.621 881 1HD1 LEU 109 HD11 LEU 109 1.461 4.404 14.923 882 2HD1 LEU 109 HD12 LEU 109 -0.189 4.962 15.198 883 3HD1 LEU 109 HD13 LEU 109 0.639 5.366 13.695 884 1HD2 LEU 109 HD21 LEU 109 -0.483 1.732 15.157 885 2HD2 LEU 109 HD22 LEU 109 -1.869 2.333 14.250 886 3HD2 LEU 109 HD23 LEU 109 -1.222 3.272 15.594 887 H HIS 110 HN HIS 110 -1.204 6.516 10.976 888 HA HIS 110 HA HIS 110 -3.165 5.675 8.944 889 1HB HIS 110 HB2 HIS 110 -2.141 8.470 9.455 890 2HB HIS 110 HB1 HIS 110 -3.379 8.005 8.294 891 HD1 HIS 110 HD1 HIS 110 -5.379 6.476 9.771 892 HD2 HIS 110 HD2 HIS 110 -3.341 9.616 11.574 893 HE1 HIS 110 HE1 HIS 110 -6.827 7.200 11.692 894 HE2 HIS 110 HE2 HIS 110 -5.509 9.010 12.847 895 H MET 111 HN MET 111 -2.372 5.105 7.026 896 HA MET 111 HA MET 111 -0.048 6.351 5.906 897 1HB MET 111 HB2 MET 111 1.328 4.345 5.747 898 2HB MET 111 HB1 MET 111 1.015 4.761 7.427 899 1HG MET 111 HG2 MET 111 -0.664 3.032 7.579 900 2HG MET 111 HG1 MET 111 -0.450 2.647 5.873 901 1HE MET 111 HE1 MET 111 2.724 3.520 8.179 902 2HE MET 111 HE2 MET 111 2.771 2.016 9.098 903 3HE MET 111 HE3 MET 111 1.371 3.082 9.221 904 H MET 112 HN MET 112 -0.393 6.501 3.810 905 HA MET 112 HA MET 112 -2.403 4.845 2.541 906 1HB MET 112 HB2 MET 112 -0.985 7.364 1.789 907 2HB MET 112 HB1 MET 112 -1.693 6.381 0.521 908 1HG MET 112 HG2 MET 112 -3.289 8.014 1.062 909 2HG MET 112 HG1 MET 112 -3.865 6.508 1.768 910 1HE MET 112 HE1 MET 112 -4.851 9.808 3.192 911 2HE MET 112 HE2 MET 112 -5.397 8.557 4.307 912 3HE MET 112 HE3 MET 112 -5.440 8.267 2.568 913 H ARG 113 HN ARG 113 -2.074 3.673 0.628 914 HA ARG 113 HA ARG 113 0.676 3.132 -0.172 915 1HB ARG 113 HB2 ARG 113 0.113 1.440 1.555 916 2HB ARG 113 HB1 ARG 113 -1.261 0.932 0.586 917 1HG ARG 113 HG2 ARG 113 0.234 0.219 -1.193 918 2HG ARG 113 HG1 ARG 113 1.626 0.765 -0.254 919 1HD ARG 113 HD2 ARG 113 -0.313 -1.418 0.507 920 2HD ARG 113 HD1 ARG 113 1.350 -1.632 -0.036 921 HE ARG 113 HE ARG 113 1.367 0.027 2.216 922 1HH1 ARG 113 HH11 ARG 113 0.663 -3.283 1.371 923 2HH1 ARG 113 HH12 ARG 113 1.085 -3.904 2.931 924 1HH2 ARG 113 HH21 ARG 113 1.921 -0.792 4.279 925 2HH2 ARG 113 HH22 ARG 113 1.798 -2.494 4.580 926 H LEU 114 HN LEU 114 0.835 2.363 -2.348 927 HA LEU 114 HA LEU 114 -1.663 2.102 -3.839 928 1HB LEU 114 HB2 LEU 114 -1.084 4.513 -3.812 929 2HB LEU 114 HB1 LEU 114 0.452 4.132 -4.561 930 HG LEU 114 HG LEU 114 -2.234 3.624 -5.846 931 1HD1 LEU 114 HD11 LEU 114 -2.084 5.628 -6.953 932 2HD1 LEU 114 HD12 LEU 114 -0.339 5.746 -6.731 933 3HD1 LEU 114 HD13 LEU 114 -1.423 6.065 -5.377 934 1HD2 LEU 114 HD21 LEU 114 -0.621 3.648 -7.899 935 2HD2 LEU 114 HD22 LEU 114 -0.796 2.184 -6.932 936 3HD2 LEU 114 HD23 LEU 114 0.602 3.234 -6.698 937 H TYR 115 HN TYR 115 -1.512 0.442 -5.172 938 HA TYR 115 HA TYR 115 1.154 -0.469 -5.991 939 1HB TYR 115 HB2 TYR 115 -1.486 -1.939 -5.925 940 2HB TYR 115 HB1 TYR 115 0.023 -2.620 -6.513 941 HD1 TYR 115 HD1 TYR 115 -1.664 -1.293 -3.482 942 HD2 TYR 115 HD2 TYR 115 1.594 -3.563 -5.013 943 HE1 TYR 115 HE1 TYR 115 -1.120 -2.054 -1.203 944 HE2 TYR 115 HE2 TYR 115 2.136 -4.329 -2.744 945 HH TYR 115 HH TYR 115 0.449 -4.533 -0.417 946 H SER 116 HN SER 116 1.792 -0.111 -8.000 947 HA SER 116 HA SER 116 -0.226 0.448 -10.066 948 1HB SER 116 HB2 SER 116 1.617 1.555 -11.301 949 2HB SER 116 HB1 SER 116 1.366 2.276 -9.711 950 HG SER 116 HG SER 116 3.403 1.886 -9.421 951 H ARG 117 HN ARG 117 -0.366 -0.829 -11.869 952 HA ARG 117 HA ARG 117 0.778 -3.410 -11.799 953 1HB ARG 117 HB2 ARG 117 -0.385 -2.031 -14.220 954 2HB ARG 117 HB1 ARG 117 -0.241 -3.763 -13.953 955 1HG ARG 117 HG2 ARG 117 -1.980 -1.876 -12.381 956 2HG ARG 117 HG1 ARG 117 -2.520 -3.005 -13.625 957 1HD ARG 117 HD2 ARG 117 -1.895 -4.884 -12.296 958 2HD ARG 117 HD1 ARG 117 -1.077 -3.852 -11.122 959 HE ARG 117 HE ARG 117 -3.668 -2.977 -11.148 960 1HH1 ARG 117 HH11 ARG 117 -2.119 -6.051 -10.582 961 2HH1 ARG 117 HH12 ARG 117 -3.312 -6.577 -9.444 962 1HH2 ARG 117 HH21 ARG 117 -5.211 -3.654 -9.639 963 2HH2 ARG 117 HH22 ARG 117 -5.066 -5.214 -8.900 964 H SER 118 HN SER 118 1.502 -0.588 -13.810 965 HA SER 118 HA SER 118 4.209 -1.622 -14.227 966 1HB SER 118 HB2 SER 118 2.394 -0.620 -16.440 967 2HB SER 118 HB1 SER 118 4.097 -1.027 -16.631 968 HG SER 118 HG SER 118 3.612 -3.084 -16.626 969 HA PRO 119 HA PRO 119 5.941 2.379 -13.552 970 1HB PRO 119 HB2 PRO 119 6.410 2.534 -16.511 971 2HB PRO 119 HB1 PRO 119 7.496 2.958 -15.182 972 1HG PRO 119 HG2 PRO 119 7.760 0.639 -16.477 973 2HG PRO 119 HG1 PRO 119 8.023 0.749 -14.727 974 1HD PRO 119 HD2 PRO 119 5.791 -0.485 -16.222 975 2HD PRO 119 HD1 PRO 119 6.386 -0.837 -14.589 976 H GLU 120 HN GLU 120 3.785 2.026 -16.317 977 HA GLU 120 HA GLU 120 3.082 4.733 -16.623 978 1HB GLU 120 HB2 GLU 120 1.448 2.261 -17.228 979 2HB GLU 120 HB1 GLU 120 1.108 3.879 -17.825 980 1HG GLU 120 HG2 GLU 120 3.216 3.879 -19.046 981 2HG GLU 120 HG1 GLU 120 3.571 2.263 -18.436 982 H VAL 121 HN VAL 121 1.642 6.010 -15.616 983 HA VAL 121 HA VAL 121 -0.424 4.929 -13.920 984 HB VAL 121 HB VAL 121 1.750 6.633 -12.683 985 1HG1 VAL 121 HG11 VAL 121 -0.378 7.235 -11.752 986 2HG1 VAL 121 HG12 VAL 121 0.477 6.235 -10.578 987 3HG1 VAL 121 HG13 VAL 121 -0.821 5.540 -11.548 988 1HG2 VAL 121 HG21 VAL 121 2.564 4.406 -12.879 989 2HG2 VAL 121 HG22 VAL 121 1.026 3.731 -12.341 990 3HG2 VAL 121 HG23 VAL 121 2.044 4.619 -11.207 991 H SER 122 HN SER 122 -2.142 6.121 -14.309 992 HA SER 122 HA SER 122 -2.028 8.578 -15.710 993 1HB SER 122 HB2 SER 122 -3.925 7.053 -15.948 994 2HB SER 122 HB1 SER 122 -4.343 7.282 -14.250 995 HG SER 122 HG SER 122 -5.605 8.724 -15.234 996 HA PRO 123 HA PRO 123 -1.499 11.640 -12.578 997 1HB PRO 123 HB2 PRO 123 -3.443 13.443 -13.460 998 2HB PRO 123 HB1 PRO 123 -1.769 13.386 -14.018 999 1HG PRO 123 HG2 PRO 123 -4.224 12.241 -15.268 1000 2HG PRO 123 HG1 PRO 123 -2.825 13.011 -16.040 1001 1HD PRO 123 HD2 PRO 123 -3.119 10.359 -16.068 1002 2HD PRO 123 HD1 PRO 123 -1.515 11.095 -15.853 1003 H ALA 124 HN ALA 124 -4.717 10.492 -13.414 1004 HA ALA 124 HA ALA 124 -6.124 11.530 -11.219 1005 1HB ALA 124 HB1 ALA 124 -6.587 9.388 -13.206 1006 2HB ALA 124 HB2 ALA 124 -7.613 10.743 -12.737 1007 3HB ALA 124 HB3 ALA 124 -7.529 9.307 -11.716 1008 H ALA 125 HN ALA 125 -4.773 8.272 -11.703 1009 HA ALA 125 HA ALA 125 -5.405 7.158 -9.269 1010 1HB ALA 125 HB1 ALA 125 -4.450 5.514 -10.427 1011 2HB ALA 125 HB2 ALA 125 -2.915 6.106 -9.792 1012 3HB ALA 125 HB3 ALA 125 -3.477 6.633 -11.379 1013 H THR 126 HN THR 126 -2.507 9.032 -10.093 1014 HA THR 126 HA THR 126 -1.453 8.873 -7.436 1015 HB THR 126 HB THR 126 -0.686 10.661 -9.740 1016 HG1 THR 126 HG1 THR 126 0.746 9.109 -10.237 1017 1HG2 THR 126 HG21 THR 126 0.813 11.639 -8.451 1018 2HG2 THR 126 HG22 THR 126 1.474 10.071 -7.983 1019 3HG2 THR 126 HG23 THR 126 0.152 10.785 -7.057 1020 H ALA 127 HN ALA 127 -2.924 11.529 -9.328 1021 HA ALA 127 HA ALA 127 -2.829 13.385 -7.175 1022 1HB ALA 127 HB1 ALA 127 -3.044 13.806 -9.726 1023 2HB ALA 127 HB2 ALA 127 -3.837 14.900 -8.591 1024 3HB ALA 127 HB3 ALA 127 -4.773 13.657 -9.423 1025 H ILE 128 HN ILE 128 -5.583 11.593 -8.614 1026 HA ILE 128 HA ILE 128 -7.488 12.505 -6.795 1027 HB ILE 128 HB ILE 128 -7.496 9.843 -8.222 1028 1HG1 ILE 128 HG12 ILE 128 -8.820 12.462 -8.976 1029 2HG1 ILE 128 HG11 ILE 128 -7.349 11.840 -9.715 1030 1HG2 ILE 128 HG21 ILE 128 -9.903 9.871 -7.845 1031 2HG2 ILE 128 HG22 ILE 128 -9.755 11.391 -6.963 1032 3HG2 ILE 128 HG23 ILE 128 -9.031 9.922 -6.313 1033 1HD1 ILE 128 HD11 ILE 128 -10.155 10.904 -9.993 1034 2HD1 ILE 128 HD12 ILE 128 -8.839 9.745 -10.179 1035 3HD1 ILE 128 HD13 ILE 128 -8.918 11.163 -11.225 1036 H PHE 129 HN PHE 129 -5.329 9.671 -6.578 1037 HA PHE 129 HA PHE 129 -6.477 8.573 -4.261 1038 1HB PHE 129 HB2 PHE 129 -4.790 7.339 -5.547 1039 2HB PHE 129 HB1 PHE 129 -3.567 8.532 -5.115 1040 HD1 PHE 129 HD1 PHE 129 -2.017 7.280 -3.886 1041 HD2 PHE 129 HD2 PHE 129 -6.159 7.007 -2.933 1042 HE1 PHE 129 HE1 PHE 129 -1.465 5.987 -1.866 1043 HE2 PHE 129 HE2 PHE 129 -5.611 5.714 -0.913 1044 HZ PHE 129 HZ PHE 129 -3.263 5.205 -0.376 1045 H ARG 130 HN ARG 130 -4.107 11.122 -4.741 1046 HA ARG 130 HA ARG 130 -3.459 11.522 -2.013 1047 1HB ARG 130 HB2 ARG 130 -2.016 12.369 -3.781 1048 2HB ARG 130 HB1 ARG 130 -3.309 13.389 -4.391 1049 1HG ARG 130 HG2 ARG 130 -3.239 14.733 -2.375 1050 2HG ARG 130 HG1 ARG 130 -1.995 13.682 -1.695 1051 1HD ARG 130 HD2 ARG 130 -0.468 14.302 -3.490 1052 2HD ARG 130 HD1 ARG 130 -1.723 15.289 -4.236 1053 HE ARG 130 HE ARG 130 -1.123 16.967 -2.832 1054 1HH1 ARG 130 HH11 ARG 130 -0.145 13.952 -1.357 1055 2HH1 ARG 130 HH12 ARG 130 0.580 14.719 0.014 1056 1HH2 ARG 130 HH21 ARG 130 -0.159 17.969 -1.039 1057 2HH2 ARG 130 HH22 ARG 130 0.575 16.999 0.194 1058 H LYS 131 HN LYS 131 -5.712 13.157 -4.222 1059 HA LYS 131 HA LYS 131 -6.792 14.955 -2.335 1060 1HB LYS 131 HB2 LYS 131 -7.050 15.208 -4.782 1061 2HB LYS 131 HB1 LYS 131 -8.086 13.788 -4.809 1062 1HG LYS 131 HG2 LYS 131 -9.733 14.936 -3.442 1063 2HG LYS 131 HG1 LYS 131 -8.687 16.354 -3.350 1064 1HD LYS 131 HD2 LYS 131 -10.420 16.675 -5.030 1065 2HD LYS 131 HD1 LYS 131 -8.827 16.607 -5.786 1066 1HE LYS 131 HE2 LYS 131 -9.213 14.268 -6.388 1067 2HE LYS 131 HE1 LYS 131 -10.802 14.333 -5.626 1068 1HZ LYS 131 HZ1 LYS 131 -10.844 14.622 -8.070 1069 2HZ LYS 131 HZ2 LYS 131 -9.980 16.065 -7.893 1070 3HZ LYS 131 HZ3 LYS 131 -11.530 15.921 -7.230 1071 H LEU 132 HN LEU 132 -7.865 11.788 -3.486 1072 HA LEU 132 HA LEU 132 -10.159 11.554 -1.878 1073 1HB LEU 132 HB2 LEU 132 -10.056 10.087 -3.686 1074 2HB LEU 132 HB1 LEU 132 -8.401 9.630 -3.350 1075 HG LEU 132 HG LEU 132 -10.221 7.881 -2.960 1076 1HD1 LEU 132 HD11 LEU 132 -8.387 7.012 -2.042 1077 2HD1 LEU 132 HD12 LEU 132 -9.038 7.561 -0.498 1078 3HD1 LEU 132 HD13 LEU 132 -7.879 8.559 -1.373 1079 1HD2 LEU 132 HD21 LEU 132 -11.835 8.226 -1.471 1080 2HD2 LEU 132 HD22 LEU 132 -11.296 9.901 -1.360 1081 3HD2 LEU 132 HD23 LEU 132 -10.671 8.699 -0.233 1082 H ALA 133 HN ALA 133 -6.777 10.805 -1.332 1083 HA ALA 133 HA ALA 133 -7.000 9.302 1.013 1084 1HB ALA 133 HB1 ALA 133 -4.844 9.226 0.366 1085 2HB ALA 133 HB2 ALA 133 -4.673 10.638 1.409 1086 3HB ALA 133 HB3 ALA 133 -4.887 10.846 -0.329 1087 H GLY 134 HN GLY 134 -6.822 12.809 0.520 1088 1HA GLY 134 HA2 GLY 134 -6.717 13.552 3.232 1089 2HA GLY 134 HA1 GLY 134 -7.299 14.567 1.921 1090 H GLU 135 HN GLU 135 -9.496 13.112 1.067 1091 HA GLU 135 HA GLU 135 -11.508 13.948 2.808 1092 1HB GLU 135 HB2 GLU 135 -11.676 11.754 0.731 1093 2HB GLU 135 HB1 GLU 135 -13.036 12.628 1.422 1094 1HG GLU 135 HG2 GLU 135 -10.858 13.790 -0.299 1095 2HG GLU 135 HG1 GLU 135 -12.516 13.448 -0.791 1096 H ARG 136 HN ARG 136 -9.707 10.972 2.664 1097 HA ARG 136 HA ARG 136 -11.425 9.375 4.239 1098 1HB ARG 136 HB2 ARG 136 -8.468 9.180 3.685 1099 2HB ARG 136 HB1 ARG 136 -9.373 7.953 4.557 1100 1HG ARG 136 HG2 ARG 136 -10.011 8.847 1.759 1101 2HG ARG 136 HG1 ARG 136 -9.000 7.456 2.151 1102 1HD ARG 136 HD2 ARG 136 -11.817 7.756 3.165 1103 2HD ARG 136 HD1 ARG 136 -11.443 6.989 1.625 1104 HE ARG 136 HE ARG 136 -10.628 5.156 2.753 1105 1HH1 ARG 136 HH11 ARG 136 -11.337 7.693 5.044 1106 2HH1 ARG 136 HH12 ARG 136 -10.996 6.710 6.423 1107 1HH2 ARG 136 HH21 ARG 136 -10.191 3.866 4.565 1108 2HH2 ARG 136 HH22 ARG 136 -10.349 4.537 6.154 1109 H ASN 137 HN ASN 137 -8.710 11.490 5.062 1110 HA ASN 137 HA ASN 137 -9.671 11.757 7.747 1111 1HB ASN 137 HB2 ASN 137 -8.510 9.618 7.973 1112 2HB ASN 137 HB1 ASN 137 -7.049 10.320 7.284 1113 1HD2 ASN 137 HD21 ASN 137 -5.577 10.780 8.728 1114 2HD2 ASN 137 HD22 ASN 137 -5.851 11.291 10.356 1115 H TYR 138 HN TYR 138 -6.685 12.081 5.806 1116 HA TYR 138 HA TYR 138 -6.621 14.785 5.480 1117 1HB TYR 138 HB2 TYR 138 -6.203 14.141 8.259 1118 2HB TYR 138 HB1 TYR 138 -4.747 14.874 7.599 1119 HD1 TYR 138 HD1 TYR 138 -4.821 16.934 8.743 1120 HD2 TYR 138 HD2 TYR 138 -8.201 15.647 6.502 1121 HE1 TYR 138 HE1 TYR 138 -5.830 19.160 8.996 1122 HE2 TYR 138 HE2 TYR 138 -9.221 17.871 6.751 1123 HH TYR 138 HH TYR 138 -8.645 19.930 8.860 1124 H THR 139 HN THR 139 -5.130 14.976 3.923 1125 HA THR 139 HA THR 139 -3.010 13.040 3.695 1126 HB THR 139 HB THR 139 -2.366 14.296 1.661 1127 HG1 THR 139 HG1 THR 139 -3.113 16.222 1.283 1128 1HG2 THR 139 HG21 THR 139 -4.825 12.940 2.044 1129 2HG2 THR 139 HG22 THR 139 -3.855 13.089 0.577 1130 3HG2 THR 139 HG23 THR 139 -5.096 14.286 0.945 1131 H ASP 140 HN ASP 140 -3.353 16.410 4.621 1132 HA ASP 140 HA ASP 140 -0.699 17.213 4.677 1133 1HB ASP 140 HB2 ASP 140 -2.621 18.727 5.047 1134 2HB ASP 140 HB1 ASP 140 -2.890 17.984 6.621 1135 H GLU 141 HN GLU 141 -2.504 15.234 6.887 1136 HA GLU 141 HA GLU 141 -1.088 15.169 9.194 1137 1HB GLU 141 HB2 GLU 141 -2.965 13.769 9.017 1138 2HB GLU 141 HB1 GLU 141 -2.353 12.973 7.575 1139 1HG GLU 141 HG2 GLU 141 -2.264 11.454 9.414 1140 2HG GLU 141 HG1 GLU 141 -0.621 11.889 8.954 1141 H MET 142 HN MET 142 -0.366 12.934 6.538 1142 HA MET 142 HA MET 142 2.464 13.309 6.728 1143 1HB MET 142 HB2 MET 142 1.211 10.752 7.744 1144 2HB MET 142 HB1 MET 142 2.873 10.828 7.182 1145 1HG MET 142 HG2 MET 142 1.689 12.333 9.500 1146 2HG MET 142 HG1 MET 142 2.769 10.944 9.582 1147 1HE MET 142 HE1 MET 142 5.027 13.783 10.937 1148 2HE MET 142 HE2 MET 142 3.993 12.406 11.319 1149 3HE MET 142 HE3 MET 142 3.278 13.990 11.025 1150 H VAL 143 HN VAL 143 3.444 12.615 4.840 1151 HA VAL 143 HA VAL 143 1.693 11.296 2.851 1152 HB VAL 143 HB VAL 143 3.730 13.477 2.322 1153 1HG1 VAL 143 HG11 VAL 143 2.350 13.587 0.128 1154 2HG1 VAL 143 HG12 VAL 143 1.880 11.942 0.551 1155 3HG1 VAL 143 HG13 VAL 143 3.583 12.341 0.322 1156 1HG2 VAL 143 HG21 VAL 143 0.827 13.973 1.947 1157 2HG2 VAL 143 HG22 VAL 143 2.116 15.082 2.413 1158 3HG2 VAL 143 HG23 VAL 143 1.446 13.961 3.597 1159 H ALA 144 HN ALA 144 3.193 10.644 0.849 1160 HA ALA 144 HA ALA 144 5.862 9.880 1.385 1161 1HB ALA 144 HB1 ALA 144 5.409 7.998 2.527 1162 2HB ALA 144 HB2 ALA 144 5.024 7.341 0.941 1163 3HB ALA 144 HB3 ALA 144 3.732 7.941 1.984 1164 H MET 145 HN MET 145 6.869 9.794 -0.598 1165 HA MET 145 HA MET 145 5.163 9.140 -2.903 1166 1HB MET 145 HB2 MET 145 7.143 11.415 -2.817 1167 2HB MET 145 HB1 MET 145 6.187 10.930 -4.211 1168 1HG MET 145 HG2 MET 145 5.083 11.949 -1.605 1169 2HG MET 145 HG1 MET 145 5.269 12.893 -3.084 1170 1HE MET 145 HE1 MET 145 1.886 13.101 -3.407 1171 2HE MET 145 HE2 MET 145 3.039 13.375 -2.100 1172 3HE MET 145 HE3 MET 145 1.730 12.212 -1.890 1173 H LEU 146 HN LEU 146 5.958 7.841 -4.369 1174 HA LEU 146 HA LEU 146 7.852 6.044 -4.181 1175 1HB LEU 146 HB2 LEU 146 8.036 5.955 -6.585 1176 2HB LEU 146 HB1 LEU 146 6.382 6.272 -6.102 1177 HG LEU 146 HG LEU 146 8.318 8.341 -7.142 1178 1HD1 LEU 146 HD11 LEU 146 7.698 6.818 -8.899 1179 2HD1 LEU 146 HD12 LEU 146 6.828 8.336 -9.123 1180 3HD1 LEU 146 HD13 LEU 146 5.996 6.933 -8.452 1181 1HD2 LEU 146 HD21 LEU 146 6.134 9.650 -7.345 1182 2HD2 LEU 146 HD22 LEU 146 6.826 9.473 -5.734 1183 3HD2 LEU 146 HD23 LEU 146 5.462 8.467 -6.223 1184 HA PRO 147 HA PRO 147 11.947 7.679 -4.119 1185 1HB PRO 147 HB2 PRO 147 13.344 5.686 -5.247 1186 2HB PRO 147 HB1 PRO 147 12.549 5.481 -3.678 1187 1HG PRO 147 HG2 PRO 147 11.559 4.689 -6.403 1188 2HG PRO 147 HG1 PRO 147 11.647 3.703 -4.932 1189 1HD PRO 147 HD2 PRO 147 9.360 4.891 -5.673 1190 2HD PRO 147 HD1 PRO 147 9.816 4.762 -3.961 1191 H ARG 148 HN ARG 148 13.620 8.543 -5.409 1192 HA ARG 148 HA ARG 148 12.766 9.326 -8.051 1193 1HB ARG 148 HB2 ARG 148 15.264 10.038 -6.496 1194 2HB ARG 148 HB1 ARG 148 14.772 10.771 -8.017 1195 1HG ARG 148 HG2 ARG 148 12.777 11.663 -6.976 1196 2HG ARG 148 HG1 ARG 148 13.194 10.874 -5.455 1197 1HD ARG 148 HD2 ARG 148 15.214 12.229 -5.294 1198 2HD ARG 148 HD1 ARG 148 14.838 12.990 -6.840 1199 HE ARG 148 HE ARG 148 12.653 13.359 -5.145 1200 1HH1 ARG 148 HH11 ARG 148 15.989 14.354 -5.369 1201 2HH1 ARG 148 HH12 ARG 148 15.723 15.861 -4.558 1202 1HH2 ARG 148 HH21 ARG 148 12.304 15.344 -4.077 1203 2HH2 ARG 148 HH22 ARG 148 13.636 16.422 -3.825 1204 H GLN 149 HN GLN 149 16.128 9.158 -8.018 1205 HA GLN 149 HA GLN 149 16.164 7.228 -10.112 1206 1HB GLN 149 HB2 GLN 149 18.414 8.576 -8.621 1207 2HB GLN 149 HB1 GLN 149 18.615 7.591 -10.064 1208 1HG GLN 149 HG2 GLN 149 17.165 9.168 -11.295 1209 2HG GLN 149 HG1 GLN 149 17.093 10.179 -9.852 1210 1HE2 GLN 149 HE21 GLN 149 18.505 9.908 -12.739 1211 2HE2 GLN 149 HE22 GLN 149 20.008 10.705 -12.436 1212 H GLU 150 HN GLU 150 17.547 5.325 -10.159 1213 HA GLU 150 HA GLU 150 16.963 3.528 -8.069 1214 1HB GLU 150 HB2 GLU 150 18.390 1.939 -9.306 1215 2HB GLU 150 HB1 GLU 150 17.220 2.749 -10.338 1216 1HG GLU 150 HG2 GLU 150 18.961 4.246 -11.156 1217 2HG GLU 150 HG1 GLU 150 20.139 3.461 -10.105 1218 H GLU 151 HN GLU 151 17.942 5.110 -6.418 1219 HA GLU 151 HA GLU 151 20.583 4.066 -5.708 1220 1HB GLU 151 HB2 GLU 151 19.863 7.009 -5.663 1221 2HB GLU 151 HB1 GLU 151 21.344 6.315 -5.015 1222 1HG GLU 151 HG2 GLU 151 20.494 6.225 -7.898 1223 2HG GLU 151 HG1 GLU 151 21.669 7.343 -7.207 1224 H CYS 152 HN CYS 152 19.387 6.754 -3.924 1225 HA CYS 152 HA CYS 152 17.805 5.230 -2.066 1226 1HB CYS 152 HB2 CYS 152 20.442 6.435 -1.180 1227 2HB CYS 152 HB1 CYS 152 19.229 5.738 -0.113 1228 H THR 153 HN THR 153 16.303 6.810 -2.847 1229 HA THR 153 HA THR 153 16.293 9.239 -1.283 1230 HB THR 153 HB THR 153 17.567 10.108 -3.068 1231 HG1 THR 153 HG1 THR 153 14.914 10.700 -3.845 1232 1HG2 THR 153 HG21 THR 153 16.984 9.880 -5.426 1233 2HG2 THR 153 HG22 THR 153 15.660 8.796 -4.993 1234 3HG2 THR 153 HG23 THR 153 17.328 8.318 -4.683 1235 H VAL 154 HN VAL 154 14.238 10.438 -1.494 1236 HA VAL 154 HA VAL 154 12.058 8.942 -2.738 1237 HB VAL 154 HB VAL 154 12.387 8.223 -0.308 1238 1HG1 VAL 154 HG11 VAL 154 12.034 9.617 1.427 1239 2HG1 VAL 154 HG12 VAL 154 10.809 10.551 0.571 1240 3HG1 VAL 154 HG13 VAL 154 12.518 10.848 0.260 1241 1HG2 VAL 154 HG21 VAL 154 10.269 8.121 -1.840 1242 2HG2 VAL 154 HG22 VAL 154 9.637 9.294 -0.684 1243 3HG2 VAL 154 HG23 VAL 154 10.168 7.707 -0.130 1244 H ASP 155 HN ASP 155 10.465 10.216 -3.546 1245 HA ASP 155 HA ASP 155 10.882 12.973 -3.831 1246 1HB ASP 155 HB2 ASP 155 9.578 11.702 -5.450 1247 2HB ASP 155 HB1 ASP 155 8.350 11.365 -4.237 1248 H GLU 156 HN GLU 156 10.227 14.723 -2.729 1249 HA GLU 156 HA GLU 156 8.023 14.901 -1.020 1250 1HB GLU 156 HB2 GLU 156 9.967 13.397 0.185 1251 2HB GLU 156 HB1 GLU 156 10.352 15.007 0.777 1252 1HG GLU 156 HG2 GLU 156 7.743 13.538 1.069 1253 2HG GLU 156 HG1 GLU 156 8.898 13.929 2.341 1254 H VAL 157 HN VAL 157 7.676 17.003 -0.395 1255 HA VAL 157 HA VAL 157 7.968 19.262 -0.217 1256 HB VAL 157 HB VAL 157 10.926 18.828 -0.624 1257 1HG1 VAL 157 HG11 VAL 157 11.241 20.975 0.065 1258 2HG1 VAL 157 HG12 VAL 157 9.781 20.990 1.055 1259 3HG1 VAL 157 HG13 VAL 157 9.659 21.147 -0.697 1260 1HG2 VAL 157 HG21 VAL 157 10.290 17.434 1.215 1261 2HG2 VAL 157 HG22 VAL 157 9.319 18.724 1.923 1262 3HG2 VAL 157 HG23 VAL 157 11.075 18.873 1.861 Start of MODEL 14 1 1H MET 1 HT1 MET 1 -22.425 -9.502 -19.219 2 2H MET 1 HT2 MET 1 -23.293 -9.630 -17.774 3 3H MET 1 HT3 MET 1 -24.117 -9.519 -19.247 4 HA MET 1 HA MET 1 -24.042 -11.793 -18.275 5 1HB MET 1 HB2 MET 1 -23.537 -12.836 -20.447 6 2HB MET 1 HB1 MET 1 -24.501 -11.377 -20.637 7 1HG MET 1 HG2 MET 1 -22.498 -10.128 -21.252 8 2HG MET 1 HG1 MET 1 -21.527 -11.586 -21.054 9 1HE MET 1 HE1 MET 1 -25.212 -11.694 -23.251 10 2HE MET 1 HE2 MET 1 -24.485 -10.415 -24.224 11 3HE MET 1 HE3 MET 1 -24.645 -10.213 -22.479 12 H THR 2 HN THR 2 -22.854 -13.384 -17.397 13 HA THR 2 HA THR 2 -21.082 -14.534 -16.561 14 HB THR 2 HB THR 2 -19.629 -13.333 -18.926 15 HG1 THR 2 HG1 THR 2 -20.496 -14.879 -20.051 16 1HG2 THR 2 HG21 THR 2 -17.802 -14.219 -18.015 17 2HG2 THR 2 HG22 THR 2 -18.505 -15.774 -18.459 18 3HG2 THR 2 HG23 THR 2 -18.725 -15.140 -16.828 19 H VAL 3 HN VAL 3 -19.779 -14.169 -14.876 20 HA VAL 3 HA VAL 3 -19.206 -11.470 -14.112 21 HB VAL 3 HB VAL 3 -18.220 -12.447 -12.088 22 1HG1 VAL 3 HG11 VAL 3 -20.261 -13.625 -11.278 23 2HG1 VAL 3 HG12 VAL 3 -20.870 -13.610 -12.933 24 3HG1 VAL 3 HG13 VAL 3 -20.591 -12.091 -12.083 25 1HG2 VAL 3 HG21 VAL 3 -17.166 -14.409 -12.457 26 2HG2 VAL 3 HG22 VAL 3 -18.273 -14.884 -13.745 27 3HG2 VAL 3 HG23 VAL 3 -18.742 -15.094 -12.058 28 HA PRO 4 HA PRO 4 -15.203 -10.960 -15.960 29 1HB PRO 4 HB2 PRO 4 -14.594 -9.438 -13.479 30 2HB PRO 4 HB1 PRO 4 -14.438 -8.946 -15.169 31 1HG PRO 4 HG2 PRO 4 -16.424 -8.013 -13.665 32 2HG PRO 4 HG1 PRO 4 -16.692 -8.437 -15.366 33 1HD PRO 4 HD2 PRO 4 -17.446 -9.941 -12.896 34 2HD PRO 4 HD1 PRO 4 -18.335 -9.756 -14.422 35 H ASP 5 HN ASP 5 -13.223 -11.904 -15.842 36 HA ASP 5 HA ASP 5 -12.789 -14.060 -14.138 37 1HB ASP 5 HB2 ASP 5 -10.492 -14.077 -15.009 38 2HB ASP 5 HB1 ASP 5 -11.662 -13.819 -16.301 39 H ARG 6 HN ARG 6 -12.113 -14.221 -12.101 40 HA ARG 6 HA ARG 6 -11.517 -11.917 -10.554 41 1HB ARG 6 HB2 ARG 6 -11.194 -14.841 -9.860 42 2HB ARG 6 HB1 ARG 6 -11.049 -13.518 -8.718 43 1HG ARG 6 HG2 ARG 6 -13.201 -13.990 -8.308 44 2HG ARG 6 HG1 ARG 6 -13.475 -12.977 -9.723 45 1HD ARG 6 HD2 ARG 6 -14.781 -14.927 -10.024 46 2HD ARG 6 HD1 ARG 6 -13.404 -15.082 -11.107 47 HE ARG 6 HE ARG 6 -13.957 -16.666 -8.730 48 1HH1 ARG 6 HH11 ARG 6 -11.768 -15.956 -11.360 49 2HH1 ARG 6 HH12 ARG 6 -10.776 -17.342 -11.066 50 1HH2 ARG 6 HH21 ARG 6 -12.654 -18.487 -8.356 51 2HH2 ARG 6 HH22 ARG 6 -11.277 -18.777 -9.366 52 H SER 7 HN SER 7 -9.596 -14.317 -12.187 53 HA SER 7 HA SER 7 -7.142 -14.047 -10.959 54 1HB SER 7 HB2 SER 7 -7.703 -14.417 -13.911 55 2HB SER 7 HB1 SER 7 -6.155 -14.725 -13.125 56 HG SER 7 HG SER 7 -6.937 -16.502 -12.242 57 H GLU 8 HN GLU 8 -8.770 -11.815 -13.103 58 HA GLU 8 HA GLU 8 -6.731 -10.264 -14.075 59 1HB GLU 8 HB2 GLU 8 -8.284 -8.425 -14.182 60 2HB GLU 8 HB1 GLU 8 -9.156 -9.912 -14.525 61 1HG GLU 8 HG2 GLU 8 -9.940 -9.927 -12.170 62 2HG GLU 8 HG1 GLU 8 -9.169 -8.358 -11.950 63 H ILE 9 HN ILE 9 -8.232 -10.043 -10.872 64 HA ILE 9 HA ILE 9 -6.678 -7.873 -9.948 65 HB ILE 9 HB ILE 9 -7.998 -10.054 -8.322 66 1HG1 ILE 9 HG12 ILE 9 -9.603 -8.941 -9.780 67 2HG1 ILE 9 HG11 ILE 9 -9.865 -8.447 -8.110 68 1HG2 ILE 9 HG21 ILE 9 -6.224 -8.163 -7.442 69 2HG2 ILE 9 HG22 ILE 9 -7.451 -8.953 -6.452 70 3HG2 ILE 9 HG23 ILE 9 -7.779 -7.377 -7.173 71 1HD1 ILE 9 HD11 ILE 9 -8.330 -6.444 -8.768 72 2HD1 ILE 9 HD12 ILE 9 -10.035 -6.451 -9.218 73 3HD1 ILE 9 HD13 ILE 9 -8.808 -6.880 -10.409 74 H ALA 10 HN ALA 10 -6.273 -11.382 -9.748 75 HA ALA 10 HA ALA 10 -3.988 -11.376 -8.095 76 1HB ALA 10 HB1 ALA 10 -4.176 -13.536 -10.083 77 2HB ALA 10 HB2 ALA 10 -5.607 -13.310 -9.079 78 3HB ALA 10 HB3 ALA 10 -4.043 -13.616 -8.326 79 H GLY 11 HN GLY 11 -1.902 -10.904 -8.522 80 1HA GLY 11 HA2 GLY 11 -0.405 -11.456 -10.716 81 2HA GLY 11 HA1 GLY 11 -1.219 -9.969 -11.172 82 H LYS 12 HN LYS 12 0.572 -8.683 -11.252 83 HA LYS 12 HA LYS 12 2.176 -8.441 -8.807 84 1HB LYS 12 HB2 LYS 12 2.756 -7.489 -11.613 85 2HB LYS 12 HB1 LYS 12 3.825 -7.286 -10.232 86 1HG LYS 12 HG2 LYS 12 4.016 -9.711 -10.019 87 2HG LYS 12 HG1 LYS 12 2.944 -9.915 -11.406 88 1HD LYS 12 HD2 LYS 12 4.553 -8.736 -12.823 89 2HD LYS 12 HD1 LYS 12 5.623 -8.525 -11.435 90 1HE LYS 12 HE2 LYS 12 6.342 -10.398 -12.823 91 2HE LYS 12 HE1 LYS 12 5.838 -10.946 -11.224 92 1HZ LYS 12 HZ1 LYS 12 5.018 -12.105 -13.439 93 2HZ LYS 12 HZ2 LYS 12 3.809 -10.928 -13.319 94 3HZ LYS 12 HZ3 LYS 12 4.048 -12.025 -12.054 95 H TRP 13 HN TRP 13 2.157 -6.697 -7.602 96 HA TRP 13 HA TRP 13 0.688 -4.307 -8.517 97 1HB TRP 13 HB2 TRP 13 0.991 -5.541 -5.773 98 2HB TRP 13 HB1 TRP 13 0.379 -3.912 -6.014 99 HD1 TRP 13 HD1 TRP 13 -0.879 -6.121 -8.703 100 HE1 TRP 13 HE1 TRP 13 -3.300 -6.837 -8.218 101 HE3 TRP 13 HE3 TRP 13 -1.210 -4.630 -3.822 102 HZ2 TRP 13 HZ2 TRP 13 -5.111 -6.779 -6.059 103 HZ3 TRP 13 HZ3 TRP 13 -3.323 -5.003 -2.618 104 HH2 TRP 13 HH2 TRP 13 -5.233 -6.055 -3.717 105 H TYR 14 HN TYR 14 1.845 -2.412 -8.592 106 HA TYR 14 HA TYR 14 4.515 -2.456 -7.328 107 1HB TYR 14 HB2 TYR 14 3.544 -0.868 -9.710 108 2HB TYR 14 HB1 TYR 14 5.136 -0.699 -8.978 109 HD1 TYR 14 HD1 TYR 14 2.989 -3.548 -10.137 110 HD2 TYR 14 HD2 TYR 14 6.821 -1.700 -10.165 111 HE1 TYR 14 HE1 TYR 14 3.844 -5.357 -11.564 112 HE2 TYR 14 HE2 TYR 14 7.686 -3.502 -11.596 113 HH TYR 14 HH TYR 14 6.393 -5.230 -13.367 114 H VAL 15 HN VAL 15 4.439 -1.444 -5.412 115 HA VAL 15 HA VAL 15 2.693 0.858 -5.109 116 HB VAL 15 HB VAL 15 2.361 -0.412 -3.246 117 1HG1 VAL 15 HG11 VAL 15 4.498 -1.290 -1.951 118 2HG1 VAL 15 HG12 VAL 15 5.182 -1.216 -3.571 119 3HG1 VAL 15 HG13 VAL 15 3.753 -2.195 -3.267 120 1HG2 VAL 15 HG21 VAL 15 4.615 1.414 -2.408 121 2HG2 VAL 15 HG22 VAL 15 3.477 0.637 -1.311 122 3HG2 VAL 15 HG23 VAL 15 2.900 1.820 -2.483 123 H VAL 16 HN VAL 16 3.256 2.856 -5.075 124 HA VAL 16 HA VAL 16 6.015 3.655 -4.558 125 HB VAL 16 HB VAL 16 6.022 5.162 -6.528 126 1HG1 VAL 16 HG11 VAL 16 5.721 2.212 -7.063 127 2HG1 VAL 16 HG12 VAL 16 7.208 3.091 -6.709 128 3HG1 VAL 16 HG13 VAL 16 6.361 3.368 -8.230 129 1HG2 VAL 16 HG21 VAL 16 4.342 5.335 -8.033 130 2HG2 VAL 16 HG22 VAL 16 3.355 4.796 -6.682 131 3HG2 VAL 16 HG23 VAL 16 3.894 3.637 -7.890 132 H ALA 17 HN ALA 17 2.665 4.701 -5.161 133 HA ALA 17 HA ALA 17 3.122 7.248 -3.827 134 1HB ALA 17 HB1 ALA 17 1.360 6.372 -5.808 135 2HB ALA 17 HB2 ALA 17 1.384 7.956 -5.035 136 3HB ALA 17 HB3 ALA 17 0.347 6.678 -4.400 137 H LEU 18 HN LEU 18 2.419 7.764 -1.766 138 HA LEU 18 HA LEU 18 0.657 5.941 -0.346 139 1HB LEU 18 HB2 LEU 18 3.469 6.471 0.609 140 2HB LEU 18 HB1 LEU 18 2.233 5.655 1.538 141 HG LEU 18 HG LEU 18 2.188 3.963 -0.414 142 1HD1 LEU 18 HD11 LEU 18 4.093 5.770 -1.407 143 2HD1 LEU 18 HD12 LEU 18 3.626 4.210 -2.083 144 3HD1 LEU 18 HD13 LEU 18 4.978 4.312 -0.956 145 1HD2 LEU 18 HD21 LEU 18 4.138 4.296 1.785 146 2HD2 LEU 18 HD22 LEU 18 4.461 3.024 0.607 147 3HD2 LEU 18 HD23 LEU 18 2.945 3.028 1.509 148 H ALA 19 HN ALA 19 0.791 6.679 2.131 149 HA ALA 19 HA ALA 19 1.158 9.422 2.713 150 1HB ALA 19 HB1 ALA 19 -0.727 10.228 1.780 151 2HB ALA 19 HB2 ALA 19 -1.524 9.519 3.182 152 3HB ALA 19 HB3 ALA 19 -1.465 8.633 1.660 153 H SER 20 HN SER 20 1.847 9.173 4.826 154 HA SER 20 HA SER 20 0.154 7.445 6.506 155 1HB SER 20 HB2 SER 20 2.202 6.411 7.467 156 2HB SER 20 HB1 SER 20 1.945 6.037 5.761 157 HG SER 20 HG SER 20 3.902 6.763 5.532 158 H ASN 21 HN ASN 21 0.098 7.810 8.685 159 HA ASN 21 HA ASN 21 1.367 10.305 9.603 160 1HB ASN 21 HB2 ASN 21 -1.172 8.995 10.623 161 2HB ASN 21 HB1 ASN 21 -0.452 10.457 11.276 162 1HD2 ASN 21 HD21 ASN 21 -1.146 9.354 7.953 163 2HD2 ASN 21 HD22 ASN 21 -2.065 10.745 7.518 164 H THR 22 HN THR 22 3.018 9.963 10.979 165 HA THR 22 HA THR 22 2.913 8.528 13.341 166 HB THR 22 HB THR 22 2.657 6.520 11.959 167 HG1 THR 22 HG1 THR 22 3.742 5.828 13.621 168 1HG2 THR 22 HG21 THR 22 5.412 6.696 10.909 169 2HG2 THR 22 HG22 THR 22 4.156 7.617 10.081 170 3HG2 THR 22 HG23 THR 22 3.996 5.870 10.260 171 H GLU 23 HN GLU 23 5.558 7.461 13.471 172 HA GLU 23 HA GLU 23 7.048 9.868 13.806 173 1HB GLU 23 HB2 GLU 23 7.851 6.961 13.995 174 2HB GLU 23 HB1 GLU 23 8.956 8.287 14.323 175 1HG GLU 23 HG2 GLU 23 8.177 7.570 16.412 176 2HG GLU 23 HG1 GLU 23 7.310 9.065 16.068 177 H PHE 24 HN PHE 24 8.086 10.950 12.287 178 HA PHE 24 HA PHE 24 8.605 9.704 9.725 179 1HB PHE 24 HB2 PHE 24 9.193 11.989 8.989 180 2HB PHE 24 HB1 PHE 24 7.595 11.903 9.721 181 HD1 PHE 24 HD1 PHE 24 7.011 13.455 11.310 182 HD2 PHE 24 HD2 PHE 24 11.134 12.666 10.613 183 HE1 PHE 24 HE1 PHE 24 7.616 15.279 12.846 184 HE2 PHE 24 HE2 PHE 24 11.746 14.485 12.153 185 HZ PHE 24 HZ PHE 24 9.986 15.794 13.271 186 H PHE 25 HN PHE 25 10.442 11.019 12.422 187 HA PHE 25 HA PHE 25 12.962 11.130 11.249 188 1HB PHE 25 HB2 PHE 25 12.461 12.092 13.440 189 2HB PHE 25 HB1 PHE 25 12.253 10.480 14.115 190 HD1 PHE 25 HD1 PHE 25 14.874 11.792 11.824 191 HD2 PHE 25 HD2 PHE 25 13.943 10.232 15.672 192 HE1 PHE 25 HE1 PHE 25 17.272 11.716 12.368 193 HE2 PHE 25 HE2 PHE 25 16.339 10.153 16.225 194 HZ PHE 25 HZ PHE 25 18.007 10.896 14.572 195 H LEU 26 HN LEU 26 11.446 8.414 12.980 196 HA LEU 26 HA LEU 26 13.643 6.676 12.825 197 1HB LEU 26 HB2 LEU 26 11.778 6.331 14.354 198 2HB LEU 26 HB1 LEU 26 10.702 6.035 13.002 199 HG LEU 26 HG LEU 26 11.958 4.005 12.433 200 1HD1 LEU 26 HD11 LEU 26 14.156 4.493 13.145 201 2HD1 LEU 26 HD12 LEU 26 13.596 3.168 14.165 202 3HD1 LEU 26 HD13 LEU 26 13.630 4.814 14.797 203 1HD2 LEU 26 HD21 LEU 26 10.167 3.439 13.750 204 2HD2 LEU 26 HD22 LEU 26 10.749 4.369 15.132 205 3HD2 LEU 26 HD23 LEU 26 11.498 2.823 14.731 206 H ARG 27 HN ARG 27 10.839 7.021 10.668 207 HA ARG 27 HA ARG 27 11.464 4.872 8.981 208 1HB ARG 27 HB2 ARG 27 9.985 6.038 7.326 209 2HB ARG 27 HB1 ARG 27 9.269 5.756 8.906 210 1HG ARG 27 HG2 ARG 27 9.554 8.037 9.523 211 2HG ARG 27 HG1 ARG 27 10.511 8.364 8.077 212 1HD ARG 27 HD2 ARG 27 8.161 9.157 7.916 213 2HD ARG 27 HD1 ARG 27 8.603 7.997 6.665 214 HE ARG 27 HE ARG 27 7.489 6.579 8.787 215 1HH1 ARG 27 HH11 ARG 27 6.499 8.952 6.428 216 2HH1 ARG 27 HH12 ARG 27 4.867 8.378 6.354 217 1HH2 ARG 27 HH21 ARG 27 5.356 5.819 8.687 218 2HH2 ARG 27 HH22 ARG 27 4.218 6.599 7.645 219 H GLU 28 HN GLU 28 12.543 8.241 8.880 220 HA GLU 28 HA GLU 28 13.492 8.486 6.339 221 1HB GLU 28 HB2 GLU 28 14.765 9.404 8.911 222 2HB GLU 28 HB1 GLU 28 15.379 9.863 7.330 223 1HG GLU 28 HG2 GLU 28 13.248 10.917 6.799 224 2HG GLU 28 HG1 GLU 28 12.621 10.447 8.376 225 H LYS 29 HN LYS 29 15.443 7.169 9.025 226 HA LYS 29 HA LYS 29 17.406 6.171 7.151 227 1HB LYS 29 HB2 LYS 29 17.233 5.918 10.158 228 2HB LYS 29 HB1 LYS 29 18.597 5.396 9.178 229 1HG LYS 29 HG2 LYS 29 18.941 7.709 8.440 230 2HG LYS 29 HG1 LYS 29 17.594 8.222 9.457 231 1HD LYS 29 HD2 LYS 29 20.135 6.911 10.422 232 2HD LYS 29 HD1 LYS 29 19.752 8.628 10.543 233 1HE LYS 29 HE2 LYS 29 17.814 8.083 11.948 234 2HE LYS 29 HE1 LYS 29 18.228 6.373 11.842 235 1HZ LYS 29 HZ1 LYS 29 19.987 8.467 12.999 236 2HZ LYS 29 HZ2 LYS 29 20.287 6.803 12.978 237 3HZ LYS 29 HZ3 LYS 29 19.012 7.419 13.903 238 H ASP 30 HN ASP 30 14.901 4.860 9.252 239 HA ASP 30 HA ASP 30 15.597 2.130 8.822 240 1HB ASP 30 HB2 ASP 30 14.369 2.872 10.814 241 2HB ASP 30 HB1 ASP 30 13.004 3.340 9.803 242 H LYS 31 HN LYS 31 12.664 3.896 7.778 243 HA LYS 31 HA LYS 31 12.153 1.903 5.750 244 1HB LYS 31 HB2 LYS 31 10.657 4.466 6.335 245 2HB LYS 31 HB1 LYS 31 10.085 3.124 5.355 246 1HG LYS 31 HG2 LYS 31 10.098 1.676 7.323 247 2HG LYS 31 HG1 LYS 31 10.660 3.027 8.308 248 1HD LYS 31 HD2 LYS 31 8.257 2.726 8.551 249 2HD LYS 31 HD1 LYS 31 8.614 4.264 7.766 250 1HE LYS 31 HE2 LYS 31 8.128 3.268 5.588 251 2HE LYS 31 HE1 LYS 31 7.786 1.723 6.367 252 1HZ LYS 31 HZ1 LYS 31 5.888 3.422 5.780 253 2HZ LYS 31 HZ2 LYS 31 6.305 4.072 7.284 254 3HZ LYS 31 HZ3 LYS 31 5.808 2.460 7.170 255 H MET 32 HN MET 32 10.888 4.086 4.008 256 HA MET 32 HA MET 32 11.387 5.302 2.171 257 1HB MET 32 HB2 MET 32 13.869 5.778 3.780 258 2HB MET 32 HB1 MET 32 13.757 6.366 2.127 259 1HG MET 32 HG2 MET 32 13.140 8.083 3.737 260 2HG MET 32 HG1 MET 32 11.791 7.658 2.689 261 1HE MET 32 HE1 MET 32 10.366 8.687 6.230 262 2HE MET 32 HE2 MET 32 9.840 8.729 4.549 263 3HE MET 32 HE3 MET 32 11.424 9.362 4.995 264 H LYS 33 HN LYS 33 11.192 3.360 0.983 265 HA LYS 33 HA LYS 33 13.497 2.793 -0.637 266 1HB LYS 33 HB2 LYS 33 12.337 0.656 1.145 267 2HB LYS 33 HB1 LYS 33 13.285 0.285 -0.284 268 1HG LYS 33 HG2 LYS 33 14.988 0.230 1.164 269 2HG LYS 33 HG1 LYS 33 14.951 1.983 0.996 270 1HD LYS 33 HD2 LYS 33 15.035 1.381 3.341 271 2HD LYS 33 HD1 LYS 33 13.476 2.114 2.972 272 1HE LYS 33 HE2 LYS 33 13.198 0.176 4.415 273 2HE LYS 33 HE1 LYS 33 12.459 -0.108 2.842 274 1HZ LYS 33 HZ1 LYS 33 13.652 -2.050 3.474 275 2HZ LYS 33 HZ2 LYS 33 15.053 -1.168 3.816 276 3HZ LYS 33 HZ3 LYS 33 14.519 -1.319 2.219 277 H MET 34 HN MET 34 12.930 1.527 -2.559 278 HA MET 34 HA MET 34 10.399 2.184 -3.611 279 1HB MET 34 HB2 MET 34 12.353 1.718 -5.034 280 2HB MET 34 HB1 MET 34 12.338 0.038 -4.515 281 1HG MET 34 HG2 MET 34 10.155 -0.269 -5.558 282 2HG MET 34 HG1 MET 34 10.160 1.418 -6.069 283 1HE MET 34 HE1 MET 34 9.627 0.624 -8.494 284 2HE MET 34 HE2 MET 34 9.738 -1.096 -8.122 285 3HE MET 34 HE3 MET 34 10.660 -0.423 -9.467 286 H ALA 35 HN ALA 35 8.492 0.847 -3.995 287 HA ALA 35 HA ALA 35 8.518 -1.584 -2.324 288 1HB ALA 35 HB1 ALA 35 6.361 -1.098 -1.491 289 2HB ALA 35 HB2 ALA 35 6.161 0.251 -2.609 290 3HB ALA 35 HB3 ALA 35 7.334 0.361 -1.297 291 H MET 36 HN MET 36 7.653 -3.363 -3.082 292 HA MET 36 HA MET 36 6.154 -3.294 -5.611 293 1HB MET 36 HB2 MET 36 8.252 -5.328 -4.812 294 2HB MET 36 HB1 MET 36 7.274 -5.388 -6.272 295 1HG MET 36 HG2 MET 36 8.298 -3.313 -7.046 296 2HG MET 36 HG1 MET 36 9.276 -3.250 -5.581 297 1HE MET 36 HE1 MET 36 10.726 -5.132 -4.814 298 2HE MET 36 HE2 MET 36 11.728 -6.111 -5.887 299 3HE MET 36 HE3 MET 36 10.106 -6.653 -5.455 300 H ALA 37 HN ALA 37 4.679 -5.168 -5.845 301 HA ALA 37 HA ALA 37 4.165 -6.710 -3.440 302 1HB ALA 37 HB1 ALA 37 2.173 -4.708 -4.476 303 2HB ALA 37 HB2 ALA 37 2.982 -4.693 -2.910 304 3HB ALA 37 HB3 ALA 37 1.811 -5.956 -3.286 305 H ARG 38 HN ARG 38 2.612 -8.391 -3.706 306 HA ARG 38 HA ARG 38 1.728 -8.962 -6.437 307 1HB ARG 38 HB2 ARG 38 3.975 -10.018 -6.093 308 2HB ARG 38 HB1 ARG 38 3.295 -10.941 -4.765 309 1HG ARG 38 HG2 ARG 38 2.377 -11.109 -7.627 310 2HG ARG 38 HG1 ARG 38 3.495 -12.229 -6.852 311 1HD ARG 38 HD2 ARG 38 1.696 -12.719 -5.175 312 2HD ARG 38 HD1 ARG 38 0.600 -11.756 -6.164 313 HE ARG 38 HE ARG 38 0.371 -13.549 -7.526 314 1HH1 ARG 38 HH11 ARG 38 3.402 -13.883 -5.826 315 2HH1 ARG 38 HH12 ARG 38 3.789 -15.401 -6.564 316 1HH2 ARG 38 HH21 ARG 38 0.880 -15.543 -8.494 317 2HH2 ARG 38 HH22 ARG 38 2.359 -16.343 -8.078 318 H ILE 39 HN ILE 39 -0.405 -9.302 -6.239 319 HA ILE 39 HA ILE 39 -1.483 -10.247 -3.701 320 HB ILE 39 HB ILE 39 -2.599 -8.346 -4.672 321 1HG1 ILE 39 HG12 ILE 39 -4.290 -10.854 -4.855 322 2HG1 ILE 39 HG11 ILE 39 -3.968 -9.928 -3.393 323 1HG2 ILE 39 HG21 ILE 39 -3.836 -8.541 -6.802 324 2HG2 ILE 39 HG22 ILE 39 -3.098 -10.122 -7.052 325 3HG2 ILE 39 HG23 ILE 39 -2.090 -8.678 -7.003 326 1HD1 ILE 39 HD11 ILE 39 -6.214 -9.602 -4.550 327 2HD1 ILE 39 HD12 ILE 39 -5.314 -8.690 -5.762 328 3HD1 ILE 39 HD13 ILE 39 -5.318 -8.159 -4.080 329 H SER 40 HN SER 40 -2.666 -12.064 -3.374 330 HA SER 40 HA SER 40 -3.304 -13.876 -5.526 331 1HB SER 40 HB2 SER 40 -1.998 -15.760 -4.614 332 2HB SER 40 HB1 SER 40 -0.946 -14.436 -5.121 333 HG SER 40 HG SER 40 -1.638 -15.274 -2.525 334 H PHE 41 HN PHE 41 -5.091 -15.015 -5.022 335 HA PHE 41 HA PHE 41 -6.245 -14.672 -2.372 336 1HB PHE 41 HB2 PHE 41 -7.389 -15.892 -4.895 337 2HB PHE 41 HB1 PHE 41 -8.278 -15.659 -3.397 338 HD1 PHE 41 HD1 PHE 41 -5.995 -13.417 -5.354 339 HD2 PHE 41 HD2 PHE 41 -9.864 -14.051 -3.697 340 HE1 PHE 41 HE1 PHE 41 -6.672 -11.177 -6.094 341 HE2 PHE 41 HE2 PHE 41 -10.548 -11.809 -4.438 342 HZ PHE 41 HZ PHE 41 -8.952 -10.368 -5.638 343 H LEU 42 HN LEU 42 -6.120 -16.179 -0.813 344 HA LEU 42 HA LEU 42 -5.226 -18.873 -1.540 345 1HB LEU 42 HB2 LEU 42 -4.305 -17.317 0.408 346 2HB LEU 42 HB1 LEU 42 -5.633 -18.043 1.287 347 HG LEU 42 HG LEU 42 -3.627 -19.274 1.759 348 1HD1 LEU 42 HD11 LEU 42 -4.520 -21.341 1.586 349 2HD1 LEU 42 HD12 LEU 42 -4.896 -21.161 -0.128 350 3HD1 LEU 42 HD13 LEU 42 -5.940 -20.423 1.087 351 1HD2 LEU 42 HD21 LEU 42 -3.244 -19.049 -1.152 352 2HD2 LEU 42 HD22 LEU 42 -2.770 -20.586 -0.430 353 3HD2 LEU 42 HD23 LEU 42 -2.060 -19.082 0.155 354 H GLY 43 HN GLY 43 -6.663 -20.427 -1.795 355 1HA GLY 43 HA2 GLY 43 -9.422 -20.105 -1.213 356 2HA GLY 43 HA1 GLY 43 -8.654 -21.563 -1.808 357 H GLU 44 HN GLU 44 -8.630 -19.696 1.244 358 HA GLU 44 HA GLU 44 -9.794 -21.893 2.672 359 1HB GLU 44 HB2 GLU 44 -6.914 -21.160 3.234 360 2HB GLU 44 HB1 GLU 44 -7.908 -22.168 4.272 361 1HG GLU 44 HG2 GLU 44 -8.143 -23.781 2.426 362 2HG GLU 44 HG1 GLU 44 -7.069 -22.781 1.449 363 H ASP 45 HN ASP 45 -10.410 -19.175 2.161 364 HA ASP 45 HA ASP 45 -11.391 -17.449 3.264 365 1HB ASP 45 HB2 ASP 45 -12.053 -19.152 4.964 366 2HB ASP 45 HB1 ASP 45 -10.552 -18.827 5.825 367 H GLU 46 HN GLU 46 -8.725 -17.225 2.332 368 HA GLU 46 HA GLU 46 -7.966 -14.922 3.828 369 1HB GLU 46 HB2 GLU 46 -5.784 -15.590 4.595 370 2HB GLU 46 HB1 GLU 46 -6.986 -16.677 5.274 371 1HG GLU 46 HG2 GLU 46 -5.338 -17.305 2.844 372 2HG GLU 46 HG1 GLU 46 -4.900 -17.777 4.483 373 H LEU 47 HN LEU 47 -6.674 -13.560 2.733 374 HA LEU 47 HA LEU 47 -5.576 -14.455 0.159 375 1HB LEU 47 HB2 LEU 47 -7.136 -11.915 0.664 376 2HB LEU 47 HB1 LEU 47 -6.338 -12.329 -0.841 377 HG LEU 47 HG LEU 47 -7.850 -14.319 -1.022 378 1HD1 LEU 47 HD11 LEU 47 -10.018 -13.587 0.526 379 2HD1 LEU 47 HD12 LEU 47 -8.644 -13.393 1.613 380 3HD1 LEU 47 HD13 LEU 47 -8.932 -14.943 0.821 381 1HD2 LEU 47 HD21 LEU 47 -8.287 -12.232 -2.229 382 2HD2 LEU 47 HD22 LEU 47 -9.225 -11.641 -0.858 383 3HD2 LEU 47 HD23 LEU 47 -9.780 -13.048 -1.765 384 H LYS 48 HN LYS 48 -3.587 -13.501 -0.392 385 HA LYS 48 HA LYS 48 -2.576 -11.496 1.496 386 1HB LYS 48 HB2 LYS 48 -0.519 -12.681 1.835 387 2HB LYS 48 HB1 LYS 48 -1.858 -13.756 2.197 388 1HG LYS 48 HG2 LYS 48 -0.400 -15.113 1.030 389 2HG LYS 48 HG1 LYS 48 -1.551 -14.614 -0.209 390 1HD LYS 48 HD2 LYS 48 -0.018 -13.046 -1.122 391 2HD LYS 48 HD1 LYS 48 1.060 -13.187 0.263 392 1HE LYS 48 HE2 LYS 48 1.555 -15.494 -0.356 393 2HE LYS 48 HE1 LYS 48 0.453 -15.370 -1.727 394 1HZ LYS 48 HZ1 LYS 48 3.135 -14.287 -1.396 395 2HZ LYS 48 HZ2 LYS 48 2.031 -13.308 -2.221 396 3HZ LYS 48 HZ3 LYS 48 2.365 -14.866 -2.787 397 H VAL 49 HN VAL 49 -0.758 -10.297 0.851 398 HA VAL 49 HA VAL 49 -0.193 -10.314 -2.028 399 HB VAL 49 HB VAL 49 -1.762 -8.444 -1.417 400 1HG1 VAL 49 HG11 VAL 49 -1.285 -6.837 0.100 401 2HG1 VAL 49 HG12 VAL 49 0.451 -6.914 -0.196 402 3HG1 VAL 49 HG13 VAL 49 -0.325 -8.133 0.814 403 1HG2 VAL 49 HG21 VAL 49 -0.140 -6.633 -2.415 404 2HG2 VAL 49 HG22 VAL 49 -0.701 -7.992 -3.389 405 3HG2 VAL 49 HG23 VAL 49 0.908 -8.030 -2.666 406 H SER 50 HN SER 50 1.912 -10.777 -2.261 407 HA SER 50 HA SER 50 3.752 -10.334 -0.070 408 1HB SER 50 HB2 SER 50 3.851 -12.426 -1.407 409 2HB SER 50 HB1 SER 50 4.287 -11.474 -2.826 410 HG SER 50 HG SER 50 5.767 -11.715 -0.415 411 H TYR 51 HN TYR 51 4.561 -8.341 0.198 412 HA TYR 51 HA TYR 51 5.257 -6.845 -2.224 413 1HB TYR 51 HB2 TYR 51 5.141 -4.795 -0.915 414 2HB TYR 51 HB1 TYR 51 3.633 -5.685 -0.799 415 HD1 TYR 51 HD1 TYR 51 6.868 -5.305 1.058 416 HD2 TYR 51 HD2 TYR 51 2.657 -5.865 1.264 417 HE1 TYR 51 HE1 TYR 51 6.970 -5.129 3.509 418 HE2 TYR 51 HE2 TYR 51 2.746 -5.689 3.710 419 HH TYR 51 HH TYR 51 5.691 -5.761 5.457 420 H ALA 52 HN ALA 52 7.276 -6.385 -2.691 421 HA ALA 52 HA ALA 52 9.315 -6.997 -0.661 422 1HB ALA 52 HB1 ALA 52 9.520 -7.281 -3.656 423 2HB ALA 52 HB2 ALA 52 9.345 -8.596 -2.495 424 3HB ALA 52 HB3 ALA 52 10.810 -7.616 -2.501 425 H VAL 53 HN VAL 53 10.253 -5.234 0.091 426 HA VAL 53 HA VAL 53 10.364 -2.834 -1.574 427 HB VAL 53 HB VAL 53 10.989 -3.137 1.365 428 1HG1 VAL 53 HG11 VAL 53 10.226 -0.569 0.066 429 2HG1 VAL 53 HG12 VAL 53 11.880 -1.157 -0.109 430 3HG1 VAL 53 HG13 VAL 53 11.213 -0.863 1.496 431 1HG2 VAL 53 HG21 VAL 53 8.447 -2.653 -0.105 432 2HG2 VAL 53 HG22 VAL 53 8.709 -1.812 1.424 433 3HG2 VAL 53 HG23 VAL 53 8.743 -3.575 1.368 434 HA PRO 54 HA PRO 54 14.786 -3.777 -1.861 435 1HB PRO 54 HB2 PRO 54 15.040 -3.204 -4.470 436 2HB PRO 54 HB1 PRO 54 14.268 -4.693 -3.916 437 1HG PRO 54 HG2 PRO 54 13.063 -2.337 -5.178 438 2HG PRO 54 HG1 PRO 54 12.404 -3.970 -4.994 439 1HD PRO 54 HD2 PRO 54 11.930 -1.600 -3.363 440 2HD PRO 54 HD1 PRO 54 11.076 -3.155 -3.344 441 H LYS 55 HN LYS 55 16.682 -2.534 -2.214 442 HA LYS 55 HA LYS 55 16.748 0.104 -3.160 443 1HB LYS 55 HB2 LYS 55 15.450 0.267 -0.892 444 2HB LYS 55 HB1 LYS 55 17.047 0.098 -0.177 445 1HG LYS 55 HG2 LYS 55 16.119 2.265 -2.048 446 2HG LYS 55 HG1 LYS 55 16.496 2.425 -0.333 447 1HD LYS 55 HD2 LYS 55 18.832 1.885 -0.785 448 2HD LYS 55 HD1 LYS 55 18.461 1.673 -2.497 449 1HE LYS 55 HE2 LYS 55 17.747 4.027 -2.609 450 2HE LYS 55 HE1 LYS 55 18.198 4.226 -0.916 451 1HZ LYS 55 HZ1 LYS 55 20.245 3.156 -2.686 452 2HZ LYS 55 HZ2 LYS 55 20.384 4.256 -1.411 453 3HZ LYS 55 HZ3 LYS 55 19.831 4.779 -2.921 454 HA PRO 56 HA PRO 56 20.905 -1.675 -2.949 455 1HB PRO 56 HB2 PRO 56 21.999 -0.108 -4.854 456 2HB PRO 56 HB1 PRO 56 20.952 -1.478 -5.243 457 1HG PRO 56 HG2 PRO 56 20.287 1.440 -5.117 458 2HG PRO 56 HG1 PRO 56 19.817 0.237 -6.333 459 1HD PRO 56 HD2 PRO 56 18.159 1.037 -4.336 460 2HD PRO 56 HD1 PRO 56 18.108 -0.592 -5.036 461 H ASN 57 HN ASN 57 21.011 -0.655 -0.752 462 HA ASN 57 HA ASN 57 23.240 1.033 -0.542 463 1HB ASN 57 HB2 ASN 57 21.685 2.772 -1.329 464 2HB ASN 57 HB1 ASN 57 20.604 2.411 0.015 465 1HD2 ASN 57 HD21 ASN 57 20.774 3.714 1.675 466 2HD2 ASN 57 HD22 ASN 57 22.181 4.602 2.141 467 H GLY 58 HN GLY 58 22.814 -1.292 0.644 468 1HA GLY 58 HA2 GLY 58 23.232 -2.123 2.787 469 2HA GLY 58 HA1 GLY 58 22.751 -0.572 3.457 470 H CYS 59 HN CYS 59 20.204 -0.290 2.390 471 HA CYS 59 HA CYS 59 18.647 -1.743 4.178 472 1HB CYS 59 HB2 CYS 59 17.844 -0.351 1.613 473 2HB CYS 59 HB1 CYS 59 16.701 -0.968 2.801 474 H ARG 60 HN ARG 60 19.577 -2.453 0.866 475 HA ARG 60 HA ARG 60 19.506 -4.375 -0.343 476 1HB ARG 60 HB2 ARG 60 20.224 -5.353 1.870 477 2HB ARG 60 HB1 ARG 60 18.539 -5.742 2.173 478 1HG ARG 60 HG2 ARG 60 19.675 -7.690 1.356 479 2HG ARG 60 HG1 ARG 60 18.534 -7.136 0.132 480 1HD ARG 60 HD2 ARG 60 20.311 -6.111 -1.132 481 2HD ARG 60 HD1 ARG 60 21.476 -6.477 0.139 482 HE ARG 60 HE ARG 60 21.723 -8.536 -0.792 483 1HH1 ARG 60 HH11 ARG 60 18.610 -7.294 -1.761 484 2HH1 ARG 60 HH12 ARG 60 18.219 -8.677 -2.724 485 1HH2 ARG 60 HH21 ARG 60 21.212 -10.353 -2.063 486 2HH2 ARG 60 HH22 ARG 60 19.696 -10.413 -2.898 487 H LYS 61 HN LYS 61 17.119 -6.244 1.096 488 HA LYS 61 HA LYS 61 14.901 -4.892 -0.218 489 1HB LYS 61 HB2 LYS 61 15.715 -7.723 -0.896 490 2HB LYS 61 HB1 LYS 61 14.267 -6.909 -1.471 491 1HG LYS 61 HG2 LYS 61 15.651 -5.285 -2.658 492 2HG LYS 61 HG1 LYS 61 17.103 -6.101 -2.080 493 1HD LYS 61 HD2 LYS 61 16.392 -8.148 -3.242 494 2HD LYS 61 HD1 LYS 61 14.967 -7.299 -3.843 495 1HE LYS 61 HE2 LYS 61 17.836 -6.575 -4.422 496 2HE LYS 61 HE1 LYS 61 16.731 -7.386 -5.532 497 1HZ LYS 61 HZ1 LYS 61 15.305 -5.416 -5.453 498 2HZ LYS 61 HZ2 LYS 61 16.850 -5.044 -6.029 499 3HZ LYS 61 HZ3 LYS 61 16.420 -4.640 -4.444 500 H TRP 62 HN TRP 62 13.005 -5.187 0.831 501 HA TRP 62 HA TRP 62 12.983 -7.186 2.998 502 1HB TRP 62 HB2 TRP 62 12.875 -4.880 3.824 503 2HB TRP 62 HB1 TRP 62 11.466 -4.575 2.814 504 HD1 TRP 62 HD1 TRP 62 9.470 -4.369 4.395 505 HE1 TRP 62 HE1 TRP 62 8.534 -5.718 6.375 506 HE3 TRP 62 HE3 TRP 62 13.191 -7.854 4.844 507 HZ2 TRP 62 HZ2 TRP 62 9.271 -7.957 7.923 508 HZ3 TRP 62 HZ3 TRP 62 12.995 -9.564 6.602 509 HH2 TRP 62 HH2 TRP 62 11.075 -9.613 8.110 510 H GLU 63 HN GLU 63 11.206 -8.512 3.258 511 HA GLU 63 HA GLU 63 9.018 -8.243 1.330 512 1HB GLU 63 HB2 GLU 63 10.573 -10.797 1.788 513 2HB GLU 63 HB1 GLU 63 9.110 -10.658 0.823 514 1HG GLU 63 HG2 GLU 63 10.261 -9.147 -0.710 515 2HG GLU 63 HG1 GLU 63 11.729 -9.286 0.258 516 H THR 64 HN THR 64 7.055 -8.777 2.119 517 HA THR 64 HA THR 64 6.799 -10.388 4.510 518 HB THR 64 HB THR 64 5.982 -7.479 4.473 519 HG1 THR 64 HG1 THR 64 7.389 -7.417 6.294 520 1HG2 THR 64 HG21 THR 64 5.423 -9.596 6.534 521 2HG2 THR 64 HG22 THR 64 4.245 -8.666 5.608 522 3HG2 THR 64 HG23 THR 64 5.255 -7.861 6.808 523 H THR 65 HN THR 65 4.865 -11.387 4.656 524 HA THR 65 HA THR 65 3.046 -10.984 2.405 525 HB THR 65 HB THR 65 3.450 -13.267 4.334 526 HG1 THR 65 HG1 THR 65 4.865 -12.877 2.446 527 1HG2 THR 65 HG21 THR 65 1.836 -14.553 3.058 528 2HG2 THR 65 HG22 THR 65 1.437 -13.125 2.102 529 3HG2 THR 65 HG23 THR 65 1.070 -13.163 3.826 530 H PHE 66 HN PHE 66 1.406 -9.633 2.774 531 HA PHE 66 HA PHE 66 0.213 -9.473 5.442 532 1HB PHE 66 HB2 PHE 66 0.024 -7.831 2.936 533 2HB PHE 66 HB1 PHE 66 -1.252 -7.721 4.141 534 HD1 PHE 66 HD1 PHE 66 2.200 -8.345 5.166 535 HD2 PHE 66 HD2 PHE 66 -0.786 -5.377 4.537 536 HE1 PHE 66 HE1 PHE 66 3.542 -6.728 6.446 537 HE2 PHE 66 HE2 PHE 66 0.550 -3.757 5.816 538 HZ PHE 66 HZ PHE 66 2.717 -4.431 6.772 539 H LYS 67 HN LYS 67 -1.410 -10.851 5.935 540 HA LYS 67 HA LYS 67 -3.323 -11.560 3.832 541 1HB LYS 67 HB2 LYS 67 -1.515 -13.260 3.861 542 2HB LYS 67 HB1 LYS 67 -1.899 -13.600 5.538 543 1HG LYS 67 HG2 LYS 67 -4.209 -14.216 4.797 544 2HG LYS 67 HG1 LYS 67 -3.636 -14.080 3.133 545 1HD LYS 67 HD2 LYS 67 -2.526 -15.933 5.243 546 2HD LYS 67 HD1 LYS 67 -3.579 -16.398 3.907 547 1HE LYS 67 HE2 LYS 67 -1.881 -15.731 2.306 548 2HE LYS 67 HE1 LYS 67 -0.836 -15.181 3.615 549 1HZ LYS 67 HZ1 LYS 67 -1.756 -17.984 3.268 550 2HZ LYS 67 HZ2 LYS 67 -0.640 -17.420 4.407 551 3HZ LYS 67 HZ3 LYS 67 -0.250 -17.400 2.762 552 H LYS 68 HN LYS 68 -5.344 -12.086 4.485 553 HA LYS 68 HA LYS 68 -6.170 -12.979 6.954 554 1HB LYS 68 HB2 LYS 68 -5.303 -10.629 7.600 555 2HB LYS 68 HB1 LYS 68 -6.762 -10.034 6.818 556 1HG LYS 68 HG2 LYS 68 -7.110 -10.252 9.211 557 2HG LYS 68 HG1 LYS 68 -8.125 -11.396 8.339 558 1HD LYS 68 HD2 LYS 68 -6.574 -13.193 8.837 559 2HD LYS 68 HD1 LYS 68 -5.482 -12.058 9.630 560 1HE LYS 68 HE2 LYS 68 -7.196 -11.568 11.299 561 2HE LYS 68 HE1 LYS 68 -8.299 -12.688 10.501 562 1HZ LYS 68 HZ1 LYS 68 -6.881 -14.506 11.046 563 2HZ LYS 68 HZ2 LYS 68 -7.144 -13.624 12.465 564 3HZ LYS 68 HZ3 LYS 68 -5.674 -13.479 11.640 565 H THR 69 HN THR 69 -8.538 -10.762 6.652 566 HA THR 69 HA THR 69 -9.989 -12.470 4.772 567 HB THR 69 HB THR 69 -11.023 -12.179 6.940 568 HG1 THR 69 HG1 THR 69 -12.488 -10.657 5.056 569 1HG2 THR 69 HG21 THR 69 -11.881 -10.071 7.723 570 2HG2 THR 69 HG22 THR 69 -11.198 -9.240 6.326 571 3HG2 THR 69 HG23 THR 69 -10.132 -9.971 7.526 572 H SER 70 HN SER 70 -11.610 -11.447 3.319 573 HA SER 70 HA SER 70 -10.900 -8.764 2.421 574 1HB SER 70 HB2 SER 70 -10.726 -9.490 0.071 575 2HB SER 70 HB1 SER 70 -9.490 -10.245 1.077 576 HG SER 70 HG SER 70 -11.045 -12.053 1.229 577 H ASP 71 HN ASP 71 -12.573 -7.608 1.529 578 HA ASP 71 HA ASP 71 -15.216 -8.821 1.769 579 1HB ASP 71 HB2 ASP 71 -16.089 -6.687 1.965 580 2HB ASP 71 HB1 ASP 71 -14.477 -6.453 2.631 581 H ASP 72 HN ASP 72 -16.864 -8.497 0.113 582 HA ASP 72 HA ASP 72 -15.841 -9.106 -2.512 583 1HB ASP 72 HB2 ASP 72 -18.226 -9.379 -3.119 584 2HB ASP 72 HB1 ASP 72 -17.798 -10.301 -1.683 585 H GLY 73 HN GLY 73 -17.637 -7.955 -4.241 586 1HA GLY 73 HA2 GLY 73 -18.081 -6.038 -5.432 587 2HA GLY 73 HA1 GLY 73 -18.020 -5.169 -3.905 588 H GLU 74 HN GLU 74 -15.708 -4.925 -3.034 589 HA GLU 74 HA GLU 74 -13.904 -4.228 -5.257 590 1HB GLU 74 HB2 GLU 74 -14.160 -2.815 -2.586 591 2HB GLU 74 HB1 GLU 74 -13.073 -2.367 -3.892 592 1HG GLU 74 HG2 GLU 74 -14.769 -0.857 -4.171 593 2HG GLU 74 HG1 GLU 74 -15.259 -2.137 -5.278 594 H VAL 75 HN VAL 75 -11.950 -3.529 -2.849 595 HA VAL 75 HA VAL 75 -11.478 -6.278 -1.990 596 HB VAL 75 HB VAL 75 -10.057 -6.324 -3.829 597 1HG1 VAL 75 HG11 VAL 75 -9.747 -4.369 -4.856 598 2HG1 VAL 75 HG12 VAL 75 -8.297 -4.254 -3.863 599 3HG1 VAL 75 HG13 VAL 75 -9.783 -3.457 -3.349 600 1HG2 VAL 75 HG21 VAL 75 -8.171 -6.960 -2.809 601 2HG2 VAL 75 HG22 VAL 75 -8.980 -6.473 -1.320 602 3HG2 VAL 75 HG23 VAL 75 -7.882 -5.357 -2.133 603 H TYR 76 HN TYR 76 -11.761 -6.026 0.087 604 HA TYR 76 HA TYR 76 -10.386 -3.834 1.487 605 1HB TYR 76 HB2 TYR 76 -12.763 -3.753 1.842 606 2HB TYR 76 HB1 TYR 76 -12.824 -5.474 2.196 607 HD1 TYR 76 HD1 TYR 76 -10.805 -2.599 3.498 608 HD2 TYR 76 HD2 TYR 76 -13.346 -5.892 4.384 609 HE1 TYR 76 HE1 TYR 76 -10.578 -2.121 5.901 610 HE2 TYR 76 HE2 TYR 76 -13.130 -5.421 6.786 611 HH TYR 76 HH TYR 76 -11.850 -2.537 7.988 612 H TYR 77 HN TYR 77 -8.686 -4.358 2.741 613 HA TYR 77 HA TYR 77 -8.336 -7.194 3.431 614 1HB TYR 77 HB2 TYR 77 -6.559 -6.426 2.028 615 2HB TYR 77 HB1 TYR 77 -6.323 -4.985 3.004 616 HD1 TYR 77 HD1 TYR 77 -4.104 -5.179 3.706 617 HD2 TYR 77 HD2 TYR 77 -6.727 -8.498 4.144 618 HE1 TYR 77 HE1 TYR 77 -2.393 -6.351 5.018 619 HE2 TYR 77 HE2 TYR 77 -5.018 -9.682 5.459 620 HH TYR 77 HH TYR 77 -1.932 -8.138 6.278 621 H SER 78 HN SER 78 -9.055 -7.570 5.436 622 HA SER 78 HA SER 78 -8.450 -5.578 7.510 623 1HB SER 78 HB2 SER 78 -10.851 -6.070 7.207 624 2HB SER 78 HB1 SER 78 -10.541 -7.768 7.555 625 HG SER 78 HG SER 78 -10.609 -5.581 9.261 626 H GLU 79 HN GLU 79 -6.720 -6.041 8.645 627 HA GLU 79 HA GLU 79 -6.059 -8.850 9.147 628 1HB GLU 79 HB2 GLU 79 -4.462 -6.638 8.378 629 2HB GLU 79 HB1 GLU 79 -3.992 -7.081 10.009 630 1HG GLU 79 HG2 GLU 79 -4.160 -9.025 7.739 631 2HG GLU 79 HG1 GLU 79 -2.687 -8.184 8.212 632 H GLU 80 HN GLU 80 -8.154 -7.734 10.544 633 HA GLU 80 HA GLU 80 -8.974 -7.128 12.603 634 1HB GLU 80 HB2 GLU 80 -8.379 -8.790 14.323 635 2HB GLU 80 HB1 GLU 80 -8.755 -9.515 12.768 636 1HG GLU 80 HG2 GLU 80 -6.427 -9.878 12.320 637 2HG GLU 80 HG1 GLU 80 -5.975 -9.025 13.796 638 H ALA 81 HN ALA 81 -8.634 -5.301 13.641 639 HA ALA 81 HA ALA 81 -7.551 -3.560 14.665 640 1HB ALA 81 HB1 ALA 81 -7.997 -4.801 16.582 641 2HB ALA 81 HB2 ALA 81 -6.288 -4.392 16.729 642 3HB ALA 81 HB3 ALA 81 -6.767 -6.006 16.203 643 H LYS 82 HN LYS 82 -4.820 -5.318 15.733 644 HA LYS 82 HA LYS 82 -2.719 -4.007 15.337 645 1HB LYS 82 HB2 LYS 82 -2.965 -6.724 14.060 646 2HB LYS 82 HB1 LYS 82 -1.440 -5.931 14.435 647 1HG LYS 82 HG2 LYS 82 -2.093 -5.885 16.815 648 2HG LYS 82 HG1 LYS 82 -3.555 -6.783 16.398 649 1HD LYS 82 HD2 LYS 82 -0.720 -7.713 15.971 650 2HD LYS 82 HD1 LYS 82 -1.811 -8.270 17.241 651 1HE LYS 82 HE2 LYS 82 -2.213 -8.598 14.269 652 2HE LYS 82 HE1 LYS 82 -1.729 -9.862 15.398 653 1HZ LYS 82 HZ1 LYS 82 -4.041 -10.091 15.014 654 2HZ LYS 82 HZ2 LYS 82 -4.334 -8.448 15.287 655 3HZ LYS 82 HZ3 LYS 82 -3.878 -9.450 16.571 656 H LYS 83 HN LYS 83 -4.175 -5.407 12.379 657 HA LYS 83 HA LYS 83 -3.004 -3.148 10.922 658 1HB LYS 83 HB2 LYS 83 -2.762 -6.045 10.133 659 2HB LYS 83 HB1 LYS 83 -2.422 -4.712 9.044 660 1HG LYS 83 HG2 LYS 83 -0.634 -3.962 10.508 661 2HG LYS 83 HG1 LYS 83 -1.003 -5.262 11.642 662 1HD LYS 83 HD2 LYS 83 -0.482 -6.913 9.895 663 2HD LYS 83 HD1 LYS 83 -0.076 -5.599 8.789 664 1HE LYS 83 HE2 LYS 83 1.305 -6.186 11.407 665 2HE LYS 83 HE1 LYS 83 1.921 -6.599 9.808 666 1HZ LYS 83 HZ1 LYS 83 1.321 -3.822 10.662 667 2HZ LYS 83 HZ2 LYS 83 2.140 -4.314 9.266 668 3HZ LYS 83 HZ3 LYS 83 2.854 -4.527 10.784 669 H LYS 84 HN LYS 84 -4.725 -2.083 10.225 670 HA LYS 84 HA LYS 84 -6.997 -3.584 9.102 671 1HB LYS 84 HB2 LYS 84 -7.322 -1.860 10.985 672 2HB LYS 84 HB1 LYS 84 -6.944 -0.640 9.782 673 1HG LYS 84 HG2 LYS 84 -9.201 -2.613 9.542 674 2HG LYS 84 HG1 LYS 84 -9.367 -0.975 10.173 675 1HD LYS 84 HD2 LYS 84 -8.530 -1.773 7.388 676 2HD LYS 84 HD1 LYS 84 -10.041 -1.007 7.863 677 1HE LYS 84 HE2 LYS 84 -7.286 0.203 8.069 678 2HE LYS 84 HE1 LYS 84 -8.526 0.624 6.890 679 1HZ LYS 84 HZ1 LYS 84 -8.440 2.205 8.723 680 2HZ LYS 84 HZ2 LYS 84 -8.770 0.969 9.830 681 3HZ LYS 84 HZ3 LYS 84 -9.931 1.406 8.680 682 H VAL 85 HN VAL 85 -7.336 -3.476 6.909 683 HA VAL 85 HA VAL 85 -5.910 -1.372 5.438 684 HB VAL 85 HB VAL 85 -5.863 -4.290 4.684 685 1HG1 VAL 85 HG11 VAL 85 -4.938 -1.800 3.336 686 2HG1 VAL 85 HG12 VAL 85 -5.825 -3.166 2.664 687 3HG1 VAL 85 HG13 VAL 85 -4.109 -3.328 3.046 688 1HG2 VAL 85 HG21 VAL 85 -3.291 -3.630 4.972 689 2HG2 VAL 85 HG22 VAL 85 -4.265 -4.276 6.293 690 3HG2 VAL 85 HG23 VAL 85 -3.996 -2.538 6.164 691 H GLU 86 HN GLU 86 -6.716 -0.786 3.435 692 HA GLU 86 HA GLU 86 -9.266 -1.935 2.571 693 1HB GLU 86 HB2 GLU 86 -8.814 1.019 3.039 694 2HB GLU 86 HB1 GLU 86 -10.257 0.305 2.337 695 1HG GLU 86 HG2 GLU 86 -10.743 -0.822 4.427 696 2HG GLU 86 HG1 GLU 86 -9.263 -0.180 5.138 697 H VAL 87 HN VAL 87 -9.110 -2.365 0.457 698 HA VAL 87 HA VAL 87 -7.278 -0.722 -1.158 699 HB VAL 87 HB VAL 87 -8.328 -3.381 -2.055 700 1HG1 VAL 87 HG11 VAL 87 -7.143 -2.831 -3.847 701 2HG1 VAL 87 HG12 VAL 87 -5.695 -3.007 -2.862 702 3HG1 VAL 87 HG13 VAL 87 -6.456 -1.427 -3.032 703 1HG2 VAL 87 HG21 VAL 87 -5.728 -3.770 -1.053 704 2HG2 VAL 87 HG22 VAL 87 -7.232 -4.487 -0.478 705 3HG2 VAL 87 HG23 VAL 87 -6.652 -2.979 0.223 706 H LEU 88 HN LEU 88 -8.262 0.761 -2.330 707 HA LEU 88 HA LEU 88 -10.906 0.158 -3.479 708 1HB LEU 88 HB2 LEU 88 -11.569 2.442 -3.128 709 2HB LEU 88 HB1 LEU 88 -11.026 1.761 -1.608 710 HG LEU 88 HG LEU 88 -9.258 3.484 -3.340 711 1HD1 LEU 88 HD11 LEU 88 -10.914 4.355 -0.978 712 2HD1 LEU 88 HD12 LEU 88 -11.296 4.709 -2.662 713 3HD1 LEU 88 HD13 LEU 88 -9.824 5.355 -1.938 714 1HD2 LEU 88 HD21 LEU 88 -8.488 3.772 -0.736 715 2HD2 LEU 88 HD22 LEU 88 -7.748 2.672 -1.898 716 3HD2 LEU 88 HD23 LEU 88 -8.983 2.080 -0.788 717 H ASP 89 HN ASP 89 -10.986 2.778 -4.837 718 HA ASP 89 HA ASP 89 -10.502 3.644 -6.880 719 1HB ASP 89 HB2 ASP 89 -8.405 4.319 -5.954 720 2HB ASP 89 HB1 ASP 89 -7.764 2.687 -6.044 721 H THR 90 HN THR 90 -8.054 1.173 -7.270 722 HA THR 90 HA THR 90 -7.791 -0.373 -8.943 723 HB THR 90 HB THR 90 -10.404 -1.149 -7.650 724 HG1 THR 90 HG1 THR 90 -9.173 -2.200 -6.230 725 1HG2 THR 90 HG21 THR 90 -8.625 -2.714 -9.477 726 2HG2 THR 90 HG22 THR 90 -10.376 -2.514 -9.535 727 3HG2 THR 90 HG23 THR 90 -9.641 -3.497 -8.268 728 H ASP 91 HN ASP 91 -7.857 0.107 -11.031 729 HA ASP 91 HA ASP 91 -10.208 1.088 -12.359 730 1HB ASP 91 HB2 ASP 91 -7.853 1.678 -13.050 731 2HB ASP 91 HB1 ASP 91 -7.661 0.022 -13.607 732 H TYR 92 HN TYR 92 -8.968 -1.922 -11.463 733 HA TYR 92 HA TYR 92 -9.887 -4.008 -11.625 734 1HB TYR 92 HB2 TYR 92 -12.029 -2.576 -12.297 735 2HB TYR 92 HB1 TYR 92 -11.686 -3.254 -13.883 736 HD1 TYR 92 HD1 TYR 92 -11.475 -4.723 -10.454 737 HD2 TYR 92 HD2 TYR 92 -13.254 -4.903 -14.316 738 HE1 TYR 92 HE1 TYR 92 -12.665 -6.772 -9.802 739 HE2 TYR 92 HE2 TYR 92 -14.449 -6.956 -13.673 740 HH TYR 92 HH TYR 92 -15.014 -7.915 -10.738 741 H LYS 93 HN LYS 93 -7.878 -2.536 -13.568 742 HA LYS 93 HA LYS 93 -7.215 -4.895 -14.994 743 1HB LYS 93 HB2 LYS 93 -7.557 -4.092 -17.281 744 2HB LYS 93 HB1 LYS 93 -9.066 -4.241 -16.399 745 1HG LYS 93 HG2 LYS 93 -9.267 -2.251 -17.596 746 2HG LYS 93 HG1 LYS 93 -8.869 -1.739 -15.957 747 1HD LYS 93 HD2 LYS 93 -6.563 -1.383 -16.596 748 2HD LYS 93 HD1 LYS 93 -6.878 -2.014 -18.209 749 1HE LYS 93 HE2 LYS 93 -8.084 0.472 -16.997 750 2HE LYS 93 HE1 LYS 93 -6.800 0.426 -18.202 751 1HZ LYS 93 HZ1 LYS 93 -8.422 -0.787 -19.657 752 2HZ LYS 93 HZ2 LYS 93 -8.798 0.833 -19.354 753 3HZ LYS 93 HZ3 LYS 93 -9.627 -0.393 -18.536 754 H SER 94 HN SER 94 -6.394 -1.668 -14.025 755 HA SER 94 HA SER 94 -3.694 -2.212 -14.969 756 1HB SER 94 HB2 SER 94 -3.447 0.014 -16.022 757 2HB SER 94 HB1 SER 94 -4.601 -1.030 -16.852 758 HG SER 94 HG SER 94 -5.480 1.025 -16.618 759 H TYR 95 HN TYR 95 -5.733 0.021 -13.046 760 HA TYR 95 HA TYR 95 -3.364 0.407 -11.341 761 1HB TYR 95 HB2 TYR 95 -3.844 2.784 -11.105 762 2HB TYR 95 HB1 TYR 95 -3.552 2.365 -12.787 763 HD1 TYR 95 HD1 TYR 95 -6.415 2.764 -10.399 764 HD2 TYR 95 HD2 TYR 95 -4.990 3.212 -14.384 765 HE1 TYR 95 HE1 TYR 95 -8.536 3.841 -11.031 766 HE2 TYR 95 HE2 TYR 95 -7.106 4.289 -15.026 767 HH TYR 95 HH TYR 95 -9.816 4.067 -13.533 768 H ALA 96 HN ALA 96 -3.710 0.790 -9.151 769 HA ALA 96 HA ALA 96 -6.405 0.915 -8.105 770 1HB ALA 96 HB1 ALA 96 -5.037 -1.605 -8.331 771 2HB ALA 96 HB2 ALA 96 -6.671 -1.267 -7.772 772 3HB ALA 96 HB3 ALA 96 -5.326 -1.215 -6.637 773 H VAL 97 HN VAL 97 -6.499 1.534 -5.934 774 HA VAL 97 HA VAL 97 -3.917 2.263 -4.716 775 HB VAL 97 HB VAL 97 -4.730 4.303 -3.925 776 1HG1 VAL 97 HG11 VAL 97 -4.546 5.192 -5.944 777 2HG1 VAL 97 HG12 VAL 97 -6.273 4.942 -6.178 778 3HG1 VAL 97 HG13 VAL 97 -5.128 3.710 -6.701 779 1HG2 VAL 97 HG21 VAL 97 -7.301 4.812 -4.418 780 2HG2 VAL 97 HG22 VAL 97 -6.749 4.061 -2.922 781 3HG2 VAL 97 HG23 VAL 97 -7.403 3.063 -4.218 782 H ILE 98 HN ILE 98 -3.691 1.864 -2.518 783 HA ILE 98 HA ILE 98 -6.000 0.709 -1.130 784 HB ILE 98 HB ILE 98 -4.775 -1.175 -2.036 785 1HG1 ILE 98 HG12 ILE 98 -5.777 -1.244 0.299 786 2HG1 ILE 98 HG11 ILE 98 -4.569 -2.470 -0.062 787 1HG2 ILE 98 HG21 ILE 98 -2.357 -0.849 -0.433 788 2HG2 ILE 98 HG22 ILE 98 -2.533 0.341 -1.720 789 3HG2 ILE 98 HG23 ILE 98 -2.557 -1.379 -2.101 790 1HD1 ILE 98 HD11 ILE 98 -4.602 -0.484 2.008 791 2HD1 ILE 98 HD12 ILE 98 -3.145 -0.330 1.026 792 3HD1 ILE 98 HD13 ILE 98 -3.532 -1.867 1.795 793 H TYR 99 HN TYR 99 -6.284 1.561 0.785 794 HA TYR 99 HA TYR 99 -4.035 2.918 2.115 795 1HB TYR 99 HB2 TYR 99 -5.861 4.434 1.707 796 2HB TYR 99 HB1 TYR 99 -7.030 3.283 2.343 797 HD1 TYR 99 HD1 TYR 99 -3.818 4.721 3.632 798 HD2 TYR 99 HD2 TYR 99 -7.956 4.017 4.319 799 HE1 TYR 99 HE1 TYR 99 -3.617 5.742 5.858 800 HE2 TYR 99 HE2 TYR 99 -7.763 5.036 6.549 801 HH TYR 99 HH TYR 99 -5.425 6.960 7.505 802 H ALA 100 HN ALA 100 -3.471 2.359 4.215 803 HA ALA 100 HA ALA 100 -5.094 0.307 5.536 804 1HB ALA 100 HB1 ALA 100 -2.303 -0.001 4.592 805 2HB ALA 100 HB2 ALA 100 -3.604 -1.187 4.692 806 3HB ALA 100 HB3 ALA 100 -2.727 -0.714 6.147 807 H THR 101 HN THR 101 -5.190 0.429 7.690 808 HA THR 101 HA THR 101 -3.421 2.331 9.070 809 HB THR 101 HB THR 101 -6.397 1.962 9.485 810 HG1 THR 101 HG1 THR 101 -5.703 3.293 7.695 811 1HG2 THR 101 HG21 THR 101 -6.313 3.017 11.430 812 2HG2 THR 101 HG22 THR 101 -5.202 4.236 10.807 813 3HG2 THR 101 HG23 THR 101 -4.578 2.705 11.422 814 H ARG 102 HN ARG 102 -2.444 1.523 10.832 815 HA ARG 102 HA ARG 102 -3.218 -1.164 11.695 816 1HB ARG 102 HB2 ARG 102 -0.713 0.408 12.314 817 2HB ARG 102 HB1 ARG 102 -1.010 -1.270 12.740 818 1HG ARG 102 HG2 ARG 102 -1.077 -1.881 10.394 819 2HG ARG 102 HG1 ARG 102 -0.846 -0.193 9.934 820 1HD ARG 102 HD2 ARG 102 1.319 -0.205 11.124 821 2HD ARG 102 HD1 ARG 102 1.087 -1.916 11.481 822 HE ARG 102 HE ARG 102 1.859 -2.370 9.395 823 1HH1 ARG 102 HH11 ARG 102 0.617 0.893 9.388 824 2HH1 ARG 102 HH12 ARG 102 1.038 1.181 7.734 825 1HH2 ARG 102 HH21 ARG 102 2.419 -1.990 7.226 826 2HH2 ARG 102 HH22 ARG 102 2.063 -0.456 6.506 827 H VAL 103 HN VAL 103 -3.730 -1.689 13.786 828 HA VAL 103 HA VAL 103 -3.689 0.396 15.816 829 HB VAL 103 HB VAL 103 -6.014 -0.047 16.506 830 1HG1 VAL 103 HG11 VAL 103 -6.023 0.813 13.631 831 2HG1 VAL 103 HG12 VAL 103 -5.299 1.805 14.896 832 3HG1 VAL 103 HG13 VAL 103 -7.015 1.402 14.965 833 1HG2 VAL 103 HG21 VAL 103 -7.536 -1.183 14.946 834 2HG2 VAL 103 HG22 VAL 103 -6.294 -2.265 15.568 835 3HG2 VAL 103 HG23 VAL 103 -6.158 -1.615 13.935 836 H LYS 104 HN LYS 104 -2.786 -0.413 17.554 837 HA LYS 104 HA LYS 104 -3.541 -2.985 18.618 838 1HB LYS 104 HB2 LYS 104 -1.852 -3.665 17.005 839 2HB LYS 104 HB1 LYS 104 -0.724 -2.479 17.642 840 1HG LYS 104 HG2 LYS 104 -0.678 -3.697 19.775 841 2HG LYS 104 HG1 LYS 104 -1.771 -4.903 19.089 842 1HD LYS 104 HD2 LYS 104 -0.116 -5.422 17.361 843 2HD LYS 104 HD1 LYS 104 0.974 -4.211 18.036 844 1HE LYS 104 HE2 LYS 104 -0.014 -6.685 19.449 845 2HE LYS 104 HE1 LYS 104 1.584 -6.472 18.736 846 1HZ LYS 104 HZ1 LYS 104 1.655 -6.088 21.101 847 2HZ LYS 104 HZ2 LYS 104 0.455 -4.902 20.989 848 3HZ LYS 104 HZ3 LYS 104 1.970 -4.641 20.283 849 H ASP 105 HN ASP 105 -3.260 -3.075 20.799 850 HA ASP 105 HA ASP 105 -2.965 -2.283 22.917 851 1HB ASP 105 HB2 ASP 105 -0.589 -2.832 22.180 852 2HB ASP 105 HB1 ASP 105 -0.383 -1.111 21.872 853 H GLY 106 HN GLY 106 -4.500 -0.653 21.215 854 1HA GLY 106 HA2 GLY 106 -5.487 1.415 21.224 855 2HA GLY 106 HA1 GLY 106 -4.615 1.728 22.714 856 H ARG 107 HN ARG 107 -3.329 1.123 19.444 857 HA ARG 107 HA ARG 107 -2.343 3.898 19.412 858 1HB ARG 107 HB2 ARG 107 -0.167 3.267 18.769 859 2HB ARG 107 HB1 ARG 107 -0.573 2.175 20.084 860 1HG ARG 107 HG2 ARG 107 -1.304 0.563 18.194 861 2HG ARG 107 HG1 ARG 107 -0.331 1.607 17.163 862 1HD ARG 107 HD2 ARG 107 0.608 0.136 19.623 863 2HD ARG 107 HD1 ARG 107 0.996 -0.264 17.950 864 HE ARG 107 HE ARG 107 2.299 1.652 19.575 865 1HH1 ARG 107 HH11 ARG 107 1.288 1.066 16.287 866 2HH1 ARG 107 HH12 ARG 107 2.485 2.113 15.604 867 1HH2 ARG 107 HH21 ARG 107 3.872 3.025 18.676 868 2HH2 ARG 107 HH22 ARG 107 3.953 3.223 16.957 869 H THR 108 HN THR 108 -2.531 4.928 17.464 870 HA THR 108 HA THR 108 -3.683 3.330 15.277 871 HB THR 108 HB THR 108 -5.196 5.028 16.107 872 HG1 THR 108 HG1 THR 108 -5.029 4.647 13.801 873 1HG2 THR 108 HG21 THR 108 -3.153 7.096 15.345 874 2HG2 THR 108 HG22 THR 108 -3.496 6.596 17.000 875 3HG2 THR 108 HG23 THR 108 -4.753 7.370 16.037 876 H LEU 109 HN LEU 109 -2.959 3.523 13.192 877 HA LEU 109 HA LEU 109 -0.687 5.288 12.642 878 1HB LEU 109 HB2 LEU 109 -0.711 2.327 12.054 879 2HB LEU 109 HB1 LEU 109 0.506 3.456 11.497 880 HG LEU 109 HG LEU 109 -0.030 2.720 14.374 881 1HD1 LEU 109 HD11 LEU 109 2.583 2.087 13.653 882 2HD1 LEU 109 HD12 LEU 109 1.599 1.548 12.293 883 3HD1 LEU 109 HD13 LEU 109 1.254 0.959 13.920 884 1HD2 LEU 109 HD21 LEU 109 0.877 4.744 14.747 885 2HD2 LEU 109 HD22 LEU 109 1.502 4.881 13.104 886 3HD2 LEU 109 HD23 LEU 109 2.390 3.951 14.312 887 H HIS 110 HN HIS 110 -0.898 6.254 10.708 888 HA HIS 110 HA HIS 110 -2.926 5.162 8.877 889 1HB HIS 110 HB2 HIS 110 -1.845 7.980 9.082 890 2HB HIS 110 HB1 HIS 110 -3.088 7.442 7.958 891 HD1 HIS 110 HD1 HIS 110 -4.145 9.599 9.523 892 HD2 HIS 110 HD2 HIS 110 -4.009 5.767 11.122 893 HE1 HIS 110 HE1 HIS 110 -5.827 9.589 11.393 894 HE2 HIS 110 HE2 HIS 110 -5.661 7.287 12.402 895 H MET 111 HN MET 111 -2.415 4.682 6.786 896 HA MET 111 HA MET 111 -0.022 5.604 5.542 897 1HB MET 111 HB2 MET 111 0.985 3.895 6.952 898 2HB MET 111 HB1 MET 111 -0.146 2.694 6.342 899 1HG MET 111 HG2 MET 111 0.801 2.968 4.093 900 2HG MET 111 HG1 MET 111 1.950 4.138 4.736 901 1HE MET 111 HE1 MET 111 3.740 2.799 3.542 902 2HE MET 111 HE2 MET 111 2.830 1.359 3.083 903 3HE MET 111 HE3 MET 111 4.322 1.201 4.011 904 H MET 112 HN MET 112 -0.456 5.821 3.489 905 HA MET 112 HA MET 112 -2.589 4.232 2.254 906 1HB MET 112 HB2 MET 112 -1.376 6.899 1.564 907 2HB MET 112 HB1 MET 112 -2.355 6.013 0.415 908 1HG MET 112 HG2 MET 112 -3.781 7.584 1.413 909 2HG MET 112 HG1 MET 112 -4.194 6.029 2.130 910 1HE MET 112 HE1 MET 112 -4.655 9.114 4.644 911 2HE MET 112 HE2 MET 112 -5.407 7.521 4.559 912 3HE MET 112 HE3 MET 112 -5.249 8.502 3.101 913 H ARG 113 HN ARG 113 -2.256 3.200 0.283 914 HA ARG 113 HA ARG 113 0.500 3.090 -0.711 915 1HB ARG 113 HB2 ARG 113 0.288 1.158 0.729 916 2HB ARG 113 HB1 ARG 113 -1.241 0.716 -0.017 917 1HG ARG 113 HG2 ARG 113 -0.051 0.307 -2.138 918 2HG ARG 113 HG1 ARG 113 1.469 0.667 -1.321 919 1HD ARG 113 HD2 ARG 113 -0.444 -1.539 -0.572 920 2HD ARG 113 HD1 ARG 113 1.050 -1.748 -1.484 921 HE ARG 113 HE ARG 113 1.648 -0.474 0.942 922 1HH1 ARG 113 HH11 ARG 113 0.554 -3.562 -0.252 923 2HH1 ARG 113 HH12 ARG 113 1.242 -4.459 1.060 924 1HH2 ARG 113 HH21 ARG 113 2.557 -1.657 2.680 925 2HH2 ARG 113 HH22 ARG 113 2.377 -3.379 2.723 926 H LEU 114 HN LEU 114 0.656 3.029 -2.898 927 HA LEU 114 HA LEU 114 -1.849 2.684 -4.417 928 1HB LEU 114 HB2 LEU 114 -1.240 5.033 -4.377 929 2HB LEU 114 HB1 LEU 114 0.389 4.649 -4.895 930 HG LEU 114 HG LEU 114 -0.409 3.969 -7.079 931 1HD1 LEU 114 HD11 LEU 114 -2.464 3.142 -7.246 932 2HD1 LEU 114 HD12 LEU 114 -3.054 4.803 -7.194 933 3HD1 LEU 114 HD13 LEU 114 -2.950 3.858 -5.708 934 1HD2 LEU 114 HD21 LEU 114 0.012 6.175 -7.327 935 2HD2 LEU 114 HD22 LEU 114 -1.019 6.634 -5.972 936 3HD2 LEU 114 HD23 LEU 114 -1.737 6.262 -7.539 937 H TYR 115 HN TYR 115 -1.713 0.871 -5.573 938 HA TYR 115 HA TYR 115 0.874 0.227 -6.813 939 1HB TYR 115 HB2 TYR 115 0.386 -2.132 -6.547 940 2HB TYR 115 HB1 TYR 115 0.309 -1.332 -4.982 941 HD1 TYR 115 HD1 TYR 115 -1.618 -1.483 -3.666 942 HD2 TYR 115 HD2 TYR 115 -1.809 -2.609 -7.759 943 HE1 TYR 115 HE1 TYR 115 -3.875 -2.388 -3.304 944 HE2 TYR 115 HE2 TYR 115 -4.068 -3.515 -7.414 945 HH TYR 115 HH TYR 115 -5.559 -4.190 -5.793 946 H SER 116 HN SER 116 0.906 -0.136 -8.944 947 HA SER 116 HA SER 116 -1.654 -0.007 -10.360 948 1HB SER 116 HB2 SER 116 0.045 1.637 -11.033 949 2HB SER 116 HB1 SER 116 1.168 0.329 -11.407 950 HG SER 116 HG SER 116 -1.194 1.081 -12.739 951 H ARG 117 HN ARG 117 -2.377 -1.618 -11.658 952 HA ARG 117 HA ARG 117 -1.568 -4.262 -11.217 953 1HB ARG 117 HB2 ARG 117 -3.029 -3.266 -13.665 954 2HB ARG 117 HB1 ARG 117 -3.093 -4.878 -12.974 955 1HG ARG 117 HG2 ARG 117 -4.123 -2.395 -11.617 956 2HG ARG 117 HG1 ARG 117 -5.110 -3.526 -12.540 957 1HD ARG 117 HD2 ARG 117 -4.620 -5.301 -10.996 958 2HD ARG 117 HD1 ARG 117 -3.461 -4.287 -10.136 959 HE ARG 117 HE ARG 117 -5.832 -2.920 -10.008 960 1HH1 ARG 117 HH11 ARG 117 -4.808 -6.128 -9.114 961 2HH1 ARG 117 HH12 ARG 117 -5.857 -6.216 -7.740 962 1HH2 ARG 117 HH21 ARG 117 -7.206 -3.034 -8.189 963 2HH2 ARG 117 HH22 ARG 117 -7.215 -4.463 -7.214 964 H SER 118 HN SER 118 -0.783 -1.950 -13.734 965 HA SER 118 HA SER 118 1.359 -3.736 -14.672 966 1HB SER 118 HB2 SER 118 -0.356 -1.901 -16.365 967 2HB SER 118 HB1 SER 118 1.017 -2.840 -16.950 968 HG SER 118 HG SER 118 -0.266 -4.484 -17.116 969 HA PRO 119 HA PRO 119 4.515 -0.720 -14.080 970 1HB PRO 119 HB2 PRO 119 4.628 -0.529 -17.070 971 2HB PRO 119 HB1 PRO 119 5.953 -0.655 -15.906 972 1HG PRO 119 HG2 PRO 119 5.118 -2.786 -17.290 973 2HG PRO 119 HG1 PRO 119 5.654 -2.926 -15.607 974 1HD PRO 119 HD2 PRO 119 2.934 -3.132 -16.736 975 2HD PRO 119 HD1 PRO 119 3.577 -3.777 -15.214 976 H GLU 120 HN GLU 120 2.236 0.044 -16.697 977 HA GLU 120 HA GLU 120 2.591 2.868 -16.504 978 1HB GLU 120 HB2 GLU 120 1.843 1.903 -18.586 979 2HB GLU 120 HB1 GLU 120 0.436 1.196 -17.803 980 1HG GLU 120 HG2 GLU 120 -0.429 3.445 -17.352 981 2HG GLU 120 HG1 GLU 120 0.970 4.137 -18.172 982 H VAL 121 HN VAL 121 1.357 4.402 -15.504 983 HA VAL 121 HA VAL 121 -0.854 3.466 -13.808 984 HB VAL 121 HB VAL 121 1.256 5.452 -12.938 985 1HG1 VAL 121 HG11 VAL 121 -0.915 5.996 -12.017 986 2HG1 VAL 121 HG12 VAL 121 0.115 5.326 -10.752 987 3HG1 VAL 121 HG13 VAL 121 -1.140 4.329 -11.489 988 1HG2 VAL 121 HG21 VAL 121 1.095 2.561 -12.732 989 2HG2 VAL 121 HG22 VAL 121 1.227 3.336 -11.153 990 3HG2 VAL 121 HG23 VAL 121 2.444 3.643 -12.392 991 H SER 122 HN SER 122 -2.630 4.437 -14.463 992 HA SER 122 HA SER 122 -2.673 6.696 -16.149 993 1HB SER 122 HB2 SER 122 -4.458 5.028 -16.177 994 2HB SER 122 HB1 SER 122 -4.906 5.457 -14.526 995 HG SER 122 HG SER 122 -5.851 6.511 -16.698 996 HA PRO 123 HA PRO 123 -2.392 10.202 -13.485 997 1HB PRO 123 HB2 PRO 123 -4.435 11.723 -14.633 998 2HB PRO 123 HB1 PRO 123 -2.755 11.696 -15.171 999 1HG PRO 123 HG2 PRO 123 -5.113 10.215 -16.246 1000 2HG PRO 123 HG1 PRO 123 -3.761 10.960 -17.120 1001 1HD PRO 123 HD2 PRO 123 -3.871 8.319 -16.759 1002 2HD PRO 123 HD1 PRO 123 -2.325 9.188 -16.648 1003 H ALA 124 HN ALA 124 -5.551 8.813 -14.207 1004 HA ALA 124 HA ALA 124 -7.022 10.029 -12.146 1005 1HB ALA 124 HB1 ALA 124 -8.244 7.598 -12.493 1006 2HB ALA 124 HB2 ALA 124 -7.412 7.839 -14.031 1007 3HB ALA 124 HB3 ALA 124 -8.553 9.048 -13.445 1008 H ALA 125 HN ALA 125 -5.404 6.864 -12.279 1009 HA ALA 125 HA ALA 125 -6.093 5.902 -9.789 1010 1HB ALA 125 HB1 ALA 125 -4.405 5.098 -11.793 1011 2HB ALA 125 HB2 ALA 125 -4.659 4.266 -10.260 1012 3HB ALA 125 HB3 ALA 125 -3.303 5.377 -10.442 1013 H THR 126 HN THR 126 -3.251 7.882 -10.623 1014 HA THR 126 HA THR 126 -2.431 8.146 -7.892 1015 HB THR 126 HB THR 126 -0.805 8.250 -9.700 1016 HG1 THR 126 HG1 THR 126 0.298 9.525 -8.483 1017 1HG2 THR 126 HG21 THR 126 -0.630 9.991 -11.269 1018 2HG2 THR 126 HG22 THR 126 -1.889 10.939 -10.478 1019 3HG2 THR 126 HG23 THR 126 -2.311 9.457 -11.336 1020 H ALA 127 HN ALA 127 -4.011 10.335 -10.213 1021 HA ALA 127 HA ALA 127 -4.172 12.516 -8.401 1022 1HB ALA 127 HB1 ALA 127 -5.913 12.099 -10.816 1023 2HB ALA 127 HB2 ALA 127 -4.245 12.666 -10.905 1024 3HB ALA 127 HB3 ALA 127 -5.458 13.622 -10.054 1025 H ILE 128 HN ILE 128 -6.701 10.283 -9.595 1026 HA ILE 128 HA ILE 128 -8.768 11.266 -8.032 1027 HB ILE 128 HB ILE 128 -8.372 8.405 -8.921 1028 1HG1 ILE 128 HG12 ILE 128 -9.996 10.655 -10.134 1029 2HG1 ILE 128 HG11 ILE 128 -8.460 10.063 -10.758 1030 1HG2 ILE 128 HG21 ILE 128 -9.966 8.593 -7.060 1031 2HG2 ILE 128 HG22 ILE 128 -10.761 8.125 -8.562 1032 3HG2 ILE 128 HG23 ILE 128 -10.883 9.785 -7.982 1033 1HD1 ILE 128 HD11 ILE 128 -10.079 9.056 -12.094 1034 2HD1 ILE 128 HD12 ILE 128 -11.118 8.684 -10.715 1035 3HD1 ILE 128 HD13 ILE 128 -9.608 7.802 -10.950 1036 H PHE 129 HN PHE 129 -6.285 8.852 -7.214 1037 HA PHE 129 HA PHE 129 -7.376 8.120 -4.718 1038 1HB PHE 129 HB2 PHE 129 -5.514 6.886 -5.815 1039 2HB PHE 129 HB1 PHE 129 -4.443 8.241 -5.476 1040 HD1 PHE 129 HD1 PHE 129 -7.031 6.762 -3.260 1041 HD2 PHE 129 HD2 PHE 129 -2.874 7.308 -4.000 1042 HE1 PHE 129 HE1 PHE 129 -6.515 5.805 -1.053 1043 HE2 PHE 129 HE2 PHE 129 -2.352 6.351 -1.793 1044 HZ PHE 129 HZ PHE 129 -4.175 5.600 -0.316 1045 H ARG 130 HN ARG 130 -5.096 10.650 -5.673 1046 HA ARG 130 HA ARG 130 -4.680 11.724 -3.092 1047 1HB ARG 130 HB2 ARG 130 -3.171 12.243 -4.943 1048 2HB ARG 130 HB1 ARG 130 -4.479 13.021 -5.822 1049 1HG ARG 130 HG2 ARG 130 -3.008 14.665 -4.815 1050 2HG ARG 130 HG1 ARG 130 -4.619 14.746 -4.098 1051 1HD ARG 130 HD2 ARG 130 -2.878 14.923 -2.399 1052 2HD ARG 130 HD1 ARG 130 -3.843 13.465 -2.181 1053 HE ARG 130 HE ARG 130 -1.630 12.779 -3.721 1054 1HH1 ARG 130 HH11 ARG 130 -2.281 13.952 -0.499 1055 2HH1 ARG 130 HH12 ARG 130 -0.920 13.145 0.204 1056 1HH2 ARG 130 HH21 ARG 130 0.161 11.718 -2.797 1057 2HH2 ARG 130 HH22 ARG 130 0.460 11.872 -1.100 1058 H LYS 131 HN LYS 131 -6.940 12.439 -5.702 1059 HA LYS 131 HA LYS 131 -8.238 14.641 -4.521 1060 1HB LYS 131 HB2 LYS 131 -8.441 14.011 -6.916 1061 2HB LYS 131 HB1 LYS 131 -9.376 12.600 -6.443 1062 1HG LYS 131 HG2 LYS 131 -11.120 14.033 -5.538 1063 2HG LYS 131 HG1 LYS 131 -10.178 15.463 -5.963 1064 1HD LYS 131 HD2 LYS 131 -11.901 15.061 -7.629 1065 2HD LYS 131 HD1 LYS 131 -10.300 14.827 -8.332 1066 1HE LYS 131 HE2 LYS 131 -11.818 13.077 -9.064 1067 2HE LYS 131 HE1 LYS 131 -10.539 12.405 -8.055 1068 1HZ LYS 131 HZ1 LYS 131 -13.189 13.136 -6.958 1069 2HZ LYS 131 HZ2 LYS 131 -12.008 12.146 -6.263 1070 3HZ LYS 131 HZ3 LYS 131 -12.877 11.606 -7.609 1071 H LEU 132 HN LEU 132 -8.957 11.174 -4.511 1072 HA LEU 132 HA LEU 132 -11.283 11.305 -2.919 1073 1HB LEU 132 HB2 LEU 132 -10.594 9.355 -4.319 1074 2HB LEU 132 HB1 LEU 132 -9.311 9.028 -3.171 1075 HG LEU 132 HG LEU 132 -12.237 9.003 -2.436 1076 1HD1 LEU 132 HD11 LEU 132 -11.992 6.531 -2.490 1077 2HD1 LEU 132 HD12 LEU 132 -10.423 6.745 -3.268 1078 3HD1 LEU 132 HD13 LEU 132 -11.891 7.289 -4.079 1079 1HD2 LEU 132 HD21 LEU 132 -9.701 8.589 -1.003 1080 2HD2 LEU 132 HD22 LEU 132 -10.950 7.383 -0.693 1081 3HD2 LEU 132 HD23 LEU 132 -11.278 9.091 -0.398 1082 H ALA 133 HN ALA 133 -7.867 11.046 -2.219 1083 HA ALA 133 HA ALA 133 -7.985 10.485 0.522 1084 1HB ALA 133 HB1 ALA 133 -5.750 12.144 0.067 1085 2HB ALA 133 HB2 ALA 133 -5.995 11.206 -1.404 1086 3HB ALA 133 HB3 ALA 133 -5.797 10.382 0.141 1087 H GLY 134 HN GLY 134 -8.016 13.546 -1.252 1088 1HA GLY 134 HA2 GLY 134 -7.894 15.267 0.971 1089 2HA GLY 134 HA1 GLY 134 -8.543 15.684 -0.607 1090 H GLU 135 HN GLU 135 -10.645 13.788 -0.679 1091 HA GLU 135 HA GLU 135 -12.737 15.175 0.458 1092 1HB GLU 135 HB2 GLU 135 -12.638 12.210 -0.132 1093 2HB GLU 135 HB1 GLU 135 -14.100 13.165 0.078 1094 1HG GLU 135 HG2 GLU 135 -12.063 13.485 -2.115 1095 2HG GLU 135 HG1 GLU 135 -13.659 12.753 -2.263 1096 H ARG 136 HN ARG 136 -10.717 12.698 1.878 1097 HA ARG 136 HA ARG 136 -12.327 12.142 4.149 1098 1HB ARG 136 HB2 ARG 136 -10.402 10.754 3.224 1099 2HB ARG 136 HB1 ARG 136 -9.323 11.909 3.990 1100 1HG ARG 136 HG2 ARG 136 -11.398 10.320 5.477 1101 2HG ARG 136 HG1 ARG 136 -9.723 9.812 5.278 1102 1HD ARG 136 HD2 ARG 136 -9.030 11.956 6.368 1103 2HD ARG 136 HD1 ARG 136 -10.733 12.266 6.706 1104 HE ARG 136 HE ARG 136 -10.106 9.728 7.682 1105 1HH1 ARG 136 HH11 ARG 136 -9.320 13.066 8.329 1106 2HH1 ARG 136 HH12 ARG 136 -9.024 12.800 10.015 1107 1HH2 ARG 136 HH21 ARG 136 -9.717 9.374 9.894 1108 2HH2 ARG 136 HH22 ARG 136 -9.250 10.702 10.904 1109 H ASN 137 HN ASN 137 -9.402 14.142 3.766 1110 HA ASN 137 HA ASN 137 -10.315 16.276 5.327 1111 1HB ASN 137 HB2 ASN 137 -10.172 14.715 7.206 1112 2HB ASN 137 HB1 ASN 137 -8.499 14.349 6.795 1113 1HD2 ASN 137 HD21 ASN 137 -7.092 15.312 8.037 1114 2HD2 ASN 137 HD22 ASN 137 -7.265 16.856 8.792 1115 H TYR 138 HN TYR 138 -7.322 14.405 4.850 1116 HA TYR 138 HA TYR 138 -6.071 15.853 2.943 1117 1HB TYR 138 HB2 TYR 138 -6.252 17.467 5.325 1118 2HB TYR 138 HB1 TYR 138 -4.563 17.110 4.986 1119 HD1 TYR 138 HD1 TYR 138 -3.746 19.164 4.228 1120 HD2 TYR 138 HD2 TYR 138 -7.315 17.588 2.532 1121 HE1 TYR 138 HE1 TYR 138 -3.716 20.940 2.527 1122 HE2 TYR 138 HE2 TYR 138 -7.298 19.359 0.829 1123 HH TYR 138 HH TYR 138 -5.330 22.097 1.039 1124 H THR 139 HN THR 139 -4.708 14.251 2.405 1125 HA THR 139 HA THR 139 -3.440 12.654 4.441 1126 HB THR 139 HB THR 139 -2.308 11.539 2.486 1127 HG1 THR 139 HG1 THR 139 -3.086 12.060 0.439 1128 1HG2 THR 139 HG21 THR 139 -5.155 11.481 1.788 1129 2HG2 THR 139 HG22 THR 139 -4.756 11.087 3.456 1130 3HG2 THR 139 HG23 THR 139 -4.040 10.163 2.136 1131 H ASP 140 HN ASP 140 -2.654 15.424 2.506 1132 HA ASP 140 HA ASP 140 0.127 15.359 2.531 1133 1HB ASP 140 HB2 ASP 140 -1.192 17.099 1.348 1134 2HB ASP 140 HB1 ASP 140 -1.654 17.791 2.902 1135 H GLU 141 HN GLU 141 -2.196 16.137 5.033 1136 HA GLU 141 HA GLU 141 -0.740 17.343 7.002 1137 1HB GLU 141 HB2 GLU 141 -3.116 16.793 7.201 1138 2HB GLU 141 HB1 GLU 141 -2.736 15.084 7.298 1139 1HG GLU 141 HG2 GLU 141 -3.217 15.783 9.485 1140 2HG GLU 141 HG1 GLU 141 -1.461 15.612 9.408 1141 H MET 142 HN MET 142 -0.585 14.053 5.897 1142 HA MET 142 HA MET 142 1.998 13.640 6.995 1143 1HB MET 142 HB2 MET 142 -0.305 12.780 8.552 1144 2HB MET 142 HB1 MET 142 0.762 11.441 8.161 1145 1HG MET 142 HG2 MET 142 2.536 12.342 9.322 1146 2HG MET 142 HG1 MET 142 1.890 13.980 9.243 1147 1HE MET 142 HE1 MET 142 -0.024 14.914 10.882 1148 2HE MET 142 HE2 MET 142 -1.017 13.842 11.868 1149 3HE MET 142 HE3 MET 142 -1.059 13.713 10.111 1150 H VAL 143 HN VAL 143 1.933 13.495 4.605 1151 HA VAL 143 HA VAL 143 0.833 11.124 3.370 1152 HB VAL 143 HB VAL 143 0.765 13.163 2.113 1153 1HG1 VAL 143 HG11 VAL 143 3.166 14.042 1.366 1154 2HG1 VAL 143 HG12 VAL 143 3.596 13.407 2.953 1155 3HG1 VAL 143 HG13 VAL 143 2.339 14.636 2.803 1156 1HG2 VAL 143 HG21 VAL 143 3.009 11.642 0.806 1157 2HG2 VAL 143 HG22 VAL 143 1.724 12.569 0.042 1158 3HG2 VAL 143 HG23 VAL 143 1.346 11.046 0.841 1159 H ALA 144 HN ALA 144 2.520 10.169 1.617 1160 HA ALA 144 HA ALA 144 5.177 9.655 2.590 1161 1HB ALA 144 HB1 ALA 144 4.641 7.096 2.365 1162 2HB ALA 144 HB2 ALA 144 2.995 7.603 2.743 1163 3HB ALA 144 HB3 ALA 144 4.301 7.934 3.881 1164 H MET 145 HN MET 145 6.375 9.772 0.733 1165 HA MET 145 HA MET 145 5.137 8.772 -1.753 1166 1HB MET 145 HB2 MET 145 6.518 10.509 -2.949 1167 2HB MET 145 HB1 MET 145 5.193 11.132 -1.976 1168 1HG MET 145 HG2 MET 145 6.821 11.610 -0.171 1169 2HG MET 145 HG1 MET 145 8.112 11.101 -1.255 1170 1HE MET 145 HE1 MET 145 7.849 14.103 0.216 1171 2HE MET 145 HE2 MET 145 8.656 14.926 -1.118 1172 3HE MET 145 HE3 MET 145 9.203 13.329 -0.607 1173 H LEU 146 HN LEU 146 6.450 7.859 -3.334 1174 HA LEU 146 HA LEU 146 8.368 6.051 -2.525 1175 1HB LEU 146 HB2 LEU 146 7.160 5.890 -4.629 1176 2HB LEU 146 HB1 LEU 146 7.960 7.327 -5.229 1177 HG LEU 146 HG LEU 146 10.135 6.067 -5.100 1178 1HD1 LEU 146 HD11 LEU 146 8.651 4.237 -3.657 1179 2HD1 LEU 146 HD12 LEU 146 10.273 3.997 -4.305 1180 3HD1 LEU 146 HD13 LEU 146 8.868 3.463 -5.226 1181 1HD2 LEU 146 HD21 LEU 146 7.903 5.599 -6.955 1182 2HD2 LEU 146 HD22 LEU 146 9.211 4.419 -7.036 1183 3HD2 LEU 146 HD23 LEU 146 9.553 6.133 -7.271 1184 HA PRO 147 HA PRO 147 12.001 8.566 -1.784 1185 1HB PRO 147 HB2 PRO 147 13.841 6.531 -2.014 1186 2HB PRO 147 HB1 PRO 147 12.914 6.869 -0.547 1187 1HG PRO 147 HG2 PRO 147 12.395 4.847 -2.694 1188 2HG PRO 147 HG1 PRO 147 12.274 4.668 -0.933 1189 1HD PRO 147 HD2 PRO 147 10.090 5.018 -2.430 1190 2HD PRO 147 HD1 PRO 147 10.234 5.782 -0.836 1191 H ARG 148 HN ARG 148 13.803 9.364 -2.966 1192 HA ARG 148 HA ARG 148 14.189 8.345 -5.671 1193 1HB ARG 148 HB2 ARG 148 13.994 10.717 -6.559 1194 2HB ARG 148 HB1 ARG 148 12.497 9.902 -6.132 1195 1HG ARG 148 HG2 ARG 148 12.446 12.197 -5.382 1196 2HG ARG 148 HG1 ARG 148 12.456 11.104 -3.998 1197 1HD ARG 148 HD2 ARG 148 13.946 13.053 -3.704 1198 2HD ARG 148 HD1 ARG 148 14.801 11.515 -3.629 1199 HE ARG 148 HE ARG 148 14.893 12.457 -6.264 1200 1HH1 ARG 148 HH11 ARG 148 16.138 13.292 -3.110 1201 2HH1 ARG 148 HH12 ARG 148 17.566 14.044 -3.738 1202 1HH2 ARG 148 HH21 ARG 148 16.767 13.443 -7.087 1203 2HH2 ARG 148 HH22 ARG 148 17.924 14.130 -5.996 1204 H GLN 149 HN GLN 149 15.616 9.276 -2.907 1205 HA GLN 149 HA GLN 149 17.870 10.601 -4.221 1206 1HB GLN 149 HB2 GLN 149 17.035 11.658 -2.169 1207 2HB GLN 149 HB1 GLN 149 17.336 10.170 -1.281 1208 1HG GLN 149 HG2 GLN 149 19.716 10.369 -1.705 1209 2HG GLN 149 HG1 GLN 149 19.440 11.826 -2.651 1210 1HE2 GLN 149 HE21 GLN 149 17.243 12.116 -0.290 1211 2HE2 GLN 149 HE22 GLN 149 18.168 12.966 0.891 1212 H GLU 150 HN GLU 150 19.977 9.807 -4.044 1213 HA GLU 150 HA GLU 150 20.257 6.999 -4.240 1214 1HB GLU 150 HB2 GLU 150 22.363 9.133 -3.850 1215 2HB GLU 150 HB1 GLU 150 22.683 7.472 -4.328 1216 1HG GLU 150 HG2 GLU 150 21.202 9.570 -5.895 1217 2HG GLU 150 HG1 GLU 150 22.768 8.851 -6.268 1218 H GLU 151 HN GLU 151 19.015 7.033 -1.980 1219 HA GLU 151 HA GLU 151 20.500 5.645 -0.133 1220 1HB GLU 151 HB2 GLU 151 20.922 7.185 1.675 1221 2HB GLU 151 HB1 GLU 151 21.693 7.821 0.231 1222 1HG GLU 151 HG2 GLU 151 19.753 9.327 -0.083 1223 2HG GLU 151 HG1 GLU 151 19.106 8.739 1.446 1224 H CYS 152 HN CYS 152 19.151 4.757 1.394 1225 HA CYS 152 HA CYS 152 16.424 4.734 1.025 1226 1HB CYS 152 HB2 CYS 152 17.832 4.244 3.660 1227 2HB CYS 152 HB1 CYS 152 16.264 3.606 3.170 1228 H THR 153 HN THR 153 15.971 7.072 0.755 1229 HA THR 153 HA THR 153 14.894 8.199 3.194 1230 HB THR 153 HB THR 153 17.255 9.028 3.137 1231 HG1 THR 153 HG1 THR 153 16.668 11.065 3.666 1232 1HG2 THR 153 HG21 THR 153 17.366 9.195 0.612 1233 2HG2 THR 153 HG22 THR 153 18.029 10.548 1.524 1234 3HG2 THR 153 HG23 THR 153 16.439 10.684 0.774 1235 H VAL 154 HN VAL 154 13.647 10.233 2.733 1236 HA VAL 154 HA VAL 154 12.871 10.633 -0.038 1237 HB VAL 154 HB VAL 154 11.396 8.803 0.708 1238 1HG1 VAL 154 HG11 VAL 154 9.874 10.557 2.529 1239 2HG1 VAL 154 HG12 VAL 154 11.412 9.948 3.141 1240 3HG1 VAL 154 HG13 VAL 154 10.166 8.820 2.605 1241 1HG2 VAL 154 HG21 VAL 154 9.218 10.002 0.227 1242 2HG2 VAL 154 HG22 VAL 154 10.498 10.199 -0.969 1243 3HG2 VAL 154 HG23 VAL 154 10.159 11.492 0.181 1244 H ASP 155 HN ASP 155 12.096 12.663 -0.435 1245 HA ASP 155 HA ASP 155 12.702 14.737 1.296 1246 1HB ASP 155 HB2 ASP 155 12.375 15.052 -1.119 1247 2HB ASP 155 HB1 ASP 155 10.653 14.738 -0.933 1248 H GLU 156 HN GLU 156 11.628 15.867 2.831 1249 HA GLU 156 HA GLU 156 8.854 15.868 3.251 1250 1HB GLU 156 HB2 GLU 156 8.709 14.490 5.289 1251 2HB GLU 156 HB1 GLU 156 9.133 13.533 3.876 1252 1HG GLU 156 HG2 GLU 156 11.471 13.536 4.567 1253 2HG GLU 156 HG1 GLU 156 11.056 14.509 5.977 1254 H VAL 157 HN VAL 157 10.729 17.831 3.179 1255 HA VAL 157 HA VAL 157 10.384 19.068 5.764 1256 HB VAL 157 HB VAL 157 13.184 18.664 4.694 1257 1HG1 VAL 157 HG11 VAL 157 13.842 19.721 6.859 1258 2HG1 VAL 157 HG12 VAL 157 12.144 20.125 7.115 1259 3HG1 VAL 157 HG13 VAL 157 13.015 20.806 5.741 1260 1HG2 VAL 157 HG21 VAL 157 13.513 17.402 6.834 1261 2HG2 VAL 157 HG22 VAL 157 12.461 16.609 5.662 1262 3HG2 VAL 157 HG23 VAL 157 11.764 17.441 7.053 Start of MODEL 15 1 1H MET 1 HT1 MET 1 -26.093 -12.790 -16.389 2 2H MET 1 HT2 MET 1 -25.147 -13.891 -15.522 3 3H MET 1 HT3 MET 1 -24.672 -13.405 -17.071 4 HA MET 1 HA MET 1 -24.522 -11.081 -16.193 5 1HB MET 1 HB2 MET 1 -24.696 -12.614 -13.590 6 2HB MET 1 HB1 MET 1 -24.292 -10.909 -13.738 7 1HG MET 1 HG2 MET 1 -26.498 -10.468 -14.688 8 2HG MET 1 HG1 MET 1 -26.902 -12.177 -14.538 9 1HE MET 1 HE1 MET 1 -24.880 -10.089 -11.666 10 2HE MET 1 HE2 MET 1 -26.295 -9.208 -11.090 11 3HE MET 1 HE3 MET 1 -25.760 -9.022 -12.760 12 H THR 2 HN THR 2 -22.445 -10.434 -16.267 13 HA THR 2 HA THR 2 -20.380 -12.287 -16.667 14 HB THR 2 HB THR 2 -18.873 -10.329 -16.600 15 HG1 THR 2 HG1 THR 2 -21.203 -8.960 -15.746 16 1HG2 THR 2 HG21 THR 2 -20.984 -10.703 -18.392 17 2HG2 THR 2 HG22 THR 2 -19.498 -9.787 -18.646 18 3HG2 THR 2 HG23 THR 2 -20.941 -8.975 -18.039 19 H VAL 3 HN VAL 3 -18.971 -13.262 -15.348 20 HA VAL 3 HA VAL 3 -19.356 -13.094 -12.516 21 HB VAL 3 HB VAL 3 -17.581 -14.782 -12.357 22 1HG1 VAL 3 HG11 VAL 3 -19.262 -15.672 -14.653 23 2HG1 VAL 3 HG12 VAL 3 -20.043 -15.214 -13.139 24 3HG1 VAL 3 HG13 VAL 3 -18.855 -16.518 -13.160 25 1HG2 VAL 3 HG21 VAL 3 -16.511 -15.663 -14.365 26 2HG2 VAL 3 HG22 VAL 3 -16.143 -13.951 -14.159 27 3HG2 VAL 3 HG23 VAL 3 -17.341 -14.458 -15.348 28 HA PRO 4 HA PRO 4 -16.536 -9.818 -11.518 29 1HB PRO 4 HB2 PRO 4 -15.921 -11.516 -9.150 30 2HB PRO 4 HB1 PRO 4 -16.396 -9.816 -9.221 31 1HG PRO 4 HG2 PRO 4 -18.140 -11.674 -8.461 32 2HG PRO 4 HG1 PRO 4 -18.645 -10.320 -9.489 33 1HD PRO 4 HD2 PRO 4 -18.133 -13.170 -10.222 34 2HD PRO 4 HD1 PRO 4 -19.360 -12.047 -10.842 35 H ASP 5 HN ASP 5 -15.600 -13.177 -11.563 36 HA ASP 5 HA ASP 5 -13.695 -14.225 -12.225 37 1HB ASP 5 HB2 ASP 5 -12.762 -11.447 -12.984 38 2HB ASP 5 HB1 ASP 5 -11.951 -12.946 -13.420 39 H ARG 6 HN ARG 6 -12.134 -15.044 -10.993 40 HA ARG 6 HA ARG 6 -11.492 -13.898 -8.492 41 1HB ARG 6 HB2 ARG 6 -10.366 -16.221 -10.040 42 2HB ARG 6 HB1 ARG 6 -9.709 -15.747 -8.483 43 1HG ARG 6 HG2 ARG 6 -11.323 -17.612 -8.355 44 2HG ARG 6 HG1 ARG 6 -11.793 -16.214 -7.390 45 1HD ARG 6 HD2 ARG 6 -12.835 -16.702 -10.172 46 2HD ARG 6 HD1 ARG 6 -13.626 -17.340 -8.731 47 HE ARG 6 HE ARG 6 -13.267 -14.620 -8.325 48 1HH1 ARG 6 HH11 ARG 6 -15.027 -16.694 -10.513 49 2HH1 ARG 6 HH12 ARG 6 -16.299 -15.548 -10.767 50 1HH2 ARG 6 HH21 ARG 6 -14.932 -13.120 -8.658 51 2HH2 ARG 6 HH22 ARG 6 -16.246 -13.517 -9.715 52 H SER 7 HN SER 7 -9.900 -13.907 -11.612 53 HA SER 7 HA SER 7 -7.337 -13.105 -10.978 54 1HB SER 7 HB2 SER 7 -7.286 -12.046 -13.222 55 2HB SER 7 HB1 SER 7 -8.014 -13.651 -13.261 56 HG SER 7 HG SER 7 -9.830 -12.795 -13.878 57 H GLU 8 HN GLU 8 -10.287 -11.228 -11.010 58 HA GLU 8 HA GLU 8 -9.469 -8.638 -11.103 59 1HB GLU 8 HB2 GLU 8 -11.390 -8.056 -9.782 60 2HB GLU 8 HB1 GLU 8 -11.816 -9.441 -10.780 61 1HG GLU 8 HG2 GLU 8 -11.351 -10.903 -8.814 62 2HG GLU 8 HG1 GLU 8 -11.154 -9.445 -7.849 63 H ILE 9 HN ILE 9 -8.964 -10.917 -8.528 64 HA ILE 9 HA ILE 9 -7.186 -9.012 -7.211 65 HB ILE 9 HB ILE 9 -9.385 -10.556 -5.833 66 1HG1 ILE 9 HG12 ILE 9 -10.001 -8.363 -6.767 67 2HG1 ILE 9 HG11 ILE 9 -10.052 -8.354 -5.007 68 1HG2 ILE 9 HG21 ILE 9 -6.788 -9.981 -4.823 69 2HG2 ILE 9 HG22 ILE 9 -8.157 -10.717 -3.992 70 3HG2 ILE 9 HG23 ILE 9 -7.951 -8.966 -3.977 71 1HD1 ILE 9 HD11 ILE 9 -9.070 -6.320 -5.772 72 2HD1 ILE 9 HD12 ILE 9 -7.908 -7.193 -6.765 73 3HD1 ILE 9 HD13 ILE 9 -7.816 -7.288 -5.006 74 H ALA 10 HN ALA 10 -6.034 -10.711 -8.750 75 HA ALA 10 HA ALA 10 -4.633 -12.486 -6.985 76 1HB ALA 10 HB1 ALA 10 -5.484 -14.475 -7.526 77 2HB ALA 10 HB2 ALA 10 -5.503 -14.087 -9.247 78 3HB ALA 10 HB3 ALA 10 -6.842 -13.588 -8.216 79 H GLY 11 HN GLY 11 -2.600 -12.025 -7.510 80 1HA GLY 11 HA2 GLY 11 -1.192 -12.752 -9.654 81 2HA GLY 11 HA1 GLY 11 -1.930 -11.272 -10.247 82 H LYS 12 HN LYS 12 -0.223 -9.926 -10.384 83 HA LYS 12 HA LYS 12 1.376 -9.535 -7.944 84 1HB LYS 12 HB2 LYS 12 3.176 -8.702 -9.438 85 2HB LYS 12 HB1 LYS 12 2.773 -10.393 -9.701 86 1HG LYS 12 HG2 LYS 12 1.212 -8.674 -11.416 87 2HG LYS 12 HG1 LYS 12 2.942 -8.386 -11.616 88 1HD LYS 12 HD2 LYS 12 2.146 -10.112 -13.154 89 2HD LYS 12 HD1 LYS 12 3.301 -10.773 -11.996 90 1HE LYS 12 HE2 LYS 12 1.406 -11.600 -10.639 91 2HE LYS 12 HE1 LYS 12 0.297 -11.011 -11.878 92 1HZ LYS 12 HZ1 LYS 12 2.430 -12.775 -12.776 93 2HZ LYS 12 HZ2 LYS 12 0.815 -12.689 -13.271 94 3HZ LYS 12 HZ3 LYS 12 1.217 -13.485 -11.834 95 H TRP 13 HN TRP 13 1.099 -7.711 -6.951 96 HA TRP 13 HA TRP 13 -0.029 -5.396 -8.371 97 1HB TRP 13 HB2 TRP 13 0.017 -6.120 -5.434 98 2HB TRP 13 HB1 TRP 13 -0.617 -4.612 -6.072 99 HD1 TRP 13 HD1 TRP 13 -1.527 -7.478 -8.271 100 HE1 TRP 13 HE1 TRP 13 -3.980 -8.145 -7.878 101 HE3 TRP 13 HE3 TRP 13 -2.416 -4.809 -4.005 102 HZ2 TRP 13 HZ2 TRP 13 -6.019 -7.615 -6.004 103 HZ3 TRP 13 HZ3 TRP 13 -4.642 -4.948 -2.970 104 HH2 TRP 13 HH2 TRP 13 -6.407 -6.323 -3.950 105 H TYR 14 HN TYR 14 1.156 -3.522 -8.512 106 HA TYR 14 HA TYR 14 3.786 -3.537 -7.187 107 1HB TYR 14 HB2 TYR 14 2.870 -1.962 -9.601 108 2HB TYR 14 HB1 TYR 14 4.478 -1.897 -8.892 109 HD1 TYR 14 HD1 TYR 14 2.119 -4.571 -10.049 110 HD2 TYR 14 HD2 TYR 14 6.086 -3.035 -10.056 111 HE1 TYR 14 HE1 TYR 14 2.828 -6.424 -11.500 112 HE2 TYR 14 HE2 TYR 14 6.806 -4.883 -11.508 113 HH TYR 14 HH TYR 14 5.391 -7.591 -11.881 114 H VAL 15 HN VAL 15 4.103 -2.198 -5.538 115 HA VAL 15 HA VAL 15 2.201 -0.035 -5.089 116 HB VAL 15 HB VAL 15 4.287 -1.271 -3.316 117 1HG1 VAL 15 HG11 VAL 15 2.454 1.021 -2.611 118 2HG1 VAL 15 HG12 VAL 15 4.185 1.177 -2.915 119 3HG1 VAL 15 HG13 VAL 15 3.613 0.234 -1.541 120 1HG2 VAL 15 HG21 VAL 15 1.291 -1.196 -3.267 121 2HG2 VAL 15 HG22 VAL 15 2.277 -1.780 -1.927 122 3HG2 VAL 15 HG23 VAL 15 2.329 -2.603 -3.485 123 H VAL 16 HN VAL 16 2.630 1.997 -5.614 124 HA VAL 16 HA VAL 16 5.435 2.859 -5.778 125 HB VAL 16 HB VAL 16 4.262 2.241 -8.021 126 1HG1 VAL 16 HG11 VAL 16 2.834 3.727 -9.028 127 2HG1 VAL 16 HG12 VAL 16 3.327 5.072 -7.999 128 3HG1 VAL 16 HG13 VAL 16 2.289 3.801 -7.355 129 1HG2 VAL 16 HG21 VAL 16 5.860 3.415 -9.076 130 2HG2 VAL 16 HG22 VAL 16 6.411 3.709 -7.429 131 3HG2 VAL 16 HG23 VAL 16 5.447 4.926 -8.265 132 H ALA 17 HN ALA 17 2.034 3.892 -5.584 133 HA ALA 17 HA ALA 17 2.807 6.578 -4.766 134 1HB ALA 17 HB1 ALA 17 0.846 7.165 -5.622 135 2HB ALA 17 HB2 ALA 17 -0.014 6.061 -4.547 136 3HB ALA 17 HB3 ALA 17 0.605 5.481 -6.092 137 H LEU 18 HN LEU 18 2.412 7.500 -2.726 138 HA LEU 18 HA LEU 18 0.997 6.124 -0.687 139 1HB LEU 18 HB2 LEU 18 3.041 5.915 0.847 140 2HB LEU 18 HB1 LEU 18 2.745 4.671 -0.342 141 HG LEU 18 HG LEU 18 4.763 6.894 -0.670 142 1HD1 LEU 18 HD11 LEU 18 5.082 5.114 1.192 143 2HD1 LEU 18 HD12 LEU 18 6.416 5.489 0.101 144 3HD1 LEU 18 HD13 LEU 18 5.446 4.039 -0.157 145 1HD2 LEU 18 HD21 LEU 18 4.346 6.195 -2.828 146 2HD2 LEU 18 HD22 LEU 18 3.946 4.552 -2.326 147 3HD2 LEU 18 HD23 LEU 18 5.626 5.082 -2.346 148 H ALA 19 HN ALA 19 1.847 7.116 1.608 149 HA ALA 19 HA ALA 19 2.667 9.823 1.669 150 1HB ALA 19 HB1 ALA 19 0.787 10.874 1.056 151 2HB ALA 19 HB2 ALA 19 0.044 10.251 2.528 152 3HB ALA 19 HB3 ALA 19 -0.107 9.356 1.017 153 H SER 20 HN SER 20 3.603 9.876 3.711 154 HA SER 20 HA SER 20 2.101 8.423 5.810 155 1HB SER 20 HB2 SER 20 4.002 7.105 5.103 156 2HB SER 20 HB1 SER 20 5.088 8.461 5.406 157 HG SER 20 HG SER 20 4.020 6.655 7.148 158 H ASN 21 HN ASN 21 1.830 9.278 7.757 159 HA ASN 21 HA ASN 21 3.217 11.806 8.399 160 1HB ASN 21 HB2 ASN 21 0.558 10.993 9.592 161 2HB ASN 21 HB1 ASN 21 1.336 12.564 9.648 162 1HD2 ASN 21 HD21 ASN 21 0.052 10.230 7.335 163 2HD2 ASN 21 HD22 ASN 21 -0.630 11.401 6.268 164 H THR 22 HN THR 22 3.902 12.060 10.579 165 HA THR 22 HA THR 22 4.182 11.375 12.819 166 HB THR 22 HB THR 22 3.799 8.529 11.865 167 HG1 THR 22 HG1 THR 22 1.949 10.323 13.043 168 1HG2 THR 22 HG21 THR 22 4.639 8.067 13.876 169 2HG2 THR 22 HG22 THR 22 3.060 8.578 14.468 170 3HG2 THR 22 HG23 THR 22 4.411 9.713 14.469 171 H GLU 23 HN GLU 23 6.244 11.896 13.036 172 HA GLU 23 HA GLU 23 8.511 11.875 12.922 173 1HB GLU 23 HB2 GLU 23 8.071 8.884 12.965 174 2HB GLU 23 HB1 GLU 23 9.568 9.709 13.374 175 1HG GLU 23 HG2 GLU 23 8.424 10.822 15.246 176 2HG GLU 23 HG1 GLU 23 6.954 9.931 14.855 177 H PHE 24 HN PHE 24 9.486 12.587 11.166 178 HA PHE 24 HA PHE 24 9.214 11.201 8.637 179 1HB PHE 24 HB2 PHE 24 10.459 13.130 7.711 180 2HB PHE 24 HB1 PHE 24 9.027 13.615 8.611 181 HD1 PHE 24 HD1 PHE 24 9.215 15.337 10.112 182 HD2 PHE 24 HD2 PHE 24 12.687 13.080 9.130 183 HE1 PHE 24 HE1 PHE 24 10.586 16.861 11.471 184 HE2 PHE 24 HE2 PHE 24 14.063 14.597 10.492 185 HZ PHE 24 HZ PHE 24 13.013 16.492 11.664 186 H PHE 25 HN PHE 25 11.636 11.748 11.093 187 HA PHE 25 HA PHE 25 13.909 10.969 9.633 188 1HB PHE 25 HB2 PHE 25 14.037 12.178 11.757 189 2HB PHE 25 HB1 PHE 25 13.381 10.781 12.603 190 HD1 PHE 25 HD1 PHE 25 16.027 11.060 9.994 191 HD2 PHE 25 HD2 PHE 25 15.029 9.960 13.981 192 HE1 PHE 25 HE1 PHE 25 18.306 10.193 10.321 193 HE2 PHE 25 HE2 PHE 25 17.306 9.092 14.317 194 HZ PHE 25 HZ PHE 25 18.949 9.208 12.485 195 H LEU 26 HN LEU 26 11.751 9.078 11.737 196 HA LEU 26 HA LEU 26 13.224 6.661 11.363 197 1HB LEU 26 HB2 LEU 26 10.451 7.131 12.446 198 2HB LEU 26 HB1 LEU 26 11.284 5.588 12.480 199 HG LEU 26 HG LEU 26 12.099 8.105 13.932 200 1HD1 LEU 26 HD11 LEU 26 10.172 6.628 14.770 201 2HD1 LEU 26 HD12 LEU 26 11.463 7.036 15.899 202 3HD1 LEU 26 HD13 LEU 26 11.428 5.446 15.137 203 1HD2 LEU 26 HD21 LEU 26 14.167 7.243 13.565 204 2HD2 LEU 26 HD22 LEU 26 13.564 5.605 13.315 205 3HD2 LEU 26 HD23 LEU 26 13.715 6.249 14.950 206 H ARG 27 HN ARG 27 10.216 7.943 9.974 207 HA ARG 27 HA ARG 27 9.512 5.640 8.551 208 1HB ARG 27 HB2 ARG 27 8.102 7.109 7.175 209 2HB ARG 27 HB1 ARG 27 7.922 7.427 8.892 210 1HG ARG 27 HG2 ARG 27 8.014 9.551 8.075 211 2HG ARG 27 HG1 ARG 27 9.719 9.272 8.426 212 1HD ARG 27 HD2 ARG 27 9.402 10.316 6.236 213 2HD ARG 27 HD1 ARG 27 10.124 8.719 6.089 214 HE ARG 27 HE ARG 27 7.355 8.453 5.842 215 1HH1 ARG 27 HH11 ARG 27 10.046 9.853 4.116 216 2HH1 ARG 27 HH12 ARG 27 9.308 9.665 2.561 217 1HH2 ARG 27 HH21 ARG 27 6.385 8.206 3.791 218 2HH2 ARG 27 HH22 ARG 27 7.238 8.733 2.379 219 H GLU 28 HN GLU 28 11.696 8.278 7.690 220 HA GLU 28 HA GLU 28 11.989 7.474 4.976 221 1HB GLU 28 HB2 GLU 28 13.908 8.993 4.916 222 2HB GLU 28 HB1 GLU 28 12.514 9.752 5.670 223 1HG GLU 28 HG2 GLU 28 13.482 9.317 7.874 224 2HG GLU 28 HG1 GLU 28 14.886 8.583 7.103 225 H LYS 29 HN LYS 29 13.936 6.903 7.895 226 HA LYS 29 HA LYS 29 15.853 5.305 6.487 227 1HB LYS 29 HB2 LYS 29 15.366 5.664 9.450 228 2HB LYS 29 HB1 LYS 29 16.722 4.784 8.757 229 1HG LYS 29 HG2 LYS 29 17.526 6.800 7.686 230 2HG LYS 29 HG1 LYS 29 16.131 7.696 8.281 231 1HD LYS 29 HD2 LYS 29 18.036 8.186 9.666 232 2HD LYS 29 HD1 LYS 29 16.876 7.240 10.598 233 1HE LYS 29 HE2 LYS 29 19.231 6.015 9.179 234 2HE LYS 29 HE1 LYS 29 19.313 6.596 10.840 235 1HZ LYS 29 HZ1 LYS 29 17.086 4.997 10.755 236 2HZ LYS 29 HZ2 LYS 29 18.584 4.602 11.430 237 3HZ LYS 29 HZ3 LYS 29 18.235 4.161 9.835 238 H ASP 30 HN ASP 30 13.069 4.636 8.560 239 HA ASP 30 HA ASP 30 13.434 1.826 8.656 240 1HB ASP 30 HB2 ASP 30 12.070 3.045 10.299 241 2HB ASP 30 HB1 ASP 30 10.909 3.449 9.038 242 H LYS 31 HN LYS 31 11.119 3.804 6.786 243 HA LYS 31 HA LYS 31 10.943 1.589 4.849 244 1HB LYS 31 HB2 LYS 31 8.818 1.880 5.956 245 2HB LYS 31 HB1 LYS 31 8.852 3.613 5.667 246 1HG LYS 31 HG2 LYS 31 7.299 2.477 4.173 247 2HG LYS 31 HG1 LYS 31 8.610 3.243 3.277 248 1HD LYS 31 HD2 LYS 31 9.740 1.073 3.091 249 2HD LYS 31 HD1 LYS 31 8.420 0.314 3.986 250 1HE LYS 31 HE2 LYS 31 6.849 0.963 2.233 251 2HE LYS 31 HE1 LYS 31 8.153 1.749 1.346 252 1HZ LYS 31 HZ1 LYS 31 7.758 -0.393 0.406 253 2HZ LYS 31 HZ2 LYS 31 7.883 -1.152 1.912 254 3HZ LYS 31 HZ3 LYS 31 9.248 -0.447 1.205 255 H MET 32 HN MET 32 11.863 2.021 2.956 256 HA MET 32 HA MET 32 11.400 4.358 1.459 257 1HB MET 32 HB2 MET 32 12.851 5.407 3.123 258 2HB MET 32 HB1 MET 32 14.105 4.218 2.802 259 1HG MET 32 HG2 MET 32 14.329 5.056 0.529 260 2HG MET 32 HG1 MET 32 13.056 6.238 0.834 261 1HE MET 32 HE1 MET 32 14.969 8.671 0.416 262 2HE MET 32 HE2 MET 32 15.230 7.148 -0.431 263 3HE MET 32 HE3 MET 32 16.569 7.927 0.409 264 H LYS 33 HN LYS 33 10.982 2.329 0.232 265 HA LYS 33 HA LYS 33 13.209 1.806 -1.541 266 1HB LYS 33 HB2 LYS 33 11.888 -0.449 -0.027 267 2HB LYS 33 HB1 LYS 33 13.055 -0.639 -1.324 268 1HG LYS 33 HG2 LYS 33 14.771 0.400 0.056 269 2HG LYS 33 HG1 LYS 33 13.596 0.634 1.352 270 1HD LYS 33 HD2 LYS 33 13.300 -1.750 1.574 271 2HD LYS 33 HD1 LYS 33 14.348 -2.044 0.188 272 1HE LYS 33 HE2 LYS 33 16.235 -1.083 1.416 273 2HE LYS 33 HE1 LYS 33 15.183 -0.788 2.801 274 1HZ LYS 33 HZ1 LYS 33 16.622 -2.891 2.785 275 2HZ LYS 33 HZ2 LYS 33 15.489 -3.506 1.690 276 3HZ LYS 33 HZ3 LYS 33 14.999 -3.043 3.241 277 H MET 34 HN MET 34 12.485 0.398 -3.414 278 HA MET 34 HA MET 34 10.006 1.320 -4.437 279 1HB MET 34 HB2 MET 34 11.869 0.574 -5.885 280 2HB MET 34 HB1 MET 34 11.658 -1.070 -5.302 281 1HG MET 34 HG2 MET 34 9.431 -1.143 -6.279 282 2HG MET 34 HG1 MET 34 9.623 0.515 -6.848 283 1HE MET 34 HE1 MET 34 11.441 1.262 -8.581 284 2HE MET 34 HE2 MET 34 12.488 0.162 -9.477 285 3HE MET 34 HE3 MET 34 12.761 0.434 -7.756 286 H ALA 35 HN ALA 35 7.945 0.171 -4.620 287 HA ALA 35 HA ALA 35 7.850 -2.104 -2.746 288 1HB ALA 35 HB1 ALA 35 5.636 -1.383 -2.091 289 2HB ALA 35 HB2 ALA 35 5.724 -0.038 -3.229 290 3HB ALA 35 HB3 ALA 35 6.817 -0.096 -1.850 291 H MET 36 HN MET 36 7.360 -3.941 -3.552 292 HA MET 36 HA MET 36 5.539 -4.147 -5.865 293 1HB MET 36 HB2 MET 36 7.904 -5.939 -5.231 294 2HB MET 36 HB1 MET 36 6.809 -6.122 -6.595 295 1HG MET 36 HG2 MET 36 7.580 -4.001 -7.509 296 2HG MET 36 HG1 MET 36 8.662 -3.797 -6.133 297 1HE MET 36 HE1 MET 36 10.000 -7.263 -6.204 298 2HE MET 36 HE2 MET 36 10.046 -5.717 -5.356 299 3HE MET 36 HE3 MET 36 11.372 -6.177 -6.425 300 H ALA 37 HN ALA 37 4.079 -6.006 -5.745 301 HA ALA 37 HA ALA 37 4.191 -7.622 -3.341 302 1HB ALA 37 HB1 ALA 37 2.446 -6.768 -2.182 303 2HB ALA 37 HB2 ALA 37 1.605 -6.227 -3.635 304 3HB ALA 37 HB3 ALA 37 2.958 -5.292 -2.997 305 H ARG 38 HN ARG 38 2.818 -9.401 -3.298 306 HA ARG 38 HA ARG 38 1.372 -9.961 -5.804 307 1HB ARG 38 HB2 ARG 38 3.445 -11.236 -5.806 308 2HB ARG 38 HB1 ARG 38 3.098 -11.862 -4.202 309 1HG ARG 38 HG2 ARG 38 1.124 -13.018 -5.106 310 2HG ARG 38 HG1 ARG 38 1.538 -12.423 -6.714 311 1HD ARG 38 HD2 ARG 38 3.684 -13.612 -6.589 312 2HD ARG 38 HD1 ARG 38 3.245 -14.222 -4.993 313 HE ARG 38 HE ARG 38 1.216 -14.930 -6.772 314 1HH1 ARG 38 HH11 ARG 38 4.585 -15.658 -6.217 315 2HH1 ARG 38 HH12 ARG 38 4.478 -17.251 -6.884 316 1HH2 ARG 38 HH21 ARG 38 1.077 -17.027 -7.648 317 2HH2 ARG 38 HH22 ARG 38 2.490 -18.028 -7.697 318 H ILE 39 HN ILE 39 -0.740 -10.189 -5.397 319 HA ILE 39 HA ILE 39 -1.596 -10.827 -2.681 320 HB ILE 39 HB ILE 39 -2.568 -8.851 -3.759 321 1HG1 ILE 39 HG12 ILE 39 -4.708 -10.954 -3.423 322 2HG1 ILE 39 HG11 ILE 39 -3.809 -10.294 -2.060 323 1HG2 ILE 39 HG21 ILE 39 -3.498 -10.866 -5.773 324 2HG2 ILE 39 HG22 ILE 39 -2.661 -9.336 -6.036 325 3HG2 ILE 39 HG23 ILE 39 -4.353 -9.343 -5.536 326 1HD1 ILE 39 HD11 ILE 39 -5.866 -9.126 -2.205 327 2HD1 ILE 39 HD12 ILE 39 -5.646 -8.826 -3.929 328 3HD1 ILE 39 HD13 ILE 39 -4.603 -8.027 -2.755 329 H SER 40 HN SER 40 -2.940 -12.459 -2.110 330 HA SER 40 HA SER 40 -4.024 -14.318 -4.027 331 1HB SER 40 HB2 SER 40 -1.847 -15.210 -2.116 332 2HB SER 40 HB1 SER 40 -2.829 -16.286 -3.112 333 HG SER 40 HG SER 40 -0.953 -15.920 -4.223 334 H PHE 41 HN PHE 41 -5.913 -15.048 -3.238 335 HA PHE 41 HA PHE 41 -6.587 -14.468 -0.482 336 1HB PHE 41 HB2 PHE 41 -8.871 -15.116 -1.125 337 2HB PHE 41 HB1 PHE 41 -8.197 -13.912 -2.216 338 HD1 PHE 41 HD1 PHE 41 -8.322 -14.250 -4.488 339 HD2 PHE 41 HD2 PHE 41 -8.643 -17.597 -1.880 340 HE1 PHE 41 HE1 PHE 41 -8.870 -15.687 -6.407 341 HE2 PHE 41 HE2 PHE 41 -9.186 -19.043 -3.797 342 HZ PHE 41 HZ PHE 41 -9.302 -18.087 -6.064 343 H LEU 42 HN LEU 42 -6.941 -15.883 1.143 344 HA LEU 42 HA LEU 42 -6.503 -18.736 0.556 345 1HB LEU 42 HB2 LEU 42 -5.825 -17.168 3.044 346 2HB LEU 42 HB1 LEU 42 -5.771 -18.915 2.952 347 HG LEU 42 HG LEU 42 -4.039 -18.760 1.204 348 1HD1 LEU 42 HD11 LEU 42 -4.465 -15.828 1.624 349 2HD1 LEU 42 HD12 LEU 42 -4.362 -16.736 0.116 350 3HD1 LEU 42 HD13 LEU 42 -2.910 -16.449 1.072 351 1HD2 LEU 42 HD21 LEU 42 -3.704 -17.667 3.937 352 2HD2 LEU 42 HD22 LEU 42 -2.346 -17.504 2.825 353 3HD2 LEU 42 HD23 LEU 42 -2.996 -19.102 3.194 354 H GLY 43 HN GLY 43 -7.864 -20.258 1.486 355 1HA GLY 43 HA2 GLY 43 -10.537 -19.584 1.825 356 2HA GLY 43 HA1 GLY 43 -9.817 -21.091 2.363 357 H GLU 44 HN GLU 44 -11.453 -20.917 4.047 358 HA GLU 44 HA GLU 44 -12.044 -20.615 6.216 359 1HB GLU 44 HB2 GLU 44 -9.243 -19.508 6.477 360 2HB GLU 44 HB1 GLU 44 -10.302 -19.909 7.823 361 1HG GLU 44 HG2 GLU 44 -9.228 -21.837 5.776 362 2HG GLU 44 HG1 GLU 44 -8.662 -21.653 7.436 363 H ASP 45 HN ASP 45 -9.924 -17.804 5.787 364 HA ASP 45 HA ASP 45 -11.780 -15.854 5.226 365 1HB ASP 45 HB2 ASP 45 -12.181 -14.811 7.452 366 2HB ASP 45 HB1 ASP 45 -12.938 -16.391 7.303 367 H GLU 46 HN GLU 46 -9.180 -16.298 4.517 368 HA GLU 46 HA GLU 46 -7.927 -13.862 5.485 369 1HB GLU 46 HB2 GLU 46 -6.563 -16.550 5.663 370 2HB GLU 46 HB1 GLU 46 -5.768 -15.003 5.912 371 1HG GLU 46 HG2 GLU 46 -7.253 -14.564 7.815 372 2HG GLU 46 HG1 GLU 46 -7.996 -16.145 7.579 373 H LEU 47 HN LEU 47 -6.562 -12.900 4.093 374 HA LEU 47 HA LEU 47 -5.781 -14.272 1.635 375 1HB LEU 47 HB2 LEU 47 -6.562 -12.532 0.191 376 2HB LEU 47 HB1 LEU 47 -7.917 -13.061 1.166 377 HG LEU 47 HG LEU 47 -7.398 -11.041 2.664 378 1HD1 LEU 47 HD11 LEU 47 -5.384 -10.160 2.087 379 2HD1 LEU 47 HD12 LEU 47 -6.411 -9.208 1.014 380 3HD1 LEU 47 HD13 LEU 47 -5.545 -10.613 0.391 381 1HD2 LEU 47 HD21 LEU 47 -9.375 -10.914 1.472 382 2HD2 LEU 47 HD22 LEU 47 -8.560 -10.972 -0.090 383 3HD2 LEU 47 HD23 LEU 47 -8.495 -9.503 0.883 384 H LYS 48 HN LYS 48 -3.850 -13.336 0.693 385 HA LYS 48 HA LYS 48 -2.579 -11.334 2.436 386 1HB LYS 48 HB2 LYS 48 -0.535 -12.583 2.510 387 2HB LYS 48 HB1 LYS 48 -1.851 -13.627 3.027 388 1HG LYS 48 HG2 LYS 48 -1.801 -14.879 1.064 389 2HG LYS 48 HG1 LYS 48 -0.895 -13.645 0.189 390 1HD LYS 48 HD2 LYS 48 1.061 -14.093 1.597 391 2HD LYS 48 HD1 LYS 48 0.154 -15.342 2.455 392 1HE LYS 48 HE2 LYS 48 1.636 -16.282 0.733 393 2HE LYS 48 HE1 LYS 48 -0.062 -16.626 0.409 394 1HZ LYS 48 HZ1 LYS 48 1.691 -15.562 -1.357 395 2HZ LYS 48 HZ2 LYS 48 0.864 -14.192 -0.810 396 3HZ LYS 48 HZ3 LYS 48 0.006 -15.482 -1.488 397 H VAL 49 HN VAL 49 -0.777 -10.243 1.631 398 HA VAL 49 HA VAL 49 -0.351 -10.305 -1.255 399 HB VAL 49 HB VAL 49 -1.952 -8.418 -0.618 400 1HG1 VAL 49 HG11 VAL 49 -0.493 -7.887 1.466 401 2HG1 VAL 49 HG12 VAL 49 -1.282 -6.579 0.585 402 3HG1 VAL 49 HG13 VAL 49 0.434 -6.905 0.336 403 1HG2 VAL 49 HG21 VAL 49 -1.300 -7.476 -2.511 404 2HG2 VAL 49 HG22 VAL 49 0.104 -8.541 -2.485 405 3HG2 VAL 49 HG23 VAL 49 0.213 -6.922 -1.796 406 H SER 50 HN SER 50 1.695 -10.998 -1.324 407 HA SER 50 HA SER 50 3.580 -10.270 0.755 408 1HB SER 50 HB2 SER 50 5.145 -11.759 -0.582 409 2HB SER 50 HB1 SER 50 3.699 -12.554 0.044 410 HG SER 50 HG SER 50 2.903 -12.715 -1.944 411 H TYR 51 HN TYR 51 4.383 -8.254 0.593 412 HA TYR 51 HA TYR 51 5.155 -7.331 -2.064 413 1HB TYR 51 HB2 TYR 51 5.424 -5.077 -0.809 414 2HB TYR 51 HB1 TYR 51 3.816 -5.658 -1.206 415 HD1 TYR 51 HD1 TYR 51 6.265 -5.991 1.621 416 HD2 TYR 51 HD2 TYR 51 2.228 -5.418 0.409 417 HE1 TYR 51 HE1 TYR 51 5.594 -5.765 3.975 418 HE2 TYR 51 HE2 TYR 51 1.548 -5.189 2.758 419 HH TYR 51 HH TYR 51 3.754 -4.734 5.269 420 H ALA 52 HN ALA 52 7.168 -6.916 -2.645 421 HA ALA 52 HA ALA 52 9.254 -7.405 -0.628 422 1HB ALA 52 HB1 ALA 52 9.260 -9.098 -2.345 423 2HB ALA 52 HB2 ALA 52 10.690 -8.086 -2.528 424 3HB ALA 52 HB3 ALA 52 9.312 -7.870 -3.608 425 H VAL 53 HN VAL 53 10.453 -5.722 -0.076 426 HA VAL 53 HA VAL 53 10.444 -3.354 -1.786 427 HB VAL 53 HB VAL 53 11.286 -2.136 0.149 428 1HG1 VAL 53 HG11 VAL 53 8.936 -2.182 -0.010 429 2HG1 VAL 53 HG12 VAL 53 9.308 -2.528 1.679 430 3HG1 VAL 53 HG13 VAL 53 8.850 -3.838 0.591 431 1HG2 VAL 53 HG21 VAL 53 11.252 -3.401 2.381 432 2HG2 VAL 53 HG22 VAL 53 12.645 -3.627 1.324 433 3HG2 VAL 53 HG23 VAL 53 11.387 -4.858 1.401 434 HA PRO 54 HA PRO 54 14.733 -4.493 -2.630 435 1HB PRO 54 HB2 PRO 54 14.707 -3.810 -5.210 436 2HB PRO 54 HB1 PRO 54 13.846 -5.243 -4.636 437 1HG PRO 54 HG2 PRO 54 12.773 -2.668 -5.576 438 2HG PRO 54 HG1 PRO 54 11.978 -4.246 -5.477 439 1HD PRO 54 HD2 PRO 54 11.863 -2.030 -3.601 440 2HD PRO 54 HD1 PRO 54 10.929 -3.541 -3.596 441 H LYS 55 HN LYS 55 16.567 -3.357 -2.583 442 HA LYS 55 HA LYS 55 17.087 -0.848 -3.698 443 1HB LYS 55 HB2 LYS 55 16.146 -0.812 -0.862 444 2HB LYS 55 HB1 LYS 55 17.483 0.238 -1.299 445 1HG LYS 55 HG2 LYS 55 14.708 0.264 -2.465 446 2HG LYS 55 HG1 LYS 55 15.440 1.475 -1.421 447 1HD LYS 55 HD2 LYS 55 17.132 1.908 -3.179 448 2HD LYS 55 HD1 LYS 55 16.278 0.780 -4.233 449 1HE LYS 55 HE2 LYS 55 15.115 3.293 -3.040 450 2HE LYS 55 HE1 LYS 55 15.672 3.111 -4.700 451 1HZ LYS 55 HZ1 LYS 55 13.547 2.590 -5.089 452 2HZ LYS 55 HZ2 LYS 55 13.220 2.218 -3.474 453 3HZ LYS 55 HZ3 LYS 55 13.955 1.068 -4.472 454 HA PRO 56 HA PRO 56 20.610 -3.423 -1.993 455 1HB PRO 56 HB2 PRO 56 21.276 -4.329 -4.636 456 2HB PRO 56 HB1 PRO 56 20.696 -5.277 -3.267 457 1HG PRO 56 HG2 PRO 56 19.261 -4.835 -5.572 458 2HG PRO 56 HG1 PRO 56 18.543 -5.249 -4.006 459 1HD PRO 56 HD2 PRO 56 18.797 -2.577 -5.330 460 2HD PRO 56 HD1 PRO 56 17.450 -3.248 -4.387 461 H ASN 57 HN ASN 57 20.529 -0.609 -2.816 462 HA ASN 57 HA ASN 57 23.310 -0.380 -3.718 463 1HB ASN 57 HB2 ASN 57 20.957 1.160 -4.825 464 2HB ASN 57 HB1 ASN 57 22.622 1.675 -5.035 465 1HD2 ASN 57 HD21 ASN 57 23.149 -1.437 -5.164 466 2HD2 ASN 57 HD22 ASN 57 22.831 -1.776 -6.823 467 H GLY 58 HN GLY 58 22.167 -0.287 -1.123 468 1HA GLY 58 HA2 GLY 58 23.461 1.692 0.162 469 2HA GLY 58 HA1 GLY 58 21.968 2.487 -0.327 470 H CYS 59 HN CYS 59 20.108 0.573 -0.044 471 HA CYS 59 HA CYS 59 20.079 0.175 2.849 472 1HB CYS 59 HB2 CYS 59 17.848 0.181 0.804 473 2HB CYS 59 HB1 CYS 59 17.614 -0.163 2.514 474 H ARG 60 HN ARG 60 18.025 -1.778 0.781 475 HA ARG 60 HA ARG 60 19.634 -4.012 0.410 476 1HB ARG 60 HB2 ARG 60 19.535 -3.836 3.009 477 2HB ARG 60 HB1 ARG 60 17.912 -4.479 2.832 478 1HG ARG 60 HG2 ARG 60 19.432 -6.273 3.309 479 2HG ARG 60 HG1 ARG 60 18.857 -6.437 1.650 480 1HD ARG 60 HD2 ARG 60 21.262 -6.859 1.810 481 2HD ARG 60 HD1 ARG 60 20.915 -5.446 0.815 482 HE ARG 60 HE ARG 60 22.146 -4.216 2.278 483 1HH1 ARG 60 HH11 ARG 60 21.047 -7.081 3.944 484 2HH1 ARG 60 HH12 ARG 60 21.835 -6.669 5.429 485 1HH2 ARG 60 HH21 ARG 60 23.183 -3.677 4.230 486 2HH2 ARG 60 HH22 ARG 60 23.048 -4.739 5.592 487 H LYS 61 HN LYS 61 17.166 -5.664 1.607 488 HA LYS 61 HA LYS 61 15.033 -4.937 -0.147 489 1HB LYS 61 HB2 LYS 61 16.490 -6.079 -1.757 490 2HB LYS 61 HB1 LYS 61 16.583 -7.478 -0.695 491 1HG LYS 61 HG2 LYS 61 14.181 -7.848 -0.970 492 2HG LYS 61 HG1 LYS 61 14.091 -6.450 -2.041 493 1HD LYS 61 HD2 LYS 61 15.629 -7.549 -3.600 494 2HD LYS 61 HD1 LYS 61 15.718 -8.946 -2.525 495 1HE LYS 61 HE2 LYS 61 13.314 -9.315 -2.812 496 2HE LYS 61 HE1 LYS 61 13.228 -7.917 -3.882 497 1HZ LYS 61 HZ1 LYS 61 14.976 -9.166 -5.247 498 2HZ LYS 61 HZ2 LYS 61 13.376 -9.710 -5.320 499 3HZ LYS 61 HZ3 LYS 61 14.505 -10.533 -4.367 500 H TRP 62 HN TRP 62 13.078 -5.853 0.574 501 HA TRP 62 HA TRP 62 13.264 -8.067 2.465 502 1HB TRP 62 HB2 TRP 62 13.556 -6.090 3.866 503 2HB TRP 62 HB1 TRP 62 12.062 -5.407 3.237 504 HD1 TRP 62 HD1 TRP 62 10.335 -5.515 5.119 505 HE1 TRP 62 HE1 TRP 62 9.561 -7.287 6.817 506 HE3 TRP 62 HE3 TRP 62 13.694 -9.217 4.026 507 HZ2 TRP 62 HZ2 TRP 62 10.278 -9.904 7.593 508 HZ3 TRP 62 HZ3 TRP 62 13.579 -11.324 5.293 509 HH2 TRP 62 HH2 TRP 62 11.906 -11.658 7.040 510 H GLU 63 HN GLU 63 11.424 -9.249 2.761 511 HA GLU 63 HA GLU 63 9.052 -8.420 1.238 512 1HB GLU 63 HB2 GLU 63 8.711 -10.807 0.606 513 2HB GLU 63 HB1 GLU 63 10.140 -10.083 -0.117 514 1HG GLU 63 HG2 GLU 63 10.757 -12.248 0.562 515 2HG GLU 63 HG1 GLU 63 11.478 -11.139 1.727 516 H THR 64 HN THR 64 7.098 -8.832 2.191 517 HA THR 64 HA THR 64 7.019 -10.447 4.613 518 HB THR 64 HB THR 64 6.273 -7.518 4.562 519 HG1 THR 64 HG1 THR 64 8.247 -8.995 5.952 520 1HG2 THR 64 HG21 THR 64 5.602 -7.702 6.843 521 2HG2 THR 64 HG22 THR 64 6.023 -9.414 6.881 522 3HG2 THR 64 HG23 THR 64 4.669 -8.859 5.896 523 H THR 65 HN THR 65 5.090 -11.393 4.979 524 HA THR 65 HA THR 65 3.058 -11.036 2.910 525 HB THR 65 HB THR 65 3.662 -13.222 4.891 526 HG1 THR 65 HG1 THR 65 3.538 -13.194 2.060 527 1HG2 THR 65 HG21 THR 65 1.328 -13.321 4.878 528 2HG2 THR 65 HG22 THR 65 1.856 -14.517 3.695 529 3HG2 THR 65 HG23 THR 65 1.238 -12.956 3.155 530 H PHE 66 HN PHE 66 1.490 -9.599 3.388 531 HA PHE 66 HA PHE 66 0.582 -9.412 6.175 532 1HB PHE 66 HB2 PHE 66 0.478 -7.581 3.831 533 2HB PHE 66 HB1 PHE 66 -0.859 -7.494 4.969 534 HD1 PHE 66 HD1 PHE 66 -0.298 -5.223 5.598 535 HD2 PHE 66 HD2 PHE 66 2.493 -8.395 6.130 536 HE1 PHE 66 HE1 PHE 66 1.036 -3.796 7.093 537 HE2 PHE 66 HE2 PHE 66 3.831 -6.970 7.626 538 HZ PHE 66 HZ PHE 66 3.102 -4.668 8.109 539 H LYS 67 HN LYS 67 -1.109 -10.604 6.780 540 HA LYS 67 HA LYS 67 -3.227 -11.151 4.823 541 1HB LYS 67 HB2 LYS 67 -1.660 -13.031 4.791 542 2HB LYS 67 HB1 LYS 67 -1.861 -13.233 6.523 543 1HG LYS 67 HG2 LYS 67 -4.331 -13.595 6.031 544 2HG LYS 67 HG1 LYS 67 -3.851 -13.751 4.341 545 1HD LYS 67 HD2 LYS 67 -2.806 -15.432 6.622 546 2HD LYS 67 HD1 LYS 67 -4.036 -15.932 5.463 547 1HE LYS 67 HE2 LYS 67 -1.962 -16.879 4.775 548 2HE LYS 67 HE1 LYS 67 -2.355 -15.584 3.646 549 1HZ LYS 67 HZ1 LYS 67 0.011 -15.889 4.896 550 2HZ LYS 67 HZ2 LYS 67 -0.745 -14.749 5.888 551 3HZ LYS 67 HZ3 LYS 67 -0.547 -14.435 4.238 552 H LYS 68 HN LYS 68 -5.255 -11.306 5.589 553 HA LYS 68 HA LYS 68 -6.053 -12.074 8.111 554 1HB LYS 68 HB2 LYS 68 -4.847 -9.897 8.723 555 2HB LYS 68 HB1 LYS 68 -6.207 -9.072 7.973 556 1HG LYS 68 HG2 LYS 68 -6.540 -9.220 10.368 557 2HG LYS 68 HG1 LYS 68 -7.734 -10.211 9.536 558 1HD LYS 68 HD2 LYS 68 -6.407 -12.208 9.998 559 2HD LYS 68 HD1 LYS 68 -5.190 -11.218 10.807 560 1HE LYS 68 HE2 LYS 68 -6.680 -12.301 12.416 561 2HE LYS 68 HE1 LYS 68 -6.828 -10.545 12.478 562 1HZ LYS 68 HZ1 LYS 68 -8.954 -11.921 12.493 563 2HZ LYS 68 HZ2 LYS 68 -8.668 -12.181 10.847 564 3HZ LYS 68 HZ3 LYS 68 -8.887 -10.608 11.428 565 H THR 69 HN THR 69 -8.083 -9.511 7.883 566 HA THR 69 HA THR 69 -9.850 -11.018 6.088 567 HB THR 69 HB THR 69 -10.684 -10.791 8.346 568 HG1 THR 69 HG1 THR 69 -12.529 -10.640 7.398 569 1HG2 THR 69 HG21 THR 69 -11.335 -7.996 8.361 570 2HG2 THR 69 HG22 THR 69 -9.588 -8.234 8.306 571 3HG2 THR 69 HG23 THR 69 -10.539 -8.976 9.592 572 H SER 70 HN SER 70 -11.255 -9.968 4.645 573 HA SER 70 HA SER 70 -10.744 -7.174 3.986 574 1HB SER 70 HB2 SER 70 -9.136 -8.426 2.591 575 2HB SER 70 HB1 SER 70 -10.459 -9.403 1.955 576 HG SER 70 HG SER 70 -11.335 -7.526 1.041 577 H ASP 71 HN ASP 71 -12.604 -6.149 3.413 578 HA ASP 71 HA ASP 71 -15.039 -7.715 3.422 579 1HB ASP 71 HB2 ASP 71 -16.232 -5.616 3.375 580 2HB ASP 71 HB1 ASP 71 -14.924 -5.527 4.546 581 H ASP 72 HN ASP 72 -16.737 -7.583 1.855 582 HA ASP 72 HA ASP 72 -15.770 -7.886 -0.845 583 1HB ASP 72 HB2 ASP 72 -18.571 -8.083 0.288 584 2HB ASP 72 HB1 ASP 72 -18.109 -8.527 -1.351 585 H GLY 73 HN GLY 73 -17.863 -6.971 -2.413 586 1HA GLY 73 HA2 GLY 73 -18.643 -5.084 -3.488 587 2HA GLY 73 HA1 GLY 73 -18.667 -4.301 -1.911 588 H GLU 74 HN GLU 74 -16.428 -3.773 -1.074 589 HA GLU 74 HA GLU 74 -14.695 -2.752 -3.220 590 1HB GLU 74 HB2 GLU 74 -14.108 -0.880 -1.664 591 2HB GLU 74 HB1 GLU 74 -15.784 -0.848 -2.188 592 1HG GLU 74 HG2 GLU 74 -14.898 -2.022 0.432 593 2HG GLU 74 HG1 GLU 74 -15.399 -0.343 0.233 594 H VAL 75 HN VAL 75 -12.845 -1.929 -0.775 595 HA VAL 75 HA VAL 75 -12.293 -4.551 0.295 596 HB VAL 75 HB VAL 75 -10.365 -3.283 -1.643 597 1HG1 VAL 75 HG11 VAL 75 -9.835 -5.647 0.161 598 2HG1 VAL 75 HG12 VAL 75 -9.188 -4.028 0.419 599 3HG1 VAL 75 HG13 VAL 75 -8.727 -4.942 -1.015 600 1HG2 VAL 75 HG21 VAL 75 -11.763 -5.948 -1.532 601 2HG2 VAL 75 HG22 VAL 75 -10.461 -5.566 -2.656 602 3HG2 VAL 75 HG23 VAL 75 -11.978 -4.671 -2.727 603 H TYR 76 HN TYR 76 -11.694 -4.362 2.283 604 HA TYR 76 HA TYR 76 -9.993 -2.127 3.082 605 1HB TYR 76 HB2 TYR 76 -11.285 -1.452 4.869 606 2HB TYR 76 HB1 TYR 76 -12.551 -1.903 3.742 607 HD1 TYR 76 HD1 TYR 76 -14.339 -2.932 4.744 608 HD2 TYR 76 HD2 TYR 76 -10.456 -3.697 6.304 609 HE1 TYR 76 HE1 TYR 76 -15.317 -4.419 6.440 610 HE2 TYR 76 HE2 TYR 76 -11.424 -5.195 7.990 611 HH TYR 76 HH TYR 76 -13.940 -5.295 9.128 612 H TYR 77 HN TYR 77 -8.309 -2.770 4.225 613 HA TYR 77 HA TYR 77 -8.170 -5.612 4.910 614 1HB TYR 77 HB2 TYR 77 -6.511 -4.142 3.374 615 2HB TYR 77 HB1 TYR 77 -5.729 -3.938 4.935 616 HD1 TYR 77 HD1 TYR 77 -7.518 -6.935 3.672 617 HD2 TYR 77 HD2 TYR 77 -3.766 -5.197 4.672 618 HE1 TYR 77 HE1 TYR 77 -6.436 -9.117 3.379 619 HE2 TYR 77 HE2 TYR 77 -2.675 -7.379 4.377 620 HH TYR 77 HH TYR 77 -3.572 -9.672 2.781 621 H SER 78 HN SER 78 -8.238 -6.211 6.940 622 HA SER 78 HA SER 78 -7.298 -4.352 9.021 623 1HB SER 78 HB2 SER 78 -9.693 -6.209 9.120 624 2HB SER 78 HB1 SER 78 -9.032 -5.377 10.528 625 HG SER 78 HG SER 78 -9.503 -3.400 9.497 626 H GLU 79 HN GLU 79 -5.448 -5.170 9.742 627 HA GLU 79 HA GLU 79 -5.211 -8.092 9.963 628 1HB GLU 79 HB2 GLU 79 -3.178 -5.962 9.395 629 2HB GLU 79 HB1 GLU 79 -2.710 -7.589 9.859 630 1HG GLU 79 HG2 GLU 79 -3.842 -8.486 7.910 631 2HG GLU 79 HG1 GLU 79 -4.374 -6.867 7.458 632 H GLU 80 HN GLU 80 -5.444 -8.770 11.975 633 HA GLU 80 HA GLU 80 -5.308 -8.967 14.240 634 1HB GLU 80 HB2 GLU 80 -2.749 -8.528 13.214 635 2HB GLU 80 HB1 GLU 80 -2.848 -7.466 14.611 636 1HG GLU 80 HG2 GLU 80 -1.918 -9.580 15.257 637 2HG GLU 80 HG1 GLU 80 -3.511 -9.393 15.991 638 H ALA 81 HN ALA 81 -3.687 -5.889 13.767 639 HA ALA 81 HA ALA 81 -5.747 -4.183 14.580 640 1HB ALA 81 HB1 ALA 81 -3.991 -5.236 16.752 641 2HB ALA 81 HB2 ALA 81 -5.698 -4.790 16.798 642 3HB ALA 81 HB3 ALA 81 -4.457 -3.536 16.797 643 H LYS 82 HN LYS 82 -2.395 -4.117 15.695 644 HA LYS 82 HA LYS 82 -1.528 -1.723 14.999 645 1HB LYS 82 HB2 LYS 82 0.711 -2.633 14.630 646 2HB LYS 82 HB1 LYS 82 -0.073 -3.373 16.014 647 1HG LYS 82 HG2 LYS 82 0.047 -4.627 13.294 648 2HG LYS 82 HG1 LYS 82 1.216 -4.939 14.569 649 1HD LYS 82 HD2 LYS 82 -1.740 -5.543 14.617 650 2HD LYS 82 HD1 LYS 82 -0.420 -6.704 14.534 651 1HE LYS 82 HE2 LYS 82 -1.005 -4.847 16.838 652 2HE LYS 82 HE1 LYS 82 -1.329 -6.578 16.790 653 1HZ LYS 82 HZ1 LYS 82 1.079 -6.933 16.508 654 2HZ LYS 82 HZ2 LYS 82 0.696 -6.184 17.976 655 3HZ LYS 82 HZ3 LYS 82 1.336 -5.272 16.704 656 H LYS 83 HN LYS 83 -2.184 -4.276 12.619 657 HA LYS 83 HA LYS 83 -1.366 -2.392 10.516 658 1HB LYS 83 HB2 LYS 83 -1.645 -5.357 10.578 659 2HB LYS 83 HB1 LYS 83 -1.943 -4.533 9.061 660 1HG LYS 83 HG2 LYS 83 0.329 -5.259 9.106 661 2HG LYS 83 HG1 LYS 83 0.294 -3.501 9.214 662 1HD LYS 83 HD2 LYS 83 1.875 -4.089 10.802 663 2HD LYS 83 HD1 LYS 83 0.411 -3.889 11.761 664 1HE LYS 83 HE2 LYS 83 1.505 -6.513 10.747 665 2HE LYS 83 HE1 LYS 83 1.671 -5.906 12.392 666 1HZ LYS 83 HZ1 LYS 83 -0.695 -6.980 11.036 667 2HZ LYS 83 HZ2 LYS 83 -0.922 -5.811 12.237 668 3HZ LYS 83 HZ3 LYS 83 -0.134 -7.259 12.607 669 H LYS 84 HN LYS 84 -2.912 -1.105 9.843 670 HA LYS 84 HA LYS 84 -5.588 -2.228 9.338 671 1HB LYS 84 HB2 LYS 84 -4.979 0.567 10.336 672 2HB LYS 84 HB1 LYS 84 -6.564 -0.024 9.874 673 1HG LYS 84 HG2 LYS 84 -4.904 -1.095 12.143 674 2HG LYS 84 HG1 LYS 84 -6.264 0.020 12.296 675 1HD LYS 84 HD2 LYS 84 -7.720 -1.689 11.242 676 2HD LYS 84 HD1 LYS 84 -6.352 -2.805 11.241 677 1HE LYS 84 HE2 LYS 84 -6.218 -2.585 13.696 678 2HE LYS 84 HE1 LYS 84 -7.641 -1.547 13.660 679 1HZ LYS 84 HZ1 LYS 84 -7.440 -4.437 13.182 680 2HZ LYS 84 HZ2 LYS 84 -8.673 -3.568 12.418 681 3HZ LYS 84 HZ3 LYS 84 -8.567 -3.576 14.106 682 H VAL 85 HN VAL 85 -6.483 -1.669 7.351 683 HA VAL 85 HA VAL 85 -5.214 0.375 5.740 684 HB VAL 85 HB VAL 85 -5.276 -2.098 4.196 685 1HG1 VAL 85 HG11 VAL 85 -4.210 0.161 3.667 686 2HG1 VAL 85 HG12 VAL 85 -3.277 -1.289 3.299 687 3HG1 VAL 85 HG13 VAL 85 -2.910 -0.344 4.738 688 1HG2 VAL 85 HG21 VAL 85 -3.362 -3.192 5.172 689 2HG2 VAL 85 HG22 VAL 85 -4.632 -3.058 6.388 690 3HG2 VAL 85 HG23 VAL 85 -3.252 -1.960 6.429 691 H GLU 86 HN GLU 86 -6.510 1.128 4.097 692 HA GLU 86 HA GLU 86 -9.085 -0.254 3.698 693 1HB GLU 86 HB2 GLU 86 -8.609 2.730 3.782 694 2HB GLU 86 HB1 GLU 86 -10.150 1.948 3.462 695 1HG GLU 86 HG2 GLU 86 -8.586 1.733 6.025 696 2HG GLU 86 HG1 GLU 86 -9.980 2.778 5.757 697 H VAL 87 HN VAL 87 -9.172 -1.019 1.690 698 HA VAL 87 HA VAL 87 -7.625 0.257 -0.428 699 HB VAL 87 HB VAL 87 -9.237 -2.279 -0.620 700 1HG1 VAL 87 HG11 VAL 87 -7.443 -0.810 -2.426 701 2HG1 VAL 87 HG12 VAL 87 -8.783 -1.899 -2.787 702 3HG1 VAL 87 HG13 VAL 87 -7.203 -2.556 -2.360 703 1HG2 VAL 87 HG21 VAL 87 -6.283 -2.118 -0.102 704 2HG2 VAL 87 HG22 VAL 87 -7.316 -3.548 -0.088 705 3HG2 VAL 87 HG23 VAL 87 -7.477 -2.331 1.179 706 H LEU 88 HN LEU 88 -8.509 1.715 -1.685 707 HA LEU 88 HA LEU 88 -11.326 1.431 -2.455 708 1HB LEU 88 HB2 LEU 88 -11.616 3.865 -2.319 709 2HB LEU 88 HB1 LEU 88 -11.242 3.159 -0.763 710 HG LEU 88 HG LEU 88 -9.200 4.560 -2.491 711 1HD1 LEU 88 HD11 LEU 88 -10.994 6.094 -1.799 712 2HD1 LEU 88 HD12 LEU 88 -9.462 6.464 -1.010 713 3HD1 LEU 88 HD13 LEU 88 -10.730 5.625 -0.120 714 1HD2 LEU 88 HD21 LEU 88 -8.475 4.655 0.191 715 2HD2 LEU 88 HD22 LEU 88 -7.770 3.627 -1.056 716 3HD2 LEU 88 HD23 LEU 88 -9.077 3.014 -0.046 717 H ASP 89 HN ASP 89 -11.009 4.027 -4.017 718 HA ASP 89 HA ASP 89 -10.409 4.694 -6.100 719 1HB ASP 89 HB2 ASP 89 -8.089 4.439 -5.274 720 2HB ASP 89 HB1 ASP 89 -8.103 2.759 -5.791 721 H THR 90 HN THR 90 -8.894 1.797 -7.194 722 HA THR 90 HA THR 90 -11.423 0.625 -8.035 723 HB THR 90 HB THR 90 -9.292 1.253 -10.079 724 HG1 THR 90 HG1 THR 90 -11.725 2.614 -9.557 725 1HG2 THR 90 HG21 THR 90 -10.795 -0.631 -10.595 726 2HG2 THR 90 HG22 THR 90 -10.971 0.727 -11.706 727 3HG2 THR 90 HG23 THR 90 -12.169 0.463 -10.439 728 H ASP 91 HN ASP 91 -10.481 -0.834 -6.361 729 HA ASP 91 HA ASP 91 -8.182 -2.407 -7.068 730 1HB ASP 91 HB2 ASP 91 -8.730 -1.913 -4.729 731 2HB ASP 91 HB1 ASP 91 -10.244 -2.796 -4.888 732 H TYR 92 HN TYR 92 -10.519 -2.419 -8.926 733 HA TYR 92 HA TYR 92 -10.740 -5.319 -9.184 734 1HB TYR 92 HB2 TYR 92 -13.134 -3.463 -9.339 735 2HB TYR 92 HB1 TYR 92 -13.143 -5.173 -9.737 736 HD1 TYR 92 HD1 TYR 92 -12.085 -3.044 -6.833 737 HD2 TYR 92 HD2 TYR 92 -14.111 -6.531 -8.182 738 HE1 TYR 92 HE1 TYR 92 -12.682 -3.588 -4.512 739 HE2 TYR 92 HE2 TYR 92 -14.716 -7.084 -5.866 740 HH TYR 92 HH TYR 92 -14.596 -4.967 -3.379 741 H LYS 93 HN LYS 93 -9.438 -2.885 -10.567 742 HA LYS 93 HA LYS 93 -10.309 -3.625 -13.276 743 1HB LYS 93 HB2 LYS 93 -11.316 -1.473 -12.833 744 2HB LYS 93 HB1 LYS 93 -9.781 -0.826 -12.274 745 1HG LYS 93 HG2 LYS 93 -10.304 -0.037 -14.517 746 2HG LYS 93 HG1 LYS 93 -8.850 -1.038 -14.514 747 1HD LYS 93 HD2 LYS 93 -10.171 -2.949 -15.287 748 2HD LYS 93 HD1 LYS 93 -11.621 -1.942 -15.302 749 1HE LYS 93 HE2 LYS 93 -10.655 -2.189 -17.541 750 2HE LYS 93 HE1 LYS 93 -10.629 -0.511 -17.000 751 1HZ LYS 93 HZ1 LYS 93 -8.341 -0.583 -16.659 752 2HZ LYS 93 HZ2 LYS 93 -8.544 -1.452 -18.097 753 3HZ LYS 93 HZ3 LYS 93 -8.288 -2.274 -16.643 754 H SER 94 HN SER 94 -7.923 -1.145 -12.539 755 HA SER 94 HA SER 94 -5.744 -3.006 -13.107 756 1HB SER 94 HB2 SER 94 -4.788 -1.474 -14.802 757 2HB SER 94 HB1 SER 94 -6.357 -2.112 -15.291 758 HG SER 94 HG SER 94 -6.100 0.178 -15.613 759 H TYR 95 HN TYR 95 -6.920 -0.194 -11.538 760 HA TYR 95 HA TYR 95 -4.349 0.080 -10.191 761 1HB TYR 95 HB2 TYR 95 -4.687 2.617 -10.284 762 2HB TYR 95 HB1 TYR 95 -4.113 1.818 -11.742 763 HD1 TYR 95 HD1 TYR 95 -7.296 2.961 -10.141 764 HD2 TYR 95 HD2 TYR 95 -5.171 2.253 -13.757 765 HE1 TYR 95 HE1 TYR 95 -9.160 3.927 -11.418 766 HE2 TYR 95 HE2 TYR 95 -7.028 3.222 -15.044 767 HH TYR 95 HH TYR 95 -9.148 5.123 -14.082 768 H ALA 96 HN ALA 96 -4.509 0.302 -8.065 769 HA ALA 96 HA ALA 96 -7.037 1.194 -6.878 770 1HB ALA 96 HB1 ALA 96 -7.540 -0.770 -5.942 771 2HB ALA 96 HB2 ALA 96 -5.884 -1.017 -5.393 772 3HB ALA 96 HB3 ALA 96 -6.347 -1.485 -7.027 773 H VAL 97 HN VAL 97 -6.857 2.013 -4.766 774 HA VAL 97 HA VAL 97 -4.091 2.556 -3.918 775 HB VAL 97 HB VAL 97 -4.699 4.720 -3.155 776 1HG1 VAL 97 HG11 VAL 97 -6.150 5.365 -5.438 777 2HG1 VAL 97 HG12 VAL 97 -5.235 3.927 -5.886 778 3HG1 VAL 97 HG13 VAL 97 -4.393 5.346 -5.274 779 1HG2 VAL 97 HG21 VAL 97 -6.734 4.765 -2.166 780 2HG2 VAL 97 HG22 VAL 97 -7.453 3.672 -3.347 781 3HG2 VAL 97 HG23 VAL 97 -7.234 5.375 -3.745 782 H ILE 98 HN ILE 98 -3.575 2.158 -1.848 783 HA ILE 98 HA ILE 98 -5.706 1.497 0.053 784 HB ILE 98 HB ILE 98 -5.128 -0.632 -0.827 785 1HG1 ILE 98 HG12 ILE 98 -4.046 -1.767 1.095 786 2HG1 ILE 98 HG11 ILE 98 -3.604 -0.190 1.739 787 1HG2 ILE 98 HG21 ILE 98 -2.226 -0.007 -0.346 788 2HG2 ILE 98 HG22 ILE 98 -3.031 0.109 -1.912 789 3HG2 ILE 98 HG23 ILE 98 -2.898 -1.452 -1.099 790 1HD1 ILE 98 HD11 ILE 98 -5.663 0.207 2.516 791 2HD1 ILE 98 HD12 ILE 98 -5.827 -1.547 2.415 792 3HD1 ILE 98 HD13 ILE 98 -6.436 -0.525 1.117 793 H TYR 99 HN TYR 99 -5.389 2.761 1.785 794 HA TYR 99 HA TYR 99 -2.637 3.541 2.431 795 1HB TYR 99 HB2 TYR 99 -3.560 5.376 3.701 796 2HB TYR 99 HB1 TYR 99 -4.288 5.354 2.101 797 HD1 TYR 99 HD1 TYR 99 -4.953 4.086 5.557 798 HD2 TYR 99 HD2 TYR 99 -6.568 5.616 1.931 799 HE1 TYR 99 HE1 TYR 99 -7.191 4.114 6.574 800 HE2 TYR 99 HE2 TYR 99 -8.811 5.650 2.938 801 HH TYR 99 HH TYR 99 -9.734 5.797 5.380 802 H ALA 100 HN ALA 100 -1.642 2.954 4.247 803 HA ALA 100 HA ALA 100 -3.064 1.101 6.014 804 1HB ALA 100 HB1 ALA 100 -0.330 1.305 5.012 805 2HB ALA 100 HB2 ALA 100 -1.232 -0.105 5.567 806 3HB ALA 100 HB3 ALA 100 -0.431 0.944 6.735 807 H THR 101 HN THR 101 -3.195 1.353 8.175 808 HA THR 101 HA THR 101 -1.942 3.696 9.413 809 HB THR 101 HB THR 101 -4.839 2.899 9.806 810 HG1 THR 101 HG1 THR 101 -5.351 4.548 8.528 811 1HG2 THR 101 HG21 THR 101 -5.104 4.681 11.257 812 2HG2 THR 101 HG22 THR 101 -3.597 5.445 10.752 813 3HG2 THR 101 HG23 THR 101 -3.557 3.990 11.747 814 H ARG 102 HN ARG 102 -1.042 3.225 11.372 815 HA ARG 102 HA ARG 102 -1.312 0.472 12.249 816 1HB ARG 102 HB2 ARG 102 0.615 2.565 13.241 817 2HB ARG 102 HB1 ARG 102 0.674 0.841 13.573 818 1HG ARG 102 HG2 ARG 102 0.989 2.106 10.861 819 2HG ARG 102 HG1 ARG 102 2.295 1.484 11.871 820 1HD ARG 102 HD2 ARG 102 -0.006 -0.152 10.808 821 2HD ARG 102 HD1 ARG 102 1.605 -0.095 10.096 822 HE ARG 102 HE ARG 102 0.798 -1.657 12.309 823 1HH1 ARG 102 HH11 ARG 102 3.494 0.205 11.104 824 2HH1 ARG 102 HH12 ARG 102 4.669 -0.665 12.032 825 1HH2 ARG 102 HH21 ARG 102 2.345 -2.806 13.523 826 2HH2 ARG 102 HH22 ARG 102 4.018 -2.375 13.403 827 H VAL 103 HN VAL 103 -1.955 -0.223 14.198 828 HA VAL 103 HA VAL 103 -2.734 1.674 16.263 829 HB VAL 103 HB VAL 103 -4.793 1.452 15.008 830 1HG1 VAL 103 HG11 VAL 103 -4.200 -0.749 13.981 831 2HG1 VAL 103 HG12 VAL 103 -5.864 -0.620 14.548 832 3HG1 VAL 103 HG13 VAL 103 -4.677 -1.515 15.496 833 1HG2 VAL 103 HG21 VAL 103 -6.258 0.529 16.781 834 2HG2 VAL 103 HG22 VAL 103 -5.030 1.634 17.398 835 3HG2 VAL 103 HG23 VAL 103 -4.824 -0.107 17.589 836 H LYS 104 HN LYS 104 -1.510 0.971 17.859 837 HA LYS 104 HA LYS 104 -1.882 -1.696 18.933 838 1HB LYS 104 HB2 LYS 104 -0.064 -1.858 17.172 839 2HB LYS 104 HB1 LYS 104 0.894 -0.775 18.165 840 1HG LYS 104 HG2 LYS 104 -0.121 -3.460 19.075 841 2HG LYS 104 HG1 LYS 104 1.486 -3.167 18.411 842 1HD LYS 104 HD2 LYS 104 1.809 -1.475 20.257 843 2HD LYS 104 HD1 LYS 104 0.314 -2.090 20.964 844 1HE LYS 104 HE2 LYS 104 2.803 -3.691 20.403 845 2HE LYS 104 HE1 LYS 104 2.249 -3.147 21.987 846 1HZ LYS 104 HZ1 LYS 104 0.100 -4.443 21.206 847 2HZ LYS 104 HZ2 LYS 104 1.379 -5.221 21.992 848 3HZ LYS 104 HZ3 LYS 104 1.243 -5.311 20.309 849 H ASP 105 HN ASP 105 -1.993 -1.470 21.085 850 HA ASP 105 HA ASP 105 -1.837 -0.577 23.174 851 1HB ASP 105 HB2 ASP 105 0.575 -1.242 22.693 852 2HB ASP 105 HB1 ASP 105 0.871 0.451 22.309 853 H GLY 106 HN GLY 106 -3.158 0.996 21.252 854 1HA GLY 106 HA2 GLY 106 -4.077 3.090 21.079 855 2HA GLY 106 HA1 GLY 106 -3.273 3.485 22.589 856 H ARG 107 HN ARG 107 -1.718 2.500 19.575 857 HA ARG 107 HA ARG 107 -0.558 5.201 19.372 858 1HB ARG 107 HB2 ARG 107 1.291 3.955 19.983 859 2HB ARG 107 HB1 ARG 107 0.724 2.509 19.165 860 1HG ARG 107 HG2 ARG 107 1.396 4.802 17.438 861 2HG ARG 107 HG1 ARG 107 2.740 4.014 18.275 862 1HD ARG 107 HD2 ARG 107 1.925 1.838 17.414 863 2HD ARG 107 HD1 ARG 107 0.704 2.704 16.483 864 HE ARG 107 HE ARG 107 3.093 3.831 15.757 865 1HH1 ARG 107 HH11 ARG 107 1.783 0.598 15.774 866 2HH1 ARG 107 HH12 ARG 107 2.659 0.098 14.367 867 1HH2 ARG 107 HH21 ARG 107 4.247 3.188 13.914 868 2HH2 ARG 107 HH22 ARG 107 4.066 1.577 13.306 869 H THR 108 HN THR 108 -0.802 6.224 17.486 870 HA THR 108 HA THR 108 -1.983 4.701 15.268 871 HB THR 108 HB THR 108 -3.479 6.382 16.170 872 HG1 THR 108 HG1 THR 108 -3.605 6.137 13.952 873 1HG2 THR 108 HG21 THR 108 -1.110 8.040 16.217 874 2HG2 THR 108 HG22 THR 108 -2.655 8.247 17.043 875 3HG2 THR 108 HG23 THR 108 -2.456 8.826 15.390 876 H LEU 109 HN LEU 109 -1.296 4.952 13.202 877 HA LEU 109 HA LEU 109 0.977 6.722 12.650 878 1HB LEU 109 HB2 LEU 109 1.927 4.497 13.129 879 2HB LEU 109 HB1 LEU 109 0.869 3.796 11.919 880 HG LEU 109 HG LEU 109 2.002 5.121 10.172 881 1HD1 LEU 109 HD11 LEU 109 4.392 5.882 11.190 882 2HD1 LEU 109 HD12 LEU 109 3.311 6.282 12.525 883 3HD1 LEU 109 HD13 LEU 109 3.027 6.965 10.924 884 1HD2 LEU 109 HD21 LEU 109 4.235 3.905 10.371 885 2HD2 LEU 109 HD22 LEU 109 2.773 2.918 10.362 886 3HD2 LEU 109 HD23 LEU 109 3.606 3.247 11.881 887 H HIS 110 HN HIS 110 0.885 7.631 10.612 888 HA HIS 110 HA HIS 110 -1.378 6.733 8.949 889 1HB HIS 110 HB2 HIS 110 -0.131 9.476 9.115 890 2HB HIS 110 HB1 HIS 110 -1.479 9.028 8.076 891 HD1 HIS 110 HD1 HIS 110 -0.769 8.700 11.808 892 HD2 HIS 110 HD2 HIS 110 -3.795 9.829 9.195 893 HE1 HIS 110 HE1 HIS 110 -2.710 9.348 13.269 894 HE2 HIS 110 HE2 HIS 110 -4.560 9.936 11.664 895 H MET 111 HN MET 111 -0.999 6.018 6.975 896 HA MET 111 HA MET 111 1.165 6.914 5.373 897 1HB MET 111 HB2 MET 111 2.408 4.826 5.216 898 2HB MET 111 HB1 MET 111 2.425 5.446 6.861 899 1HG MET 111 HG2 MET 111 0.760 3.844 7.531 900 2HG MET 111 HG1 MET 111 0.596 3.274 5.871 901 1HE MET 111 HE1 MET 111 3.911 1.484 5.162 902 2HE MET 111 HE2 MET 111 3.879 3.242 5.015 903 3HE MET 111 HE3 MET 111 2.483 2.289 4.512 904 H MET 112 HN MET 112 0.605 6.747 3.341 905 HA MET 112 HA MET 112 -1.684 5.086 2.618 906 1HB MET 112 HB2 MET 112 -0.423 7.541 1.443 907 2HB MET 112 HB1 MET 112 -1.470 6.529 0.462 908 1HG MET 112 HG2 MET 112 -2.669 8.415 1.432 909 2HG MET 112 HG1 MET 112 -3.300 6.875 1.999 910 1HE MET 112 HE1 MET 112 -4.377 8.946 3.193 911 2HE MET 112 HE2 MET 112 -3.749 9.664 4.676 912 3HE MET 112 HE3 MET 112 -4.411 8.030 4.700 913 H ARG 113 HN ARG 113 -1.652 3.837 0.681 914 HA ARG 113 HA ARG 113 0.926 3.358 -0.579 915 1HB ARG 113 HB2 ARG 113 0.637 1.782 1.441 916 2HB ARG 113 HB1 ARG 113 -0.625 1.003 0.495 917 1HG ARG 113 HG2 ARG 113 0.973 0.479 -1.252 918 2HG ARG 113 HG1 ARG 113 2.245 1.309 -0.356 919 1HD ARG 113 HD2 ARG 113 0.744 -1.145 0.545 920 2HD ARG 113 HD1 ARG 113 2.394 -1.106 -0.063 921 HE ARG 113 HE ARG 113 3.102 -0.305 1.978 922 1HH1 ARG 113 HH11 ARG 113 -0.390 -0.329 1.874 923 2HH1 ARG 113 HH12 ARG 113 -0.565 -0.014 3.565 924 1HH2 ARG 113 HH21 ARG 113 2.869 0.091 4.205 925 2HH2 ARG 113 HH22 ARG 113 1.285 0.224 4.890 926 H LEU 114 HN LEU 114 0.706 2.580 -2.709 927 HA LEU 114 HA LEU 114 -2.064 2.161 -3.624 928 1HB LEU 114 HB2 LEU 114 -1.254 4.493 -4.032 929 2HB LEU 114 HB1 LEU 114 0.002 3.829 -5.055 930 HG LEU 114 HG LEU 114 -2.958 3.543 -5.581 931 1HD1 LEU 114 HD11 LEU 114 -1.128 5.236 -7.213 932 2HD1 LEU 114 HD12 LEU 114 -1.785 5.880 -5.708 933 3HD1 LEU 114 HD13 LEU 114 -2.874 5.351 -6.991 934 1HD2 LEU 114 HD21 LEU 114 -0.493 2.613 -6.973 935 2HD2 LEU 114 HD22 LEU 114 -1.895 3.084 -7.933 936 3HD2 LEU 114 HD23 LEU 114 -2.037 1.792 -6.742 937 H TYR 115 HN TYR 115 -2.261 0.273 -4.609 938 HA TYR 115 HA TYR 115 0.111 -0.979 -5.799 939 1HB TYR 115 HB2 TYR 115 -2.554 -2.161 -4.997 940 2HB TYR 115 HB1 TYR 115 -1.243 -3.064 -5.736 941 HD1 TYR 115 HD1 TYR 115 -1.516 -0.635 -2.909 942 HD2 TYR 115 HD2 TYR 115 -0.156 -4.436 -4.231 943 HE1 TYR 115 HE1 TYR 115 -0.589 -1.072 -0.682 944 HE2 TYR 115 HE2 TYR 115 0.777 -4.888 -2.006 945 HH TYR 115 HH TYR 115 0.070 -3.819 0.535 946 H SER 116 HN SER 116 0.344 -0.837 -7.933 947 HA SER 116 HA SER 116 -2.028 -0.410 -9.600 948 1HB SER 116 HB2 SER 116 -0.423 0.204 -11.379 949 2HB SER 116 HB1 SER 116 -0.184 1.180 -9.930 950 HG SER 116 HG SER 116 1.366 -1.001 -10.847 951 H ARG 117 HN ARG 117 -2.848 -2.017 -10.781 952 HA ARG 117 HA ARG 117 -1.762 -4.633 -10.635 953 1HB ARG 117 HB2 ARG 117 -4.000 -3.502 -12.317 954 2HB ARG 117 HB1 ARG 117 -3.574 -5.208 -12.288 955 1HG ARG 117 HG2 ARG 117 -5.292 -5.138 -10.770 956 2HG ARG 117 HG1 ARG 117 -3.891 -4.963 -9.714 957 1HD ARG 117 HD2 ARG 117 -4.263 -2.427 -10.028 958 2HD ARG 117 HD1 ARG 117 -5.862 -2.887 -10.599 959 HE ARG 117 HE ARG 117 -6.454 -3.206 -8.432 960 1HH1 ARG 117 HH11 ARG 117 -2.987 -3.540 -8.660 961 2HH1 ARG 117 HH12 ARG 117 -2.770 -3.737 -6.953 962 1HH2 ARG 117 HH21 ARG 117 -6.166 -3.459 -6.190 963 2HH2 ARG 117 HH22 ARG 117 -4.572 -3.686 -5.553 964 H SER 118 HN SER 118 -1.619 -2.083 -13.008 965 HA SER 118 HA SER 118 0.250 -3.725 -14.578 966 1HB SER 118 HB2 SER 118 -1.841 -3.525 -15.831 967 2HB SER 118 HB1 SER 118 -1.800 -1.771 -15.651 968 HG SER 118 HG SER 118 -0.252 -3.440 -17.274 969 HA PRO 119 HA PRO 119 3.419 -0.688 -14.044 970 1HB PRO 119 HB2 PRO 119 3.445 -0.626 -17.040 971 2HB PRO 119 HB1 PRO 119 4.800 -0.743 -15.910 972 1HG PRO 119 HG2 PRO 119 3.889 -2.898 -17.204 973 2HG PRO 119 HG1 PRO 119 4.464 -2.999 -15.530 974 1HD PRO 119 HD2 PRO 119 1.704 -3.151 -16.588 975 2HD PRO 119 HD1 PRO 119 2.379 -3.817 -15.090 976 H GLU 120 HN GLU 120 0.917 -0.168 -16.450 977 HA GLU 120 HA GLU 120 1.202 2.689 -16.521 978 1HB GLU 120 HB2 GLU 120 0.399 1.487 -18.482 979 2HB GLU 120 HB1 GLU 120 -0.960 0.851 -17.567 980 1HG GLU 120 HG2 GLU 120 -1.698 2.647 -18.981 981 2HG GLU 120 HG1 GLU 120 -1.822 3.132 -17.292 982 H VAL 121 HN VAL 121 -0.119 4.223 -15.574 983 HA VAL 121 HA VAL 121 -2.214 3.281 -13.754 984 HB VAL 121 HB VAL 121 -0.016 5.198 -12.944 985 1HG1 VAL 121 HG11 VAL 121 -1.914 6.022 -11.869 986 2HG1 VAL 121 HG12 VAL 121 -1.207 4.935 -10.674 987 3HG1 VAL 121 HG13 VAL 121 -2.595 4.412 -11.629 988 1HG2 VAL 121 HG21 VAL 121 -0.664 2.365 -12.173 989 2HG2 VAL 121 HG22 VAL 121 0.336 3.412 -11.166 990 3HG2 VAL 121 HG23 VAL 121 0.850 3.012 -12.804 991 H SER 122 HN SER 122 -3.996 4.236 -14.407 992 HA SER 122 HA SER 122 -4.158 6.451 -16.092 993 1HB SER 122 HB2 SER 122 -5.984 4.804 -15.786 994 2HB SER 122 HB1 SER 122 -6.266 5.444 -14.167 995 HG SER 122 HG SER 122 -7.140 7.213 -14.992 996 HA PRO 123 HA PRO 123 -3.488 10.068 -13.649 997 1HB PRO 123 HB2 PRO 123 -5.671 11.556 -14.588 998 2HB PRO 123 HB1 PRO 123 -4.060 11.517 -15.312 999 1HG PRO 123 HG2 PRO 123 -6.518 10.005 -16.070 1000 2HG PRO 123 HG1 PRO 123 -5.265 10.707 -17.111 1001 1HD PRO 123 HD2 PRO 123 -5.344 8.084 -16.649 1002 2HD PRO 123 HD1 PRO 123 -3.791 8.945 -16.723 1003 H ALA 124 HN ALA 124 -6.722 8.688 -13.885 1004 HA ALA 124 HA ALA 124 -7.888 10.018 -11.699 1005 1HB ALA 124 HB1 ALA 124 -9.681 8.976 -12.493 1006 2HB ALA 124 HB2 ALA 124 -9.041 7.431 -11.931 1007 3HB ALA 124 HB3 ALA 124 -8.661 8.007 -13.554 1008 H ALA 125 HN ALA 125 -6.422 6.785 -11.933 1009 HA ALA 125 HA ALA 125 -6.777 5.949 -9.340 1010 1HB ALA 125 HB1 ALA 125 -5.497 4.233 -9.943 1011 2HB ALA 125 HB2 ALA 125 -4.135 5.268 -10.372 1012 3HB ALA 125 HB3 ALA 125 -5.440 4.997 -11.528 1013 H THR 126 HN THR 126 -4.013 7.786 -10.623 1014 HA THR 126 HA THR 126 -2.807 8.092 -8.048 1015 HB THR 126 HB THR 126 -1.250 9.609 -9.200 1016 HG1 THR 126 HG1 THR 126 -1.551 10.168 -11.291 1017 1HG2 THR 126 HG21 THR 126 -1.074 7.791 -11.307 1018 2HG2 THR 126 HG22 THR 126 -1.702 6.881 -9.933 1019 3HG2 THR 126 HG23 THR 126 -0.186 7.772 -9.786 1020 H ALA 127 HN ALA 127 -4.528 10.329 -10.229 1021 HA ALA 127 HA ALA 127 -4.391 12.543 -8.478 1022 1HB ALA 127 HB1 ALA 127 -4.881 12.522 -10.990 1023 2HB ALA 127 HB2 ALA 127 -5.756 13.679 -9.986 1024 3HB ALA 127 HB3 ALA 127 -6.549 12.198 -10.526 1025 H ILE 128 HN ILE 128 -7.136 10.372 -9.225 1026 HA ILE 128 HA ILE 128 -8.919 11.457 -7.403 1027 HB ILE 128 HB ILE 128 -8.740 8.560 -8.248 1028 1HG1 ILE 128 HG12 ILE 128 -10.460 10.824 -9.291 1029 2HG1 ILE 128 HG11 ILE 128 -9.048 10.167 -10.108 1030 1HG2 ILE 128 HG21 ILE 128 -11.389 9.398 -7.603 1031 2HG2 ILE 128 HG22 ILE 128 -10.330 9.753 -6.241 1032 3HG2 ILE 128 HG23 ILE 128 -10.425 8.111 -6.875 1033 1HD1 ILE 128 HD11 ILE 128 -11.587 8.674 -9.490 1034 2HD1 ILE 128 HD12 ILE 128 -10.167 8.008 -10.295 1035 3HD1 ILE 128 HD13 ILE 128 -11.092 9.296 -11.066 1036 H PHE 129 HN PHE 129 -6.355 9.061 -6.891 1037 HA PHE 129 HA PHE 129 -7.070 8.341 -4.272 1038 1HB PHE 129 HB2 PHE 129 -5.289 7.169 -5.553 1039 2HB PHE 129 HB1 PHE 129 -4.262 8.589 -5.390 1040 HD1 PHE 129 HD1 PHE 129 -2.472 7.701 -4.127 1041 HD2 PHE 129 HD2 PHE 129 -6.478 7.158 -2.794 1042 HE1 PHE 129 HE1 PHE 129 -1.638 6.865 -1.966 1043 HE2 PHE 129 HE2 PHE 129 -5.650 6.322 -0.634 1044 HZ PHE 129 HZ PHE 129 -3.230 6.176 -0.217 1045 H ARG 130 HN ARG 130 -5.181 10.993 -5.578 1046 HA ARG 130 HA ARG 130 -4.486 12.151 -3.068 1047 1HB ARG 130 HB2 ARG 130 -3.173 12.625 -5.070 1048 2HB ARG 130 HB1 ARG 130 -4.582 13.310 -5.864 1049 1HG ARG 130 HG2 ARG 130 -4.624 15.129 -4.237 1050 2HG ARG 130 HG1 ARG 130 -3.214 14.443 -3.429 1051 1HD ARG 130 HD2 ARG 130 -1.884 14.753 -5.444 1052 2HD ARG 130 HD1 ARG 130 -3.296 15.366 -6.302 1053 HE ARG 130 HE ARG 130 -1.575 16.842 -4.612 1054 1HH1 ARG 130 HH11 ARG 130 -4.941 16.541 -5.499 1055 2HH1 ARG 130 HH12 ARG 130 -5.319 18.180 -5.092 1056 1HH2 ARG 130 HH21 ARG 130 -2.075 18.998 -4.088 1057 2HH2 ARG 130 HH22 ARG 130 -3.695 19.574 -4.295 1058 H LYS 131 HN LYS 131 -7.080 12.536 -5.407 1059 HA LYS 131 HA LYS 131 -8.311 14.810 -4.268 1060 1HB LYS 131 HB2 LYS 131 -8.754 13.965 -6.567 1061 2HB LYS 131 HB1 LYS 131 -9.595 12.591 -5.867 1062 1HG LYS 131 HG2 LYS 131 -11.265 14.062 -4.905 1063 2HG LYS 131 HG1 LYS 131 -10.406 15.471 -5.528 1064 1HD LYS 131 HD2 LYS 131 -12.287 14.920 -6.966 1065 2HD LYS 131 HD1 LYS 131 -10.765 14.664 -7.820 1066 1HE LYS 131 HE2 LYS 131 -10.910 12.264 -7.345 1067 2HE LYS 131 HE1 LYS 131 -12.438 12.527 -6.504 1068 1HZ LYS 131 HZ1 LYS 131 -13.206 11.960 -8.551 1069 2HZ LYS 131 HZ2 LYS 131 -11.864 12.581 -9.372 1070 3HZ LYS 131 HZ3 LYS 131 -13.059 13.628 -8.792 1071 H LEU 132 HN LEU 132 -9.041 11.332 -3.966 1072 HA LEU 132 HA LEU 132 -11.100 11.635 -2.063 1073 1HB LEU 132 HB2 LEU 132 -10.835 9.256 -1.625 1074 2HB LEU 132 HB1 LEU 132 -10.826 9.579 -3.347 1075 HG LEU 132 HG LEU 132 -8.273 9.474 -3.189 1076 1HD1 LEU 132 HD11 LEU 132 -7.959 7.672 -1.136 1077 2HD1 LEU 132 HD12 LEU 132 -8.998 8.909 -0.429 1078 3HD1 LEU 132 HD13 LEU 132 -7.440 9.355 -1.124 1079 1HD2 LEU 132 HD21 LEU 132 -8.933 7.645 -4.301 1080 2HD2 LEU 132 HD22 LEU 132 -10.260 7.326 -3.185 1081 3HD2 LEU 132 HD23 LEU 132 -8.624 6.804 -2.782 1082 H ALA 133 HN ALA 133 -7.629 11.427 -1.836 1083 HA ALA 133 HA ALA 133 -7.342 10.937 0.901 1084 1HB ALA 133 HB1 ALA 133 -5.655 11.608 -1.260 1085 2HB ALA 133 HB2 ALA 133 -5.191 11.036 0.340 1086 3HB ALA 133 HB3 ALA 133 -5.327 12.766 0.025 1087 H GLY 134 HN GLY 134 -7.675 13.990 -0.889 1088 1HA GLY 134 HA2 GLY 134 -7.407 15.728 1.292 1089 2HA GLY 134 HA1 GLY 134 -8.280 16.093 -0.188 1090 H GLU 135 HN GLU 135 -10.383 14.394 -0.148 1091 HA GLU 135 HA GLU 135 -12.162 15.609 1.647 1092 1HB GLU 135 HB2 GLU 135 -12.515 12.964 0.220 1093 2HB GLU 135 HB1 GLU 135 -13.799 13.959 0.896 1094 1HG GLU 135 HG2 GLU 135 -11.993 14.698 -1.394 1095 2HG GLU 135 HG1 GLU 135 -13.682 14.206 -1.508 1096 H ARG 136 HN ARG 136 -10.571 12.452 1.703 1097 HA ARG 136 HA ARG 136 -11.662 11.763 4.293 1098 1HB ARG 136 HB2 ARG 136 -11.016 10.187 2.289 1099 2HB ARG 136 HB1 ARG 136 -9.401 10.295 2.974 1100 1HG ARG 136 HG2 ARG 136 -11.857 9.317 4.410 1101 2HG ARG 136 HG1 ARG 136 -10.580 8.306 3.736 1102 1HD ARG 136 HD2 ARG 136 -8.963 9.349 5.257 1103 2HD ARG 136 HD1 ARG 136 -10.252 10.343 5.938 1104 HE ARG 136 HE ARG 136 -9.644 7.672 6.630 1105 1HH1 ARG 136 HH11 ARG 136 -12.344 9.837 6.170 1106 2HH1 ARG 136 HH12 ARG 136 -13.404 8.931 7.196 1107 1HH2 ARG 136 HH21 ARG 136 -11.035 6.482 7.978 1108 2HH2 ARG 136 HH22 ARG 136 -12.661 7.028 8.225 1109 H ASN 137 HN ASN 137 -10.543 14.043 4.820 1110 HA ASN 137 HA ASN 137 -9.063 15.125 6.155 1111 1HB ASN 137 HB2 ASN 137 -8.073 12.331 6.754 1112 2HB ASN 137 HB1 ASN 137 -7.542 13.779 7.598 1113 1HD2 ASN 137 HD21 ASN 137 -10.679 14.400 6.945 1114 2HD2 ASN 137 HD22 ASN 137 -11.411 13.766 8.374 1115 H TYR 138 HN TYR 138 -7.321 16.273 5.634 1116 HA TYR 138 HA TYR 138 -6.015 16.037 3.255 1117 1HB TYR 138 HB2 TYR 138 -5.343 17.443 5.787 1118 2HB TYR 138 HB1 TYR 138 -4.102 17.346 4.543 1119 HD1 TYR 138 HD1 TYR 138 -3.931 19.483 3.708 1120 HD2 TYR 138 HD2 TYR 138 -7.786 17.750 4.170 1121 HE1 TYR 138 HE1 TYR 138 -4.923 21.408 2.550 1122 HE2 TYR 138 HE2 TYR 138 -8.794 19.673 3.012 1123 HH TYR 138 HH TYR 138 -7.527 21.563 1.132 1124 H THR 139 HN THR 139 -4.865 14.456 2.455 1125 HA THR 139 HA THR 139 -3.143 12.805 4.118 1126 HB THR 139 HB THR 139 -3.856 12.767 1.190 1127 HG1 THR 139 HG1 THR 139 -5.063 11.747 3.178 1128 1HG2 THR 139 HG21 THR 139 -1.904 11.802 0.773 1129 2HG2 THR 139 HG22 THR 139 -2.570 10.409 1.624 1130 3HG2 THR 139 HG23 THR 139 -1.549 11.564 2.482 1131 H ASP 140 HN ASP 140 -2.964 15.348 1.730 1132 HA ASP 140 HA ASP 140 -0.286 15.314 1.064 1133 1HB ASP 140 HB2 ASP 140 -0.510 17.713 0.597 1134 2HB ASP 140 HB1 ASP 140 -1.901 16.817 0.002 1135 H GLU 141 HN GLU 141 -1.830 16.269 4.021 1136 HA GLU 141 HA GLU 141 -0.126 17.902 5.334 1137 1HB GLU 141 HB2 GLU 141 -2.095 16.934 6.373 1138 2HB GLU 141 HB1 GLU 141 -1.357 15.343 6.366 1139 1HG GLU 141 HG2 GLU 141 0.330 16.101 7.942 1140 2HG GLU 141 HG1 GLU 141 -0.381 17.714 7.931 1141 H MET 142 HN MET 142 0.388 14.551 4.513 1142 HA MET 142 HA MET 142 3.235 14.872 4.676 1143 1HB MET 142 HB2 MET 142 1.937 12.691 6.318 1144 2HB MET 142 HB1 MET 142 3.656 12.960 6.108 1145 1HG MET 142 HG2 MET 142 1.805 14.918 7.435 1146 2HG MET 142 HG1 MET 142 2.760 13.716 8.297 1147 1HE MET 142 HE1 MET 142 4.243 17.296 8.973 1148 2HE MET 142 HE2 MET 142 4.524 15.749 9.771 1149 3HE MET 142 HE3 MET 142 2.884 16.231 9.335 1150 H VAL 143 HN VAL 143 3.890 14.042 2.828 1151 HA VAL 143 HA VAL 143 2.237 11.991 1.527 1152 HB VAL 143 HB VAL 143 4.275 13.839 0.274 1153 1HG1 VAL 143 HG11 VAL 143 4.079 12.158 -1.269 1154 2HG1 VAL 143 HG12 VAL 143 2.783 13.235 -1.789 1155 3HG1 VAL 143 HG13 VAL 143 2.406 11.801 -0.835 1156 1HG2 VAL 143 HG21 VAL 143 2.749 15.452 0.031 1157 2HG2 VAL 143 HG22 VAL 143 1.874 14.625 1.320 1158 3HG2 VAL 143 HG23 VAL 143 1.463 14.307 -0.363 1159 H ALA 144 HN ALA 144 3.592 10.747 -0.164 1160 HA ALA 144 HA ALA 144 6.275 10.042 0.435 1161 1HB ALA 144 HB1 ALA 144 4.249 7.859 0.935 1162 2HB ALA 144 HB2 ALA 144 4.933 8.829 2.240 1163 3HB ALA 144 HB3 ALA 144 5.986 7.829 1.242 1164 H MET 145 HN MET 145 7.037 9.757 -1.622 1165 HA MET 145 HA MET 145 5.229 8.428 -3.535 1166 1HB MET 145 HB2 MET 145 6.260 9.907 -5.296 1167 2HB MET 145 HB1 MET 145 5.190 10.704 -4.151 1168 1HG MET 145 HG2 MET 145 7.248 11.371 -2.868 1169 2HG MET 145 HG1 MET 145 8.190 10.780 -4.234 1170 1HE MET 145 HE1 MET 145 5.387 12.959 -3.049 1171 2HE MET 145 HE2 MET 145 4.651 12.946 -4.652 1172 3HE MET 145 HE3 MET 145 5.436 14.408 -4.053 1173 H LEU 146 HN LEU 146 6.121 7.254 -5.221 1174 HA LEU 146 HA LEU 146 7.963 5.387 -4.777 1175 1HB LEU 146 HB2 LEU 146 6.655 5.400 -6.763 1176 2HB LEU 146 HB1 LEU 146 7.421 6.860 -7.341 1177 HG LEU 146 HG LEU 146 9.556 5.592 -7.577 1178 1HD1 LEU 146 HD11 LEU 146 8.300 3.703 -6.007 1179 2HD1 LEU 146 HD12 LEU 146 9.819 3.499 -6.880 1180 3HD1 LEU 146 HD13 LEU 146 8.303 2.978 -7.614 1181 1HD2 LEU 146 HD21 LEU 146 7.340 5.658 -9.247 1182 2HD2 LEU 146 HD22 LEU 146 7.856 3.971 -9.270 1183 3HD2 LEU 146 HD23 LEU 146 8.993 5.248 -9.703 1184 HA PRO 147 HA PRO 147 11.912 7.394 -4.147 1185 1HB PRO 147 HB2 PRO 147 12.959 4.728 -4.933 1186 2HB PRO 147 HB1 PRO 147 13.282 5.681 -3.481 1187 1HG PRO 147 HG2 PRO 147 11.719 3.519 -3.393 1188 2HG PRO 147 HG1 PRO 147 11.363 4.956 -2.416 1189 1HD PRO 147 HD2 PRO 147 10.076 4.009 -4.940 1190 2HD PRO 147 HD1 PRO 147 9.342 4.783 -3.522 1191 H ARG 148 HN ARG 148 13.922 7.714 -5.368 1192 HA ARG 148 HA ARG 148 13.364 8.181 -8.127 1193 1HB ARG 148 HB2 ARG 148 15.872 8.571 -6.484 1194 2HB ARG 148 HB1 ARG 148 15.710 9.072 -8.163 1195 1HG ARG 148 HG2 ARG 148 13.894 10.571 -7.555 1196 2HG ARG 148 HG1 ARG 148 14.026 10.060 -5.872 1197 1HD ARG 148 HD2 ARG 148 16.262 10.968 -5.731 1198 2HD ARG 148 HD1 ARG 148 16.242 11.362 -7.447 1199 HE ARG 148 HE ARG 148 15.170 12.926 -5.338 1200 1HH1 ARG 148 HH11 ARG 148 14.611 12.024 -8.664 1201 2HH1 ARG 148 HH12 ARG 148 13.716 13.459 -9.033 1202 1HH2 ARG 148 HH21 ARG 148 13.988 14.818 -5.830 1203 2HH2 ARG 148 HH22 ARG 148 13.364 15.042 -7.430 1204 H GLN 149 HN GLN 149 16.567 7.397 -8.141 1205 HA GLN 149 HA GLN 149 16.146 5.147 -9.835 1206 1HB GLN 149 HB2 GLN 149 18.678 6.366 -8.729 1207 2HB GLN 149 HB1 GLN 149 18.640 5.075 -9.921 1208 1HG GLN 149 HG2 GLN 149 19.013 7.187 -11.010 1209 2HG GLN 149 HG1 GLN 149 17.431 6.555 -11.462 1210 1HE2 GLN 149 HE21 GLN 149 15.866 7.979 -11.464 1211 2HE2 GLN 149 HE22 GLN 149 15.781 9.412 -10.503 1212 H GLU 150 HN GLU 150 17.632 3.157 -9.497 1213 HA GLU 150 HA GLU 150 16.683 1.707 -7.313 1214 1HB GLU 150 HB2 GLU 150 18.405 0.006 -7.857 1215 2HB GLU 150 HB1 GLU 150 17.457 0.511 -9.245 1216 1HG GLU 150 HG2 GLU 150 20.182 1.615 -8.628 1217 2HG GLU 150 HG1 GLU 150 19.918 0.183 -9.618 1218 H GLU 151 HN GLU 151 17.134 3.426 -5.712 1219 HA GLU 151 HA GLU 151 19.101 2.628 -3.891 1220 1HB GLU 151 HB2 GLU 151 20.687 4.467 -4.003 1221 2HB GLU 151 HB1 GLU 151 20.627 3.662 -5.564 1222 1HG GLU 151 HG2 GLU 151 19.226 5.405 -6.460 1223 2HG GLU 151 HG1 GLU 151 19.158 6.190 -4.885 1224 H CYS 152 HN CYS 152 18.565 3.404 -1.911 1225 HA CYS 152 HA CYS 152 16.194 4.740 -1.439 1226 1HB CYS 152 HB2 CYS 152 18.662 4.390 0.256 1227 2HB CYS 152 HB1 CYS 152 17.215 5.188 0.869 1228 H THR 153 HN THR 153 15.935 6.607 -2.645 1229 HA THR 153 HA THR 153 16.887 9.028 -1.483 1230 HB THR 153 HB THR 153 18.908 8.461 -2.790 1231 HG1 THR 153 HG1 THR 153 17.449 10.631 -3.896 1232 1HG2 THR 153 HG21 THR 153 17.468 8.951 -5.342 1233 2HG2 THR 153 HG22 THR 153 17.465 7.328 -4.658 1234 3HG2 THR 153 HG23 THR 153 18.993 8.118 -5.047 1235 H VAL 154 HN VAL 154 14.417 8.667 -1.556 1236 HA VAL 154 HA VAL 154 13.066 9.160 -4.016 1237 HB VAL 154 HB VAL 154 12.003 7.953 -2.161 1238 1HG1 VAL 154 HG11 VAL 154 12.454 8.786 -0.128 1239 2HG1 VAL 154 HG12 VAL 154 11.011 9.754 -0.414 1240 3HG1 VAL 154 HG13 VAL 154 12.604 10.442 -0.717 1241 1HG2 VAL 154 HG21 VAL 154 10.451 8.757 -3.679 1242 2HG2 VAL 154 HG22 VAL 154 10.721 10.439 -3.223 1243 3HG2 VAL 154 HG23 VAL 154 9.845 9.359 -2.138 1244 H ASP 155 HN ASP 155 12.082 11.038 -4.766 1245 HA ASP 155 HA ASP 155 13.396 13.460 -4.373 1246 1HB ASP 155 HB2 ASP 155 11.504 14.476 -5.611 1247 2HB ASP 155 HB1 ASP 155 12.075 12.998 -6.376 1248 H GLU 156 HN GLU 156 11.583 15.449 -3.998 1249 HA GLU 156 HA GLU 156 10.813 16.800 -2.350 1250 1HB GLU 156 HB2 GLU 156 8.887 15.971 -1.099 1251 2HB GLU 156 HB1 GLU 156 8.790 15.524 -2.795 1252 1HG GLU 156 HG2 GLU 156 9.442 13.265 -2.286 1253 2HG GLU 156 HG1 GLU 156 9.713 13.688 -0.595 1254 H VAL 157 HN VAL 157 11.517 17.599 -0.490 1255 HA VAL 157 HA VAL 157 12.876 17.788 1.337 1256 HB VAL 157 HB VAL 157 12.188 16.457 3.267 1257 1HG1 VAL 157 HG11 VAL 157 10.728 18.310 2.020 1258 2HG1 VAL 157 HG12 VAL 157 10.194 17.510 3.499 1259 3HG1 VAL 157 HG13 VAL 157 9.595 16.962 1.934 1260 1HG2 VAL 157 HG21 VAL 157 10.637 14.653 3.130 1261 2HG2 VAL 157 HG22 VAL 157 11.943 14.309 1.995 1262 3HG2 VAL 157 HG23 VAL 157 10.395 14.912 1.402 Start of MODEL 16 1 1H MET 1 HT1 MET 1 -19.438 -14.246 -23.194 2 2H MET 1 HT2 MET 1 -20.712 -13.180 -22.878 3 3H MET 1 HT3 MET 1 -20.963 -14.849 -22.776 4 HA MET 1 HA MET 1 -20.794 -13.953 -20.575 5 1HB MET 1 HB2 MET 1 -18.321 -15.476 -21.426 6 2HB MET 1 HB1 MET 1 -18.923 -15.356 -19.778 7 1HG MET 1 HG2 MET 1 -20.970 -16.510 -20.440 8 2HG MET 1 HG1 MET 1 -20.368 -16.629 -22.092 9 1HE MET 1 HE1 MET 1 -19.815 -17.761 -18.353 10 2HE MET 1 HE2 MET 1 -18.297 -16.975 -18.787 11 3HE MET 1 HE3 MET 1 -18.340 -18.715 -18.509 12 H THR 2 HN THR 2 -20.006 -12.437 -19.218 13 HA THR 2 HA THR 2 -17.393 -11.280 -19.555 14 HB THR 2 HB THR 2 -18.220 -8.960 -19.868 15 HG1 THR 2 HG1 THR 2 -20.703 -10.267 -20.258 16 1HG2 THR 2 HG21 THR 2 -19.213 -10.713 -22.096 17 2HG2 THR 2 HG22 THR 2 -17.516 -10.310 -21.837 18 3HG2 THR 2 HG23 THR 2 -18.680 -9.035 -22.197 19 H VAL 3 HN VAL 3 -18.599 -12.670 -17.450 20 HA VAL 3 HA VAL 3 -19.613 -10.864 -15.475 21 HB VAL 3 HB VAL 3 -18.512 -13.652 -15.093 22 1HG1 VAL 3 HG11 VAL 3 -18.689 -12.250 -13.041 23 2HG1 VAL 3 HG12 VAL 3 -19.717 -13.683 -13.021 24 3HG1 VAL 3 HG13 VAL 3 -20.418 -12.099 -13.349 25 1HG2 VAL 3 HG21 VAL 3 -20.610 -13.051 -16.664 26 2HG2 VAL 3 HG22 VAL 3 -21.422 -13.169 -15.104 27 3HG2 VAL 3 HG23 VAL 3 -20.494 -14.536 -15.720 28 HA PRO 4 HA PRO 4 -15.814 -9.099 -13.998 29 1HB PRO 4 HB2 PRO 4 -17.140 -9.233 -11.338 30 2HB PRO 4 HB1 PRO 4 -16.412 -7.852 -12.164 31 1HG PRO 4 HG2 PRO 4 -19.059 -8.101 -12.006 32 2HG PRO 4 HG1 PRO 4 -18.287 -7.482 -13.478 33 1HD PRO 4 HD2 PRO 4 -19.445 -10.183 -12.935 34 2HD PRO 4 HD1 PRO 4 -19.481 -9.217 -14.424 35 H ASP 5 HN ASP 5 -14.599 -11.058 -14.329 36 HA ASP 5 HA ASP 5 -14.556 -13.219 -12.545 37 1HB ASP 5 HB2 ASP 5 -13.579 -13.343 -14.787 38 2HB ASP 5 HB1 ASP 5 -12.346 -12.173 -14.329 39 H ARG 6 HN ARG 6 -13.770 -13.443 -10.562 40 HA ARG 6 HA ARG 6 -12.612 -11.264 -9.166 41 1HB ARG 6 HB2 ARG 6 -12.812 -14.183 -8.397 42 2HB ARG 6 HB1 ARG 6 -12.369 -12.878 -7.304 43 1HG ARG 6 HG2 ARG 6 -14.562 -11.848 -7.657 44 2HG ARG 6 HG1 ARG 6 -15.006 -13.176 -8.728 45 1HD ARG 6 HD2 ARG 6 -15.933 -13.537 -6.517 46 2HD ARG 6 HD1 ARG 6 -14.711 -14.756 -6.873 47 HE ARG 6 HE ARG 6 -13.574 -14.024 -5.048 48 1HH1 ARG 6 HH11 ARG 6 -15.608 -11.407 -6.152 49 2HH1 ARG 6 HH12 ARG 6 -15.121 -10.333 -4.885 50 1HH2 ARG 6 HH21 ARG 6 -12.946 -12.613 -3.378 51 2HH2 ARG 6 HH22 ARG 6 -13.614 -11.016 -3.310 52 H SER 7 HN SER 7 -11.324 -14.068 -10.795 53 HA SER 7 HA SER 7 -8.769 -14.216 -9.757 54 1HB SER 7 HB2 SER 7 -9.658 -15.847 -11.358 55 2HB SER 7 HB1 SER 7 -9.617 -14.630 -12.634 56 HG SER 7 HG SER 7 -7.588 -15.063 -12.908 57 H GLU 8 HN GLU 8 -10.120 -11.864 -11.965 58 HA GLU 8 HA GLU 8 -7.907 -10.782 -13.167 59 1HB GLU 8 HB2 GLU 8 -9.116 -8.724 -13.378 60 2HB GLU 8 HB1 GLU 8 -10.275 -10.040 -13.499 61 1HG GLU 8 HG2 GLU 8 -10.809 -9.678 -11.084 62 2HG GLU 8 HG1 GLU 8 -9.789 -8.243 -11.139 63 H ILE 9 HN ILE 9 -9.089 -10.175 -9.890 64 HA ILE 9 HA ILE 9 -7.337 -8.150 -9.137 65 HB ILE 9 HB ILE 9 -8.367 -10.388 -7.383 66 1HG1 ILE 9 HG12 ILE 9 -10.197 -9.247 -8.538 67 2HG1 ILE 9 HG11 ILE 9 -10.197 -8.833 -6.828 68 1HG2 ILE 9 HG21 ILE 9 -8.206 -8.122 -5.848 69 2HG2 ILE 9 HG22 ILE 9 -6.765 -8.010 -6.858 70 3HG2 ILE 9 HG23 ILE 9 -7.034 -9.440 -5.862 71 1HD1 ILE 9 HD11 ILE 9 -8.758 -6.794 -7.705 72 2HD1 ILE 9 HD12 ILE 9 -10.521 -6.773 -7.713 73 3HD1 ILE 9 HD13 ILE 9 -9.637 -7.144 -9.193 74 H ALA 10 HN ALA 10 -6.915 -11.653 -9.150 75 HA ALA 10 HA ALA 10 -4.416 -11.748 -7.860 76 1HB ALA 10 HB1 ALA 10 -4.531 -13.967 -8.231 77 2HB ALA 10 HB2 ALA 10 -4.889 -13.765 -9.946 78 3HB ALA 10 HB3 ALA 10 -6.178 -13.608 -8.752 79 H GLY 11 HN GLY 11 -2.410 -11.222 -8.547 80 1HA GLY 11 HA2 GLY 11 -1.258 -11.607 -10.986 81 2HA GLY 11 HA1 GLY 11 -2.094 -10.075 -11.174 82 H LYS 12 HN LYS 12 -0.237 -8.859 -11.420 83 HA LYS 12 HA LYS 12 1.577 -8.779 -9.107 84 1HB LYS 12 HB2 LYS 12 3.323 -8.032 -10.500 85 2HB LYS 12 HB1 LYS 12 2.538 -9.324 -11.390 86 1HG LYS 12 HG2 LYS 12 2.132 -6.376 -11.862 87 2HG LYS 12 HG1 LYS 12 3.153 -7.442 -12.824 88 1HD LYS 12 HD2 LYS 12 0.155 -7.561 -12.528 89 2HD LYS 12 HD1 LYS 12 1.071 -7.129 -13.969 90 1HE LYS 12 HE2 LYS 12 1.070 -9.828 -12.622 91 2HE LYS 12 HE1 LYS 12 0.218 -9.415 -14.109 92 1HZ LYS 12 HZ1 LYS 12 2.667 -8.681 -14.772 93 2HZ LYS 12 HZ2 LYS 12 2.091 -10.252 -15.016 94 3HZ LYS 12 HZ3 LYS 12 3.054 -9.906 -13.670 95 H TRP 13 HN TRP 13 1.757 -7.017 -7.904 96 HA TRP 13 HA TRP 13 0.316 -4.577 -8.737 97 1HB TRP 13 HB2 TRP 13 0.831 -5.749 -5.996 98 2HB TRP 13 HB1 TRP 13 0.193 -4.132 -6.244 99 HD1 TRP 13 HD1 TRP 13 -1.264 -6.523 -8.698 100 HE1 TRP 13 HE1 TRP 13 -3.640 -7.192 -7.973 101 HE3 TRP 13 HE3 TRP 13 -1.229 -4.664 -3.933 102 HZ2 TRP 13 HZ2 TRP 13 -5.281 -6.964 -5.704 103 HZ3 TRP 13 HZ3 TRP 13 -3.246 -4.937 -2.551 104 HH2 TRP 13 HH2 TRP 13 -5.230 -6.065 -3.420 105 H TYR 14 HN TYR 14 1.549 -2.752 -9.018 106 HA TYR 14 HA TYR 14 4.316 -2.823 -8.007 107 1HB TYR 14 HB2 TYR 14 2.999 -1.193 -10.176 108 2HB TYR 14 HB1 TYR 14 4.596 -0.802 -9.547 109 HD1 TYR 14 HD1 TYR 14 2.968 -4.050 -10.450 110 HD2 TYR 14 HD2 TYR 14 6.182 -1.344 -11.118 111 HE1 TYR 14 HE1 TYR 14 3.986 -5.651 -12.013 112 HE2 TYR 14 HE2 TYR 14 7.206 -2.937 -12.685 113 HH TYR 14 HH TYR 14 7.175 -5.325 -13.162 114 H VAL 15 HN VAL 15 4.447 -1.973 -5.990 115 HA VAL 15 HA VAL 15 2.785 0.347 -5.381 116 HB VAL 15 HB VAL 15 2.441 -1.184 -3.696 117 1HG1 VAL 15 HG11 VAL 15 3.855 -2.925 -3.815 118 2HG1 VAL 15 HG12 VAL 15 4.653 -2.085 -2.484 119 3HG1 VAL 15 HG13 VAL 15 5.255 -1.908 -4.129 120 1HG2 VAL 15 HG21 VAL 15 3.477 -0.291 -1.659 121 2HG2 VAL 15 HG22 VAL 15 2.935 0.995 -2.737 122 3HG2 VAL 15 HG23 VAL 15 4.647 0.588 -2.643 123 H VAL 16 HN VAL 16 3.473 2.297 -5.170 124 HA VAL 16 HA VAL 16 6.188 2.935 -4.441 125 HB VAL 16 HB VAL 16 6.628 4.323 -6.434 126 1HG1 VAL 16 HG11 VAL 16 7.408 1.940 -6.210 127 2HG1 VAL 16 HG12 VAL 16 7.310 2.547 -7.863 128 3HG1 VAL 16 HG13 VAL 16 6.054 1.478 -7.241 129 1HG2 VAL 16 HG21 VAL 16 3.951 4.094 -6.965 130 2HG2 VAL 16 HG22 VAL 16 4.657 2.980 -8.130 131 3HG2 VAL 16 HG23 VAL 16 5.168 4.667 -8.103 132 H ALA 17 HN ALA 17 2.986 4.071 -5.455 133 HA ALA 17 HA ALA 17 3.364 6.734 -4.405 134 1HB ALA 17 HB1 ALA 17 1.627 7.166 -5.730 135 2HB ALA 17 HB2 ALA 17 0.599 6.100 -4.773 136 3HB ALA 17 HB3 ALA 17 1.523 5.450 -6.126 137 H LEU 18 HN LEU 18 2.742 7.514 -2.395 138 HA LEU 18 HA LEU 18 0.990 5.968 -0.683 139 1HB LEU 18 HB2 LEU 18 3.858 6.426 0.129 140 2HB LEU 18 HB1 LEU 18 2.604 5.803 1.172 141 HG LEU 18 HG LEU 18 2.420 3.895 -0.566 142 1HD1 LEU 18 HD11 LEU 18 4.393 5.449 -1.802 143 2HD1 LEU 18 HD12 LEU 18 3.864 3.829 -2.251 144 3HD1 LEU 18 HD13 LEU 18 5.229 4.038 -1.154 145 1HD2 LEU 18 HD21 LEU 18 4.414 4.380 1.564 146 2HD2 LEU 18 HD22 LEU 18 4.653 2.959 0.546 147 3HD2 LEU 18 HD23 LEU 18 3.151 3.155 1.450 148 H ALA 19 HN ALA 19 1.152 6.960 1.650 149 HA ALA 19 HA ALA 19 1.701 9.766 1.862 150 1HB ALA 19 HB1 ALA 19 -0.763 9.186 0.773 151 2HB ALA 19 HB2 ALA 19 -0.333 10.684 1.596 152 3HB ALA 19 HB3 ALA 19 -1.124 9.384 2.488 153 H SER 20 HN SER 20 2.683 9.673 3.862 154 HA SER 20 HA SER 20 1.244 8.107 5.921 155 1HB SER 20 HB2 SER 20 3.452 7.438 6.818 156 2HB SER 20 HB1 SER 20 3.167 6.855 5.176 157 HG SER 20 HG SER 20 5.183 7.720 5.151 158 H ASN 21 HN ASN 21 1.431 8.668 8.060 159 HA ASN 21 HA ASN 21 2.894 11.005 8.875 160 1HB ASN 21 HB2 ASN 21 0.763 12.013 9.915 161 2HB ASN 21 HB1 ASN 21 1.037 12.260 8.197 162 1HD2 ASN 21 HD21 ASN 21 -0.181 11.072 6.705 163 2HD2 ASN 21 HD22 ASN 21 -1.698 10.372 7.140 164 H THR 22 HN THR 22 3.731 10.566 10.758 165 HA THR 22 HA THR 22 2.408 9.606 13.018 166 HB THR 22 HB THR 22 2.138 7.525 11.813 167 HG1 THR 22 HG1 THR 22 2.818 6.305 13.407 168 1HG2 THR 22 HG21 THR 22 4.494 8.099 10.553 169 2HG2 THR 22 HG22 THR 22 3.639 6.558 10.488 170 3HG2 THR 22 HG23 THR 22 4.947 6.793 11.648 171 H GLU 23 HN GLU 23 3.687 9.904 14.771 172 HA GLU 23 HA GLU 23 6.186 11.152 14.515 173 1HB GLU 23 HB2 GLU 23 4.850 9.844 16.884 174 2HB GLU 23 HB1 GLU 23 6.380 10.700 17.002 175 1HG GLU 23 HG2 GLU 23 4.555 12.125 17.688 176 2HG GLU 23 HG1 GLU 23 5.299 12.746 16.216 177 H PHE 24 HN PHE 24 5.283 7.799 14.833 178 HA PHE 24 HA PHE 24 7.956 6.891 15.426 179 1HB PHE 24 HB2 PHE 24 5.441 5.398 14.663 180 2HB PHE 24 HB1 PHE 24 6.967 4.613 15.041 181 HD1 PHE 24 HD1 PHE 24 6.853 3.553 17.049 182 HD2 PHE 24 HD2 PHE 24 5.021 7.375 16.663 183 HE1 PHE 24 HE1 PHE 24 6.231 3.492 19.427 184 HE2 PHE 24 HE2 PHE 24 4.403 7.323 19.040 185 HZ PHE 24 HZ PHE 24 5.005 5.380 20.426 186 H PHE 25 HN PHE 25 7.240 8.398 12.824 187 HA PHE 25 HA PHE 25 7.457 6.653 10.658 188 1HB PHE 25 HB2 PHE 25 8.054 8.574 9.331 189 2HB PHE 25 HB1 PHE 25 6.834 9.065 10.499 190 HD1 PHE 25 HD1 PHE 25 7.173 10.987 11.722 191 HD2 PHE 25 HD2 PHE 25 10.537 8.980 10.058 192 HE1 PHE 25 HE1 PHE 25 8.629 12.825 12.459 193 HE2 PHE 25 HE2 PHE 25 11.999 10.814 10.796 194 HZ PHE 25 HZ PHE 25 11.047 12.740 11.999 195 H LEU 26 HN LEU 26 9.827 7.800 12.898 196 HA LEU 26 HA LEU 26 12.194 7.542 11.506 197 1HB LEU 26 HB2 LEU 26 11.566 6.891 14.381 198 2HB LEU 26 HB1 LEU 26 13.194 6.869 13.735 199 HG LEU 26 HG LEU 26 12.875 8.940 14.879 200 1HD1 LEU 26 HD11 LEU 26 13.249 10.564 13.078 201 2HD1 LEU 26 HD12 LEU 26 12.725 9.360 11.902 202 3HD1 LEU 26 HD13 LEU 26 14.183 9.085 12.854 203 1HD2 LEU 26 HD21 LEU 26 10.556 9.597 13.087 204 2HD2 LEU 26 HD22 LEU 26 11.106 10.452 14.527 205 3HD2 LEU 26 HD23 LEU 26 10.351 8.864 14.677 206 H ARG 27 HN ARG 27 10.475 4.995 13.305 207 HA ARG 27 HA ARG 27 12.271 2.922 12.610 208 1HB ARG 27 HB2 ARG 27 9.366 2.759 13.435 209 2HB ARG 27 HB1 ARG 27 10.484 1.403 13.384 210 1HG ARG 27 HG2 ARG 27 10.726 3.829 15.152 211 2HG ARG 27 HG1 ARG 27 10.195 2.221 15.652 212 1HD ARG 27 HD2 ARG 27 12.377 1.308 15.029 213 2HD ARG 27 HD1 ARG 27 12.906 2.912 14.523 214 HE ARG 27 HE ARG 27 12.049 3.062 17.182 215 1HH1 ARG 27 HH11 ARG 27 14.614 1.629 15.300 216 2HH1 ARG 27 HH12 ARG 27 15.757 1.664 16.601 217 1HH2 ARG 27 HH21 ARG 27 13.549 3.109 18.894 218 2HH2 ARG 27 HH22 ARG 27 15.153 2.503 18.642 219 H GLU 28 HN GLU 28 9.310 4.134 11.161 220 HA GLU 28 HA GLU 28 8.844 2.126 9.291 221 1HB GLU 28 HB2 GLU 28 7.259 3.938 9.826 222 2HB GLU 28 HB1 GLU 28 8.311 5.090 9.015 223 1HG GLU 28 HG2 GLU 28 6.430 4.451 7.615 224 2HG GLU 28 HG1 GLU 28 7.963 3.952 6.904 225 H LYS 29 HN LYS 29 11.171 4.724 9.282 226 HA LYS 29 HA LYS 29 11.776 4.791 6.540 227 1HB LYS 29 HB2 LYS 29 13.484 5.438 8.944 228 2HB LYS 29 HB1 LYS 29 13.956 5.781 7.287 229 1HG LYS 29 HG2 LYS 29 11.526 6.899 8.671 230 2HG LYS 29 HG1 LYS 29 13.053 7.749 8.427 231 1HD LYS 29 HD2 LYS 29 12.777 7.642 6.030 232 2HD LYS 29 HD1 LYS 29 11.319 6.666 6.211 233 1HE LYS 29 HE2 LYS 29 10.760 8.989 5.733 234 2HE LYS 29 HE1 LYS 29 10.208 8.523 7.341 235 1HZ LYS 29 HZ1 LYS 29 11.811 9.805 8.357 236 2HZ LYS 29 HZ2 LYS 29 11.419 10.760 7.018 237 3HZ LYS 29 HZ3 LYS 29 12.829 9.825 7.006 238 H ASP 30 HN ASP 30 13.185 2.865 9.164 239 HA ASP 30 HA ASP 30 15.259 1.714 7.660 240 1HB ASP 30 HB2 ASP 30 15.120 1.743 10.147 241 2HB ASP 30 HB1 ASP 30 13.867 0.509 10.055 242 H LYS 31 HN LYS 31 11.929 1.173 7.375 243 HA LYS 31 HA LYS 31 12.386 -1.517 6.278 244 1HB LYS 31 HB2 LYS 31 9.826 -0.234 7.221 245 2HB LYS 31 HB1 LYS 31 9.949 -1.849 6.538 246 1HG LYS 31 HG2 LYS 31 11.480 -2.455 8.396 247 2HG LYS 31 HG1 LYS 31 11.178 -0.869 9.104 248 1HD LYS 31 HD2 LYS 31 9.070 -2.950 8.529 249 2HD LYS 31 HD1 LYS 31 9.790 -2.645 10.109 250 1HE LYS 31 HE2 LYS 31 7.724 -1.499 10.094 251 2HE LYS 31 HE1 LYS 31 8.969 -0.269 9.890 252 1HZ LYS 31 HZ1 LYS 31 8.138 0.308 7.927 253 2HZ LYS 31 HZ2 LYS 31 6.782 -0.629 8.301 254 3HZ LYS 31 HZ3 LYS 31 8.040 -1.293 7.387 255 H MET 32 HN MET 32 11.050 1.646 5.529 256 HA MET 32 HA MET 32 9.820 0.926 3.097 257 1HB MET 32 HB2 MET 32 10.752 3.577 4.161 258 2HB MET 32 HB1 MET 32 9.920 3.406 2.624 259 1HG MET 32 HG2 MET 32 8.010 2.396 3.793 260 2HG MET 32 HG1 MET 32 8.840 2.654 5.327 261 1HE MET 32 HE1 MET 32 9.112 6.595 5.347 262 2HE MET 32 HE2 MET 32 10.275 5.392 4.789 263 3HE MET 32 HE3 MET 32 9.402 5.140 6.300 264 H LYS 33 HN LYS 33 10.390 1.026 1.040 265 HA LYS 33 HA LYS 33 12.824 2.086 0.003 266 1HB LYS 33 HB2 LYS 33 12.538 -0.921 0.228 267 2HB LYS 33 HB1 LYS 33 13.621 -0.150 -0.916 268 1HG LYS 33 HG2 LYS 33 15.138 -0.422 0.700 269 2HG LYS 33 HG1 LYS 33 14.408 1.027 1.388 270 1HD LYS 33 HD2 LYS 33 12.955 -0.367 2.778 271 2HD LYS 33 HD1 LYS 33 13.659 -1.817 2.070 272 1HE LYS 33 HE2 LYS 33 15.843 -1.194 2.967 273 2HE LYS 33 HE1 LYS 33 15.147 0.267 3.664 274 1HZ LYS 33 HZ1 LYS 33 15.438 -1.730 5.178 275 2HZ LYS 33 HZ2 LYS 33 14.127 -2.419 4.360 276 3HZ LYS 33 HZ3 LYS 33 13.929 -0.965 5.202 277 H MET 34 HN MET 34 12.909 0.716 -2.474 278 HA MET 34 HA MET 34 10.513 1.671 -3.703 279 1HB MET 34 HB2 MET 34 12.567 1.470 -5.017 280 2HB MET 34 HB1 MET 34 12.609 -0.264 -4.742 281 1HG MET 34 HG2 MET 34 10.557 -0.530 -6.019 282 2HG MET 34 HG1 MET 34 10.476 1.214 -6.264 283 1HE MET 34 HE1 MET 34 10.995 0.751 -9.615 284 2HE MET 34 HE2 MET 34 9.922 0.050 -8.404 285 3HE MET 34 HE3 MET 34 11.015 -0.987 -9.321 286 H ALA 35 HN ALA 35 8.598 0.366 -4.391 287 HA ALA 35 HA ALA 35 8.667 -2.273 -3.075 288 1HB ALA 35 HB1 ALA 35 7.467 -0.473 -1.813 289 2HB ALA 35 HB2 ALA 35 6.559 -1.953 -2.119 290 3HB ALA 35 HB3 ALA 35 6.249 -0.512 -3.086 291 H MET 36 HN MET 36 7.901 -3.954 -3.997 292 HA MET 36 HA MET 36 6.305 -3.718 -6.460 293 1HB MET 36 HB2 MET 36 8.604 -4.495 -6.976 294 2HB MET 36 HB1 MET 36 8.409 -5.811 -5.826 295 1HG MET 36 HG2 MET 36 6.606 -6.737 -7.177 296 2HG MET 36 HG1 MET 36 6.781 -5.410 -8.325 297 1HE MET 36 HE1 MET 36 10.557 -5.691 -8.583 298 2HE MET 36 HE2 MET 36 9.131 -4.706 -8.912 299 3HE MET 36 HE3 MET 36 9.776 -5.770 -10.162 300 H ALA 37 HN ALA 37 4.732 -5.558 -6.687 301 HA ALA 37 HA ALA 37 4.358 -7.109 -4.247 302 1HB ALA 37 HB1 ALA 37 1.906 -6.366 -4.212 303 2HB ALA 37 HB2 ALA 37 2.458 -5.000 -5.179 304 3HB ALA 37 HB3 ALA 37 3.127 -5.266 -3.571 305 H ARG 38 HN ARG 38 2.881 -8.809 -4.353 306 HA ARG 38 HA ARG 38 1.806 -9.557 -6.974 307 1HB ARG 38 HB2 ARG 38 4.049 -10.597 -6.771 308 2HB ARG 38 HB1 ARG 38 3.554 -11.348 -5.262 309 1HG ARG 38 HG2 ARG 38 3.376 -13.032 -6.865 310 2HG ARG 38 HG1 ARG 38 1.720 -12.478 -6.613 311 1HD ARG 38 HD2 ARG 38 1.916 -11.056 -8.610 312 2HD ARG 38 HD1 ARG 38 3.550 -11.659 -8.866 313 HE ARG 38 HE ARG 38 2.638 -13.485 -9.864 314 1HH1 ARG 38 HH11 ARG 38 0.223 -12.100 -7.758 315 2HH1 ARG 38 HH12 ARG 38 -0.995 -13.250 -8.195 316 1HH2 ARG 38 HH21 ARG 38 1.036 -14.992 -10.441 317 2HH2 ARG 38 HH22 ARG 38 -0.535 -14.889 -9.719 318 H ILE 39 HN ILE 39 -0.331 -9.761 -6.518 319 HA ILE 39 HA ILE 39 -1.167 -10.675 -3.881 320 HB ILE 39 HB ILE 39 -2.288 -8.716 -4.785 321 1HG1 ILE 39 HG12 ILE 39 -4.099 -11.139 -4.631 322 2HG1 ILE 39 HG11 ILE 39 -3.525 -10.195 -3.261 323 1HG2 ILE 39 HG21 ILE 39 -3.280 -10.549 -6.959 324 2HG2 ILE 39 HG22 ILE 39 -2.098 -9.256 -7.159 325 3HG2 ILE 39 HG23 ILE 39 -3.762 -8.871 -6.720 326 1HD1 ILE 39 HD11 ILE 39 -5.110 -8.921 -5.452 327 2HD1 ILE 39 HD12 ILE 39 -4.880 -8.387 -3.786 328 3HD1 ILE 39 HD13 ILE 39 -5.897 -9.786 -4.132 329 H SER 40 HN SER 40 -2.273 -12.482 -3.412 330 HA SER 40 HA SER 40 -3.353 -14.216 -5.432 331 1HB SER 40 HB2 SER 40 -1.933 -16.170 -4.882 332 2HB SER 40 HB1 SER 40 -0.977 -14.848 -5.560 333 HG SER 40 HG SER 40 -0.694 -14.283 -3.193 334 H PHE 41 HN PHE 41 -5.004 -15.364 -4.611 335 HA PHE 41 HA PHE 41 -5.619 -15.079 -1.787 336 1HB PHE 41 HB2 PHE 41 -7.221 -16.299 -4.047 337 2HB PHE 41 HB1 PHE 41 -7.811 -16.032 -2.413 338 HD1 PHE 41 HD1 PHE 41 -5.967 -13.905 -4.895 339 HD2 PHE 41 HD2 PHE 41 -9.342 -14.344 -2.338 340 HE1 PHE 41 HE1 PHE 41 -6.729 -11.663 -5.528 341 HE2 PHE 41 HE2 PHE 41 -10.112 -12.096 -2.973 342 HZ PHE 41 HZ PHE 41 -8.805 -10.753 -4.570 343 H LEU 42 HN LEU 42 -5.577 -16.697 -0.274 344 HA LEU 42 HA LEU 42 -5.139 -19.429 -1.229 345 1HB LEU 42 HB2 LEU 42 -3.542 -19.814 0.658 346 2HB LEU 42 HB1 LEU 42 -2.952 -18.808 -0.641 347 HG LEU 42 HG LEU 42 -2.168 -17.950 1.450 348 1HD1 LEU 42 HD11 LEU 42 -4.161 -15.873 1.091 349 2HD1 LEU 42 HD12 LEU 42 -3.462 -16.435 -0.425 350 3HD1 LEU 42 HD13 LEU 42 -2.418 -15.835 0.858 351 1HD2 LEU 42 HD21 LEU 42 -4.952 -18.363 2.321 352 2HD2 LEU 42 HD22 LEU 42 -4.142 -16.932 2.943 353 3HD2 LEU 42 HD23 LEU 42 -3.442 -18.527 3.209 354 H GLY 43 HN GLY 43 -5.434 -21.083 0.543 355 1HA GLY 43 HA2 GLY 43 -8.041 -20.983 1.475 356 2HA GLY 43 HA1 GLY 43 -6.818 -22.093 2.066 357 H GLU 44 HN GLU 44 -7.752 -22.009 4.131 358 HA GLU 44 HA GLU 44 -8.091 -21.246 6.251 359 1HB GLU 44 HB2 GLU 44 -5.642 -19.605 5.568 360 2HB GLU 44 HB1 GLU 44 -6.263 -19.869 7.192 361 1HG GLU 44 HG2 GLU 44 -5.200 -21.981 5.330 362 2HG GLU 44 HG1 GLU 44 -4.374 -21.313 6.737 363 H ASP 45 HN ASP 45 -9.410 -19.811 4.042 364 HA ASP 45 HA ASP 45 -10.589 -17.903 3.619 365 1HB ASP 45 HB2 ASP 45 -11.722 -18.651 5.681 366 2HB ASP 45 HB1 ASP 45 -10.568 -17.733 6.644 367 H GLU 46 HN GLU 46 -7.996 -17.414 3.134 368 HA GLU 46 HA GLU 46 -7.764 -14.633 3.891 369 1HB GLU 46 HB2 GLU 46 -5.686 -16.670 4.675 370 2HB GLU 46 HB1 GLU 46 -5.390 -14.940 4.666 371 1HG GLU 46 HG2 GLU 46 -7.069 -14.603 6.365 372 2HG GLU 46 HG1 GLU 46 -7.497 -16.309 6.317 373 H LEU 47 HN LEU 47 -6.844 -13.416 2.371 374 HA LEU 47 HA LEU 47 -5.489 -14.790 0.146 375 1HB LEU 47 HB2 LEU 47 -6.185 -12.920 -1.287 376 2HB LEU 47 HB1 LEU 47 -7.559 -13.762 -0.600 377 HG LEU 47 HG LEU 47 -7.627 -11.904 1.150 378 1HD1 LEU 47 HD11 LEU 47 -6.603 -9.812 -0.349 379 2HD1 LEU 47 HD12 LEU 47 -5.357 -11.057 -0.431 380 3HD1 LEU 47 HD13 LEU 47 -5.923 -10.478 1.135 381 1HD2 LEU 47 HD21 LEU 47 -9.063 -10.620 -0.179 382 2HD2 LEU 47 HD22 LEU 47 -9.104 -12.221 -0.916 383 3HD2 LEU 47 HD23 LEU 47 -8.139 -10.940 -1.646 384 H LYS 48 HN LYS 48 -3.421 -14.130 -0.362 385 HA LYS 48 HA LYS 48 -2.395 -11.915 1.280 386 1HB LYS 48 HB2 LYS 48 -0.434 -13.093 1.753 387 2HB LYS 48 HB1 LYS 48 -1.707 -14.289 1.896 388 1HG LYS 48 HG2 LYS 48 -0.024 -15.413 0.782 389 2HG LYS 48 HG1 LYS 48 -1.114 -14.927 -0.516 390 1HD LYS 48 HD2 LYS 48 0.337 -13.271 -1.277 391 2HD LYS 48 HD1 LYS 48 1.202 -13.190 0.258 392 1HE LYS 48 HE2 LYS 48 2.531 -14.268 -1.499 393 2HE LYS 48 HE1 LYS 48 2.192 -15.364 -0.161 394 1HZ LYS 48 HZ1 LYS 48 0.973 -15.335 -2.856 395 2HZ LYS 48 HZ2 LYS 48 0.265 -16.165 -1.563 396 3HZ LYS 48 HZ3 LYS 48 1.811 -16.594 -2.096 397 H VAL 49 HN VAL 49 -0.684 -10.679 0.548 398 HA VAL 49 HA VAL 49 -0.013 -10.856 -2.292 399 HB VAL 49 HB VAL 49 -1.790 -9.166 -2.112 400 1HG1 VAL 49 HG11 VAL 49 -0.581 -8.495 0.299 401 2HG1 VAL 49 HG12 VAL 49 -1.946 -7.690 -0.471 402 3HG1 VAL 49 HG13 VAL 49 -0.307 -7.106 -0.750 403 1HG2 VAL 49 HG21 VAL 49 -0.474 -8.592 -3.880 404 2HG2 VAL 49 HG22 VAL 49 0.970 -8.383 -2.889 405 3HG2 VAL 49 HG23 VAL 49 -0.289 -7.147 -2.889 406 H SER 50 HN SER 50 2.107 -11.101 -2.376 407 HA SER 50 HA SER 50 3.792 -10.273 -0.162 408 1HB SER 50 HB2 SER 50 4.488 -11.723 -2.732 409 2HB SER 50 HB1 SER 50 5.582 -11.463 -1.374 410 HG SER 50 HG SER 50 4.782 -13.406 -0.933 411 H TYR 51 HN TYR 51 5.330 -8.665 -0.231 412 HA TYR 51 HA TYR 51 5.493 -7.147 -2.746 413 1HB TYR 51 HB2 TYR 51 5.937 -5.655 -0.224 414 2HB TYR 51 HB1 TYR 51 5.179 -5.130 -1.721 415 HD1 TYR 51 HD1 TYR 51 4.520 -7.495 1.100 416 HD2 TYR 51 HD2 TYR 51 2.917 -4.675 -1.653 417 HE1 TYR 51 HE1 TYR 51 2.319 -7.717 2.167 418 HE2 TYR 51 HE2 TYR 51 0.709 -4.890 -0.591 419 HH TYR 51 HH TYR 51 -0.219 -5.564 1.610 420 H ALA 52 HN ALA 52 7.493 -7.086 -3.535 421 HA ALA 52 HA ALA 52 9.733 -7.571 -1.692 422 1HB ALA 52 HB1 ALA 52 9.542 -9.154 -3.557 423 2HB ALA 52 HB2 ALA 52 11.027 -8.210 -3.662 424 3HB ALA 52 HB3 ALA 52 9.658 -7.818 -4.702 425 H VAL 53 HN VAL 53 10.466 -5.659 -0.944 426 HA VAL 53 HA VAL 53 10.474 -3.339 -2.672 427 HB VAL 53 HB VAL 53 11.214 -2.066 -0.740 428 1HG1 VAL 53 HG11 VAL 53 8.856 -2.368 -0.912 429 2HG1 VAL 53 HG12 VAL 53 9.294 -2.543 0.787 430 3HG1 VAL 53 HG13 VAL 53 8.951 -3.973 -0.185 431 1HG2 VAL 53 HG21 VAL 53 11.670 -4.773 0.415 432 2HG2 VAL 53 HG22 VAL 53 11.232 -3.442 1.487 433 3HG2 VAL 53 HG23 VAL 53 12.680 -3.328 0.488 434 HA PRO 54 HA PRO 54 14.730 -4.319 -3.805 435 1HB PRO 54 HB2 PRO 54 14.485 -2.259 -5.821 436 2HB PRO 54 HB1 PRO 54 14.588 -4.007 -6.032 437 1HG PRO 54 HG2 PRO 54 12.343 -2.555 -6.565 438 2HG PRO 54 HG1 PRO 54 12.319 -4.263 -6.090 439 1HD PRO 54 HD2 PRO 54 11.816 -1.829 -4.426 440 2HD PRO 54 HD1 PRO 54 10.960 -3.381 -4.434 441 H LYS 55 HN LYS 55 16.637 -3.462 -3.413 442 HA LYS 55 HA LYS 55 17.014 -1.357 -1.708 443 1HB LYS 55 HB2 LYS 55 19.401 -1.659 -2.071 444 2HB LYS 55 HB1 LYS 55 18.577 -3.201 -1.891 445 1HG LYS 55 HG2 LYS 55 18.599 -3.483 -4.327 446 2HG LYS 55 HG1 LYS 55 19.468 -1.954 -4.481 447 1HD LYS 55 HD2 LYS 55 20.442 -4.395 -2.998 448 2HD LYS 55 HD1 LYS 55 20.993 -3.868 -4.589 449 1HE LYS 55 HE2 LYS 55 21.274 -2.329 -2.008 450 2HE LYS 55 HE1 LYS 55 22.561 -3.200 -2.839 451 1HZ LYS 55 HZ1 LYS 55 21.707 -1.609 -4.789 452 2HZ LYS 55 HZ2 LYS 55 22.944 -1.180 -3.718 453 3HZ LYS 55 HZ3 LYS 55 21.368 -0.626 -3.454 454 HA PRO 56 HA PRO 56 18.631 0.807 -6.121 455 1HB PRO 56 HB2 PRO 56 15.639 0.878 -6.407 456 2HB PRO 56 HB1 PRO 56 16.880 1.075 -7.653 457 1HG PRO 56 HG2 PRO 56 15.645 -1.311 -7.124 458 2HG PRO 56 HG1 PRO 56 17.275 -1.176 -7.802 459 1HD PRO 56 HD2 PRO 56 16.513 -2.227 -5.246 460 2HD PRO 56 HD1 PRO 56 18.146 -2.069 -5.910 461 H ASN 57 HN ASN 57 19.081 2.842 -5.770 462 HA ASN 57 HA ASN 57 18.842 5.054 -5.181 463 1HB ASN 57 HB2 ASN 57 16.362 4.263 -3.631 464 2HB ASN 57 HB1 ASN 57 16.909 5.898 -3.977 465 1HD2 ASN 57 HD21 ASN 57 14.753 3.631 -4.853 466 2HD2 ASN 57 HD22 ASN 57 14.460 4.107 -6.488 467 H GLY 58 HN GLY 58 20.301 2.949 -3.903 468 1HA GLY 58 HA2 GLY 58 21.549 2.547 -2.021 469 2HA GLY 58 HA1 GLY 58 21.367 4.267 -1.719 470 H CYS 59 HN CYS 59 19.290 1.349 -1.506 471 HA CYS 59 HA CYS 59 18.685 2.161 1.250 472 1HB CYS 59 HB2 CYS 59 16.634 1.249 -0.773 473 2HB CYS 59 HB1 CYS 59 16.319 1.606 0.921 474 H ARG 60 HN ARG 60 17.225 -0.515 -0.568 475 HA ARG 60 HA ARG 60 18.880 -2.616 0.023 476 1HB ARG 60 HB2 ARG 60 17.660 -1.607 2.444 477 2HB ARG 60 HB1 ARG 60 17.241 -3.294 2.179 478 1HG ARG 60 HG2 ARG 60 19.598 -3.871 2.021 479 2HG ARG 60 HG1 ARG 60 20.039 -2.178 2.239 480 1HD ARG 60 HD2 ARG 60 18.982 -2.195 4.450 481 2HD ARG 60 HD1 ARG 60 18.558 -3.892 4.228 482 HE ARG 60 HE ARG 60 21.320 -3.620 3.878 483 1HH1 ARG 60 HH11 ARG 60 18.936 -3.355 6.414 484 2HH1 ARG 60 HH12 ARG 60 20.044 -3.794 7.670 485 1HH2 ARG 60 HH21 ARG 60 22.774 -4.198 5.527 486 2HH2 ARG 60 HH22 ARG 60 22.223 -4.272 7.168 487 H LYS 61 HN LYS 61 17.615 -4.798 0.477 488 HA LYS 61 HA LYS 61 15.144 -4.681 -1.117 489 1HB LYS 61 HB2 LYS 61 16.968 -5.692 -2.390 490 2HB LYS 61 HB1 LYS 61 17.234 -6.859 -1.101 491 1HG LYS 61 HG2 LYS 61 15.013 -7.795 -1.479 492 2HG LYS 61 HG1 LYS 61 14.736 -6.619 -2.765 493 1HD LYS 61 HD2 LYS 61 15.398 -8.776 -3.687 494 2HD LYS 61 HD1 LYS 61 16.621 -7.549 -4.020 495 1HE LYS 61 HE2 LYS 61 17.645 -9.653 -3.326 496 2HE LYS 61 HE1 LYS 61 17.965 -8.372 -2.158 497 1HZ LYS 61 HZ1 LYS 61 17.103 -10.775 -1.467 498 2HZ LYS 61 HZ2 LYS 61 15.609 -10.009 -1.670 499 3HZ LYS 61 HZ3 LYS 61 16.738 -9.383 -0.578 500 H TRP 62 HN TRP 62 13.350 -5.663 -0.308 501 HA TRP 62 HA TRP 62 13.648 -7.698 1.747 502 1HB TRP 62 HB2 TRP 62 12.177 -5.120 2.314 503 2HB TRP 62 HB1 TRP 62 12.083 -6.561 3.312 504 HD1 TRP 62 HD1 TRP 62 14.869 -4.160 2.041 505 HE1 TRP 62 HE1 TRP 62 16.588 -3.890 3.938 506 HE3 TRP 62 HE3 TRP 62 12.818 -7.361 5.460 507 HZ2 TRP 62 HZ2 TRP 62 17.018 -4.900 6.537 508 HZ3 TRP 62 HZ3 TRP 62 13.946 -7.654 7.627 509 HH2 TRP 62 HH2 TRP 62 16.004 -6.448 8.152 510 H GLU 63 HN GLU 63 11.686 -8.813 2.268 511 HA GLU 63 HA GLU 63 9.436 -8.389 0.450 512 1HB GLU 63 HB2 GLU 63 9.347 -10.779 -0.115 513 2HB GLU 63 HB1 GLU 63 10.842 -10.041 -0.674 514 1HG GLU 63 HG2 GLU 63 12.020 -10.973 1.255 515 2HG GLU 63 HG1 GLU 63 10.519 -11.719 1.804 516 H THR 64 HN THR 64 7.451 -9.008 1.298 517 HA THR 64 HA THR 64 7.396 -10.478 3.808 518 HB THR 64 HB THR 64 7.687 -8.059 4.406 519 HG1 THR 64 HG1 THR 64 6.728 -9.195 5.974 520 1HG2 THR 64 HG21 THR 64 4.899 -7.751 3.318 521 2HG2 THR 64 HG22 THR 64 6.354 -7.058 2.602 522 3HG2 THR 64 HG23 THR 64 5.827 -6.541 4.203 523 H THR 65 HN THR 65 5.502 -11.543 4.183 524 HA THR 65 HA THR 65 3.569 -11.504 1.979 525 HB THR 65 HB THR 65 4.159 -13.560 4.114 526 HG1 THR 65 HG1 THR 65 4.792 -14.775 2.237 527 1HG2 THR 65 HG21 THR 65 1.783 -13.646 3.542 528 2HG2 THR 65 HG22 THR 65 2.658 -15.068 2.974 529 3HG2 THR 65 HG23 THR 65 2.208 -13.797 1.837 530 H PHE 66 HN PHE 66 1.826 -10.261 2.328 531 HA PHE 66 HA PHE 66 0.731 -10.122 5.058 532 1HB PHE 66 HB2 PHE 66 0.489 -8.295 2.675 533 2HB PHE 66 HB1 PHE 66 -0.680 -8.226 3.986 534 HD1 PHE 66 HD1 PHE 66 2.959 -8.861 4.324 535 HD2 PHE 66 HD2 PHE 66 -0.235 -6.097 4.854 536 HE1 PHE 66 HE1 PHE 66 4.456 -7.378 5.589 537 HE2 PHE 66 HE2 PHE 66 1.261 -4.609 6.120 538 HZ PHE 66 HZ PHE 66 3.610 -5.249 6.489 539 H LYS 67 HN LYS 67 -1.315 -10.919 5.500 540 HA LYS 67 HA LYS 67 -3.128 -11.587 3.361 541 1HB LYS 67 HB2 LYS 67 -2.990 -13.899 3.386 542 2HB LYS 67 HB1 LYS 67 -1.307 -13.429 3.555 543 1HG LYS 67 HG2 LYS 67 -3.107 -14.263 5.818 544 2HG LYS 67 HG1 LYS 67 -1.905 -15.283 5.029 545 1HD LYS 67 HD2 LYS 67 -0.133 -13.767 5.753 546 2HD LYS 67 HD1 LYS 67 -1.332 -12.724 6.523 547 1HE LYS 67 HE2 LYS 67 -1.965 -14.545 8.020 548 2HE LYS 67 HE1 LYS 67 -0.794 -15.606 7.239 549 1HZ LYS 67 HZ1 LYS 67 0.940 -14.599 8.261 550 2HZ LYS 67 HZ2 LYS 67 -0.238 -14.272 9.430 551 3HZ LYS 67 HZ3 LYS 67 0.196 -13.079 8.313 552 H LYS 68 HN LYS 68 -5.216 -11.939 4.030 553 HA LYS 68 HA LYS 68 -6.034 -12.762 6.552 554 1HB LYS 68 HB2 LYS 68 -4.992 -10.555 7.203 555 2HB LYS 68 HB1 LYS 68 -6.282 -9.775 6.299 556 1HG LYS 68 HG2 LYS 68 -6.955 -9.798 8.577 557 2HG LYS 68 HG1 LYS 68 -7.914 -11.023 7.750 558 1HD LYS 68 HD2 LYS 68 -6.430 -12.768 8.570 559 2HD LYS 68 HD1 LYS 68 -5.415 -11.554 9.354 560 1HE LYS 68 HE2 LYS 68 -7.307 -10.898 10.768 561 2HE LYS 68 HE1 LYS 68 -8.308 -12.123 9.991 562 1HZ LYS 68 HZ1 LYS 68 -5.790 -13.006 11.174 563 2HZ LYS 68 HZ2 LYS 68 -7.283 -13.796 11.093 564 3HZ LYS 68 HZ3 LYS 68 -7.034 -12.578 12.240 565 H THR 69 HN THR 69 -8.076 -10.135 5.996 566 HA THR 69 HA THR 69 -9.695 -11.736 4.121 567 HB THR 69 HB THR 69 -10.616 -11.936 6.364 568 HG1 THR 69 HG1 THR 69 -12.676 -11.412 5.815 569 1HG2 THR 69 HG21 THR 69 -10.236 -9.036 6.435 570 2HG2 THR 69 HG22 THR 69 -10.320 -10.210 7.748 571 3HG2 THR 69 HG23 THR 69 -11.804 -9.593 7.023 572 H SER 70 HN SER 70 -11.497 -10.484 3.093 573 HA SER 70 HA SER 70 -10.875 -7.664 2.665 574 1HB SER 70 HB2 SER 70 -9.654 -8.805 0.894 575 2HB SER 70 HB1 SER 70 -11.105 -9.697 0.438 576 HG SER 70 HG SER 70 -11.710 -8.049 -0.700 577 H ASP 71 HN ASP 71 -12.607 -6.379 2.214 578 HA ASP 71 HA ASP 71 -15.225 -7.485 2.711 579 1HB ASP 71 HB2 ASP 71 -14.422 -5.273 3.603 580 2HB ASP 71 HB1 ASP 71 -14.527 -4.642 1.963 581 H ASP 72 HN ASP 72 -17.083 -7.197 1.342 582 HA ASP 72 HA ASP 72 -16.567 -7.834 -1.396 583 1HB ASP 72 HB2 ASP 72 -19.182 -7.237 0.007 584 2HB ASP 72 HB1 ASP 72 -19.023 -7.953 -1.594 585 H GLY 73 HN GLY 73 -18.722 -6.533 -2.707 586 1HA GLY 73 HA2 GLY 73 -19.193 -4.626 -3.901 587 2HA GLY 73 HA1 GLY 73 -18.702 -3.722 -2.474 588 H GLU 74 HN GLU 74 -16.325 -3.582 -2.134 589 HA GLU 74 HA GLU 74 -14.893 -3.306 -4.692 590 1HB GLU 74 HB2 GLU 74 -14.533 -1.646 -2.180 591 2HB GLU 74 HB1 GLU 74 -13.641 -1.449 -3.681 592 1HG GLU 74 HG2 GLU 74 -15.193 0.233 -3.830 593 2HG GLU 74 HG1 GLU 74 -15.984 -1.062 -4.725 594 H VAL 75 HN VAL 75 -12.539 -2.639 -2.574 595 HA VAL 75 HA VAL 75 -12.263 -5.363 -1.579 596 HB VAL 75 HB VAL 75 -11.135 -5.717 -3.581 597 1HG1 VAL 75 HG11 VAL 75 -9.151 -3.855 -3.973 598 2HG1 VAL 75 HG12 VAL 75 -10.519 -2.888 -3.426 599 3HG1 VAL 75 HG13 VAL 75 -10.690 -3.937 -4.830 600 1HG2 VAL 75 HG21 VAL 75 -9.329 -6.613 -2.656 601 2HG2 VAL 75 HG22 VAL 75 -9.664 -5.681 -1.199 602 3HG2 VAL 75 HG23 VAL 75 -8.590 -5.027 -2.434 603 H TYR 76 HN TYR 76 -12.048 -5.094 0.486 604 HA TYR 76 HA TYR 76 -10.407 -2.875 1.506 605 1HB TYR 76 HB2 TYR 76 -12.653 -4.440 2.786 606 2HB TYR 76 HB1 TYR 76 -11.624 -3.329 3.677 607 HD1 TYR 76 HD1 TYR 76 -12.938 -1.537 4.282 608 HD2 TYR 76 HD2 TYR 76 -13.208 -3.005 0.299 609 HE1 TYR 76 HE1 TYR 76 -14.424 0.331 3.701 610 HE2 TYR 76 HE2 TYR 76 -14.692 -1.139 -0.293 611 HH TYR 76 HH TYR 76 -16.325 0.410 1.040 612 H TYR 77 HN TYR 77 -8.615 -3.335 2.714 613 HA TYR 77 HA TYR 77 -8.122 -6.195 3.205 614 1HB TYR 77 HB2 TYR 77 -6.649 -4.929 1.539 615 2HB TYR 77 HB1 TYR 77 -5.978 -4.097 2.937 616 HD1 TYR 77 HD1 TYR 77 -3.790 -4.896 3.115 617 HD2 TYR 77 HD2 TYR 77 -6.978 -7.657 2.558 618 HE1 TYR 77 HE1 TYR 77 -2.228 -6.765 3.462 619 HE2 TYR 77 HE2 TYR 77 -5.428 -9.529 2.906 620 HH TYR 77 HH TYR 77 -2.742 -9.777 2.575 621 H SER 78 HN SER 78 -7.925 -6.855 5.222 622 HA SER 78 HA SER 78 -7.023 -4.975 7.288 623 1HB SER 78 HB2 SER 78 -9.472 -4.937 7.394 624 2HB SER 78 HB1 SER 78 -9.512 -6.698 7.485 625 HG SER 78 HG SER 78 -9.182 -6.540 9.544 626 H GLU 79 HN GLU 79 -5.586 -5.913 8.712 627 HA GLU 79 HA GLU 79 -5.611 -8.765 9.144 628 1HB GLU 79 HB2 GLU 79 -3.375 -9.196 8.280 629 2HB GLU 79 HB1 GLU 79 -4.439 -8.620 7.004 630 1HG GLU 79 HG2 GLU 79 -3.459 -6.416 7.130 631 2HG GLU 79 HG1 GLU 79 -2.447 -6.915 8.485 632 H GLU 80 HN GLU 80 -3.359 -9.377 10.229 633 HA GLU 80 HA GLU 80 -2.274 -9.392 12.205 634 1HB GLU 80 HB2 GLU 80 -1.869 -6.479 11.508 635 2HB GLU 80 HB1 GLU 80 -0.943 -7.379 12.701 636 1HG GLU 80 HG2 GLU 80 -0.189 -8.910 10.927 637 2HG GLU 80 HG1 GLU 80 -1.052 -7.928 9.746 638 H ALA 81 HN ALA 81 -1.977 -7.290 14.159 639 HA ALA 81 HA ALA 81 -4.113 -7.827 15.819 640 1HB ALA 81 HB1 ALA 81 -3.338 -5.653 17.003 641 2HB ALA 81 HB2 ALA 81 -2.047 -5.670 15.802 642 3HB ALA 81 HB3 ALA 81 -2.241 -7.030 16.906 643 H LYS 82 HN LYS 82 -3.736 -4.391 15.274 644 HA LYS 82 HA LYS 82 -6.537 -4.317 14.372 645 1HB LYS 82 HB2 LYS 82 -5.040 -2.362 16.119 646 2HB LYS 82 HB1 LYS 82 -6.639 -2.061 15.455 647 1HG LYS 82 HG2 LYS 82 -6.984 -2.777 17.664 648 2HG LYS 82 HG1 LYS 82 -7.388 -4.160 16.647 649 1HD LYS 82 HD2 LYS 82 -5.241 -5.175 17.119 650 2HD LYS 82 HD1 LYS 82 -4.738 -3.757 18.037 651 1HE LYS 82 HE2 LYS 82 -7.010 -5.620 18.723 652 2HE LYS 82 HE1 LYS 82 -5.438 -5.563 19.517 653 1HZ LYS 82 HZ1 LYS 82 -5.940 -3.257 20.167 654 2HZ LYS 82 HZ2 LYS 82 -7.034 -4.369 20.821 655 3HZ LYS 82 HZ3 LYS 82 -7.488 -3.416 19.500 656 H LYS 83 HN LYS 83 -4.794 -4.611 12.363 657 HA LYS 83 HA LYS 83 -4.170 -1.925 11.377 658 1HB LYS 83 HB2 LYS 83 -3.402 -4.616 10.238 659 2HB LYS 83 HB1 LYS 83 -2.869 -3.055 9.632 660 1HG LYS 83 HG2 LYS 83 -1.778 -2.635 11.820 661 2HG LYS 83 HG1 LYS 83 -2.216 -4.275 12.305 662 1HD LYS 83 HD2 LYS 83 -0.947 -5.140 10.360 663 2HD LYS 83 HD1 LYS 83 -0.443 -3.490 9.993 664 1HE LYS 83 HE2 LYS 83 0.160 -5.023 12.520 665 2HE LYS 83 HE1 LYS 83 1.296 -4.671 11.219 666 1HZ LYS 83 HZ1 LYS 83 0.933 -2.284 11.684 667 2HZ LYS 83 HZ2 LYS 83 1.637 -3.118 12.976 668 3HZ LYS 83 HZ3 LYS 83 -0.004 -2.712 13.028 669 H LYS 84 HN LYS 84 -5.677 -0.941 10.245 670 HA LYS 84 HA LYS 84 -7.524 -2.545 8.617 671 1HB LYS 84 HB2 LYS 84 -7.797 0.294 9.624 672 2HB LYS 84 HB1 LYS 84 -8.987 -0.555 8.646 673 1HG LYS 84 HG2 LYS 84 -9.297 -2.189 10.435 674 2HG LYS 84 HG1 LYS 84 -8.102 -1.337 11.417 675 1HD LYS 84 HD2 LYS 84 -9.517 0.664 11.392 676 2HD LYS 84 HD1 LYS 84 -10.711 -0.194 10.416 677 1HE LYS 84 HE2 LYS 84 -11.021 -1.814 12.221 678 2HE LYS 84 HE1 LYS 84 -9.823 -0.962 13.194 679 1HZ LYS 84 HZ1 LYS 84 -11.844 -0.163 13.961 680 2HZ LYS 84 HZ2 LYS 84 -12.530 -0.081 12.418 681 3HZ LYS 84 HZ3 LYS 84 -11.354 1.043 12.880 682 H VAL 85 HN VAL 85 -7.616 -2.285 6.448 683 HA VAL 85 HA VAL 85 -6.245 -0.017 5.213 684 HB VAL 85 HB VAL 85 -5.667 -2.854 4.358 685 1HG1 VAL 85 HG11 VAL 85 -4.015 -0.502 3.607 686 2HG1 VAL 85 HG12 VAL 85 -5.553 -0.757 2.785 687 3HG1 VAL 85 HG13 VAL 85 -4.307 -2.004 2.735 688 1HG2 VAL 85 HG21 VAL 85 -4.407 -2.886 6.234 689 2HG2 VAL 85 HG22 VAL 85 -4.350 -1.129 6.357 690 3HG2 VAL 85 HG23 VAL 85 -3.289 -1.967 5.227 691 H GLU 86 HN GLU 86 -7.173 0.636 3.293 692 HA GLU 86 HA GLU 86 -9.467 -0.976 2.369 693 1HB GLU 86 HB2 GLU 86 -9.166 2.017 2.133 694 2HB GLU 86 HB1 GLU 86 -10.602 1.062 1.793 695 1HG GLU 86 HG2 GLU 86 -9.339 1.427 4.500 696 2HG GLU 86 HG1 GLU 86 -10.772 2.263 3.907 697 H VAL 87 HN VAL 87 -9.282 -1.787 0.379 698 HA VAL 87 HA VAL 87 -7.293 -0.666 -1.448 699 HB VAL 87 HB VAL 87 -8.933 -3.009 -2.252 700 1HG1 VAL 87 HG11 VAL 87 -7.379 -3.073 -3.817 701 2HG1 VAL 87 HG12 VAL 87 -6.183 -3.456 -2.583 702 3HG1 VAL 87 HG13 VAL 87 -6.484 -1.777 -3.025 703 1HG2 VAL 87 HG21 VAL 87 -6.874 -4.226 -0.899 704 2HG2 VAL 87 HG22 VAL 87 -8.556 -4.151 -0.377 705 3HG2 VAL 87 HG23 VAL 87 -7.397 -2.963 0.215 706 H LEU 88 HN LEU 88 -8.005 1.014 -2.543 707 HA LEU 88 HA LEU 88 -10.757 1.039 -3.584 708 1HB LEU 88 HB2 LEU 88 -9.602 2.818 -1.943 709 2HB LEU 88 HB1 LEU 88 -9.109 3.508 -3.475 710 HG LEU 88 HG LEU 88 -11.531 3.572 -4.140 711 1HD1 LEU 88 HD11 LEU 88 -12.894 3.611 -1.799 712 2HD1 LEU 88 HD12 LEU 88 -11.765 2.286 -1.518 713 3HD1 LEU 88 HD13 LEU 88 -12.847 2.241 -2.909 714 1HD2 LEU 88 HD21 LEU 88 -11.928 5.611 -3.066 715 2HD2 LEU 88 HD22 LEU 88 -10.171 5.469 -3.090 716 3HD2 LEU 88 HD23 LEU 88 -11.062 5.116 -1.612 717 H ASP 89 HN ASP 89 -10.127 3.366 -5.271 718 HA ASP 89 HA ASP 89 -9.759 3.807 -7.442 719 1HB ASP 89 HB2 ASP 89 -7.424 3.819 -6.422 720 2HB ASP 89 HB1 ASP 89 -7.201 2.252 -7.182 721 H THR 90 HN THR 90 -7.878 1.631 -8.925 722 HA THR 90 HA THR 90 -10.120 -0.173 -9.531 723 HB THR 90 HB THR 90 -8.199 1.078 -11.502 724 HG1 THR 90 HG1 THR 90 -9.679 2.526 -11.698 725 1HG2 THR 90 HG21 THR 90 -10.346 -0.025 -12.874 726 2HG2 THR 90 HG22 THR 90 -9.833 -1.277 -11.743 727 3HG2 THR 90 HG23 THR 90 -8.674 -0.586 -12.878 728 H ASP 91 HN ASP 91 -9.332 -1.891 -8.354 729 HA ASP 91 HA ASP 91 -6.640 -2.871 -8.918 730 1HB ASP 91 HB2 ASP 91 -7.128 -4.527 -7.137 731 2HB ASP 91 HB1 ASP 91 -7.344 -2.872 -6.581 732 H TYR 92 HN TYR 92 -8.739 -2.935 -10.982 733 HA TYR 92 HA TYR 92 -9.166 -5.824 -11.246 734 1HB TYR 92 HB2 TYR 92 -10.615 -3.444 -12.351 735 2HB TYR 92 HB1 TYR 92 -10.767 -5.016 -13.124 736 HD1 TYR 92 HD1 TYR 92 -13.042 -5.461 -12.693 737 HD2 TYR 92 HD2 TYR 92 -10.469 -4.416 -9.471 738 HE1 TYR 92 HE1 TYR 92 -14.793 -6.099 -11.091 739 HE2 TYR 92 HE2 TYR 92 -12.211 -5.053 -7.862 740 HH TYR 92 HH TYR 92 -14.544 -5.398 -7.713 741 H LYS 93 HN LYS 93 -8.058 -3.001 -13.157 742 HA LYS 93 HA LYS 93 -6.310 -4.805 -14.608 743 1HB LYS 93 HB2 LYS 93 -7.075 -4.128 -16.824 744 2HB LYS 93 HB1 LYS 93 -8.353 -4.928 -15.924 745 1HG LYS 93 HG2 LYS 93 -8.148 -1.936 -16.052 746 2HG LYS 93 HG1 LYS 93 -8.967 -2.872 -17.298 747 1HD LYS 93 HD2 LYS 93 -9.649 -2.982 -14.361 748 2HD LYS 93 HD1 LYS 93 -10.487 -1.979 -15.541 749 1HE LYS 93 HE2 LYS 93 -10.310 -4.990 -15.518 750 2HE LYS 93 HE1 LYS 93 -11.737 -4.009 -15.188 751 1HZ LYS 93 HZ1 LYS 93 -11.938 -4.754 -17.397 752 2HZ LYS 93 HZ2 LYS 93 -10.337 -4.361 -17.774 753 3HZ LYS 93 HZ3 LYS 93 -11.469 -3.132 -17.514 754 H SER 94 HN SER 94 -7.446 -1.434 -14.336 755 HA SER 94 HA SER 94 -5.061 -0.403 -15.534 756 1HB SER 94 HB2 SER 94 -5.940 1.810 -14.858 757 2HB SER 94 HB1 SER 94 -7.148 0.842 -15.701 758 HG SER 94 HG SER 94 -7.577 1.993 -13.509 759 H TYR 95 HN TYR 95 -6.035 1.056 -12.528 760 HA TYR 95 HA TYR 95 -3.695 -0.009 -11.142 761 1HB TYR 95 HB2 TYR 95 -3.291 2.489 -10.426 762 2HB TYR 95 HB1 TYR 95 -2.635 1.882 -11.943 763 HD1 TYR 95 HD1 TYR 95 -2.836 3.299 -13.729 764 HD2 TYR 95 HD2 TYR 95 -5.874 3.358 -10.755 765 HE1 TYR 95 HE1 TYR 95 -4.013 5.060 -14.974 766 HE2 TYR 95 HE2 TYR 95 -7.061 5.121 -11.989 767 HH TYR 95 HH TYR 95 -6.858 5.777 -14.901 768 H ALA 96 HN ALA 96 -3.855 -0.042 -8.925 769 HA ALA 96 HA ALA 96 -6.440 0.846 -7.830 770 1HB ALA 96 HB1 ALA 96 -6.830 -1.257 -7.275 771 2HB ALA 96 HB2 ALA 96 -5.459 -1.186 -6.172 772 3HB ALA 96 HB3 ALA 96 -5.226 -1.749 -7.825 773 H VAL 97 HN VAL 97 -6.487 1.658 -5.710 774 HA VAL 97 HA VAL 97 -3.860 2.381 -4.594 775 HB VAL 97 HB VAL 97 -4.654 4.520 -3.935 776 1HG1 VAL 97 HG11 VAL 97 -5.862 5.061 -6.388 777 2HG1 VAL 97 HG12 VAL 97 -4.803 3.684 -6.690 778 3HG1 VAL 97 HG13 VAL 97 -4.145 5.163 -5.998 779 1HG2 VAL 97 HG21 VAL 97 -6.797 4.401 -3.167 780 2HG2 VAL 97 HG22 VAL 97 -7.331 3.364 -4.487 781 3HG2 VAL 97 HG23 VAL 97 -7.118 5.092 -4.758 782 H ILE 98 HN ILE 98 -3.571 1.856 -2.505 783 HA ILE 98 HA ILE 98 -5.933 1.326 -0.865 784 HB ILE 98 HB ILE 98 -5.351 -0.848 -1.712 785 1HG1 ILE 98 HG12 ILE 98 -4.179 -0.643 1.061 786 2HG1 ILE 98 HG11 ILE 98 -5.908 -0.626 0.732 787 1HG2 ILE 98 HG21 ILE 98 -3.213 -1.773 -1.749 788 2HG2 ILE 98 HG22 ILE 98 -2.584 -0.598 -0.596 789 3HG2 ILE 98 HG23 ILE 98 -2.958 -0.099 -2.246 790 1HD1 ILE 98 HD11 ILE 98 -5.675 -2.828 1.163 791 2HD1 ILE 98 HD12 ILE 98 -3.983 -2.862 0.669 792 3HD1 ILE 98 HD13 ILE 98 -5.258 -2.873 -0.550 793 H TYR 99 HN TYR 99 -5.771 2.359 1.016 794 HA TYR 99 HA TYR 99 -3.091 3.119 1.935 795 1HB TYR 99 HB2 TYR 99 -4.136 4.866 3.238 796 2HB TYR 99 HB1 TYR 99 -4.732 4.954 1.587 797 HD1 TYR 99 HD1 TYR 99 -5.648 3.495 4.902 798 HD2 TYR 99 HD2 TYR 99 -6.998 5.158 1.228 799 HE1 TYR 99 HE1 TYR 99 -7.961 3.442 5.735 800 HE2 TYR 99 HE2 TYR 99 -9.313 5.110 2.048 801 HH TYR 99 HH TYR 99 -10.682 4.228 3.665 802 H ALA 100 HN ALA 100 -2.262 2.354 3.777 803 HA ALA 100 HA ALA 100 -3.929 0.471 5.292 804 1HB ALA 100 HB1 ALA 100 -1.893 -0.624 5.965 805 2HB ALA 100 HB2 ALA 100 -0.923 0.636 5.204 806 3HB ALA 100 HB3 ALA 100 -1.906 -0.440 4.211 807 H THR 101 HN THR 101 -4.341 0.721 7.370 808 HA THR 101 HA THR 101 -2.933 2.831 8.867 809 HB THR 101 HB THR 101 -5.055 3.315 10.036 810 HG1 THR 101 HG1 THR 101 -6.743 2.107 9.759 811 1HG2 THR 101 HG21 THR 101 -4.465 4.566 7.948 812 2HG2 THR 101 HG22 THR 101 -6.182 4.526 8.348 813 3HG2 THR 101 HG23 THR 101 -5.549 3.478 7.079 814 H ARG 102 HN ARG 102 -1.718 1.803 10.318 815 HA ARG 102 HA ARG 102 -2.645 -0.738 11.419 816 1HB ARG 102 HB2 ARG 102 -0.349 -0.988 12.243 817 2HB ARG 102 HB1 ARG 102 -0.401 -0.715 10.509 818 1HG ARG 102 HG2 ARG 102 0.226 1.603 10.831 819 2HG ARG 102 HG1 ARG 102 0.212 1.380 12.582 820 1HD ARG 102 HD2 ARG 102 2.485 1.286 11.696 821 2HD ARG 102 HD1 ARG 102 2.006 -0.260 12.395 822 HE ARG 102 HE ARG 102 1.429 -0.315 9.661 823 1HH1 ARG 102 HH11 ARG 102 4.197 -0.205 11.780 824 2HH1 ARG 102 HH12 ARG 102 5.238 -1.029 10.668 825 1HH2 ARG 102 HH21 ARG 102 2.794 -1.400 8.197 826 2HH2 ARG 102 HH22 ARG 102 4.442 -1.707 8.633 827 H VAL 103 HN VAL 103 -2.892 -1.168 13.555 828 HA VAL 103 HA VAL 103 -2.540 1.017 15.465 829 HB VAL 103 HB VAL 103 -5.073 -0.616 15.279 830 1HG1 VAL 103 HG11 VAL 103 -5.904 0.652 17.091 831 2HG1 VAL 103 HG12 VAL 103 -4.541 1.769 17.028 832 3HG1 VAL 103 HG13 VAL 103 -4.294 0.108 17.568 833 1HG2 VAL 103 HG21 VAL 103 -6.178 1.421 14.582 834 2HG2 VAL 103 HG22 VAL 103 -4.873 1.032 13.462 835 3HG2 VAL 103 HG23 VAL 103 -4.653 2.304 14.663 836 H LYS 104 HN LYS 104 -1.671 0.363 17.326 837 HA LYS 104 HA LYS 104 -2.026 -2.280 18.401 838 1HB LYS 104 HB2 LYS 104 0.340 -2.924 18.321 839 2HB LYS 104 HB1 LYS 104 -0.321 -2.744 16.701 840 1HG LYS 104 HG2 LYS 104 0.721 -0.553 16.503 841 2HG LYS 104 HG1 LYS 104 1.356 -0.699 18.143 842 1HD LYS 104 HD2 LYS 104 2.651 -2.661 17.467 843 2HD LYS 104 HD1 LYS 104 2.013 -2.522 15.828 844 1HE LYS 104 HE2 LYS 104 3.711 -0.473 17.251 845 2HE LYS 104 HE1 LYS 104 4.264 -1.585 16.000 846 1HZ LYS 104 HZ1 LYS 104 2.236 -0.419 14.747 847 2HZ LYS 104 HZ2 LYS 104 3.821 0.167 14.684 848 3HZ LYS 104 HZ3 LYS 104 2.709 0.857 15.755 849 H ASP 105 HN ASP 105 -1.761 -2.241 20.577 850 HA ASP 105 HA ASP 105 -1.439 -1.406 22.674 851 1HB ASP 105 HB2 ASP 105 0.967 -0.097 21.373 852 2HB ASP 105 HB1 ASP 105 0.711 -0.253 23.108 853 H GLY 106 HN GLY 106 -3.270 -0.037 21.056 854 1HA GLY 106 HA2 GLY 106 -4.475 1.920 21.005 855 2HA GLY 106 HA1 GLY 106 -3.614 2.373 22.469 856 H ARG 107 HN ARG 107 -2.112 1.682 19.370 857 HA ARG 107 HA ARG 107 -1.309 4.516 19.194 858 1HB ARG 107 HB2 ARG 107 0.612 3.014 19.607 859 2HB ARG 107 HB1 ARG 107 0.178 2.073 18.186 860 1HG ARG 107 HG2 ARG 107 1.986 3.528 17.608 861 2HG ARG 107 HG1 ARG 107 0.529 4.094 16.790 862 1HD ARG 107 HD2 ARG 107 0.221 5.728 18.643 863 2HD ARG 107 HD1 ARG 107 1.790 5.224 19.284 864 HE ARG 107 HE ARG 107 2.021 5.957 16.563 865 1HH1 ARG 107 HH11 ARG 107 1.656 7.331 19.746 866 2HH1 ARG 107 HH12 ARG 107 2.309 8.869 19.290 867 1HH2 ARG 107 HH21 ARG 107 2.866 7.948 15.953 868 2HH2 ARG 107 HH22 ARG 107 2.997 9.223 17.117 869 H THR 108 HN THR 108 -1.512 5.545 17.236 870 HA THR 108 HA THR 108 -2.882 4.023 15.117 871 HB THR 108 HB THR 108 -4.418 5.559 16.208 872 HG1 THR 108 HG1 THR 108 -3.631 6.605 13.696 873 1HG2 THR 108 HG21 THR 108 -3.717 8.093 15.476 874 2HG2 THR 108 HG22 THR 108 -2.189 7.421 16.044 875 3HG2 THR 108 HG23 THR 108 -3.600 7.421 17.102 876 H LEU 109 HN LEU 109 -2.104 4.165 13.111 877 HA LEU 109 HA LEU 109 -0.171 6.253 12.438 878 1HB LEU 109 HB2 LEU 109 1.104 4.292 13.243 879 2HB LEU 109 HB1 LEU 109 0.321 3.302 12.030 880 HG LEU 109 HG LEU 109 2.124 5.642 11.407 881 1HD1 LEU 109 HD11 LEU 109 2.938 3.272 12.473 882 2HD1 LEU 109 HD12 LEU 109 3.914 4.302 11.427 883 3HD1 LEU 109 HD13 LEU 109 3.027 2.940 10.743 884 1HD2 LEU 109 HD21 LEU 109 0.495 3.795 9.778 885 2HD2 LEU 109 HD22 LEU 109 2.131 4.114 9.201 886 3HD2 LEU 109 HD23 LEU 109 1.008 5.451 9.451 887 H HIS 110 HN HIS 110 -0.557 7.072 10.474 888 HA HIS 110 HA HIS 110 -2.373 5.561 8.718 889 1HB HIS 110 HB2 HIS 110 -1.851 8.536 8.827 890 2HB HIS 110 HB1 HIS 110 -2.990 7.732 7.748 891 HD1 HIS 110 HD1 HIS 110 -4.731 6.085 9.313 892 HD2 HIS 110 HD2 HIS 110 -3.155 9.561 10.958 893 HE1 HIS 110 HE1 HIS 110 -6.234 6.654 11.247 894 HE2 HIS 110 HE2 HIS 110 -5.300 8.798 12.187 895 H MET 111 HN MET 111 -1.871 5.149 6.635 896 HA MET 111 HA MET 111 0.301 6.424 5.292 897 1HB MET 111 HB2 MET 111 1.715 4.445 5.017 898 2HB MET 111 HB1 MET 111 1.583 4.912 6.707 899 1HG MET 111 HG2 MET 111 0.027 3.148 7.136 900 2HG MET 111 HG1 MET 111 -0.042 2.734 5.425 901 1HE MET 111 HE1 MET 111 0.037 0.689 6.999 902 2HE MET 111 HE2 MET 111 1.497 0.015 7.723 903 3HE MET 111 HE3 MET 111 1.166 -0.236 6.009 904 H MET 112 HN MET 112 -0.149 6.461 3.212 905 HA MET 112 HA MET 112 -2.260 4.757 2.158 906 1HB MET 112 HB2 MET 112 -0.952 7.292 1.239 907 2HB MET 112 HB1 MET 112 -1.890 6.324 0.117 908 1HG MET 112 HG2 MET 112 -3.188 8.151 1.081 909 2HG MET 112 HG1 MET 112 -3.858 6.576 1.486 910 1HE MET 112 HE1 MET 112 -5.353 7.705 3.362 911 2HE MET 112 HE2 MET 112 -4.675 9.285 2.972 912 3HE MET 112 HE3 MET 112 -4.710 8.730 4.645 913 H ARG 113 HN ARG 113 -2.043 3.531 0.274 914 HA ARG 113 HA ARG 113 0.651 3.173 -0.803 915 1HB ARG 113 HB2 ARG 113 0.327 1.442 0.949 916 2HB ARG 113 HB1 ARG 113 -1.092 0.864 0.092 917 1HG ARG 113 HG2 ARG 113 0.315 0.294 -1.833 918 2HG ARG 113 HG1 ARG 113 1.735 0.833 -0.933 919 1HD ARG 113 HD2 ARG 113 -0.130 -1.396 -0.129 920 2HD ARG 113 HD1 ARG 113 1.478 -1.596 -0.824 921 HE ARG 113 HE ARG 113 1.747 -0.021 1.453 922 1HH1 ARG 113 HH11 ARG 113 0.752 -3.263 0.644 923 2HH1 ARG 113 HH12 ARG 113 1.287 -3.940 2.145 924 1HH2 ARG 113 HH21 ARG 113 2.454 -0.910 3.437 925 2HH2 ARG 113 HH22 ARG 113 2.252 -2.605 3.730 926 H LEU 114 HN LEU 114 0.672 2.499 -2.975 927 HA LEU 114 HA LEU 114 -1.924 2.127 -4.282 928 1HB LEU 114 HB2 LEU 114 -1.323 4.559 -4.282 929 2HB LEU 114 HB1 LEU 114 0.110 4.158 -5.203 930 HG LEU 114 HG LEU 114 -2.707 3.654 -6.164 931 1HD1 LEU 114 HD11 LEU 114 -2.181 6.066 -5.845 932 2HD1 LEU 114 HD12 LEU 114 -2.486 5.615 -7.522 933 3HD1 LEU 114 HD13 LEU 114 -0.832 5.873 -6.965 934 1HD2 LEU 114 HD21 LEU 114 -1.583 2.307 -7.571 935 2HD2 LEU 114 HD22 LEU 114 -0.026 3.055 -7.209 936 3HD2 LEU 114 HD23 LEU 114 -1.125 3.816 -8.359 937 H TYR 115 HN TYR 115 -1.856 0.761 -6.013 938 HA TYR 115 HA TYR 115 0.773 0.037 -7.067 939 1HB TYR 115 HB2 TYR 115 0.302 -2.332 -6.915 940 2HB TYR 115 HB1 TYR 115 0.175 -1.605 -5.317 941 HD1 TYR 115 HD1 TYR 115 -1.891 -1.608 -4.124 942 HD2 TYR 115 HD2 TYR 115 -1.749 -2.998 -8.142 943 HE1 TYR 115 HE1 TYR 115 -4.144 -2.557 -3.869 944 HE2 TYR 115 HE2 TYR 115 -4.004 -3.949 -7.899 945 HH TYR 115 HH TYR 115 -6.003 -3.263 -5.180 946 H SER 116 HN SER 116 0.838 -0.074 -9.201 947 HA SER 116 HA SER 116 -1.710 -0.095 -10.660 948 1HB SER 116 HB2 SER 116 -0.354 1.887 -11.079 949 2HB SER 116 HB1 SER 116 1.025 0.881 -11.518 950 HG SER 116 HG SER 116 -1.440 0.685 -12.881 951 H ARG 117 HN ARG 117 -2.161 -1.629 -12.131 952 HA ARG 117 HA ARG 117 -0.824 -4.098 -12.069 953 1HB ARG 117 HB2 ARG 117 -2.936 -2.903 -13.833 954 2HB ARG 117 HB1 ARG 117 -2.238 -4.464 -14.235 955 1HG ARG 117 HG2 ARG 117 -4.400 -4.464 -12.915 956 2HG ARG 117 HG1 ARG 117 -3.090 -5.471 -12.306 957 1HD ARG 117 HD2 ARG 117 -2.530 -3.782 -10.651 958 2HD ARG 117 HD1 ARG 117 -3.768 -2.707 -11.301 959 HE ARG 117 HE ARG 117 -5.246 -3.789 -9.959 960 1HH1 ARG 117 HH11 ARG 117 -2.673 -6.031 -10.704 961 2HH1 ARG 117 HH12 ARG 117 -3.390 -7.336 -9.826 962 1HH2 ARG 117 HH21 ARG 117 -6.169 -5.498 -8.775 963 2HH2 ARG 117 HH22 ARG 117 -5.371 -7.033 -8.722 964 H SER 118 HN SER 118 -0.668 -1.382 -14.300 965 HA SER 118 HA SER 118 1.670 -2.642 -15.565 966 1HB SER 118 HB2 SER 118 -0.435 -0.946 -16.929 967 2HB SER 118 HB1 SER 118 1.026 -1.572 -17.692 968 HG SER 118 HG SER 118 -1.331 -2.851 -17.073 969 HA PRO 119 HA PRO 119 4.216 0.789 -14.556 970 1HB PRO 119 HB2 PRO 119 5.112 1.378 -17.180 971 2HB PRO 119 HB1 PRO 119 5.913 0.357 -15.986 972 1HG PRO 119 HG2 PRO 119 4.171 -0.405 -18.268 973 2HG PRO 119 HG1 PRO 119 5.530 -1.283 -17.543 974 1HD PRO 119 HD2 PRO 119 3.000 -2.047 -17.125 975 2HD PRO 119 HD1 PRO 119 4.218 -2.150 -15.834 976 H GLU 120 HN GLU 120 1.876 1.094 -17.130 977 HA GLU 120 HA GLU 120 2.035 3.863 -17.579 978 1HB GLU 120 HB2 GLU 120 0.925 2.308 -19.107 979 2HB GLU 120 HB1 GLU 120 -0.310 1.987 -17.902 980 1HG GLU 120 HG2 GLU 120 -1.105 3.495 -19.633 981 2HG GLU 120 HG1 GLU 120 -1.095 4.274 -18.054 982 H VAL 121 HN VAL 121 2.282 4.179 -15.049 983 HA VAL 121 HA VAL 121 -0.168 4.310 -13.568 984 HB VAL 121 HB VAL 121 2.509 5.573 -12.945 985 1HG1 VAL 121 HG11 VAL 121 0.084 5.109 -11.210 986 2HG1 VAL 121 HG12 VAL 121 0.738 6.667 -11.714 987 3HG1 VAL 121 HG13 VAL 121 1.662 5.635 -10.622 988 1HG2 VAL 121 HG21 VAL 121 2.329 3.536 -11.230 989 2HG2 VAL 121 HG22 VAL 121 3.056 3.370 -12.828 990 3HG2 VAL 121 HG23 VAL 121 1.390 2.858 -12.560 991 H SER 122 HN SER 122 -1.541 5.567 -14.836 992 HA SER 122 HA SER 122 -0.960 8.105 -15.871 993 1HB SER 122 HB2 SER 122 -2.853 6.812 -16.665 994 2HB SER 122 HB1 SER 122 -3.613 6.892 -15.076 995 HG SER 122 HG SER 122 -4.534 8.469 -16.324 996 HA PRO 123 HA PRO 123 -0.977 11.028 -12.572 997 1HB PRO 123 HB2 PRO 123 -2.766 12.875 -13.694 998 2HB PRO 123 HB1 PRO 123 -1.016 12.855 -13.932 999 1HG PRO 123 HG2 PRO 123 -3.181 11.765 -15.675 1000 2HG PRO 123 HG1 PRO 123 -1.669 12.572 -16.133 1001 1HD PRO 123 HD2 PRO 123 -1.910 9.932 -16.351 1002 2HD PRO 123 HD1 PRO 123 -0.395 10.653 -15.766 1003 H ALA 124 HN ALA 124 -3.994 9.883 -13.954 1004 HA ALA 124 HA ALA 124 -5.783 10.871 -12.036 1005 1HB ALA 124 HB1 ALA 124 -6.701 8.334 -12.917 1006 2HB ALA 124 HB2 ALA 124 -5.896 9.123 -14.274 1007 3HB ALA 124 HB3 ALA 124 -7.223 9.933 -13.444 1008 H ALA 125 HN ALA 125 -4.235 7.686 -12.279 1009 HA ALA 125 HA ALA 125 -5.241 6.532 -9.983 1010 1HB ALA 125 HB1 ALA 125 -3.713 4.892 -10.317 1011 2HB ALA 125 HB2 ALA 125 -2.388 6.024 -10.583 1012 3HB ALA 125 HB3 ALA 125 -3.548 5.705 -11.872 1013 H THR 126 HN THR 126 -2.249 8.427 -10.343 1014 HA THR 126 HA THR 126 -1.658 8.354 -7.548 1015 HB THR 126 HB THR 126 0.121 8.601 -9.186 1016 HG1 THR 126 HG1 THR 126 0.755 9.484 -7.325 1017 1HG2 THR 126 HG21 THR 126 -1.236 10.064 -10.776 1018 2HG2 THR 126 HG22 THR 126 0.468 10.463 -10.553 1019 3HG2 THR 126 HG23 THR 126 -0.774 11.407 -9.731 1020 H ALA 127 HN ALA 127 -2.932 10.893 -9.685 1021 HA ALA 127 HA ALA 127 -3.181 12.810 -7.600 1022 1HB ALA 127 HB1 ALA 127 -4.122 14.241 -9.193 1023 2HB ALA 127 HB2 ALA 127 -4.697 12.901 -10.184 1024 3HB ALA 127 HB3 ALA 127 -2.971 13.249 -10.092 1025 H ILE 128 HN ILE 128 -5.645 10.883 -9.341 1026 HA ILE 128 HA ILE 128 -7.839 11.811 -7.912 1027 HB ILE 128 HB ILE 128 -7.487 9.060 -9.106 1028 1HG1 ILE 128 HG12 ILE 128 -8.847 11.523 -10.227 1029 2HG1 ILE 128 HG11 ILE 128 -7.248 10.962 -10.701 1030 1HG2 ILE 128 HG21 ILE 128 -9.470 8.539 -8.253 1031 2HG2 ILE 128 HG22 ILE 128 -10.192 9.912 -9.092 1032 3HG2 ILE 128 HG23 ILE 128 -9.555 10.112 -7.461 1033 1HD1 ILE 128 HD11 ILE 128 -8.931 10.300 -12.318 1034 2HD1 ILE 128 HD12 ILE 128 -9.825 9.450 -11.056 1035 3HD1 ILE 128 HD13 ILE 128 -8.222 8.891 -11.533 1036 H PHE 129 HN PHE 129 -5.594 9.165 -7.128 1037 HA PHE 129 HA PHE 129 -7.039 8.206 -4.894 1038 1HB PHE 129 HB2 PHE 129 -5.215 6.892 -5.835 1039 2HB PHE 129 HB1 PHE 129 -4.057 8.155 -5.437 1040 HD1 PHE 129 HD1 PHE 129 -6.791 7.026 -3.228 1041 HD2 PHE 129 HD2 PHE 129 -2.613 6.879 -4.042 1042 HE1 PHE 129 HE1 PHE 129 -6.403 5.986 -1.034 1043 HE2 PHE 129 HE2 PHE 129 -2.221 5.836 -1.847 1044 HZ PHE 129 HZ PHE 129 -4.116 5.391 -0.339 1045 H ARG 130 HN ARG 130 -4.553 10.675 -5.268 1046 HA ARG 130 HA ARG 130 -4.370 11.359 -2.519 1047 1HB ARG 130 HB2 ARG 130 -2.582 11.896 -4.094 1048 2HB ARG 130 HB1 ARG 130 -3.669 12.923 -5.014 1049 1HG ARG 130 HG2 ARG 130 -3.828 14.465 -3.142 1050 2HG ARG 130 HG1 ARG 130 -2.787 13.418 -2.175 1051 1HD ARG 130 HD2 ARG 130 -0.952 13.761 -3.720 1052 2HD ARG 130 HD1 ARG 130 -1.989 14.712 -4.781 1053 HE ARG 130 HE ARG 130 -0.585 15.649 -2.516 1054 1HH1 ARG 130 HH11 ARG 130 -3.616 16.037 -4.208 1055 2HH1 ARG 130 HH12 ARG 130 -3.870 17.649 -3.633 1056 1HH2 ARG 130 HH21 ARG 130 -0.914 17.769 -1.772 1057 2HH2 ARG 130 HH22 ARG 130 -2.335 18.635 -2.253 1058 H LYS 131 HN LYS 131 -6.133 12.708 -5.276 1059 HA LYS 131 HA LYS 131 -7.381 14.838 -3.913 1060 1HB LYS 131 HB2 LYS 131 -7.246 14.642 -6.389 1061 2HB LYS 131 HB1 LYS 131 -8.378 13.299 -6.321 1062 1HG LYS 131 HG2 LYS 131 -10.100 14.773 -5.433 1063 2HG LYS 131 HG1 LYS 131 -8.967 16.124 -5.459 1064 1HD LYS 131 HD2 LYS 131 -10.425 16.213 -7.399 1065 2HD LYS 131 HD1 LYS 131 -8.764 15.890 -7.899 1066 1HE LYS 131 HE2 LYS 131 -9.290 13.507 -8.092 1067 2HE LYS 131 HE1 LYS 131 -10.949 13.832 -7.593 1068 1HZ LYS 131 HZ1 LYS 131 -10.599 13.624 -10.042 1069 2HZ LYS 131 HZ2 LYS 131 -9.707 15.061 -9.989 1070 3HZ LYS 131 HZ3 LYS 131 -11.342 15.066 -9.557 1071 H LEU 132 HN LEU 132 -8.434 11.544 -4.667 1072 HA LEU 132 HA LEU 132 -10.958 11.690 -3.408 1073 1HB LEU 132 HB2 LEU 132 -10.275 9.963 -5.073 1074 2HB LEU 132 HB1 LEU 132 -9.222 9.257 -3.864 1075 HG LEU 132 HG LEU 132 -12.221 9.467 -3.575 1076 1HD1 LEU 132 HD11 LEU 132 -11.413 7.999 -5.460 1077 2HD1 LEU 132 HD12 LEU 132 -12.375 7.195 -4.220 1078 3HD1 LEU 132 HD13 LEU 132 -10.621 7.007 -4.235 1079 1HD2 LEU 132 HD21 LEU 132 -10.021 8.524 -1.854 1080 2HD2 LEU 132 HD22 LEU 132 -11.430 7.467 -1.952 1081 3HD2 LEU 132 HD23 LEU 132 -11.617 9.140 -1.425 1082 H ALA 133 HN ALA 133 -7.750 10.729 -2.321 1083 HA ALA 133 HA ALA 133 -8.461 9.780 0.230 1084 1HB ALA 133 HB1 ALA 133 -5.933 10.795 -0.995 1085 2HB ALA 133 HB2 ALA 133 -6.317 9.188 -0.379 1086 3HB ALA 133 HB3 ALA 133 -6.006 10.511 0.744 1087 H GLY 134 HN GLY 134 -7.630 13.000 -0.963 1088 1HA GLY 134 HA2 GLY 134 -7.469 14.335 1.485 1089 2HA GLY 134 HA1 GLY 134 -7.922 15.076 -0.041 1090 H GLU 135 HN GLU 135 -10.292 13.815 -0.601 1091 HA GLU 135 HA GLU 135 -12.131 15.294 0.881 1092 1HB GLU 135 HB2 GLU 135 -12.672 12.791 -0.724 1093 2HB GLU 135 HB1 GLU 135 -13.861 14.000 -0.254 1094 1HG GLU 135 HG2 GLU 135 -11.523 14.437 -2.095 1095 2HG GLU 135 HG1 GLU 135 -13.209 14.257 -2.574 1096 H ARG 136 HN ARG 136 -11.425 11.802 1.044 1097 HA ARG 136 HA ARG 136 -13.010 11.626 3.487 1098 1HB ARG 136 HB2 ARG 136 -13.395 9.916 1.797 1099 2HB ARG 136 HB1 ARG 136 -11.696 9.468 1.834 1100 1HG ARG 136 HG2 ARG 136 -11.929 8.706 4.132 1101 2HG ARG 136 HG1 ARG 136 -13.626 9.193 4.130 1102 1HD ARG 136 HD2 ARG 136 -13.388 6.788 3.752 1103 2HD ARG 136 HD1 ARG 136 -14.097 7.595 2.354 1104 HE ARG 136 HE ARG 136 -11.333 7.464 1.973 1105 1HH1 ARG 136 HH11 ARG 136 -14.071 5.311 2.175 1106 2HH1 ARG 136 HH12 ARG 136 -13.368 4.117 1.136 1107 1HH2 ARG 136 HH21 ARG 136 -10.408 5.896 0.603 1108 2HH2 ARG 136 HH22 ARG 136 -11.288 4.447 0.247 1109 H ASN 137 HN ASN 137 -9.888 10.145 2.560 1110 HA ASN 137 HA ASN 137 -9.011 10.091 5.273 1111 1HB ASN 137 HB2 ASN 137 -7.671 9.430 2.663 1112 2HB ASN 137 HB1 ASN 137 -6.784 9.409 4.186 1113 1HD2 ASN 137 HD21 ASN 137 -6.631 7.495 5.059 1114 2HD2 ASN 137 HD22 ASN 137 -7.797 6.226 4.956 1115 H TYR 138 HN TYR 138 -6.327 11.056 3.448 1116 HA TYR 138 HA TYR 138 -6.660 13.876 4.150 1117 1HB TYR 138 HB2 TYR 138 -4.407 12.114 5.113 1118 2HB TYR 138 HB1 TYR 138 -4.347 13.870 5.144 1119 HD1 TYR 138 HD1 TYR 138 -6.560 11.078 6.301 1120 HD2 TYR 138 HD2 TYR 138 -4.959 14.943 7.075 1121 HE1 TYR 138 HE1 TYR 138 -7.675 11.095 8.492 1122 HE2 TYR 138 HE2 TYR 138 -6.065 14.968 9.269 1123 HH TYR 138 HH TYR 138 -7.368 12.225 10.702 1124 H THR 139 HN THR 139 -5.720 15.262 2.770 1125 HA THR 139 HA THR 139 -4.216 14.090 0.545 1126 HB THR 139 HB THR 139 -6.074 15.185 -0.336 1127 HG1 THR 139 HG1 THR 139 -4.917 16.224 -1.700 1128 1HG2 THR 139 HG21 THR 139 -5.745 17.095 1.865 1129 2HG2 THR 139 HG22 THR 139 -7.206 16.516 1.066 1130 3HG2 THR 139 HG23 THR 139 -6.243 17.798 0.330 1131 H ASP 140 HN ASP 140 -3.990 17.517 1.052 1132 HA ASP 140 HA ASP 140 -1.247 17.644 0.880 1133 1HB ASP 140 HB2 ASP 140 -2.722 19.582 0.567 1134 2HB ASP 140 HB1 ASP 140 -3.077 19.600 2.291 1135 H GLU 141 HN GLU 141 -3.163 16.896 3.664 1136 HA GLU 141 HA GLU 141 -1.801 17.595 5.857 1137 1HB GLU 141 HB2 GLU 141 -3.732 16.152 5.962 1138 2HB GLU 141 HB1 GLU 141 -2.834 14.830 5.229 1139 1HG GLU 141 HG2 GLU 141 -3.082 14.472 7.602 1140 2HG GLU 141 HG1 GLU 141 -1.385 14.723 7.190 1141 H MET 142 HN MET 142 -1.016 14.388 4.559 1142 HA MET 142 HA MET 142 1.819 14.958 4.624 1143 1HB MET 142 HB2 MET 142 0.526 13.003 6.522 1144 2HB MET 142 HB1 MET 142 2.221 12.899 6.076 1145 1HG MET 142 HG2 MET 142 0.877 15.203 7.473 1146 2HG MET 142 HG1 MET 142 1.968 14.024 8.197 1147 1HE MET 142 HE1 MET 142 4.108 16.514 8.853 1148 2HE MET 142 HE2 MET 142 2.346 16.524 8.918 1149 3HE MET 142 HE3 MET 142 3.197 17.730 7.955 1150 H VAL 143 HN VAL 143 2.724 13.975 2.966 1151 HA VAL 143 HA VAL 143 1.309 11.728 1.694 1152 HB VAL 143 HB VAL 143 3.258 13.683 0.440 1153 1HG1 VAL 143 HG11 VAL 143 2.100 12.768 -1.688 1154 2HG1 VAL 143 HG12 VAL 143 1.673 11.397 -0.666 1155 3HG1 VAL 143 HG13 VAL 143 3.369 11.812 -0.924 1156 1HG2 VAL 143 HG21 VAL 143 1.320 14.923 0.991 1157 2HG2 VAL 143 HG22 VAL 143 0.250 13.618 0.479 1158 3HG2 VAL 143 HG23 VAL 143 1.169 14.526 -0.721 1159 H ALA 144 HN ALA 144 2.984 10.460 0.233 1160 HA ALA 144 HA ALA 144 5.588 10.085 1.353 1161 1HB ALA 144 HB1 ALA 144 4.882 7.522 1.664 1162 2HB ALA 144 HB2 ALA 144 3.345 8.283 2.075 1163 3HB ALA 144 HB3 ALA 144 4.801 8.697 2.977 1164 H MET 145 HN MET 145 6.596 10.132 -0.586 1165 HA MET 145 HA MET 145 5.606 8.303 -2.682 1166 1HB MET 145 HB2 MET 145 6.646 9.857 -4.325 1167 2HB MET 145 HB1 MET 145 5.318 10.578 -3.425 1168 1HG MET 145 HG2 MET 145 6.953 11.676 -1.949 1169 2HG MET 145 HG1 MET 145 8.257 10.995 -2.920 1170 1HE MET 145 HE1 MET 145 6.879 11.216 -5.852 1171 2HE MET 145 HE2 MET 145 8.578 11.555 -5.520 1172 3HE MET 145 HE3 MET 145 7.598 12.734 -6.393 1173 H LEU 146 HN LEU 146 6.907 6.612 -2.948 1174 HA LEU 146 HA LEU 146 8.758 5.269 -2.811 1175 1HB LEU 146 HB2 LEU 146 9.987 7.680 -4.150 1176 2HB LEU 146 HB1 LEU 146 10.648 6.057 -4.165 1177 HG LEU 146 HG LEU 146 8.569 5.307 -5.362 1178 1HD1 LEU 146 HD11 LEU 146 8.029 8.238 -5.202 1179 2HD1 LEU 146 HD12 LEU 146 6.936 6.878 -4.946 1180 3HD1 LEU 146 HD13 LEU 146 7.444 7.306 -6.579 1181 1HD2 LEU 146 HD21 LEU 146 9.392 5.878 -7.465 1182 2HD2 LEU 146 HD22 LEU 146 10.809 5.997 -6.421 1183 3HD2 LEU 146 HD23 LEU 146 9.957 7.458 -6.922 1184 HA PRO 147 HA PRO 147 10.826 7.743 0.664 1185 1HB PRO 147 HB2 PRO 147 9.471 6.904 2.816 1186 2HB PRO 147 HB1 PRO 147 8.886 8.251 1.831 1187 1HG PRO 147 HG2 PRO 147 8.024 5.382 1.823 1188 2HG PRO 147 HG1 PRO 147 7.029 6.848 1.759 1189 1HD PRO 147 HD2 PRO 147 7.685 5.361 -0.441 1190 2HD PRO 147 HD1 PRO 147 7.326 7.096 -0.492 1191 H ARG 148 HN ARG 148 12.403 6.849 2.043 1192 HA ARG 148 HA ARG 148 12.346 3.976 2.491 1193 1HB ARG 148 HB2 ARG 148 14.804 5.222 1.282 1194 2HB ARG 148 HB1 ARG 148 14.472 3.517 1.529 1195 1HG ARG 148 HG2 ARG 148 14.070 3.648 -0.697 1196 2HG ARG 148 HG1 ARG 148 12.461 4.056 -0.103 1197 1HD ARG 148 HD2 ARG 148 12.830 6.373 -0.424 1198 2HD ARG 148 HD1 ARG 148 14.554 6.129 -0.702 1199 HE ARG 148 HE ARG 148 13.049 4.711 -2.627 1200 1HH1 ARG 148 HH11 ARG 148 13.998 7.950 -1.749 1201 2HH1 ARG 148 HH12 ARG 148 13.892 8.556 -3.368 1202 1HH2 ARG 148 HH21 ARG 148 12.908 5.508 -4.761 1203 2HH2 ARG 148 HH22 ARG 148 13.273 7.171 -5.076 1204 H GLN 149 HN GLN 149 15.349 4.267 3.112 1205 HA GLN 149 HA GLN 149 14.997 4.843 5.887 1206 1HB GLN 149 HB2 GLN 149 17.521 4.284 4.327 1207 2HB GLN 149 HB1 GLN 149 17.358 4.241 6.078 1208 1HG GLN 149 HG2 GLN 149 15.783 2.397 5.897 1209 2HG GLN 149 HG1 GLN 149 15.913 2.449 4.141 1210 1HE2 GLN 149 HE21 GLN 149 16.893 0.835 6.777 1211 2HE2 GLN 149 HE22 GLN 149 18.390 0.189 6.205 1212 H GLU 150 HN GLU 150 16.664 6.217 7.047 1213 HA GLU 150 HA GLU 150 16.385 8.894 6.223 1214 1HB GLU 150 HB2 GLU 150 17.984 9.401 8.072 1215 2HB GLU 150 HB1 GLU 150 16.610 8.421 8.560 1216 1HG GLU 150 HG2 GLU 150 18.350 7.391 9.640 1217 2HG GLU 150 HG1 GLU 150 18.214 6.426 8.173 1218 H GLU 151 HN GLU 151 18.754 6.470 5.543 1219 HA GLU 151 HA GLU 151 20.803 8.269 4.648 1220 1HB GLU 151 HB2 GLU 151 20.419 5.300 4.220 1221 2HB GLU 151 HB1 GLU 151 21.836 6.200 3.696 1222 1HG GLU 151 HG2 GLU 151 20.904 5.934 6.547 1223 2HG GLU 151 HG1 GLU 151 22.202 5.001 5.802 1224 H CYS 152 HN CYS 152 17.975 6.830 3.286 1225 HA CYS 152 HA CYS 152 18.483 8.208 0.754 1226 1HB CYS 152 HB2 CYS 152 17.695 6.242 -0.532 1227 2HB CYS 152 HB1 CYS 152 19.185 5.902 0.342 1228 H THR 153 HN THR 153 16.758 9.496 0.371 1229 HA THR 153 HA THR 153 14.082 8.504 0.640 1230 HB THR 153 HB THR 153 14.495 8.948 2.972 1231 HG1 THR 153 HG1 THR 153 12.601 9.797 3.128 1232 1HG2 THR 153 HG21 THR 153 14.730 11.538 3.491 1233 2HG2 THR 153 HG22 THR 153 15.637 11.485 1.980 1234 3HG2 THR 153 HG23 THR 153 16.124 10.469 3.336 1235 H VAL 154 HN VAL 154 12.466 9.936 -0.100 1236 HA VAL 154 HA VAL 154 13.302 11.586 -2.256 1237 HB VAL 154 HB VAL 154 10.957 11.969 -2.670 1238 1HG1 VAL 154 HG11 VAL 154 10.459 9.833 -3.292 1239 2HG1 VAL 154 HG12 VAL 154 10.919 9.155 -1.731 1240 3HG1 VAL 154 HG13 VAL 154 12.164 9.622 -2.891 1241 1HG2 VAL 154 HG21 VAL 154 9.845 12.416 -0.720 1242 2HG2 VAL 154 HG22 VAL 154 10.685 11.152 0.178 1243 3HG2 VAL 154 HG23 VAL 154 9.381 10.728 -0.931 1244 H ASP 155 HN ASP 155 13.091 13.778 -2.569 1245 HA ASP 155 HA ASP 155 13.717 15.477 -0.445 1246 1HB ASP 155 HB2 ASP 155 13.309 17.313 -2.049 1247 2HB ASP 155 HB1 ASP 155 14.269 16.017 -2.759 1248 H GLU 156 HN GLU 156 12.531 17.249 0.452 1249 HA GLU 156 HA GLU 156 10.810 18.018 1.724 1250 1HB GLU 156 HB2 GLU 156 8.785 18.621 0.480 1251 2HB GLU 156 HB1 GLU 156 10.241 19.032 -0.412 1252 1HG GLU 156 HG2 GLU 156 9.954 17.112 -1.844 1253 2HG GLU 156 HG1 GLU 156 8.560 16.584 -0.903 1254 H VAL 157 HN VAL 157 11.239 15.403 2.312 1255 HA VAL 157 HA VAL 157 8.668 14.616 3.326 1256 HB VAL 157 HB VAL 157 10.078 12.757 1.399 1257 1HG1 VAL 157 HG11 VAL 157 7.995 12.323 3.462 1258 2HG1 VAL 157 HG12 VAL 157 9.248 11.234 2.868 1259 3HG1 VAL 157 HG13 VAL 157 7.788 11.498 1.916 1260 1HG2 VAL 157 HG21 VAL 157 7.453 14.224 1.244 1261 2HG2 VAL 157 HG22 VAL 157 7.874 12.871 0.193 1262 3HG2 VAL 157 HG23 VAL 157 8.831 14.351 0.151 Start of MODEL 17 1 1H MET 1 HT1 MET 1 -20.728 -7.436 -17.596 2 2H MET 1 HT2 MET 1 -21.303 -5.935 -18.123 3 3H MET 1 HT3 MET 1 -19.875 -6.023 -17.222 4 HA MET 1 HA MET 1 -20.234 -7.232 -19.902 5 1HB MET 1 HB2 MET 1 -20.391 -4.738 -19.865 6 2HB MET 1 HB1 MET 1 -18.798 -4.683 -19.127 7 1HG MET 1 HG2 MET 1 -17.834 -5.728 -21.107 8 2HG MET 1 HG1 MET 1 -19.432 -5.812 -21.844 9 1HE MET 1 HE1 MET 1 -20.450 -2.499 -22.821 10 2HE MET 1 HE2 MET 1 -20.435 -2.328 -21.066 11 3HE MET 1 HE3 MET 1 -20.940 -3.851 -21.798 12 H THR 2 HN THR 2 -19.238 -8.756 -17.874 13 HA THR 2 HA THR 2 -16.702 -9.491 -18.805 14 HB THR 2 HB THR 2 -15.914 -7.459 -17.717 15 HG1 THR 2 HG1 THR 2 -14.718 -9.522 -17.554 16 1HG2 THR 2 HG21 THR 2 -17.739 -8.198 -15.646 17 2HG2 THR 2 HG22 THR 2 -16.840 -6.696 -15.866 18 3HG2 THR 2 HG23 THR 2 -16.110 -8.041 -14.988 19 H VAL 3 HN VAL 3 -16.348 -11.556 -18.257 20 HA VAL 3 HA VAL 3 -18.222 -12.897 -16.558 21 HB VAL 3 HB VAL 3 -15.730 -14.000 -17.860 22 1HG1 VAL 3 HG11 VAL 3 -16.776 -16.172 -17.585 23 2HG1 VAL 3 HG12 VAL 3 -18.176 -15.424 -16.816 24 3HG1 VAL 3 HG13 VAL 3 -16.603 -15.379 -16.020 25 1HG2 VAL 3 HG21 VAL 3 -18.421 -13.376 -18.894 26 2HG2 VAL 3 HG22 VAL 3 -17.756 -14.944 -19.352 27 3HG2 VAL 3 HG23 VAL 3 -16.873 -13.466 -19.734 28 HA PRO 4 HA PRO 4 -16.117 -12.565 -12.663 29 1HB PRO 4 HB2 PRO 4 -17.167 -15.306 -12.200 30 2HB PRO 4 HB1 PRO 4 -17.352 -13.849 -11.218 31 1HG PRO 4 HG2 PRO 4 -19.377 -14.775 -12.680 32 2HG PRO 4 HG1 PRO 4 -19.087 -13.032 -12.519 33 1HD PRO 4 HD2 PRO 4 -18.489 -14.852 -14.813 34 2HD PRO 4 HD1 PRO 4 -19.059 -13.171 -14.823 35 H ASP 5 HN ASP 5 -14.183 -13.182 -11.809 36 HA ASP 5 HA ASP 5 -12.993 -15.714 -12.145 37 1HB ASP 5 HB2 ASP 5 -11.178 -15.124 -13.703 38 2HB ASP 5 HB1 ASP 5 -12.756 -15.026 -14.479 39 H ARG 6 HN ARG 6 -11.634 -15.935 -10.495 40 HA ARG 6 HA ARG 6 -10.942 -13.759 -8.819 41 1HB ARG 6 HB2 ARG 6 -9.784 -16.551 -8.886 42 2HB ARG 6 HB1 ARG 6 -9.603 -15.398 -7.573 43 1HG ARG 6 HG2 ARG 6 -12.195 -16.624 -8.499 44 2HG ARG 6 HG1 ARG 6 -11.283 -17.082 -7.061 45 1HD ARG 6 HD2 ARG 6 -13.033 -15.659 -6.329 46 2HD ARG 6 HD1 ARG 6 -11.550 -14.709 -6.268 47 HE ARG 6 HE ARG 6 -12.824 -14.315 -8.749 48 1HH1 ARG 6 HH11 ARG 6 -13.218 -13.536 -5.371 49 2HH1 ARG 6 HH12 ARG 6 -14.065 -12.059 -5.684 50 1HH2 ARG 6 HH21 ARG 6 -13.932 -12.370 -9.161 51 2HH2 ARG 6 HH22 ARG 6 -14.470 -11.396 -7.833 52 H SER 7 HN SER 7 -9.305 -15.425 -11.410 53 HA SER 7 HA SER 7 -6.680 -14.688 -11.030 54 1HB SER 7 HB2 SER 7 -7.405 -16.170 -12.845 55 2HB SER 7 HB1 SER 7 -8.186 -14.810 -13.655 56 HG SER 7 HG SER 7 -5.523 -15.504 -13.531 57 H GLU 8 HN GLU 8 -9.360 -12.742 -12.221 58 HA GLU 8 HA GLU 8 -8.136 -10.605 -13.391 59 1HB GLU 8 HB2 GLU 8 -10.018 -9.259 -12.740 60 2HB GLU 8 HB1 GLU 8 -10.599 -10.890 -13.044 61 1HG GLU 8 HG2 GLU 8 -10.437 -11.270 -10.551 62 2HG GLU 8 HG1 GLU 8 -10.190 -9.533 -10.400 63 H ILE 9 HN ILE 9 -8.549 -11.151 -9.919 64 HA ILE 9 HA ILE 9 -7.091 -8.785 -9.190 65 HB ILE 9 HB ILE 9 -8.272 -11.075 -7.652 66 1HG1 ILE 9 HG12 ILE 9 -9.686 -9.170 -8.395 67 2HG1 ILE 9 HG11 ILE 9 -9.622 -9.337 -6.643 68 1HG2 ILE 9 HG21 ILE 9 -6.180 -10.701 -6.527 69 2HG2 ILE 9 HG22 ILE 9 -7.480 -10.009 -5.559 70 3HG2 ILE 9 HG23 ILE 9 -6.448 -8.959 -6.527 71 1HD1 ILE 9 HD11 ILE 9 -8.579 -7.363 -6.363 72 2HD1 ILE 9 HD12 ILE 9 -9.315 -7.009 -7.926 73 3HD1 ILE 9 HD13 ILE 9 -7.632 -7.526 -7.842 74 H ALA 10 HN ALA 10 -6.418 -12.242 -9.411 75 HA ALA 10 HA ALA 10 -3.879 -12.207 -8.193 76 1HB ALA 10 HB1 ALA 10 -4.241 -14.154 -10.360 77 2HB ALA 10 HB2 ALA 10 -5.524 -14.148 -9.149 78 3HB ALA 10 HB3 ALA 10 -3.849 -14.406 -8.659 79 H GLY 11 HN GLY 11 -1.939 -11.512 -8.888 80 1HA GLY 11 HA2 GLY 11 -0.816 -11.700 -11.363 81 2HA GLY 11 HA1 GLY 11 -1.757 -10.221 -11.462 82 H LYS 12 HN LYS 12 -0.090 -8.785 -11.620 83 HA LYS 12 HA LYS 12 1.816 -8.727 -9.375 84 1HB LYS 12 HB2 LYS 12 2.125 -7.612 -12.164 85 2HB LYS 12 HB1 LYS 12 3.306 -7.445 -10.873 86 1HG LYS 12 HG2 LYS 12 3.581 -9.871 -10.810 87 2HG LYS 12 HG1 LYS 12 2.402 -10.034 -12.114 88 1HD LYS 12 HD2 LYS 12 3.849 -8.716 -13.584 89 2HD LYS 12 HD1 LYS 12 5.028 -8.555 -12.280 90 1HE LYS 12 HE2 LYS 12 5.676 -10.314 -13.841 91 2HE LYS 12 HE1 LYS 12 5.328 -10.976 -12.245 92 1HZ LYS 12 HZ1 LYS 12 3.355 -11.911 -12.972 93 2HZ LYS 12 HZ2 LYS 12 4.383 -12.159 -14.292 94 3HZ LYS 12 HZ3 LYS 12 3.245 -10.909 -14.331 95 H TRP 13 HN TRP 13 1.720 -7.108 -8.013 96 HA TRP 13 HA TRP 13 0.178 -4.704 -8.735 97 1HB TRP 13 HB2 TRP 13 0.712 -6.024 -6.068 98 2HB TRP 13 HB1 TRP 13 0.019 -4.414 -6.217 99 HD1 TRP 13 HD1 TRP 13 -1.256 -6.732 -8.853 100 HE1 TRP 13 HE1 TRP 13 -3.645 -7.489 -8.272 101 HE3 TRP 13 HE3 TRP 13 -1.481 -5.072 -4.028 102 HZ2 TRP 13 HZ2 TRP 13 -5.389 -7.397 -6.064 103 HZ3 TRP 13 HZ3 TRP 13 -3.548 -5.448 -2.746 104 HH2 TRP 13 HH2 TRP 13 -5.462 -6.589 -3.747 105 H TYR 14 HN TYR 14 1.222 -2.772 -8.775 106 HA TYR 14 HA TYR 14 4.002 -2.732 -7.800 107 1HB TYR 14 HB2 TYR 14 2.678 -1.041 -9.929 108 2HB TYR 14 HB1 TYR 14 4.331 -0.827 -9.368 109 HD1 TYR 14 HD1 TYR 14 2.226 -3.712 -10.509 110 HD2 TYR 14 HD2 TYR 14 5.916 -1.618 -10.817 111 HE1 TYR 14 HE1 TYR 14 3.005 -5.343 -12.174 112 HE2 TYR 14 HE2 TYR 14 6.705 -3.241 -12.486 113 HH TYR 14 HH TYR 14 6.068 -5.808 -13.000 114 H VAL 15 HN VAL 15 4.533 -1.406 -6.167 115 HA VAL 15 HA VAL 15 2.576 0.657 -5.445 116 HB VAL 15 HB VAL 15 2.347 -0.715 -3.645 117 1HG1 VAL 15 HG11 VAL 15 4.465 -1.785 -2.563 118 2HG1 VAL 15 HG12 VAL 15 5.164 -1.502 -4.154 119 3HG1 VAL 15 HG13 VAL 15 3.726 -2.504 -3.992 120 1HG2 VAL 15 HG21 VAL 15 2.986 1.440 -2.764 121 2HG2 VAL 15 HG22 VAL 15 4.695 1.015 -2.860 122 3HG2 VAL 15 HG23 VAL 15 3.637 0.170 -1.730 123 H VAL 16 HN VAL 16 3.167 2.620 -5.549 124 HA VAL 16 HA VAL 16 5.943 3.389 -5.057 125 HB VAL 16 HB VAL 16 6.027 4.798 -7.036 126 1HG1 VAL 16 HG11 VAL 16 6.513 3.133 -8.561 127 2HG1 VAL 16 HG12 VAL 16 5.126 2.152 -8.091 128 3HG1 VAL 16 HG13 VAL 16 6.538 2.240 -7.041 129 1HG2 VAL 16 HG21 VAL 16 3.875 3.803 -8.596 130 2HG2 VAL 16 HG22 VAL 16 4.195 5.464 -8.104 131 3HG2 VAL 16 HG23 VAL 16 3.209 4.419 -7.091 132 H ALA 17 HN ALA 17 2.605 4.477 -5.608 133 HA ALA 17 HA ALA 17 3.039 7.040 -4.340 134 1HB ALA 17 HB1 ALA 17 1.044 5.842 -6.013 135 2HB ALA 17 HB2 ALA 17 1.274 7.542 -5.608 136 3HB ALA 17 HB3 ALA 17 0.273 6.517 -4.578 137 H LEU 18 HN LEU 18 2.532 7.583 -2.232 138 HA LEU 18 HA LEU 18 0.955 5.770 -0.599 139 1HB LEU 18 HB2 LEU 18 3.840 6.358 0.043 140 2HB LEU 18 HB1 LEU 18 2.715 5.593 1.141 141 HG LEU 18 HG LEU 18 2.465 3.803 -0.706 142 1HD1 LEU 18 HD11 LEU 18 5.177 4.094 -1.562 143 2HD1 LEU 18 HD12 LEU 18 4.270 5.548 -1.978 144 3HD1 LEU 18 HD13 LEU 18 3.709 3.970 -2.531 145 1HD2 LEU 18 HD21 LEU 18 4.667 2.759 0.126 146 2HD2 LEU 18 HD22 LEU 18 3.417 3.146 1.309 147 3HD2 LEU 18 HD23 LEU 18 4.805 4.215 1.113 148 H ALA 19 HN ALA 19 1.277 6.583 1.844 149 HA ALA 19 HA ALA 19 1.649 9.354 2.303 150 1HB ALA 19 HB1 ALA 19 -0.437 10.263 2.232 151 2HB ALA 19 HB2 ALA 19 -1.228 8.741 2.642 152 3HB ALA 19 HB3 ALA 19 -0.659 9.021 0.997 153 H SER 20 HN SER 20 2.598 9.069 4.305 154 HA SER 20 HA SER 20 1.075 7.373 6.200 155 1HB SER 20 HB2 SER 20 3.256 6.697 7.168 156 2HB SER 20 HB1 SER 20 3.052 6.197 5.488 157 HG SER 20 HG SER 20 4.342 8.612 6.172 158 H ASN 21 HN ASN 21 0.648 8.109 8.188 159 HA ASN 21 HA ASN 21 2.073 10.510 9.126 160 1HB ASN 21 HB2 ASN 21 -0.236 10.672 10.552 161 2HB ASN 21 HB1 ASN 21 0.060 11.557 9.068 162 1HD2 ASN 21 HD21 ASN 21 -0.480 10.203 7.057 163 2HD2 ASN 21 HD22 ASN 21 -2.004 9.392 7.104 164 H THR 22 HN THR 22 3.050 10.344 11.042 165 HA THR 22 HA THR 22 2.190 8.866 13.254 166 HB THR 22 HB THR 22 2.596 6.904 11.849 167 HG1 THR 22 HG1 THR 22 4.092 5.857 13.230 168 1HG2 THR 22 HG21 THR 22 5.413 7.927 11.632 169 2HG2 THR 22 HG22 THR 22 4.251 7.738 10.319 170 3HG2 THR 22 HG23 THR 22 4.876 6.318 11.155 171 H GLU 23 HN GLU 23 5.070 7.941 13.829 172 HA GLU 23 HA GLU 23 5.921 10.284 15.153 173 1HB GLU 23 HB2 GLU 23 6.492 7.983 15.893 174 2HB GLU 23 HB1 GLU 23 7.540 7.819 14.493 175 1HG GLU 23 HG2 GLU 23 8.952 9.614 15.305 176 2HG GLU 23 HG1 GLU 23 7.885 9.845 16.689 177 H PHE 24 HN PHE 24 7.148 11.924 14.511 178 HA PHE 24 HA PHE 24 7.954 12.088 11.761 179 1HB PHE 24 HB2 PHE 24 8.169 14.015 14.071 180 2HB PHE 24 HB1 PHE 24 8.754 14.385 12.453 181 HD1 PHE 24 HD1 PHE 24 5.625 12.820 13.795 182 HD2 PHE 24 HD2 PHE 24 7.382 15.857 11.385 183 HE1 PHE 24 HE1 PHE 24 3.385 13.599 13.150 184 HE2 PHE 24 HE2 PHE 24 5.142 16.643 10.740 185 HZ PHE 24 HZ PHE 24 3.140 15.513 11.622 186 H PHE 25 HN PHE 25 9.520 11.401 14.780 187 HA PHE 25 HA PHE 25 12.158 12.042 13.906 188 1HB PHE 25 HB2 PHE 25 11.109 10.503 16.270 189 2HB PHE 25 HB1 PHE 25 12.830 10.729 15.975 190 HD1 PHE 25 HD1 PHE 25 13.709 12.262 17.417 191 HD2 PHE 25 HD2 PHE 25 9.857 12.995 15.761 192 HE1 PHE 25 HE1 PHE 25 13.632 14.439 18.561 193 HE2 PHE 25 HE2 PHE 25 9.776 15.170 16.899 194 HZ PHE 25 HZ PHE 25 11.665 15.896 18.301 195 H LEU 26 HN LEU 26 11.004 8.823 14.938 196 HA LEU 26 HA LEU 26 13.018 7.611 13.248 197 1HB LEU 26 HB2 LEU 26 11.033 6.364 15.141 198 2HB LEU 26 HB1 LEU 26 12.329 5.509 14.325 199 HG LEU 26 HG LEU 26 12.669 7.708 16.365 200 1HD1 LEU 26 HD11 LEU 26 11.975 5.713 17.456 201 2HD1 LEU 26 HD12 LEU 26 13.719 5.854 17.681 202 3HD1 LEU 26 HD13 LEU 26 13.072 4.729 16.488 203 1HD2 LEU 26 HD21 LEU 26 14.466 7.901 14.843 204 2HD2 LEU 26 HD22 LEU 26 14.656 6.151 14.730 205 3HD2 LEU 26 HD23 LEU 26 15.087 6.991 16.220 206 H ARG 27 HN ARG 27 9.485 7.170 13.609 207 HA ARG 27 HA ARG 27 9.138 5.401 11.516 208 1HB ARG 27 HB2 ARG 27 7.224 7.516 12.492 209 2HB ARG 27 HB1 ARG 27 6.788 6.179 11.441 210 1HG ARG 27 HG2 ARG 27 7.826 5.954 14.260 211 2HG ARG 27 HG1 ARG 27 6.157 5.727 13.740 212 1HD ARG 27 HD2 ARG 27 7.051 3.561 13.970 213 2HD ARG 27 HD1 ARG 27 7.027 3.880 12.237 214 HE ARG 27 HE ARG 27 9.530 4.624 13.268 215 1HH1 ARG 27 HH11 ARG 27 7.638 1.754 12.667 216 2HH1 ARG 27 HH12 ARG 27 9.023 0.740 12.432 217 1HH2 ARG 27 HH21 ARG 27 11.351 3.293 12.957 218 2HH2 ARG 27 HH22 ARG 27 11.130 1.614 12.597 219 H GLU 28 HN GLU 28 9.149 8.954 11.359 220 HA GLU 28 HA GLU 28 8.335 9.236 8.715 221 1HB GLU 28 HB2 GLU 28 8.620 11.136 10.246 222 2HB GLU 28 HB1 GLU 28 10.363 10.915 10.198 223 1HG GLU 28 HG2 GLU 28 10.384 11.435 7.826 224 2HG GLU 28 HG1 GLU 28 8.631 11.609 7.837 225 H LYS 29 HN LYS 29 11.630 8.843 9.987 226 HA LYS 29 HA LYS 29 12.798 8.756 7.368 227 1HB LYS 29 HB2 LYS 29 13.965 8.040 10.064 228 2HB LYS 29 HB1 LYS 29 14.882 8.190 8.570 229 1HG LYS 29 HG2 LYS 29 13.361 10.395 9.947 230 2HG LYS 29 HG1 LYS 29 15.112 10.181 9.935 231 1HD LYS 29 HD2 LYS 29 13.386 10.660 7.505 232 2HD LYS 29 HD1 LYS 29 14.382 11.874 8.311 233 1HE LYS 29 HE2 LYS 29 16.382 10.560 7.817 234 2HE LYS 29 HE1 LYS 29 15.389 9.343 7.017 235 1HZ LYS 29 HZ1 LYS 29 15.588 12.180 6.166 236 2HZ LYS 29 HZ2 LYS 29 14.757 10.945 5.364 237 3HZ LYS 29 HZ3 LYS 29 16.445 10.903 5.461 238 H ASP 30 HN ASP 30 11.801 6.397 9.782 239 HA ASP 30 HA ASP 30 13.001 4.127 8.672 240 1HB ASP 30 HB2 ASP 30 11.984 4.180 10.922 241 2HB ASP 30 HB1 ASP 30 10.388 4.288 10.188 242 H LYS 31 HN LYS 31 9.684 5.376 8.204 243 HA LYS 31 HA LYS 31 8.955 3.418 6.309 244 1HB LYS 31 HB2 LYS 31 7.815 6.186 6.750 245 2HB LYS 31 HB1 LYS 31 7.054 4.917 5.801 246 1HG LYS 31 HG2 LYS 31 6.921 3.514 7.812 247 2HG LYS 31 HG1 LYS 31 7.622 4.832 8.752 248 1HD LYS 31 HD2 LYS 31 5.734 6.260 8.201 249 2HD LYS 31 HD1 LYS 31 5.042 4.984 7.196 250 1HE LYS 31 HE2 LYS 31 4.804 3.552 9.144 251 2HE LYS 31 HE1 LYS 31 5.563 4.778 10.159 252 1HZ LYS 31 HZ1 LYS 31 2.872 4.712 9.020 253 2HZ LYS 31 HZ2 LYS 31 3.612 6.222 9.186 254 3HZ LYS 31 HZ3 LYS 31 3.386 5.238 10.542 255 H MET 32 HN MET 32 7.861 5.259 4.251 256 HA MET 32 HA MET 32 8.442 5.964 2.166 257 1HB MET 32 HB2 MET 32 10.801 7.043 3.718 258 2HB MET 32 HB1 MET 32 10.520 7.392 2.020 259 1HG MET 32 HG2 MET 32 9.731 9.229 3.317 260 2HG MET 32 HG1 MET 32 8.342 8.391 2.631 261 1HE MET 32 HE1 MET 32 6.962 9.690 6.052 262 2HE MET 32 HE2 MET 32 6.832 9.759 4.294 263 3HE MET 32 HE3 MET 32 8.201 10.516 5.107 264 H LYS 33 HN LYS 33 8.755 4.146 0.969 265 HA LYS 33 HA LYS 33 11.481 3.340 0.437 266 1HB LYS 33 HB2 LYS 33 9.537 1.281 1.485 267 2HB LYS 33 HB1 LYS 33 11.216 1.021 1.042 268 1HG LYS 33 HG2 LYS 33 11.901 2.479 2.900 269 2HG LYS 33 HG1 LYS 33 10.208 2.651 3.360 270 1HD LYS 33 HD2 LYS 33 11.724 0.048 3.229 271 2HD LYS 33 HD1 LYS 33 11.361 0.947 4.704 272 1HE LYS 33 HE2 LYS 33 9.338 -0.214 2.791 273 2HE LYS 33 HE1 LYS 33 9.781 -0.889 4.358 274 1HZ LYS 33 HZ1 LYS 33 7.769 0.345 4.594 275 2HZ LYS 33 HZ2 LYS 33 8.440 1.711 3.855 276 3HZ LYS 33 HZ3 LYS 33 8.997 1.211 5.371 277 H MET 34 HN MET 34 11.716 2.121 -1.466 278 HA MET 34 HA MET 34 9.591 2.423 -3.386 279 1HB MET 34 HB2 MET 34 11.839 2.550 -4.227 280 2HB MET 34 HB1 MET 34 12.267 1.018 -3.490 281 1HG MET 34 HG2 MET 34 10.804 -0.157 -5.035 282 2HG MET 34 HG1 MET 34 10.324 1.374 -5.760 283 1HE MET 34 HE1 MET 34 13.437 2.847 -5.781 284 2HE MET 34 HE2 MET 34 11.973 3.030 -6.747 285 3HE MET 34 HE3 MET 34 13.496 2.602 -7.526 286 H ALA 35 HN ALA 35 8.295 0.638 -4.344 287 HA ALA 35 HA ALA 35 8.635 -1.907 -2.969 288 1HB ALA 35 HB1 ALA 35 6.362 -1.962 -2.116 289 2HB ALA 35 HB2 ALA 35 6.096 -0.325 -2.716 290 3HB ALA 35 HB3 ALA 35 7.279 -0.615 -1.443 291 H MET 36 HN MET 36 7.662 -3.646 -3.798 292 HA MET 36 HA MET 36 6.185 -3.406 -6.328 293 1HB MET 36 HB2 MET 36 8.354 -5.434 -5.703 294 2HB MET 36 HB1 MET 36 7.364 -5.414 -7.156 295 1HG MET 36 HG2 MET 36 8.324 -3.269 -7.790 296 2HG MET 36 HG1 MET 36 9.308 -3.275 -6.328 297 1HE MET 36 HE1 MET 36 10.590 -3.047 -9.457 298 2HE MET 36 HE2 MET 36 12.061 -3.864 -8.930 299 3HE MET 36 HE3 MET 36 11.249 -2.729 -7.852 300 H ALA 37 HN ALA 37 4.751 -5.355 -6.665 301 HA ALA 37 HA ALA 37 4.401 -7.005 -4.302 302 1HB ALA 37 HB1 ALA 37 2.053 -6.373 -3.978 303 2HB ALA 37 HB2 ALA 37 2.244 -5.110 -5.194 304 3HB ALA 37 HB3 ALA 37 3.163 -5.033 -3.692 305 H ARG 38 HN ARG 38 3.012 -8.742 -4.508 306 HA ARG 38 HA ARG 38 1.887 -9.349 -7.129 307 1HB ARG 38 HB2 ARG 38 2.915 -11.654 -7.001 308 2HB ARG 38 HB1 ARG 38 4.044 -10.351 -7.340 309 1HG ARG 38 HG2 ARG 38 3.647 -11.257 -4.524 310 2HG ARG 38 HG1 ARG 38 4.660 -12.198 -5.621 311 1HD ARG 38 HD2 ARG 38 5.011 -9.279 -4.937 312 2HD ARG 38 HD1 ARG 38 6.000 -10.612 -4.344 313 HE ARG 38 HE ARG 38 6.030 -10.676 -7.135 314 1HH1 ARG 38 HH11 ARG 38 7.166 -8.647 -4.532 315 2HH1 ARG 38 HH12 ARG 38 8.509 -8.033 -5.435 316 1HH2 ARG 38 HH21 ARG 38 7.787 -9.877 -8.318 317 2HH2 ARG 38 HH22 ARG 38 8.863 -8.732 -7.589 318 H ILE 39 HN ILE 39 -0.160 -10.016 -6.778 319 HA ILE 39 HA ILE 39 -0.823 -11.029 -4.112 320 HB ILE 39 HB ILE 39 -2.060 -9.071 -4.796 321 1HG1 ILE 39 HG12 ILE 39 -3.821 -11.531 -4.812 322 2HG1 ILE 39 HG11 ILE 39 -3.152 -10.776 -3.369 323 1HG2 ILE 39 HG21 ILE 39 -1.995 -9.287 -7.183 324 2HG2 ILE 39 HG22 ILE 39 -3.680 -9.206 -6.669 325 3HG2 ILE 39 HG23 ILE 39 -2.969 -10.756 -7.122 326 1HD1 ILE 39 HD11 ILE 39 -4.926 -9.309 -5.287 327 2HD1 ILE 39 HD12 ILE 39 -4.476 -8.852 -3.645 328 3HD1 ILE 39 HD13 ILE 39 -5.546 -10.229 -3.917 329 H SER 40 HN SER 40 -2.051 -12.818 -3.738 330 HA SER 40 HA SER 40 -2.951 -14.544 -5.861 331 1HB SER 40 HB2 SER 40 -0.706 -15.455 -4.037 332 2HB SER 40 HB1 SER 40 -1.567 -16.477 -5.188 333 HG SER 40 HG SER 40 0.217 -15.818 -6.262 334 H PHE 41 HN PHE 41 -4.615 -15.817 -5.179 335 HA PHE 41 HA PHE 41 -5.598 -15.385 -2.504 336 1HB PHE 41 HB2 PHE 41 -6.733 -16.998 -4.793 337 2HB PHE 41 HB1 PHE 41 -7.555 -16.709 -3.264 338 HD1 PHE 41 HD1 PHE 41 -5.802 -14.669 -5.869 339 HD2 PHE 41 HD2 PHE 41 -9.166 -15.097 -3.298 340 HE1 PHE 41 HE1 PHE 41 -6.740 -12.583 -6.760 341 HE2 PHE 41 HE2 PHE 41 -10.114 -13.010 -4.191 342 HZ PHE 41 HZ PHE 41 -8.901 -11.750 -5.923 343 H LEU 42 HN LEU 42 -5.471 -16.707 -0.795 344 HA LEU 42 HA LEU 42 -4.231 -19.338 -1.175 345 1HB LEU 42 HB2 LEU 42 -3.243 -17.680 0.450 346 2HB LEU 42 HB1 LEU 42 -4.692 -17.858 1.416 347 HG LEU 42 HG LEU 42 -4.185 -20.233 1.771 348 1HD1 LEU 42 HD11 LEU 42 -1.797 -20.927 1.143 349 2HD1 LEU 42 HD12 LEU 42 -1.860 -19.598 -0.016 350 3HD1 LEU 42 HD13 LEU 42 -3.017 -20.924 -0.131 351 1HD2 LEU 42 HD21 LEU 42 -3.393 -18.691 3.421 352 2HD2 LEU 42 HD22 LEU 42 -1.986 -18.286 2.439 353 3HD2 LEU 42 HD23 LEU 42 -2.131 -19.894 3.150 354 H GLY 43 HN GLY 43 -5.285 -21.209 -0.682 355 1HA GLY 43 HA2 GLY 43 -8.043 -21.367 -0.756 356 2HA GLY 43 HA1 GLY 43 -7.001 -22.636 -0.140 357 H GLU 44 HN GLU 44 -6.001 -20.965 2.068 358 HA GLU 44 HA GLU 44 -7.932 -21.680 4.005 359 1HB GLU 44 HB2 GLU 44 -5.543 -19.852 4.266 360 2HB GLU 44 HB1 GLU 44 -6.445 -20.550 5.603 361 1HG GLU 44 HG2 GLU 44 -5.790 -22.789 4.872 362 2HG GLU 44 HG1 GLU 44 -4.877 -22.079 3.539 363 H ASP 45 HN ASP 45 -9.472 -20.151 2.400 364 HA ASP 45 HA ASP 45 -10.724 -18.233 2.197 365 1HB ASP 45 HB2 ASP 45 -11.583 -19.478 4.244 366 2HB ASP 45 HB1 ASP 45 -10.671 -18.330 5.217 367 H GLU 46 HN GLU 46 -8.103 -17.557 1.887 368 HA GLU 46 HA GLU 46 -8.116 -14.833 2.792 369 1HB GLU 46 HB2 GLU 46 -5.995 -16.746 3.769 370 2HB GLU 46 HB1 GLU 46 -5.828 -15.000 3.830 371 1HG GLU 46 HG2 GLU 46 -7.771 -14.864 5.302 372 2HG GLU 46 HG1 GLU 46 -7.943 -16.615 5.229 373 H LEU 47 HN LEU 47 -7.085 -13.513 1.425 374 HA LEU 47 HA LEU 47 -5.461 -14.752 -0.694 375 1HB LEU 47 HB2 LEU 47 -6.115 -13.062 -2.201 376 2HB LEU 47 HB1 LEU 47 -7.585 -13.568 -1.397 377 HG LEU 47 HG LEU 47 -7.689 -11.216 -1.635 378 1HD1 LEU 47 HD11 LEU 47 -8.319 -12.229 0.599 379 2HD1 LEU 47 HD12 LEU 47 -8.044 -10.488 0.559 380 3HD1 LEU 47 HD13 LEU 47 -6.806 -11.560 1.210 381 1HD2 LEU 47 HD21 LEU 47 -5.339 -10.480 -0.069 382 2HD2 LEU 47 HD22 LEU 47 -5.963 -9.807 -1.574 383 3HD2 LEU 47 HD23 LEU 47 -4.959 -11.256 -1.606 384 H LYS 48 HN LYS 48 -3.385 -13.983 -1.063 385 HA LYS 48 HA LYS 48 -2.498 -11.907 0.826 386 1HB LYS 48 HB2 LYS 48 -0.462 -13.090 1.211 387 2HB LYS 48 HB1 LYS 48 -1.791 -14.217 1.431 388 1HG LYS 48 HG2 LYS 48 -0.272 -15.477 0.254 389 2HG LYS 48 HG1 LYS 48 -1.315 -14.873 -1.033 390 1HD LYS 48 HD2 LYS 48 0.294 -13.158 -1.588 391 2HD LYS 48 HD1 LYS 48 1.291 -13.599 -0.206 392 1HE LYS 48 HE2 LYS 48 0.676 -15.367 -2.566 393 2HE LYS 48 HE1 LYS 48 2.182 -14.485 -2.309 394 1HZ LYS 48 HZ1 LYS 48 2.635 -16.609 -1.534 395 2HZ LYS 48 HZ2 LYS 48 1.119 -16.792 -0.806 396 3HZ LYS 48 HZ3 LYS 48 2.270 -15.764 -0.114 397 H VAL 49 HN VAL 49 -0.699 -10.624 0.277 398 HA VAL 49 HA VAL 49 0.072 -10.604 -2.545 399 HB VAL 49 HB VAL 49 -1.740 -8.895 -2.156 400 1HG1 VAL 49 HG11 VAL 49 -1.058 -8.232 0.123 401 2HG1 VAL 49 HG12 VAL 49 -1.245 -6.859 -0.967 402 3HG1 VAL 49 HG13 VAL 49 0.365 -7.443 -0.557 403 1HG2 VAL 49 HG21 VAL 49 -0.632 -7.137 -3.406 404 2HG2 VAL 49 HG22 VAL 49 -0.154 -8.725 -4.006 405 3HG2 VAL 49 HG23 VAL 49 0.944 -7.802 -2.980 406 H SER 50 HN SER 50 2.196 -10.994 -2.483 407 HA SER 50 HA SER 50 3.805 -10.180 -0.216 408 1HB SER 50 HB2 SER 50 4.100 -12.382 -1.438 409 2HB SER 50 HB1 SER 50 4.752 -11.457 -2.791 410 HG SER 50 HG SER 50 6.410 -10.729 -1.432 411 H TYR 51 HN TYR 51 5.475 -8.645 -0.258 412 HA TYR 51 HA TYR 51 5.838 -7.155 -2.736 413 1HB TYR 51 HB2 TYR 51 5.473 -4.988 -1.652 414 2HB TYR 51 HB1 TYR 51 4.024 -5.980 -1.596 415 HD1 TYR 51 HD1 TYR 51 7.037 -5.278 0.531 416 HD2 TYR 51 HD2 TYR 51 2.845 -5.988 0.377 417 HE1 TYR 51 HE1 TYR 51 6.898 -4.933 2.957 418 HE2 TYR 51 HE2 TYR 51 2.694 -5.637 2.804 419 HH TYR 51 HH TYR 51 5.506 -5.397 4.808 420 H ALA 52 HN ALA 52 7.800 -6.282 -3.023 421 HA ALA 52 HA ALA 52 9.789 -6.682 -0.883 422 1HB ALA 52 HB1 ALA 52 11.448 -6.555 -2.800 423 2HB ALA 52 HB2 ALA 52 10.064 -6.657 -3.888 424 3HB ALA 52 HB3 ALA 52 10.411 -7.981 -2.776 425 H VAL 53 HN VAL 53 10.828 -4.856 -0.091 426 HA VAL 53 HA VAL 53 10.572 -2.400 -1.666 427 HB VAL 53 HB VAL 53 9.675 -1.120 0.151 428 1HG1 VAL 53 HG11 VAL 53 7.501 -1.848 0.038 429 2HG1 VAL 53 HG12 VAL 53 7.944 -3.543 0.236 430 3HG1 VAL 53 HG13 VAL 53 8.214 -2.738 -1.306 431 1HG2 VAL 53 HG21 VAL 53 8.915 -2.404 2.243 432 2HG2 VAL 53 HG22 VAL 53 10.625 -2.001 2.096 433 3HG2 VAL 53 HG23 VAL 53 10.072 -3.637 1.738 434 HA PRO 54 HA PRO 54 14.715 -1.913 0.012 435 1HB PRO 54 HB2 PRO 54 14.949 0.476 -1.599 436 2HB PRO 54 HB1 PRO 54 15.744 -1.082 -1.835 437 1HG PRO 54 HG2 PRO 54 13.841 -0.084 -3.520 438 2HG PRO 54 HG1 PRO 54 14.150 -1.815 -3.301 439 1HD PRO 54 HD2 PRO 54 12.003 -0.107 -2.093 440 2HD PRO 54 HD1 PRO 54 11.894 -1.752 -2.756 441 H LYS 55 HN LYS 55 14.930 -1.058 1.977 442 HA LYS 55 HA LYS 55 13.438 1.338 2.696 443 1HB LYS 55 HB2 LYS 55 14.020 0.770 5.007 444 2HB LYS 55 HB1 LYS 55 13.271 -0.587 4.179 445 1HG LYS 55 HG2 LYS 55 15.464 -1.603 3.842 446 2HG LYS 55 HG1 LYS 55 16.222 -0.237 4.665 447 1HD LYS 55 HD2 LYS 55 14.982 -0.781 6.706 448 2HD LYS 55 HD1 LYS 55 14.221 -2.143 5.882 449 1HE LYS 55 HE2 LYS 55 16.415 -3.172 5.556 450 2HE LYS 55 HE1 LYS 55 17.179 -1.807 6.369 451 1HZ LYS 55 HZ1 LYS 55 15.071 -3.232 7.807 452 2HZ LYS 55 HZ2 LYS 55 16.477 -2.501 8.397 453 3HZ LYS 55 HZ3 LYS 55 16.564 -4.011 7.641 454 HA PRO 56 HA PRO 56 16.880 4.106 2.479 455 1HB PRO 56 HB2 PRO 56 16.130 5.871 4.436 456 2HB PRO 56 HB1 PRO 56 15.446 5.862 2.808 457 1HG PRO 56 HG2 PRO 56 14.348 4.689 5.331 458 2HG PRO 56 HG1 PRO 56 13.506 5.585 4.052 459 1HD PRO 56 HD2 PRO 56 13.380 2.904 4.222 460 2HD PRO 56 HD1 PRO 56 13.402 3.742 2.657 461 H ASN 57 HN ASN 57 15.790 3.425 5.820 462 HA ASN 57 HA ASN 57 18.285 3.863 7.034 463 1HB ASN 57 HB2 ASN 57 16.037 2.033 7.921 464 2HB ASN 57 HB1 ASN 57 17.376 2.563 8.934 465 1HD2 ASN 57 HD21 ASN 57 16.857 4.127 10.263 466 2HD2 ASN 57 HD22 ASN 57 15.703 5.380 9.971 467 H GLY 58 HN GLY 58 20.119 2.774 6.715 468 1HA GLY 58 HA2 GLY 58 21.520 0.909 6.644 469 2HA GLY 58 HA1 GLY 58 20.099 -0.126 6.627 470 H CYS 59 HN CYS 59 18.909 1.400 4.366 471 HA CYS 59 HA CYS 59 18.832 1.361 2.104 472 1HB CYS 59 HB2 CYS 59 21.838 1.059 2.279 473 2HB CYS 59 HB1 CYS 59 20.930 1.463 0.828 474 H ARG 60 HN ARG 60 17.915 -0.830 3.008 475 HA ARG 60 HA ARG 60 19.222 -2.976 1.466 476 1HB ARG 60 HB2 ARG 60 17.757 -3.302 4.094 477 2HB ARG 60 HB1 ARG 60 18.511 -4.589 3.161 478 1HG ARG 60 HG2 ARG 60 19.944 -2.280 4.455 479 2HG ARG 60 HG1 ARG 60 19.894 -3.941 5.049 480 1HD ARG 60 HD2 ARG 60 21.011 -4.703 3.011 481 2HD ARG 60 HD1 ARG 60 21.052 -3.046 2.410 482 HE ARG 60 HE ARG 60 22.301 -3.105 4.911 483 1HH1 ARG 60 HH11 ARG 60 22.807 -4.303 1.673 484 2HH1 ARG 60 HH12 ARG 60 24.533 -4.299 1.806 485 1HH2 ARG 60 HH21 ARG 60 24.574 -3.099 5.088 486 2HH2 ARG 60 HH22 ARG 60 25.536 -3.616 3.744 487 H LYS 61 HN LYS 61 16.794 -4.658 2.472 488 HA LYS 61 HA LYS 61 14.598 -3.442 1.036 489 1HB LYS 61 HB2 LYS 61 15.860 -6.016 0.078 490 2HB LYS 61 HB1 LYS 61 14.342 -5.354 -0.512 491 1HG LYS 61 HG2 LYS 61 15.523 -3.391 -1.358 492 2HG LYS 61 HG1 LYS 61 17.046 -4.052 -0.759 493 1HD LYS 61 HD2 LYS 61 16.795 -4.477 -3.147 494 2HD LYS 61 HD1 LYS 61 16.784 -5.988 -2.236 495 1HE LYS 61 HE2 LYS 61 14.345 -6.051 -2.361 496 2HE LYS 61 HE1 LYS 61 14.346 -4.529 -3.252 497 1HZ LYS 61 HZ1 LYS 61 15.299 -5.534 -5.107 498 2HZ LYS 61 HZ2 LYS 61 14.166 -6.673 -4.580 499 3HZ LYS 61 HZ3 LYS 61 15.809 -6.898 -4.245 500 H TRP 62 HN TRP 62 12.661 -4.130 1.753 501 HA TRP 62 HA TRP 62 12.671 -6.350 3.685 502 1HB TRP 62 HB2 TRP 62 12.194 -4.172 4.714 503 2HB TRP 62 HB1 TRP 62 10.859 -3.930 3.593 504 HD1 TRP 62 HD1 TRP 62 11.567 -7.187 5.550 505 HE1 TRP 62 HE1 TRP 62 9.536 -7.674 7.054 506 HE3 TRP 62 HE3 TRP 62 8.849 -2.954 4.641 507 HZ2 TRP 62 HZ2 TRP 62 7.105 -6.428 7.764 508 HZ3 TRP 62 HZ3 TRP 62 6.681 -2.679 5.771 509 HH2 TRP 62 HH2 TRP 62 5.828 -4.382 7.300 510 H GLU 63 HN GLU 63 11.063 -7.879 3.607 511 HA GLU 63 HA GLU 63 9.091 -7.661 1.454 512 1HB GLU 63 HB2 GLU 63 9.460 -9.984 0.785 513 2HB GLU 63 HB1 GLU 63 10.920 -9.029 0.566 514 1HG GLU 63 HG2 GLU 63 10.380 -10.857 2.894 515 2HG GLU 63 HG1 GLU 63 11.352 -11.267 1.483 516 H THR 64 HN THR 64 7.099 -8.360 1.990 517 HA THR 64 HA THR 64 6.715 -10.152 4.232 518 HB THR 64 HB THR 64 5.727 -7.298 4.295 519 HG1 THR 64 HG1 THR 64 7.462 -8.765 5.988 520 1HG2 THR 64 HG21 THR 64 5.155 -9.506 6.254 521 2HG2 THR 64 HG22 THR 64 3.990 -8.783 5.147 522 3HG2 THR 64 HG23 THR 64 4.707 -7.809 6.430 523 H THR 65 HN THR 65 4.804 -11.229 4.178 524 HA THR 65 HA THR 65 3.168 -10.780 1.790 525 HB THR 65 HB THR 65 3.581 -13.193 3.551 526 HG1 THR 65 HG1 THR 65 4.745 -13.926 1.922 527 1HG2 THR 65 HG21 THR 65 2.297 -14.285 1.540 528 2HG2 THR 65 HG22 THR 65 1.513 -12.705 1.487 529 3HG2 THR 65 HG23 THR 65 1.446 -13.676 2.958 530 H PHE 66 HN PHE 66 1.452 -9.535 2.172 531 HA PHE 66 HA PHE 66 0.074 -9.602 4.725 532 1HB PHE 66 HB2 PHE 66 -0.266 -7.989 2.200 533 2HB PHE 66 HB1 PHE 66 -1.482 -7.958 3.471 534 HD1 PHE 66 HD1 PHE 66 2.081 -8.267 4.288 535 HD2 PHE 66 HD2 PHE 66 -1.201 -5.593 3.836 536 HE1 PHE 66 HE1 PHE 66 3.348 -6.517 5.462 537 HE2 PHE 66 HE2 PHE 66 0.062 -3.839 5.011 538 HZ PHE 66 HZ PHE 66 2.339 -4.300 5.826 539 H LYS 67 HN LYS 67 -1.493 -11.037 5.145 540 HA LYS 67 HA LYS 67 -3.215 -11.944 2.957 541 1HB LYS 67 HB2 LYS 67 -1.389 -13.582 3.134 542 2HB LYS 67 HB1 LYS 67 -1.756 -13.796 4.837 543 1HG LYS 67 HG2 LYS 67 -3.895 -14.747 4.325 544 2HG LYS 67 HG1 LYS 67 -3.688 -14.394 2.610 545 1HD LYS 67 HD2 LYS 67 -3.262 -16.741 3.053 546 2HD LYS 67 HD1 LYS 67 -1.782 -15.937 2.533 547 1HE LYS 67 HE2 LYS 67 -2.481 -16.398 5.426 548 2HE LYS 67 HE1 LYS 67 -1.556 -17.550 4.466 549 1HZ LYS 67 HZ1 LYS 67 0.227 -16.396 5.058 550 2HZ LYS 67 HZ2 LYS 67 -0.694 -15.138 5.712 551 3HZ LYS 67 HZ3 LYS 67 -0.313 -15.140 4.064 552 H LYS 68 HN LYS 68 -5.267 -12.280 3.501 553 HA LYS 68 HA LYS 68 -6.327 -13.227 5.830 554 1HB LYS 68 HB2 LYS 68 -5.299 -11.187 6.877 555 2HB LYS 68 HB1 LYS 68 -6.402 -10.212 5.918 556 1HG LYS 68 HG2 LYS 68 -7.383 -10.421 8.062 557 2HG LYS 68 HG1 LYS 68 -8.286 -11.500 7.000 558 1HD LYS 68 HD2 LYS 68 -7.023 -13.406 7.822 559 2HD LYS 68 HD1 LYS 68 -6.044 -12.342 8.835 560 1HE LYS 68 HE2 LYS 68 -8.050 -11.687 10.079 561 2HE LYS 68 HE1 LYS 68 -9.023 -12.757 9.071 562 1HZ LYS 68 HZ1 LYS 68 -7.145 -13.420 11.212 563 2HZ LYS 68 HZ2 LYS 68 -7.261 -14.498 9.915 564 3HZ LYS 68 HZ3 LYS 68 -8.636 -14.122 10.824 565 H THR 69 HN THR 69 -8.172 -10.435 5.362 566 HA THR 69 HA THR 69 -9.700 -11.763 3.222 567 HB THR 69 HB THR 69 -10.863 -11.986 5.356 568 HG1 THR 69 HG1 THR 69 -12.204 -11.718 3.602 569 1HG2 THR 69 HG21 THR 69 -11.162 -10.386 6.867 570 2HG2 THR 69 HG22 THR 69 -11.610 -9.194 5.648 571 3HG2 THR 69 HG23 THR 69 -9.909 -9.501 6.000 572 H SER 70 HN SER 70 -10.767 -10.472 1.712 573 HA SER 70 HA SER 70 -10.291 -7.593 1.799 574 1HB SER 70 HB2 SER 70 -9.472 -7.539 -0.509 575 2HB SER 70 HB1 SER 70 -8.414 -8.529 0.496 576 HG SER 70 HG SER 70 -9.841 -10.328 -0.324 577 H ASP 71 HN ASP 71 -12.637 -7.981 2.365 578 HA ASP 71 HA ASP 71 -14.225 -8.122 -0.112 579 1HB ASP 71 HB2 ASP 71 -16.042 -9.141 1.175 580 2HB ASP 71 HB1 ASP 71 -14.581 -10.118 1.261 581 H ASP 72 HN ASP 72 -15.776 -6.640 -0.440 582 HA ASP 72 HA ASP 72 -17.186 -5.040 1.254 583 1HB ASP 72 HB2 ASP 72 -15.144 -4.098 2.165 584 2HB ASP 72 HB1 ASP 72 -14.528 -3.758 0.553 585 H GLY 73 HN GLY 73 -18.079 -3.017 0.053 586 1HA GLY 73 HA2 GLY 73 -19.123 -3.587 -2.380 587 2HA GLY 73 HA1 GLY 73 -18.692 -1.937 -1.930 588 H GLU 74 HN GLU 74 -15.970 -2.179 -1.765 589 HA GLU 74 HA GLU 74 -15.189 -2.680 -4.555 590 1HB GLU 74 HB2 GLU 74 -13.888 -0.849 -2.517 591 2HB GLU 74 HB1 GLU 74 -13.370 -1.064 -4.183 592 1HG GLU 74 HG2 GLU 74 -14.549 0.913 -4.275 593 2HG GLU 74 HG1 GLU 74 -15.752 -0.269 -4.783 594 H VAL 75 HN VAL 75 -12.386 -2.238 -2.790 595 HA VAL 75 HA VAL 75 -12.317 -5.083 -2.034 596 HB VAL 75 HB VAL 75 -11.051 -5.086 -4.006 597 1HG1 VAL 75 HG11 VAL 75 -9.008 -3.387 -4.053 598 2HG1 VAL 75 HG12 VAL 75 -10.142 -2.426 -3.111 599 3HG1 VAL 75 HG13 VAL 75 -10.593 -2.988 -4.714 600 1HG2 VAL 75 HG21 VAL 75 -8.921 -5.795 -3.312 601 2HG2 VAL 75 HG22 VAL 75 -9.978 -6.098 -1.935 602 3HG2 VAL 75 HG23 VAL 75 -8.910 -4.695 -1.933 603 H TYR 76 HN TYR 76 -12.614 -4.743 0.101 604 HA TYR 76 HA TYR 76 -10.787 -2.940 1.530 605 1HB TYR 76 HB2 TYR 76 -13.225 -2.681 1.880 606 2HB TYR 76 HB1 TYR 76 -13.300 -4.338 2.463 607 HD1 TYR 76 HD1 TYR 76 -13.163 -4.733 4.733 608 HD2 TYR 76 HD2 TYR 76 -11.567 -1.114 3.173 609 HE1 TYR 76 HE1 TYR 76 -12.732 -3.943 7.021 610 HE2 TYR 76 HE2 TYR 76 -11.123 -0.317 5.455 611 HH TYR 76 HH TYR 76 -11.900 -0.711 7.723 612 H TYR 77 HN TYR 77 -9.034 -3.840 2.446 613 HA TYR 77 HA TYR 77 -9.152 -6.678 3.196 614 1HB TYR 77 HB2 TYR 77 -7.475 -6.238 1.525 615 2HB TYR 77 HB1 TYR 77 -6.801 -4.930 2.481 616 HD1 TYR 77 HD1 TYR 77 -7.256 -8.616 2.384 617 HD2 TYR 77 HD2 TYR 77 -5.134 -5.350 4.095 618 HE1 TYR 77 HE1 TYR 77 -5.665 -10.187 3.411 619 HE2 TYR 77 HE2 TYR 77 -3.548 -6.907 5.121 620 HH TYR 77 HH TYR 77 -2.724 -9.164 4.812 621 H SER 78 HN SER 78 -8.075 -7.381 5.098 622 HA SER 78 HA SER 78 -7.235 -5.506 7.120 623 1HB SER 78 HB2 SER 78 -9.714 -7.203 7.579 624 2HB SER 78 HB1 SER 78 -8.912 -6.207 8.793 625 HG SER 78 HG SER 78 -10.841 -5.429 7.330 626 H GLU 79 HN GLU 79 -5.974 -6.604 8.757 627 HA GLU 79 HA GLU 79 -5.946 -9.500 8.742 628 1HB GLU 79 HB2 GLU 79 -3.639 -9.738 8.032 629 2HB GLU 79 HB1 GLU 79 -4.575 -8.924 6.788 630 1HG GLU 79 HG2 GLU 79 -3.667 -6.789 7.437 631 2HG GLU 79 HG1 GLU 79 -2.801 -7.531 8.779 632 H GLU 80 HN GLU 80 -3.595 -10.092 9.887 633 HA GLU 80 HA GLU 80 -2.706 -10.388 11.939 634 1HB GLU 80 HB2 GLU 80 -2.548 -7.419 11.552 635 2HB GLU 80 HB1 GLU 80 -1.932 -8.163 13.017 636 1HG GLU 80 HG2 GLU 80 -0.137 -7.836 11.451 637 2HG GLU 80 HG1 GLU 80 -0.434 -9.557 11.677 638 H ALA 81 HN ALA 81 -3.312 -7.808 13.863 639 HA ALA 81 HA ALA 81 -5.532 -9.209 15.136 640 1HB ALA 81 HB1 ALA 81 -4.983 -7.502 17.005 641 2HB ALA 81 HB2 ALA 81 -3.491 -7.249 16.098 642 3HB ALA 81 HB3 ALA 81 -3.886 -8.853 16.718 643 H LYS 82 HN LYS 82 -4.801 -5.726 15.254 644 HA LYS 82 HA LYS 82 -7.593 -5.257 14.445 645 1HB LYS 82 HB2 LYS 82 -5.741 -3.595 16.153 646 2HB LYS 82 HB1 LYS 82 -7.338 -3.072 15.638 647 1HG LYS 82 HG2 LYS 82 -8.334 -4.954 16.842 648 2HG LYS 82 HG1 LYS 82 -6.727 -5.471 17.355 649 1HD LYS 82 HD2 LYS 82 -8.024 -2.829 18.025 650 2HD LYS 82 HD1 LYS 82 -7.877 -4.210 19.115 651 1HE LYS 82 HE2 LYS 82 -5.437 -4.060 18.963 652 2HE LYS 82 HE1 LYS 82 -5.590 -2.674 17.885 653 1HZ LYS 82 HZ1 LYS 82 -5.209 -1.789 20.002 654 2HZ LYS 82 HZ2 LYS 82 -6.299 -2.844 20.751 655 3HZ LYS 82 HZ3 LYS 82 -6.874 -1.600 19.760 656 H LYS 83 HN LYS 83 -5.728 -5.718 12.447 657 HA LYS 83 HA LYS 83 -5.056 -3.055 11.440 658 1HB LYS 83 HB2 LYS 83 -4.290 -5.713 10.231 659 2HB LYS 83 HB1 LYS 83 -3.620 -4.134 9.848 660 1HG LYS 83 HG2 LYS 83 -2.869 -4.057 12.287 661 2HG LYS 83 HG1 LYS 83 -3.222 -5.782 12.317 662 1HD LYS 83 HD2 LYS 83 -1.666 -6.128 10.450 663 2HD LYS 83 HD1 LYS 83 -1.308 -4.401 10.433 664 1HE LYS 83 HE2 LYS 83 -0.462 -4.564 12.730 665 2HE LYS 83 HE1 LYS 83 -0.798 -6.295 12.724 666 1HZ LYS 83 HZ1 LYS 83 1.342 -6.394 12.085 667 2HZ LYS 83 HZ2 LYS 83 1.363 -4.823 11.460 668 3HZ LYS 83 HZ3 LYS 83 0.706 -6.086 10.547 669 H LYS 84 HN LYS 84 -6.110 -2.128 9.816 670 HA LYS 84 HA LYS 84 -7.852 -3.735 8.104 671 1HB LYS 84 HB2 LYS 84 -8.765 -1.292 9.639 672 2HB LYS 84 HB1 LYS 84 -9.699 -2.109 8.395 673 1HG LYS 84 HG2 LYS 84 -9.733 -4.142 9.771 674 2HG LYS 84 HG1 LYS 84 -8.833 -3.288 11.027 675 1HD LYS 84 HD2 LYS 84 -11.564 -2.534 9.985 676 2HD LYS 84 HD1 LYS 84 -11.231 -3.338 11.519 677 1HE LYS 84 HE2 LYS 84 -10.301 -0.584 10.714 678 2HE LYS 84 HE1 LYS 84 -11.606 -0.950 11.841 679 1HZ LYS 84 HZ1 LYS 84 -9.654 -2.309 12.975 680 2HZ LYS 84 HZ2 LYS 84 -9.934 -0.676 13.317 681 3HZ LYS 84 HZ3 LYS 84 -8.721 -1.114 12.222 682 H VAL 85 HN VAL 85 -7.910 -3.023 6.027 683 HA VAL 85 HA VAL 85 -6.892 -0.343 5.420 684 HB VAL 85 HB VAL 85 -5.284 -1.085 3.850 685 1HG1 VAL 85 HG11 VAL 85 -4.973 -1.578 6.485 686 2HG1 VAL 85 HG12 VAL 85 -3.702 -1.799 5.286 687 3HG1 VAL 85 HG13 VAL 85 -4.660 -3.179 5.820 688 1HG2 VAL 85 HG21 VAL 85 -6.527 -2.884 2.811 689 2HG2 VAL 85 HG22 VAL 85 -6.353 -3.874 4.257 690 3HG2 VAL 85 HG23 VAL 85 -4.934 -3.464 3.294 691 H GLU 86 HN GLU 86 -7.934 0.611 3.723 692 HA GLU 86 HA GLU 86 -9.905 -1.055 2.314 693 1HB GLU 86 HB2 GLU 86 -10.791 0.858 3.620 694 2HB GLU 86 HB1 GLU 86 -9.839 1.951 2.624 695 1HG GLU 86 HG2 GLU 86 -11.094 1.236 0.647 696 2HG GLU 86 HG1 GLU 86 -12.055 0.158 1.655 697 H VAL 87 HN VAL 87 -9.456 -1.598 0.284 698 HA VAL 87 HA VAL 87 -7.470 -0.042 -1.190 699 HB VAL 87 HB VAL 87 -8.762 -2.647 -2.002 700 1HG1 VAL 87 HG11 VAL 87 -6.611 -2.743 -3.410 701 2HG1 VAL 87 HG12 VAL 87 -6.545 -1.001 -3.144 702 3HG1 VAL 87 HG13 VAL 87 -7.935 -1.717 -3.958 703 1HG2 VAL 87 HG21 VAL 87 -7.010 -3.834 -1.077 704 2HG2 VAL 87 HG22 VAL 87 -7.338 -2.605 0.144 705 3HG2 VAL 87 HG23 VAL 87 -5.977 -2.412 -0.960 706 H LEU 88 HN LEU 88 -8.199 1.605 -2.276 707 HA LEU 88 HA LEU 88 -10.905 1.562 -3.392 708 1HB LEU 88 HB2 LEU 88 -8.998 3.882 -3.024 709 2HB LEU 88 HB1 LEU 88 -10.660 3.997 -3.565 710 HG LEU 88 HG LEU 88 -11.410 3.150 -1.357 711 1HD1 LEU 88 HD11 LEU 88 -9.670 1.906 -0.474 712 2HD1 LEU 88 HD12 LEU 88 -9.591 3.397 0.465 713 3HD1 LEU 88 HD13 LEU 88 -8.461 3.127 -0.863 714 1HD2 LEU 88 HD21 LEU 88 -11.389 5.521 -1.754 715 2HD2 LEU 88 HD22 LEU 88 -9.671 5.610 -1.367 716 3HD2 LEU 88 HD23 LEU 88 -10.838 5.211 -0.107 717 H ASP 89 HN ASP 89 -10.510 3.593 -5.326 718 HA ASP 89 HA ASP 89 -10.044 3.851 -7.526 719 1HB ASP 89 HB2 ASP 89 -7.715 3.904 -6.343 720 2HB ASP 89 HB1 ASP 89 -7.476 2.358 -7.145 721 H THR 90 HN THR 90 -8.173 1.710 -8.886 722 HA THR 90 HA THR 90 -10.284 -0.324 -9.172 723 HB THR 90 HB THR 90 -8.444 0.752 -11.319 724 HG1 THR 90 HG1 THR 90 -10.219 2.110 -10.716 725 1HG2 THR 90 HG21 THR 90 -8.816 -1.175 -12.361 726 2HG2 THR 90 HG22 THR 90 -10.470 -0.598 -12.569 727 3HG2 THR 90 HG23 THR 90 -10.069 -1.654 -11.215 728 H ASP 91 HN ASP 91 -9.618 -2.138 -8.241 729 HA ASP 91 HA ASP 91 -6.769 -2.828 -8.328 730 1HB ASP 91 HB2 ASP 91 -7.311 -4.480 -6.590 731 2HB ASP 91 HB1 ASP 91 -7.838 -2.866 -6.118 732 H TYR 92 HN TYR 92 -8.483 -3.109 -10.677 733 HA TYR 92 HA TYR 92 -8.449 -6.039 -10.946 734 1HB TYR 92 HB2 TYR 92 -10.207 -4.007 -12.322 735 2HB TYR 92 HB1 TYR 92 -10.141 -5.710 -12.768 736 HD1 TYR 92 HD1 TYR 92 -11.827 -7.014 -11.940 737 HD2 TYR 92 HD2 TYR 92 -10.514 -3.694 -9.633 738 HE1 TYR 92 HE1 TYR 92 -13.508 -7.550 -10.229 739 HE2 TYR 92 HE2 TYR 92 -12.192 -4.215 -7.911 740 HH TYR 92 HH TYR 92 -14.708 -5.745 -8.196 741 H LYS 93 HN LYS 93 -8.729 -3.698 -13.595 742 HA LYS 93 HA LYS 93 -6.041 -4.461 -14.502 743 1HB LYS 93 HB2 LYS 93 -7.802 -5.835 -15.648 744 2HB LYS 93 HB1 LYS 93 -8.433 -4.346 -16.340 745 1HG LYS 93 HG2 LYS 93 -5.635 -5.391 -16.764 746 2HG LYS 93 HG1 LYS 93 -6.976 -5.621 -17.883 747 1HD LYS 93 HD2 LYS 93 -7.158 -3.147 -18.095 748 2HD LYS 93 HD1 LYS 93 -5.735 -2.992 -17.066 749 1HE LYS 93 HE2 LYS 93 -5.807 -4.449 -19.699 750 2HE LYS 93 HE1 LYS 93 -5.197 -2.812 -19.457 751 1HZ LYS 93 HZ1 LYS 93 -4.018 -5.368 -18.685 752 2HZ LYS 93 HZ2 LYS 93 -3.764 -4.057 -17.647 753 3HZ LYS 93 HZ3 LYS 93 -3.273 -3.963 -19.263 754 H SER 94 HN SER 94 -5.293 -2.446 -13.865 755 HA SER 94 HA SER 94 -4.960 -0.488 -15.674 756 1HB SER 94 HB2 SER 94 -6.546 1.340 -14.950 757 2HB SER 94 HB1 SER 94 -7.320 0.010 -15.806 758 HG SER 94 HG SER 94 -8.307 0.809 -13.750 759 H TYR 95 HN TYR 95 -6.253 0.772 -12.704 760 HA TYR 95 HA TYR 95 -3.630 0.718 -11.411 761 1HB TYR 95 HB2 TYR 95 -3.975 3.217 -10.923 762 2HB TYR 95 HB1 TYR 95 -3.465 2.780 -12.553 763 HD1 TYR 95 HD1 TYR 95 -4.677 3.563 -14.379 764 HD2 TYR 95 HD2 TYR 95 -6.533 3.482 -10.559 765 HE1 TYR 95 HE1 TYR 95 -6.636 4.722 -15.313 766 HE2 TYR 95 HE2 TYR 95 -8.496 4.643 -11.476 767 HH TYR 95 HH TYR 95 -9.156 4.883 -14.685 768 H ALA 96 HN ALA 96 -3.732 0.646 -9.194 769 HA ALA 96 HA ALA 96 -6.385 0.993 -7.968 770 1HB ALA 96 HB1 ALA 96 -5.162 -1.466 -8.347 771 2HB ALA 96 HB2 ALA 96 -6.500 -1.115 -7.256 772 3HB ALA 96 HB3 ALA 96 -4.842 -1.082 -6.656 773 H VAL 97 HN VAL 97 -6.428 1.650 -5.812 774 HA VAL 97 HA VAL 97 -3.853 2.511 -4.680 775 HB VAL 97 HB VAL 97 -4.732 4.581 -3.954 776 1HG1 VAL 97 HG11 VAL 97 -4.406 5.383 -5.997 777 2HG1 VAL 97 HG12 VAL 97 -6.113 5.113 -6.336 778 3HG1 VAL 97 HG13 VAL 97 -4.930 3.866 -6.727 779 1HG2 VAL 97 HG21 VAL 97 -7.372 3.312 -4.427 780 2HG2 VAL 97 HG22 VAL 97 -7.254 5.060 -4.633 781 3HG2 VAL 97 HG23 VAL 97 -6.825 4.317 -3.091 782 H ILE 98 HN ILE 98 -3.570 2.016 -2.539 783 HA ILE 98 HA ILE 98 -5.913 1.080 -1.042 784 HB ILE 98 HB ILE 98 -5.051 -0.969 -1.761 785 1HG1 ILE 98 HG12 ILE 98 -4.195 -2.063 0.220 786 2HG1 ILE 98 HG11 ILE 98 -3.624 -0.532 0.871 787 1HG2 ILE 98 HG21 ILE 98 -2.488 -1.391 -1.303 788 2HG2 ILE 98 HG22 ILE 98 -2.413 0.358 -1.488 789 3HG2 ILE 98 HG23 ILE 98 -3.051 -0.638 -2.796 790 1HD1 ILE 98 HD11 ILE 98 -6.434 -0.398 0.336 791 2HD1 ILE 98 HD12 ILE 98 -5.567 -0.170 1.853 792 3HD1 ILE 98 HD13 ILE 98 -6.059 -1.787 1.352 793 H TYR 99 HN TYR 99 -6.076 2.164 0.772 794 HA TYR 99 HA TYR 99 -3.711 3.364 1.990 795 1HB TYR 99 HB2 TYR 99 -5.630 4.833 1.782 796 2HB TYR 99 HB1 TYR 99 -6.666 3.654 2.580 797 HD1 TYR 99 HD1 TYR 99 -3.259 4.831 3.527 798 HD2 TYR 99 HD2 TYR 99 -7.391 4.707 4.525 799 HE1 TYR 99 HE1 TYR 99 -2.754 5.849 5.707 800 HE2 TYR 99 HE2 TYR 99 -6.898 5.728 6.707 801 HH TYR 99 HH TYR 99 -4.096 5.764 8.128 802 H ALA 100 HN ALA 100 -2.659 2.270 3.521 803 HA ALA 100 HA ALA 100 -4.083 0.105 4.887 804 1HB ALA 100 HB1 ALA 100 -1.197 0.573 4.268 805 2HB ALA 100 HB2 ALA 100 -2.217 -0.807 3.864 806 3HB ALA 100 HB3 ALA 100 -1.680 -0.565 5.526 807 H THR 101 HN THR 101 -4.523 0.142 6.945 808 HA THR 101 HA THR 101 -3.063 1.916 8.763 809 HB THR 101 HB THR 101 -5.175 2.503 9.904 810 HG1 THR 101 HG1 THR 101 -6.442 1.220 7.717 811 1HG2 THR 101 HG21 THR 101 -5.638 4.263 8.606 812 2HG2 THR 101 HG22 THR 101 -5.919 3.268 7.177 813 3HG2 THR 101 HG23 THR 101 -4.272 3.684 7.653 814 H ARG 102 HN ARG 102 -2.495 0.878 10.642 815 HA ARG 102 HA ARG 102 -3.915 -1.573 11.354 816 1HB ARG 102 HB2 ARG 102 -1.757 -2.804 11.537 817 2HB ARG 102 HB1 ARG 102 -2.198 -2.377 9.889 818 1HG ARG 102 HG2 ARG 102 -0.655 -0.490 9.965 819 2HG ARG 102 HG1 ARG 102 -0.217 -0.915 11.622 820 1HD ARG 102 HD2 ARG 102 0.615 -3.079 10.843 821 2HD ARG 102 HD1 ARG 102 0.175 -2.654 9.189 822 HE ARG 102 HE ARG 102 1.862 -0.664 10.196 823 1HH1 ARG 102 HH11 ARG 102 1.981 -4.030 9.292 824 2HH1 ARG 102 HH12 ARG 102 3.656 -3.983 8.857 825 1HH2 ARG 102 HH21 ARG 102 4.061 -0.595 9.626 826 2HH2 ARG 102 HH22 ARG 102 4.839 -2.030 9.047 827 H VAL 103 HN VAL 103 -3.851 -2.148 13.463 828 HA VAL 103 HA VAL 103 -2.114 -0.646 15.262 829 HB VAL 103 HB VAL 103 -4.227 0.590 15.245 830 1HG1 VAL 103 HG11 VAL 103 -5.353 -2.017 15.209 831 2HG1 VAL 103 HG12 VAL 103 -6.167 -0.463 15.048 832 3HG1 VAL 103 HG13 VAL 103 -5.937 -1.179 16.644 833 1HG2 VAL 103 HG21 VAL 103 -4.724 0.349 17.733 834 2HG2 VAL 103 HG22 VAL 103 -3.060 0.717 17.280 835 3HG2 VAL 103 HG23 VAL 103 -3.507 -0.926 17.737 836 H LYS 104 HN LYS 104 -1.446 -1.734 17.027 837 HA LYS 104 HA LYS 104 -2.699 -4.190 17.882 838 1HB LYS 104 HB2 LYS 104 -1.247 -4.832 15.914 839 2HB LYS 104 HB1 LYS 104 0.142 -4.306 16.854 840 1HG LYS 104 HG2 LYS 104 -0.235 -6.008 18.488 841 2HG LYS 104 HG1 LYS 104 -1.769 -6.453 17.742 842 1HD LYS 104 HD2 LYS 104 -0.071 -8.058 17.123 843 2HD LYS 104 HD1 LYS 104 -0.546 -7.126 15.703 844 1HE LYS 104 HE2 LYS 104 1.841 -7.361 15.704 845 2HE LYS 104 HE1 LYS 104 1.443 -5.680 16.059 846 1HZ LYS 104 HZ1 LYS 104 3.219 -6.694 17.476 847 2HZ LYS 104 HZ2 LYS 104 2.031 -7.679 18.167 848 3HZ LYS 104 HZ3 LYS 104 1.936 -5.998 18.333 849 H ASP 105 HN ASP 105 -2.326 -4.525 20.022 850 HA ASP 105 HA ASP 105 -1.699 -4.035 22.156 851 1HB ASP 105 HB2 ASP 105 0.978 -3.754 20.777 852 2HB ASP 105 HB1 ASP 105 0.771 -3.741 22.525 853 H GLY 106 HN GLY 106 -2.746 -1.883 20.574 854 1HA GLY 106 HA2 GLY 106 -3.192 0.341 20.961 855 2HA GLY 106 HA1 GLY 106 -2.066 0.282 22.304 856 H ARG 107 HN ARG 107 -1.410 -0.369 18.862 857 HA ARG 107 HA ARG 107 0.141 2.122 18.766 858 1HB ARG 107 HB2 ARG 107 2.094 1.098 17.939 859 2HB ARG 107 HB1 ARG 107 1.606 0.106 19.303 860 1HG ARG 107 HG2 ARG 107 0.460 -1.378 17.541 861 2HG ARG 107 HG1 ARG 107 1.456 -0.504 16.381 862 1HD ARG 107 HD2 ARG 107 3.461 -1.127 17.692 863 2HD ARG 107 HD1 ARG 107 2.433 -2.101 18.743 864 HE ARG 107 HE ARG 107 2.060 -2.863 16.052 865 1HH1 ARG 107 HH11 ARG 107 4.367 -3.096 18.658 866 2HH1 ARG 107 HH12 ARG 107 5.095 -4.546 18.053 867 1HH2 ARG 107 HH21 ARG 107 3.015 -4.769 15.249 868 2HH2 ARG 107 HH22 ARG 107 4.328 -5.496 16.113 869 H THR 108 HN THR 108 -1.177 3.161 17.362 870 HA THR 108 HA THR 108 -2.060 1.803 14.934 871 HB THR 108 HB THR 108 -3.754 3.030 16.159 872 HG1 THR 108 HG1 THR 108 -3.087 4.490 13.825 873 1HG2 THR 108 HG21 THR 108 -1.898 5.361 15.865 874 2HG2 THR 108 HG22 THR 108 -2.661 4.731 17.325 875 3HG2 THR 108 HG23 THR 108 -3.632 5.566 16.112 876 H LEU 109 HN LEU 109 -1.502 2.386 12.882 877 HA LEU 109 HA LEU 109 0.325 4.648 12.503 878 1HB LEU 109 HB2 LEU 109 0.837 1.858 11.469 879 2HB LEU 109 HB1 LEU 109 1.766 3.279 11.039 880 HG LEU 109 HG LEU 109 3.013 2.029 12.642 881 1HD1 LEU 109 HD11 LEU 109 2.090 4.031 14.549 882 2HD1 LEU 109 HD12 LEU 109 2.389 4.676 12.935 883 3HD1 LEU 109 HD13 LEU 109 3.669 3.820 13.794 884 1HD2 LEU 109 HD21 LEU 109 2.113 0.840 14.289 885 2HD2 LEU 109 HD22 LEU 109 0.531 1.298 13.659 886 3HD2 LEU 109 HD23 LEU 109 1.279 2.249 14.942 887 H HIS 110 HN HIS 110 -0.036 5.765 10.652 888 HA HIS 110 HA HIS 110 -2.093 4.680 8.848 889 1HB HIS 110 HB2 HIS 110 -1.199 7.533 9.258 890 2HB HIS 110 HB1 HIS 110 -2.509 7.011 8.207 891 HD1 HIS 110 HD1 HIS 110 -1.672 6.401 11.876 892 HD2 HIS 110 HD2 HIS 110 -4.864 7.493 9.450 893 HE1 HIS 110 HE1 HIS 110 -3.627 6.691 13.429 894 HE2 HIS 110 HE2 HIS 110 -5.570 7.244 11.926 895 H MET 111 HN MET 111 -1.637 4.298 6.737 896 HA MET 111 HA MET 111 0.566 5.591 5.407 897 1HB MET 111 HB2 MET 111 0.685 2.619 5.935 898 2HB MET 111 HB1 MET 111 1.745 3.485 4.832 899 1HG MET 111 HG2 MET 111 2.570 4.817 6.727 900 2HG MET 111 HG1 MET 111 1.556 3.872 7.808 901 1HE MET 111 HE1 MET 111 3.109 0.293 7.379 902 2HE MET 111 HE2 MET 111 1.870 0.975 6.325 903 3HE MET 111 HE3 MET 111 1.790 1.241 8.067 904 H MET 112 HN MET 112 0.136 5.798 3.302 905 HA MET 112 HA MET 112 -2.087 4.255 2.181 906 1HB MET 112 HB2 MET 112 -0.864 6.898 1.473 907 2HB MET 112 HB1 MET 112 -1.806 6.017 0.288 908 1HG MET 112 HG2 MET 112 -3.718 6.025 1.822 909 2HG MET 112 HG1 MET 112 -2.766 6.959 2.975 910 1HE MET 112 HE1 MET 112 -5.158 7.863 2.678 911 2HE MET 112 HE2 MET 112 -5.789 8.478 1.150 912 3HE MET 112 HE3 MET 112 -5.016 9.580 2.290 913 H ARG 113 HN ARG 113 -1.907 3.138 0.256 914 HA ARG 113 HA ARG 113 0.779 2.884 -0.902 915 1HB ARG 113 HB2 ARG 113 0.479 1.058 0.707 916 2HB ARG 113 HB1 ARG 113 -1.015 0.588 -0.089 917 1HG ARG 113 HG2 ARG 113 0.204 -0.037 -2.082 918 2HG ARG 113 HG1 ARG 113 1.711 0.528 -1.359 919 1HD ARG 113 HD2 ARG 113 -0.018 -1.710 -0.310 920 2HD ARG 113 HD1 ARG 113 1.492 -1.907 -1.200 921 HE ARG 113 HE ARG 113 2.054 -0.300 0.991 922 1HH1 ARG 113 HH11 ARG 113 0.920 -3.544 0.412 923 2HH1 ARG 113 HH12 ARG 113 1.628 -4.187 1.854 924 1HH2 ARG 113 HH21 ARG 113 2.989 -1.145 2.898 925 2HH2 ARG 113 HH22 ARG 113 2.803 -2.827 3.264 926 H LEU 114 HN LEU 114 0.814 2.516 -3.114 927 HA LEU 114 HA LEU 114 -1.818 2.578 -4.448 928 1HB LEU 114 HB2 LEU 114 -0.434 4.616 -4.700 929 2HB LEU 114 HB1 LEU 114 0.834 3.651 -5.422 930 HG LEU 114 HG LEU 114 -0.409 4.897 -7.110 931 1HD1 LEU 114 HD11 LEU 114 -0.517 3.224 -8.668 932 2HD1 LEU 114 HD12 LEU 114 -1.264 2.081 -7.552 933 3HD1 LEU 114 HD13 LEU 114 0.454 2.450 -7.416 934 1HD2 LEU 114 HD21 LEU 114 -2.835 3.633 -7.378 935 2HD2 LEU 114 HD22 LEU 114 -2.569 5.248 -6.723 936 3HD2 LEU 114 HD23 LEU 114 -2.690 3.866 -5.636 937 H TYR 115 HN TYR 115 -2.304 0.630 -5.279 938 HA TYR 115 HA TYR 115 -0.121 -1.046 -6.294 939 1HB TYR 115 HB2 TYR 115 -2.936 -1.661 -5.426 940 2HB TYR 115 HB1 TYR 115 -2.017 -2.798 -6.405 941 HD1 TYR 115 HD1 TYR 115 -3.111 -2.673 -3.330 942 HD2 TYR 115 HD2 TYR 115 0.678 -2.547 -5.260 943 HE1 TYR 115 HE1 TYR 115 -2.056 -3.595 -1.309 944 HE2 TYR 115 HE2 TYR 115 1.743 -3.466 -3.243 945 HH TYR 115 HH TYR 115 0.990 -4.894 -1.251 946 H SER 116 HN SER 116 0.315 -0.830 -8.376 947 HA SER 116 HA SER 116 -1.867 -0.218 -10.255 948 1HB SER 116 HB2 SER 116 -0.029 1.402 -10.272 949 2HB SER 116 HB1 SER 116 1.130 0.105 -10.569 950 HG SER 116 HG SER 116 -1.027 0.743 -12.296 951 H ARG 117 HN ARG 117 -2.384 -1.620 -11.895 952 HA ARG 117 HA ARG 117 -1.545 -4.311 -11.707 953 1HB ARG 117 HB2 ARG 117 -3.072 -2.786 -13.795 954 2HB ARG 117 HB1 ARG 117 -2.626 -4.464 -14.050 955 1HG ARG 117 HG2 ARG 117 -4.851 -4.409 -13.240 956 2HG ARG 117 HG1 ARG 117 -3.830 -5.032 -11.949 957 1HD ARG 117 HD2 ARG 117 -4.505 -2.120 -12.100 958 2HD ARG 117 HD1 ARG 117 -5.643 -3.269 -11.398 959 HE ARG 117 HE ARG 117 -3.350 -2.211 -10.155 960 1HH1 ARG 117 HH11 ARG 117 -5.089 -5.220 -10.506 961 2HH1 ARG 117 HH12 ARG 117 -4.588 -5.831 -8.966 962 1HH2 ARG 117 HH21 ARG 117 -2.703 -3.010 -8.132 963 2HH2 ARG 117 HH22 ARG 117 -3.235 -4.573 -7.615 964 H SER 118 HN SER 118 -0.783 -1.792 -14.079 965 HA SER 118 HA SER 118 1.645 -3.293 -14.792 966 1HB SER 118 HB2 SER 118 -0.181 -1.786 -16.683 967 2HB SER 118 HB1 SER 118 1.349 -2.536 -17.131 968 HG SER 118 HG SER 118 -0.373 -3.918 -17.611 969 HA PRO 119 HA PRO 119 4.332 0.157 -14.231 970 1HB PRO 119 HB2 PRO 119 4.456 0.353 -17.222 971 2HB PRO 119 HB1 PRO 119 5.768 0.433 -16.040 972 1HG PRO 119 HG2 PRO 119 5.285 -1.807 -17.417 973 2HG PRO 119 HG1 PRO 119 5.808 -1.857 -15.724 974 1HD PRO 119 HD2 PRO 119 3.170 -2.470 -16.897 975 2HD PRO 119 HD1 PRO 119 3.874 -3.008 -15.362 976 H GLU 120 HN GLU 120 1.848 0.491 -16.711 977 HA GLU 120 HA GLU 120 1.813 3.320 -16.804 978 1HB GLU 120 HB2 GLU 120 0.885 1.908 -18.586 979 2HB GLU 120 HB1 GLU 120 -0.368 1.342 -17.489 980 1HG GLU 120 HG2 GLU 120 -1.205 3.656 -17.308 981 2HG GLU 120 HG1 GLU 120 0.006 4.155 -18.489 982 H VAL 121 HN VAL 121 0.493 4.811 -15.823 983 HA VAL 121 HA VAL 121 -1.470 3.960 -13.864 984 HB VAL 121 HB VAL 121 0.937 5.605 -13.050 985 1HG1 VAL 121 HG11 VAL 121 -1.101 6.463 -12.018 986 2HG1 VAL 121 HG12 VAL 121 -0.084 5.659 -10.822 987 3HG1 VAL 121 HG13 VAL 121 -1.511 4.841 -11.458 988 1HG2 VAL 121 HG21 VAL 121 1.312 3.757 -11.449 989 2HG2 VAL 121 HG22 VAL 121 1.440 3.243 -13.131 990 3HG2 VAL 121 HG23 VAL 121 -0.012 2.870 -12.202 991 H SER 122 HN SER 122 -3.129 5.051 -14.679 992 HA SER 122 HA SER 122 -3.056 7.433 -16.111 993 1HB SER 122 HB2 SER 122 -4.979 5.879 -16.103 994 2HB SER 122 HB1 SER 122 -5.338 6.359 -14.445 995 HG SER 122 HG SER 122 -6.495 7.454 -16.266 996 HA PRO 123 HA PRO 123 -2.415 10.763 -13.278 997 1HB PRO 123 HB2 PRO 123 -4.452 12.438 -14.232 998 2HB PRO 123 HB1 PRO 123 -2.792 12.389 -14.836 999 1HG PRO 123 HG2 PRO 123 -5.245 11.077 -15.915 1000 2HG PRO 123 HG1 PRO 123 -3.886 11.808 -16.789 1001 1HD PRO 123 HD2 PRO 123 -4.115 9.161 -16.587 1002 2HD PRO 123 HD1 PRO 123 -2.524 9.946 -16.466 1003 H ALA 124 HN ALA 124 -5.628 9.474 -13.871 1004 HA ALA 124 HA ALA 124 -6.967 10.668 -11.695 1005 1HB ALA 124 HB1 ALA 124 -7.509 8.532 -13.625 1006 2HB ALA 124 HB2 ALA 124 -8.569 9.797 -13.004 1007 3HB ALA 124 HB3 ALA 124 -8.308 8.325 -12.066 1008 H ALA 125 HN ALA 125 -5.429 7.496 -12.071 1009 HA ALA 125 HA ALA 125 -6.020 6.414 -9.598 1010 1HB ALA 125 HB1 ALA 125 -4.697 4.763 -10.274 1011 2HB ALA 125 HB2 ALA 125 -3.301 5.829 -10.442 1012 3HB ALA 125 HB3 ALA 125 -4.473 5.691 -11.754 1013 H THR 126 HN THR 126 -3.218 8.402 -10.516 1014 HA THR 126 HA THR 126 -2.223 8.483 -7.824 1015 HB THR 126 HB THR 126 -0.683 8.605 -9.704 1016 HG1 THR 126 HG1 THR 126 0.552 10.243 -8.910 1017 1HG2 THR 126 HG21 THR 126 -2.219 9.933 -11.212 1018 2HG2 THR 126 HG22 THR 126 -0.515 10.389 -11.205 1019 3HG2 THR 126 HG23 THR 126 -1.690 11.359 -10.317 1020 H ALA 127 HN ALA 127 -3.836 10.815 -9.960 1021 HA ALA 127 HA ALA 127 -3.805 12.933 -8.078 1022 1HB ALA 127 HB1 ALA 127 -5.683 12.646 -10.408 1023 2HB ALA 127 HB2 ALA 127 -4.014 13.199 -10.551 1024 3HB ALA 127 HB3 ALA 127 -5.175 14.134 -9.610 1025 H ILE 128 HN ILE 128 -6.429 10.750 -9.126 1026 HA ILE 128 HA ILE 128 -8.353 11.795 -7.375 1027 HB ILE 128 HB ILE 128 -8.228 8.990 -8.495 1028 1HG1 ILE 128 HG12 ILE 128 -9.795 11.403 -9.438 1029 2HG1 ILE 128 HG11 ILE 128 -8.314 10.819 -10.189 1030 1HG2 ILE 128 HG21 ILE 128 -10.880 9.909 -7.969 1031 2HG2 ILE 128 HG22 ILE 128 -9.916 10.081 -6.505 1032 3HG2 ILE 128 HG23 ILE 128 -10.040 8.510 -7.297 1033 1HD1 ILE 128 HD11 ILE 128 -11.024 9.561 -10.136 1034 2HD1 ILE 128 HD12 ILE 128 -9.577 8.598 -10.436 1035 3HD1 ILE 128 HD13 ILE 128 -9.987 9.931 -11.515 1036 H PHE 129 HN PHE 129 -5.943 9.230 -6.932 1037 HA PHE 129 HA PHE 129 -6.934 8.367 -4.419 1038 1HB PHE 129 HB2 PHE 129 -5.313 7.041 -5.730 1039 2HB PHE 129 HB1 PHE 129 -4.088 8.274 -5.454 1040 HD1 PHE 129 HD1 PHE 129 -2.464 7.198 -4.160 1041 HD2 PHE 129 HD2 PHE 129 -6.567 6.858 -3.073 1042 HE1 PHE 129 HE1 PHE 129 -1.814 6.089 -2.059 1043 HE2 PHE 129 HE2 PHE 129 -5.922 5.750 -0.973 1044 HZ PHE 129 HZ PHE 129 -3.545 5.366 -0.463 1045 H ARG 130 HN ARG 130 -4.532 10.756 -5.398 1046 HA ARG 130 HA ARG 130 -3.813 11.581 -2.783 1047 1HB ARG 130 HB2 ARG 130 -2.379 12.019 -4.719 1048 2HB ARG 130 HB1 ARG 130 -3.631 13.015 -5.443 1049 1HG ARG 130 HG2 ARG 130 -3.400 14.646 -3.660 1050 2HG ARG 130 HG1 ARG 130 -2.189 13.633 -2.871 1051 1HD ARG 130 HD2 ARG 130 -0.702 13.879 -4.772 1052 2HD ARG 130 HD1 ARG 130 -1.930 14.796 -5.643 1053 HE ARG 130 HE ARG 130 -0.093 15.811 -3.748 1054 1HH1 ARG 130 HH11 ARG 130 -3.400 16.167 -4.819 1055 2HH1 ARG 130 HH12 ARG 130 -3.525 17.807 -4.280 1056 1HH2 ARG 130 HH21 ARG 130 -0.257 17.965 -3.051 1057 2HH2 ARG 130 HH22 ARG 130 -1.741 18.830 -3.279 1058 H LYS 131 HN LYS 131 -6.077 12.787 -5.212 1059 HA LYS 131 HA LYS 131 -7.066 14.999 -3.778 1060 1HB LYS 131 HB2 LYS 131 -7.432 14.605 -6.213 1061 2HB LYS 131 HB1 LYS 131 -8.511 13.279 -5.806 1062 1HG LYS 131 HG2 LYS 131 -10.033 14.828 -4.710 1063 2HG LYS 131 HG1 LYS 131 -8.943 16.168 -5.069 1064 1HD LYS 131 HD2 LYS 131 -10.762 16.110 -6.677 1065 2HD LYS 131 HD1 LYS 131 -9.232 15.742 -7.474 1066 1HE LYS 131 HE2 LYS 131 -9.759 13.351 -7.370 1067 2HE LYS 131 HE1 LYS 131 -11.290 13.725 -6.579 1068 1HZ LYS 131 HZ1 LYS 131 -11.931 14.988 -8.565 1069 2HZ LYS 131 HZ2 LYS 131 -11.643 13.359 -8.917 1070 3HZ LYS 131 HZ3 LYS 131 -10.491 14.528 -9.325 1071 H LEU 132 HN LEU 132 -8.091 11.639 -4.017 1072 HA LEU 132 HA LEU 132 -10.340 11.822 -2.315 1073 1HB LEU 132 HB2 LEU 132 -9.920 9.972 -3.924 1074 2HB LEU 132 HB1 LEU 132 -8.597 9.424 -2.914 1075 HG LEU 132 HG LEU 132 -11.464 9.549 -1.978 1076 1HD1 LEU 132 HD11 LEU 132 -10.032 7.029 -2.711 1077 2HD1 LEU 132 HD12 LEU 132 -10.869 7.967 -3.946 1078 3HD1 LEU 132 HD13 LEU 132 -11.763 7.331 -2.565 1079 1HD2 LEU 132 HD21 LEU 132 -10.363 9.376 -0.015 1080 2HD2 LEU 132 HD22 LEU 132 -8.885 8.784 -0.773 1081 3HD2 LEU 132 HD23 LEU 132 -10.229 7.680 -0.479 1082 H ALA 133 HN ALA 133 -6.928 11.160 -1.809 1083 HA ALA 133 HA ALA 133 -7.066 10.407 0.906 1084 1HB ALA 133 HB1 ALA 133 -4.634 11.140 0.927 1085 2HB ALA 133 HB2 ALA 133 -4.854 11.581 -0.766 1086 3HB ALA 133 HB3 ALA 133 -5.067 9.907 -0.258 1087 H GLY 134 HN GLY 134 -6.577 13.539 -0.691 1088 1HA GLY 134 HA2 GLY 134 -6.178 15.071 1.637 1089 2HA GLY 134 HA1 GLY 134 -6.744 15.689 0.093 1090 H GLU 135 HN GLU 135 -9.152 14.552 -0.256 1091 HA GLU 135 HA GLU 135 -10.829 16.041 1.434 1092 1HB GLU 135 HB2 GLU 135 -12.692 14.779 0.347 1093 2HB GLU 135 HB1 GLU 135 -11.574 15.530 -0.777 1094 1HG GLU 135 HG2 GLU 135 -11.835 13.506 -1.765 1095 2HG GLU 135 HG1 GLU 135 -10.441 13.166 -0.746 1096 H ARG 136 HN ARG 136 -9.517 12.863 1.719 1097 HA ARG 136 HA ARG 136 -11.427 11.871 3.606 1098 1HB ARG 136 HB2 ARG 136 -10.073 10.375 2.195 1099 2HB ARG 136 HB1 ARG 136 -8.619 10.926 3.017 1100 1HG ARG 136 HG2 ARG 136 -9.413 9.988 5.104 1101 2HG ARG 136 HG1 ARG 136 -10.919 9.492 4.328 1102 1HD ARG 136 HD2 ARG 136 -9.649 8.047 2.808 1103 2HD ARG 136 HD1 ARG 136 -8.153 8.527 3.608 1104 HE ARG 136 HE ARG 136 -9.965 6.540 4.473 1105 1HH1 ARG 136 HH11 ARG 136 -7.856 9.047 5.684 1106 2HH1 ARG 136 HH12 ARG 136 -7.673 8.310 7.240 1107 1HH2 ARG 136 HH21 ARG 136 -9.728 5.577 6.511 1108 2HH2 ARG 136 HH22 ARG 136 -8.734 6.337 7.709 1109 H ASN 137 HN ASN 137 -8.314 13.496 3.793 1110 HA ASN 137 HA ASN 137 -8.850 14.333 6.476 1111 1HB ASN 137 HB2 ASN 137 -8.001 12.096 6.950 1112 2HB ASN 137 HB1 ASN 137 -6.570 12.407 5.972 1113 1HD2 ASN 137 HD21 ASN 137 -4.844 12.839 7.107 1114 2HD2 ASN 137 HD22 ASN 137 -4.786 13.630 8.642 1115 H TYR 138 HN TYR 138 -6.163 13.836 4.175 1116 HA TYR 138 HA TYR 138 -5.697 16.306 3.236 1117 1HB TYR 138 HB2 TYR 138 -5.096 16.298 6.097 1118 2HB TYR 138 HB1 TYR 138 -3.709 16.784 5.131 1119 HD1 TYR 138 HD1 TYR 138 -7.207 17.457 4.150 1120 HD2 TYR 138 HD2 TYR 138 -3.651 19.054 5.855 1121 HE1 TYR 138 HE1 TYR 138 -8.141 19.724 3.958 1122 HE2 TYR 138 HE2 TYR 138 -4.575 21.324 5.667 1123 HH TYR 138 HH TYR 138 -6.344 22.475 4.172 1124 H THR 139 HN THR 139 -4.142 16.061 1.739 1125 HA THR 139 HA THR 139 -2.382 13.774 1.899 1126 HB THR 139 HB THR 139 -1.586 14.443 -0.315 1127 HG1 THR 139 HG1 THR 139 -1.982 16.365 -1.158 1128 1HG2 THR 139 HG21 THR 139 -3.354 13.483 -1.202 1129 2HG2 THR 139 HG22 THR 139 -4.239 14.998 -1.075 1130 3HG2 THR 139 HG23 THR 139 -4.294 13.842 0.253 1131 H ASP 140 HN ASP 140 -2.135 17.289 1.995 1132 HA ASP 140 HA ASP 140 0.656 17.499 2.170 1133 1HB ASP 140 HB2 ASP 140 -1.449 19.313 3.369 1134 2HB ASP 140 HB1 ASP 140 0.247 19.731 3.151 1135 H GLU 141 HN GLU 141 -1.780 16.751 4.523 1136 HA GLU 141 HA GLU 141 -0.650 17.204 6.950 1137 1HB GLU 141 HB2 GLU 141 -2.813 16.241 6.850 1138 2HB GLU 141 HB1 GLU 141 -2.241 14.853 5.933 1139 1HG GLU 141 HG2 GLU 141 -2.735 14.161 8.162 1140 2HG GLU 141 HG1 GLU 141 -0.991 14.107 7.925 1141 H MET 142 HN MET 142 -0.406 13.955 5.557 1142 HA MET 142 HA MET 142 2.458 13.872 6.010 1143 1HB MET 142 HB2 MET 142 0.582 11.976 7.437 1144 2HB MET 142 HB1 MET 142 2.326 11.805 7.365 1145 1HG MET 142 HG2 MET 142 0.822 14.052 8.671 1146 2HG MET 142 HG1 MET 142 1.634 12.723 9.492 1147 1HE MET 142 HE1 MET 142 4.183 12.224 9.143 1148 2HE MET 142 HE2 MET 142 5.390 13.444 8.739 1149 3HE MET 142 HE3 MET 142 4.432 12.696 7.462 1150 H VAL 143 HN VAL 143 3.009 13.261 4.026 1151 HA VAL 143 HA VAL 143 1.463 11.150 2.687 1152 HB VAL 143 HB VAL 143 1.401 13.136 1.389 1153 1HG1 VAL 143 HG11 VAL 143 2.938 14.636 2.147 1154 2HG1 VAL 143 HG12 VAL 143 3.743 14.126 0.664 1155 3HG1 VAL 143 HG13 VAL 143 4.239 13.449 2.213 1156 1HG2 VAL 143 HG21 VAL 143 2.539 12.646 -0.678 1157 2HG2 VAL 143 HG22 VAL 143 1.960 11.136 0.022 1158 3HG2 VAL 143 HG23 VAL 143 3.667 11.576 0.146 1159 H ALA 144 HN ALA 144 2.977 10.050 0.931 1160 HA ALA 144 HA ALA 144 5.659 9.459 1.785 1161 1HB ALA 144 HB1 ALA 144 4.687 7.830 3.165 1162 2HB ALA 144 HB2 ALA 144 5.122 6.945 1.706 1163 3HB ALA 144 HB3 ALA 144 3.449 7.428 1.975 1164 H MET 145 HN MET 145 6.860 9.239 -0.040 1165 HA MET 145 HA MET 145 5.446 8.511 -2.524 1166 1HB MET 145 HB2 MET 145 7.062 10.096 -3.673 1167 2HB MET 145 HB1 MET 145 5.780 10.827 -2.719 1168 1HG MET 145 HG2 MET 145 7.487 10.957 -0.835 1169 2HG MET 145 HG1 MET 145 8.696 10.584 -2.063 1170 1HE MET 145 HE1 MET 145 5.421 12.857 -2.649 1171 2HE MET 145 HE2 MET 145 6.056 14.349 -1.957 1172 3HE MET 145 HE3 MET 145 5.873 12.916 -0.946 1173 H LEU 146 HN LEU 146 6.596 7.506 -4.164 1174 HA LEU 146 HA LEU 146 8.382 5.500 -3.389 1175 1HB LEU 146 HB2 LEU 146 6.910 5.317 -5.314 1176 2HB LEU 146 HB1 LEU 146 7.768 6.615 -6.121 1177 HG LEU 146 HG LEU 146 9.831 5.089 -5.973 1178 1HD1 LEU 146 HD11 LEU 146 8.070 2.755 -6.035 1179 2HD1 LEU 146 HD12 LEU 146 8.200 3.531 -4.457 1180 3HD1 LEU 146 HD13 LEU 146 9.649 2.972 -5.288 1181 1HD2 LEU 146 HD21 LEU 146 7.747 5.344 -7.864 1182 2HD2 LEU 146 HD22 LEU 146 8.221 3.646 -7.829 1183 3HD2 LEU 146 HD23 LEU 146 9.428 4.890 -8.142 1184 HA PRO 147 HA PRO 147 12.341 7.554 -3.448 1185 1HB PRO 147 HB2 PRO 147 13.514 4.935 -4.089 1186 2HB PRO 147 HB1 PRO 147 13.743 5.944 -2.658 1187 1HG PRO 147 HG2 PRO 147 12.349 3.646 -2.574 1188 2HG PRO 147 HG1 PRO 147 11.926 5.043 -1.568 1189 1HD PRO 147 HD2 PRO 147 10.659 4.078 -4.102 1190 2HD PRO 147 HD1 PRO 147 9.896 4.714 -2.632 1191 H ARG 148 HN ARG 148 13.674 8.441 -4.949 1192 HA ARG 148 HA ARG 148 13.080 7.905 -7.719 1193 1HB ARG 148 HB2 ARG 148 14.553 9.822 -8.179 1194 2HB ARG 148 HB1 ARG 148 13.320 10.203 -6.989 1195 1HG ARG 148 HG2 ARG 148 15.307 11.207 -6.227 1196 2HG ARG 148 HG1 ARG 148 15.063 9.784 -5.217 1197 1HD ARG 148 HD2 ARG 148 16.729 8.562 -6.385 1198 2HD ARG 148 HD1 ARG 148 16.829 9.780 -7.655 1199 HE ARG 148 HE ARG 148 18.272 9.750 -5.235 1200 1HH1 ARG 148 HH11 ARG 148 16.625 11.949 -7.388 1201 2HH1 ARG 148 HH12 ARG 148 17.566 13.320 -6.906 1202 1HH2 ARG 148 HH21 ARG 148 19.515 11.548 -4.609 1203 2HH2 ARG 148 HH22 ARG 148 19.209 13.092 -5.331 1204 H GLN 149 HN GLN 149 14.815 6.077 -5.829 1205 HA GLN 149 HA GLN 149 16.550 5.201 -7.942 1206 1HB GLN 149 HB2 GLN 149 17.842 7.046 -6.783 1207 2HB GLN 149 HB1 GLN 149 17.870 6.018 -5.357 1208 1HG GLN 149 HG2 GLN 149 19.093 4.323 -6.553 1209 2HG GLN 149 HG1 GLN 149 18.983 5.255 -8.044 1210 1HE2 GLN 149 HE21 GLN 149 21.031 4.405 -5.722 1211 2HE2 GLN 149 HE22 GLN 149 22.085 5.772 -5.699 1212 H GLU 150 HN GLU 150 17.325 3.116 -7.647 1213 HA GLU 150 HA GLU 150 15.709 1.446 -6.050 1214 1HB GLU 150 HB2 GLU 150 17.152 -0.387 -6.906 1215 2HB GLU 150 HB1 GLU 150 16.500 0.655 -8.159 1216 1HG GLU 150 HG2 GLU 150 18.683 0.304 -8.821 1217 2HG GLU 150 HG1 GLU 150 18.743 1.882 -8.043 1218 H GLU 151 HN GLU 151 18.405 3.218 -5.097 1219 HA GLU 151 HA GLU 151 19.320 1.226 -3.187 1220 1HB GLU 151 HB2 GLU 151 20.281 4.020 -3.798 1221 2HB GLU 151 HB1 GLU 151 20.953 3.029 -2.510 1222 1HG GLU 151 HG2 GLU 151 20.922 2.290 -5.426 1223 2HG GLU 151 HG1 GLU 151 22.294 2.989 -4.567 1224 H CYS 152 HN CYS 152 19.291 4.561 -2.228 1225 HA CYS 152 HA CYS 152 16.951 4.322 -0.558 1226 1HB CYS 152 HB2 CYS 152 18.389 4.926 1.501 1227 2HB CYS 152 HB1 CYS 152 18.373 3.248 0.970 1228 H THR 153 HN THR 153 16.115 6.147 -1.453 1229 HA THR 153 HA THR 153 17.030 8.670 -0.521 1230 HB THR 153 HB THR 153 18.712 8.389 -2.257 1231 HG1 THR 153 HG1 THR 153 17.549 10.468 -1.966 1232 1HG2 THR 153 HG21 THR 153 16.652 8.393 -4.403 1233 2HG2 THR 153 HG22 THR 153 17.125 6.866 -3.659 1234 3HG2 THR 153 HG23 THR 153 18.336 7.870 -4.456 1235 H VAL 154 HN VAL 154 14.710 8.179 0.075 1236 HA VAL 154 HA VAL 154 12.706 8.289 -1.930 1237 HB VAL 154 HB VAL 154 12.630 7.433 0.572 1238 1HG1 VAL 154 HG11 VAL 154 12.881 9.927 1.303 1239 2HG1 VAL 154 HG12 VAL 154 11.797 8.850 2.176 1240 3HG1 VAL 154 HG13 VAL 154 11.148 9.987 0.995 1241 1HG2 VAL 154 HG21 VAL 154 10.860 7.656 -1.454 1242 2HG2 VAL 154 HG22 VAL 154 10.048 8.594 -0.200 1243 3HG2 VAL 154 HG23 VAL 154 10.503 6.918 0.107 1244 H ASP 155 HN ASP 155 11.617 9.990 -2.800 1245 HA ASP 155 HA ASP 155 12.725 12.571 -2.703 1246 1HB ASP 155 HB2 ASP 155 11.374 11.739 -4.598 1247 2HB ASP 155 HB1 ASP 155 9.938 11.775 -3.579 1248 H GLU 156 HN GLU 156 12.314 14.347 -1.491 1249 HA GLU 156 HA GLU 156 11.532 15.652 0.202 1250 1HB GLU 156 HB2 GLU 156 9.409 15.689 -0.851 1251 2HB GLU 156 HB1 GLU 156 9.050 14.039 -0.363 1252 1HG GLU 156 HG2 GLU 156 8.884 14.747 1.962 1253 2HG GLU 156 HG1 GLU 156 9.291 16.398 1.494 1254 H VAL 157 HN VAL 157 11.854 15.654 2.342 1255 HA VAL 157 HA VAL 157 12.669 13.326 3.676 1256 HB VAL 157 HB VAL 157 12.675 14.678 5.730 1257 1HG1 VAL 157 HG11 VAL 157 14.650 14.966 4.592 1258 2HG1 VAL 157 HG12 VAL 157 14.078 16.630 4.709 1259 3HG1 VAL 157 HG13 VAL 157 13.868 15.730 3.208 1260 1HG2 VAL 157 HG21 VAL 157 11.534 16.593 6.013 1261 2HG2 VAL 157 HG22 VAL 157 10.574 16.022 4.647 1262 3HG2 VAL 157 HG23 VAL 157 11.891 17.164 4.383 Start of MODEL 18 1 1H MET 1 HT1 MET 1 -11.877 -4.092 -24.197 2 2H MET 1 HT2 MET 1 -11.280 -4.616 -22.704 3 3H MET 1 HT3 MET 1 -12.817 -3.916 -22.802 4 HA MET 1 HA MET 1 -13.324 -5.833 -24.424 5 1HB MET 1 HB2 MET 1 -10.997 -6.902 -22.810 6 2HB MET 1 HB1 MET 1 -12.026 -7.861 -23.865 7 1HG MET 1 HG2 MET 1 -11.278 -6.554 -25.787 8 2HG MET 1 HG1 MET 1 -10.248 -5.592 -24.729 9 1HE MET 1 HE1 MET 1 -11.352 -9.031 -25.418 10 2HE MET 1 HE2 MET 1 -10.155 -9.939 -24.495 11 3HE MET 1 HE3 MET 1 -9.971 -9.759 -26.239 12 H THR 2 HN THR 2 -12.242 -5.675 -21.047 13 HA THR 2 HA THR 2 -13.289 -6.136 -19.084 14 HB THR 2 HB THR 2 -15.791 -5.956 -20.774 15 HG1 THR 2 HG1 THR 2 -14.598 -4.005 -19.103 16 1HG2 THR 2 HG21 THR 2 -16.558 -5.108 -18.350 17 2HG2 THR 2 HG22 THR 2 -15.402 -6.356 -17.887 18 3HG2 THR 2 HG23 THR 2 -16.771 -6.762 -18.923 19 H VAL 3 HN VAL 3 -13.616 -7.959 -17.937 20 HA VAL 3 HA VAL 3 -15.136 -10.169 -18.724 21 HB VAL 3 HB VAL 3 -13.418 -10.475 -20.451 22 1HG1 VAL 3 HG11 VAL 3 -11.423 -11.017 -18.275 23 2HG1 VAL 3 HG12 VAL 3 -11.602 -9.418 -18.996 24 3HG1 VAL 3 HG13 VAL 3 -11.142 -10.791 -20.001 25 1HG2 VAL 3 HG21 VAL 3 -13.615 -12.500 -18.247 26 2HG2 VAL 3 HG22 VAL 3 -12.685 -12.824 -19.709 27 3HG2 VAL 3 HG23 VAL 3 -14.413 -12.490 -19.818 28 HA PRO 4 HA PRO 4 -14.709 -10.889 -14.374 29 1HB PRO 4 HB2 PRO 4 -15.087 -13.745 -15.191 30 2HB PRO 4 HB1 PRO 4 -15.925 -12.812 -13.948 31 1HG PRO 4 HG2 PRO 4 -17.113 -13.310 -16.255 32 2HG PRO 4 HG1 PRO 4 -17.258 -11.707 -15.507 33 1HD PRO 4 HD2 PRO 4 -15.555 -12.580 -17.808 34 2HD PRO 4 HD1 PRO 4 -16.448 -11.063 -17.576 35 H ASP 5 HN ASP 5 -13.666 -14.091 -14.659 36 HA ASP 5 HA ASP 5 -11.694 -15.153 -14.332 37 1HB ASP 5 HB2 ASP 5 -10.503 -12.636 -15.518 38 2HB ASP 5 HB1 ASP 5 -9.625 -14.134 -15.234 39 H ARG 6 HN ARG 6 -10.740 -15.512 -12.458 40 HA ARG 6 HA ARG 6 -10.828 -13.626 -10.356 41 1HB ARG 6 HB2 ARG 6 -9.309 -16.232 -10.560 42 2HB ARG 6 HB1 ARG 6 -9.566 -15.323 -9.075 43 1HG ARG 6 HG2 ARG 6 -11.980 -15.629 -9.304 44 2HG ARG 6 HG1 ARG 6 -11.719 -16.548 -10.787 45 1HD ARG 6 HD2 ARG 6 -10.703 -17.290 -8.045 46 2HD ARG 6 HD1 ARG 6 -12.089 -18.014 -8.858 47 HE ARG 6 HE ARG 6 -9.378 -18.707 -9.222 48 1HH1 ARG 6 HH11 ARG 6 -12.354 -18.307 -11.006 49 2HH1 ARG 6 HH12 ARG 6 -11.885 -19.392 -12.270 50 1HH2 ARG 6 HH21 ARG 6 -8.769 -20.141 -10.879 51 2HH2 ARG 6 HH22 ARG 6 -9.854 -20.435 -12.197 52 H SER 7 HN SER 7 -8.378 -14.551 -12.658 53 HA SER 7 HA SER 7 -6.058 -13.649 -11.500 54 1HB SER 7 HB2 SER 7 -6.116 -14.739 -13.698 55 2HB SER 7 HB1 SER 7 -6.894 -13.317 -14.393 56 HG SER 7 HG SER 7 -4.366 -13.728 -14.303 57 H GLU 8 HN GLU 8 -8.661 -11.762 -12.919 58 HA GLU 8 HA GLU 8 -7.621 -9.314 -13.361 59 1HB GLU 8 HB2 GLU 8 -9.744 -8.339 -12.737 60 2HB GLU 8 HB1 GLU 8 -10.030 -9.884 -13.527 61 1HG GLU 8 HG2 GLU 8 -10.287 -10.918 -11.289 62 2HG GLU 8 HG1 GLU 8 -10.138 -9.312 -10.579 63 H ILE 9 HN ILE 9 -8.392 -10.635 -10.162 64 HA ILE 9 HA ILE 9 -7.267 -8.293 -8.856 65 HB ILE 9 HB ILE 9 -8.247 -10.807 -7.507 66 1HG1 ILE 9 HG12 ILE 9 -10.082 -10.028 -8.862 67 2HG1 ILE 9 HG11 ILE 9 -10.400 -9.577 -7.193 68 1HG2 ILE 9 HG21 ILE 9 -6.887 -8.720 -6.460 69 2HG2 ILE 9 HG22 ILE 9 -8.034 -9.708 -5.557 70 3HG2 ILE 9 HG23 ILE 9 -8.549 -8.169 -6.247 71 1HD1 ILE 9 HD11 ILE 9 -10.803 -7.892 -9.151 72 2HD1 ILE 9 HD12 ILE 9 -9.074 -7.598 -8.972 73 3HD1 ILE 9 HD13 ILE 9 -10.157 -7.346 -7.604 74 H ALA 10 HN ALA 10 -6.510 -11.684 -9.411 75 HA ALA 10 HA ALA 10 -4.197 -11.729 -7.721 76 1HB ALA 10 HB1 ALA 10 -4.168 -13.940 -8.124 77 2HB ALA 10 HB2 ALA 10 -4.353 -13.729 -9.865 78 3HB ALA 10 HB3 ALA 10 -5.765 -13.652 -8.812 79 H GLY 11 HN GLY 11 -2.100 -11.272 -8.194 80 1HA GLY 11 HA2 GLY 11 -0.690 -11.550 -10.474 81 2HA GLY 11 HA1 GLY 11 -1.552 -10.051 -10.775 82 H LYS 12 HN LYS 12 0.126 -8.634 -10.758 83 HA LYS 12 HA LYS 12 1.669 -8.464 -8.254 84 1HB LYS 12 HB2 LYS 12 3.525 -7.520 -9.560 85 2HB LYS 12 HB1 LYS 12 3.114 -9.146 -10.087 86 1HG LYS 12 HG2 LYS 12 1.911 -8.246 -11.996 87 2HG LYS 12 HG1 LYS 12 2.257 -6.602 -11.453 88 1HD LYS 12 HD2 LYS 12 4.649 -7.009 -11.716 89 2HD LYS 12 HD1 LYS 12 4.319 -8.665 -12.229 90 1HE LYS 12 HE2 LYS 12 4.747 -7.226 -14.148 91 2HE LYS 12 HE1 LYS 12 3.089 -7.825 -14.163 92 1HZ LYS 12 HZ1 LYS 12 3.861 -5.158 -13.118 93 2HZ LYS 12 HZ2 LYS 12 2.296 -5.736 -13.396 94 3HZ LYS 12 HZ3 LYS 12 3.326 -5.426 -14.701 95 H TRP 13 HN TRP 13 1.590 -6.628 -7.169 96 HA TRP 13 HA TRP 13 0.216 -4.336 -8.381 97 1HB TRP 13 HB2 TRP 13 0.626 -5.094 -5.481 98 2HB TRP 13 HB1 TRP 13 -0.182 -3.633 -6.025 99 HD1 TRP 13 HD1 TRP 13 -1.235 -6.295 -8.299 100 HE1 TRP 13 HE1 TRP 13 -3.524 -7.253 -7.611 101 HE3 TRP 13 HE3 TRP 13 -1.559 -4.334 -3.590 102 HZ2 TRP 13 HZ2 TRP 13 -5.233 -7.190 -5.375 103 HZ3 TRP 13 HZ3 TRP 13 -3.551 -4.834 -2.239 104 HH2 TRP 13 HH2 TRP 13 -5.352 -6.234 -3.114 105 H TYR 14 HN TYR 14 1.325 -2.501 -8.767 106 HA TYR 14 HA TYR 14 4.113 -2.360 -7.949 107 1HB TYR 14 HB2 TYR 14 3.449 -1.794 -10.276 108 2HB TYR 14 HB1 TYR 14 2.516 -0.438 -9.657 109 HD1 TYR 14 HD1 TYR 14 3.665 1.340 -10.733 110 HD2 TYR 14 HD2 TYR 14 5.838 -1.499 -8.426 111 HE1 TYR 14 HE1 TYR 14 5.663 2.768 -10.866 112 HE2 TYR 14 HE2 TYR 14 7.839 -0.079 -8.553 113 HH TYR 14 HH TYR 14 8.358 2.341 -8.910 114 H VAL 15 HN VAL 15 4.624 -1.507 -6.047 115 HA VAL 15 HA VAL 15 2.845 0.481 -4.844 116 HB VAL 15 HB VAL 15 5.126 -1.062 -3.626 117 1HG1 VAL 15 HG11 VAL 15 3.202 0.910 -2.426 118 2HG1 VAL 15 HG12 VAL 15 4.962 1.002 -2.464 119 3HG1 VAL 15 HG13 VAL 15 4.162 -0.216 -1.468 120 1HG2 VAL 15 HG21 VAL 15 2.156 -1.360 -3.227 121 2HG2 VAL 15 HG22 VAL 15 3.423 -2.330 -2.474 122 3HG2 VAL 15 HG23 VAL 15 3.158 -2.423 -4.215 123 H VAL 16 HN VAL 16 3.304 2.552 -4.868 124 HA VAL 16 HA VAL 16 6.040 3.520 -4.726 125 HB VAL 16 HB VAL 16 4.304 3.858 -7.150 126 1HG1 VAL 16 HG11 VAL 16 4.710 6.125 -6.679 127 2HG1 VAL 16 HG12 VAL 16 5.962 5.676 -7.837 128 3HG1 VAL 16 HG13 VAL 16 6.353 5.806 -6.123 129 1HG2 VAL 16 HG21 VAL 16 6.775 3.683 -8.086 130 2HG2 VAL 16 HG22 VAL 16 5.851 2.252 -7.627 131 3HG2 VAL 16 HG23 VAL 16 7.051 2.920 -6.520 132 H ALA 17 HN ALA 17 2.640 4.480 -5.250 133 HA ALA 17 HA ALA 17 3.076 7.016 -3.924 134 1HB ALA 17 HB1 ALA 17 1.259 7.629 -5.045 135 2HB ALA 17 HB2 ALA 17 0.296 6.383 -4.251 136 3HB ALA 17 HB3 ALA 17 1.182 6.005 -5.726 137 H LEU 18 HN LEU 18 2.661 7.474 -1.811 138 HA LEU 18 HA LEU 18 1.117 5.528 -0.249 139 1HB LEU 18 HB2 LEU 18 3.733 6.716 0.693 140 2HB LEU 18 HB1 LEU 18 2.711 5.628 1.600 141 HG LEU 18 HG LEU 18 4.673 4.475 0.802 142 1HD1 LEU 18 HD11 LEU 18 2.373 3.346 0.805 143 2HD1 LEU 18 HD12 LEU 18 3.701 2.558 -0.041 144 3HD1 LEU 18 HD13 LEU 18 2.485 3.450 -0.950 145 1HD2 LEU 18 HD21 LEU 18 4.032 4.484 -2.024 146 2HD2 LEU 18 HD22 LEU 18 5.575 4.716 -1.204 147 3HD2 LEU 18 HD23 LEU 18 4.472 6.076 -1.408 148 H ALA 19 HN ALA 19 1.195 6.567 2.184 149 HA ALA 19 HA ALA 19 1.069 9.358 2.426 150 1HB ALA 19 HB1 ALA 19 -0.984 9.934 1.793 151 2HB ALA 19 HB2 ALA 19 -1.696 8.697 2.826 152 3HB ALA 19 HB3 ALA 19 -1.217 8.300 1.175 153 H SER 20 HN SER 20 1.730 9.540 4.488 154 HA SER 20 HA SER 20 0.257 8.176 6.565 155 1HB SER 20 HB2 SER 20 1.702 6.352 6.010 156 2HB SER 20 HB1 SER 20 3.113 7.405 5.968 157 HG SER 20 HG SER 20 3.279 7.239 8.060 158 H ASN 21 HN ASN 21 0.932 8.648 8.685 159 HA ASN 21 HA ASN 21 2.906 10.606 9.270 160 1HB ASN 21 HB2 ASN 21 0.010 11.415 9.202 161 2HB ASN 21 HB1 ASN 21 1.160 12.215 10.270 162 1HD2 ASN 21 HD21 ASN 21 0.171 11.695 6.999 163 2HD2 ASN 21 HD22 ASN 21 1.147 12.929 6.286 164 H THR 22 HN THR 22 3.617 10.138 11.215 165 HA THR 22 HA THR 22 2.044 9.601 13.487 166 HB THR 22 HB THR 22 3.277 7.173 12.163 167 HG1 THR 22 HG1 THR 22 0.648 8.097 12.420 168 1HG2 THR 22 HG21 THR 22 3.248 7.375 14.768 169 2HG2 THR 22 HG22 THR 22 2.775 5.877 13.968 170 3HG2 THR 22 HG23 THR 22 1.540 6.985 14.566 171 H GLU 23 HN GLU 23 5.080 8.779 11.869 172 HA GLU 23 HA GLU 23 6.717 10.235 13.617 173 1HB GLU 23 HB2 GLU 23 6.116 8.513 15.247 174 2HB GLU 23 HB1 GLU 23 6.642 7.256 14.135 175 1HG GLU 23 HG2 GLU 23 8.303 7.629 15.843 176 2HG GLU 23 HG1 GLU 23 8.930 8.106 14.267 177 H PHE 24 HN PHE 24 8.687 10.505 12.708 178 HA PHE 24 HA PHE 24 9.147 9.568 10.093 179 1HB PHE 24 HB2 PHE 24 10.898 10.978 12.094 180 2HB PHE 24 HB1 PHE 24 11.497 10.513 10.506 181 HD1 PHE 24 HD1 PHE 24 11.794 12.468 9.332 182 HD2 PHE 24 HD2 PHE 24 8.184 11.911 11.517 183 HE1 PHE 24 HE1 PHE 24 10.896 14.547 8.374 184 HE2 PHE 24 HE2 PHE 24 7.281 13.988 10.562 185 HZ PHE 24 HZ PHE 24 8.637 15.309 8.988 186 H PHE 25 HN PHE 25 10.468 8.564 13.215 187 HA PHE 25 HA PHE 25 12.435 6.816 12.319 188 1HB PHE 25 HB2 PHE 25 10.750 6.849 14.811 189 2HB PHE 25 HB1 PHE 25 11.957 5.598 14.538 190 HD1 PHE 25 HD1 PHE 25 13.591 6.021 16.113 191 HD2 PHE 25 HD2 PHE 25 12.132 9.237 13.736 192 HE1 PHE 25 HE1 PHE 25 15.337 7.490 17.031 193 HE2 PHE 25 HE2 PHE 25 13.874 10.708 14.650 194 HZ PHE 25 HZ PHE 25 15.481 9.836 16.299 195 H LEU 26 HN LEU 26 8.998 6.195 12.940 196 HA LEU 26 HA LEU 26 9.007 3.441 12.491 197 1HB LEU 26 HB2 LEU 26 6.823 5.446 11.919 198 2HB LEU 26 HB1 LEU 26 6.600 3.708 11.979 199 HG LEU 26 HG LEU 26 7.437 5.457 14.294 200 1HD1 LEU 26 HD11 LEU 26 4.836 4.173 13.522 201 2HD1 LEU 26 HD12 LEU 26 5.158 5.862 13.913 202 3HD1 LEU 26 HD13 LEU 26 5.199 4.639 15.184 203 1HD2 LEU 26 HD21 LEU 26 7.117 2.492 13.989 204 2HD2 LEU 26 HD22 LEU 26 6.916 3.281 15.553 205 3HD2 LEU 26 HD23 LEU 26 8.454 3.398 14.697 206 H ARG 27 HN ARG 27 8.701 6.133 10.234 207 HA ARG 27 HA ARG 27 8.053 4.708 7.929 208 1HB ARG 27 HB2 ARG 27 9.690 7.233 8.217 209 2HB ARG 27 HB1 ARG 27 9.027 6.636 6.702 210 1HG ARG 27 HG2 ARG 27 6.775 6.904 7.541 211 2HG ARG 27 HG1 ARG 27 7.397 7.407 9.114 212 1HD ARG 27 HD2 ARG 27 6.687 9.321 7.759 213 2HD ARG 27 HD1 ARG 27 8.413 9.370 8.111 214 HE ARG 27 HE ARG 27 8.065 8.102 5.646 215 1HH1 ARG 27 HH11 ARG 27 7.623 11.255 7.076 216 2HH1 ARG 27 HH12 ARG 27 7.901 12.105 5.594 217 1HH2 ARG 27 HH21 ARG 27 8.440 9.222 3.695 218 2HH2 ARG 27 HH22 ARG 27 8.361 10.952 3.674 219 H GLU 28 HN GLU 28 11.189 5.355 9.412 220 HA GLU 28 HA GLU 28 12.868 4.521 7.369 221 1HB GLU 28 HB2 GLU 28 13.240 4.144 10.346 222 2HB GLU 28 HB1 GLU 28 14.515 4.031 9.141 223 1HG GLU 28 HG2 GLU 28 14.172 6.376 8.555 224 2HG GLU 28 HG1 GLU 28 12.892 6.490 9.762 225 H LYS 29 HN LYS 29 11.443 2.554 9.976 226 HA LYS 29 HA LYS 29 12.526 0.112 8.933 227 1HB LYS 29 HB2 LYS 29 12.094 0.402 11.335 228 2HB LYS 29 HB1 LYS 29 10.373 0.557 11.011 229 1HG LYS 29 HG2 LYS 29 10.935 -1.666 11.831 230 2HG LYS 29 HG1 LYS 29 10.302 -1.728 10.185 231 1HD LYS 29 HD2 LYS 29 12.579 -1.903 9.312 232 2HD LYS 29 HD1 LYS 29 13.221 -1.822 10.954 233 1HE LYS 29 HE2 LYS 29 11.402 -3.971 9.869 234 2HE LYS 29 HE1 LYS 29 13.139 -4.125 10.124 235 1HZ LYS 29 HZ1 LYS 29 12.484 -3.427 12.540 236 2HZ LYS 29 HZ2 LYS 29 12.337 -5.036 12.040 237 3HZ LYS 29 HZ3 LYS 29 10.971 -4.039 12.096 238 H ASP 30 HN ASP 30 9.351 1.680 8.892 239 HA ASP 30 HA ASP 30 7.939 -0.414 7.659 240 1HB ASP 30 HB2 ASP 30 6.815 1.461 8.772 241 2HB ASP 30 HB1 ASP 30 7.419 2.566 7.543 242 H LYS 31 HN LYS 31 9.135 2.607 6.171 243 HA LYS 31 HA LYS 31 9.317 1.139 3.625 244 1HB LYS 31 HB2 LYS 31 8.744 4.079 4.063 245 2HB LYS 31 HB1 LYS 31 8.956 3.315 2.495 246 1HG LYS 31 HG2 LYS 31 6.784 2.660 4.472 247 2HG LYS 31 HG1 LYS 31 6.600 3.665 3.033 248 1HD LYS 31 HD2 LYS 31 7.216 1.753 1.625 249 2HD LYS 31 HD1 LYS 31 7.396 0.752 3.066 250 1HE LYS 31 HE2 LYS 31 4.850 2.086 2.148 251 2HE LYS 31 HE1 LYS 31 5.239 0.376 1.968 252 1HZ LYS 31 HZ1 LYS 31 4.901 1.836 4.532 253 2HZ LYS 31 HZ2 LYS 31 5.353 0.212 4.395 254 3HZ LYS 31 HZ3 LYS 31 3.825 0.712 3.869 255 H MET 32 HN MET 32 11.241 1.162 2.556 256 HA MET 32 HA MET 32 13.297 3.072 3.357 257 1HB MET 32 HB2 MET 32 14.955 1.206 3.617 258 2HB MET 32 HB1 MET 32 13.734 1.296 4.879 259 1HG MET 32 HG2 MET 32 12.496 -0.515 3.840 260 2HG MET 32 HG1 MET 32 13.668 -0.582 2.527 261 1HE MET 32 HE1 MET 32 14.303 -1.870 6.877 262 2HE MET 32 HE2 MET 32 13.052 -0.797 6.247 263 3HE MET 32 HE3 MET 32 14.690 -0.191 6.496 264 H LYS 33 HN LYS 33 11.906 1.014 0.983 265 HA LYS 33 HA LYS 33 13.655 2.139 -1.040 266 1HB LYS 33 HB2 LYS 33 13.421 -0.852 -0.644 267 2HB LYS 33 HB1 LYS 33 14.208 -0.066 -2.002 268 1HG LYS 33 HG2 LYS 33 15.877 0.884 -0.532 269 2HG LYS 33 HG1 LYS 33 15.057 0.202 0.873 270 1HD LYS 33 HD2 LYS 33 16.285 -1.383 -1.381 271 2HD LYS 33 HD1 LYS 33 17.000 -1.136 0.210 272 1HE LYS 33 HE2 LYS 33 14.377 -2.517 -0.345 273 2HE LYS 33 HE1 LYS 33 15.900 -3.316 0.026 274 1HZ LYS 33 HZ1 LYS 33 13.991 -2.378 1.814 275 2HZ LYS 33 HZ2 LYS 33 15.360 -1.404 2.013 276 3HZ LYS 33 HZ3 LYS 33 15.487 -3.083 2.170 277 H MET 34 HN MET 34 12.903 1.070 -3.310 278 HA MET 34 HA MET 34 10.229 1.828 -3.680 279 1HB MET 34 HB2 MET 34 11.955 -0.002 -5.364 280 2HB MET 34 HB1 MET 34 10.391 0.621 -5.872 281 1HG MET 34 HG2 MET 34 11.251 2.905 -5.700 282 2HG MET 34 HG1 MET 34 12.822 2.269 -5.216 283 1HE MET 34 HE1 MET 34 12.405 4.111 -8.501 284 2HE MET 34 HE2 MET 34 14.045 3.504 -8.269 285 3HE MET 34 HE3 MET 34 13.126 4.111 -6.891 286 H ALA 35 HN ALA 35 8.324 0.434 -4.204 287 HA ALA 35 HA ALA 35 8.595 -2.177 -2.866 288 1HB ALA 35 HB1 ALA 35 6.149 -1.649 -2.100 289 2HB ALA 35 HB2 ALA 35 6.677 0.020 -2.317 290 3HB ALA 35 HB3 ALA 35 7.540 -1.040 -1.203 291 H MET 36 HN MET 36 7.653 -3.857 -3.707 292 HA MET 36 HA MET 36 5.844 -3.530 -6.009 293 1HB MET 36 HB2 MET 36 7.934 -5.690 -5.594 294 2HB MET 36 HB1 MET 36 6.828 -5.582 -6.957 295 1HG MET 36 HG2 MET 36 7.867 -3.494 -7.649 296 2HG MET 36 HG1 MET 36 8.960 -3.574 -6.268 297 1HE MET 36 HE1 MET 36 8.015 -6.875 -8.477 298 2HE MET 36 HE2 MET 36 8.950 -6.387 -9.891 299 3HE MET 36 HE3 MET 36 7.621 -5.377 -9.321 300 H ALA 37 HN ALA 37 4.382 -5.546 -6.236 301 HA ALA 37 HA ALA 37 4.088 -7.045 -3.761 302 1HB ALA 37 HB1 ALA 37 2.748 -5.413 -2.956 303 2HB ALA 37 HB2 ALA 37 1.542 -6.310 -3.877 304 3HB ALA 37 HB3 ALA 37 2.273 -4.858 -4.561 305 H ARG 38 HN ARG 38 2.607 -8.794 -3.844 306 HA ARG 38 HA ARG 38 1.527 -9.515 -6.467 307 1HB ARG 38 HB2 ARG 38 3.332 -11.326 -4.852 308 2HB ARG 38 HB1 ARG 38 2.479 -11.780 -6.319 309 1HG ARG 38 HG2 ARG 38 3.790 -10.147 -7.583 310 2HG ARG 38 HG1 ARG 38 4.655 -9.707 -6.106 311 1HD ARG 38 HD2 ARG 38 5.931 -11.298 -7.477 312 2HD ARG 38 HD1 ARG 38 5.505 -11.975 -5.904 313 HE ARG 38 HE ARG 38 3.523 -12.679 -7.753 314 1HH1 ARG 38 HH11 ARG 38 6.873 -13.375 -7.059 315 2HH1 ARG 38 HH12 ARG 38 6.810 -14.964 -7.745 316 1HH2 ARG 38 HH21 ARG 38 3.440 -14.760 -8.650 317 2HH2 ARG 38 HH22 ARG 38 4.860 -15.751 -8.650 318 H ILE 39 HN ILE 39 -0.588 -9.613 -5.892 319 HA ILE 39 HA ILE 39 -1.391 -10.700 -3.329 320 HB ILE 39 HB ILE 39 -2.591 -8.768 -4.129 321 1HG1 ILE 39 HG12 ILE 39 -4.339 -11.239 -4.231 322 2HG1 ILE 39 HG11 ILE 39 -3.844 -10.390 -2.770 323 1HG2 ILE 39 HG21 ILE 39 -3.967 -8.799 -6.123 324 2HG2 ILE 39 HG22 ILE 39 -3.465 -10.454 -6.466 325 3HG2 ILE 39 HG23 ILE 39 -2.287 -9.145 -6.531 326 1HD1 ILE 39 HD11 ILE 39 -5.119 -8.462 -3.391 327 2HD1 ILE 39 HD12 ILE 39 -6.153 -9.887 -3.497 328 3HD1 ILE 39 HD13 ILE 39 -5.494 -9.165 -4.964 329 H SER 40 HN SER 40 -2.501 -12.543 -2.924 330 HA SER 40 HA SER 40 -3.498 -14.271 -4.985 331 1HB SER 40 HB2 SER 40 -1.113 -14.848 -5.123 332 2HB SER 40 HB1 SER 40 -1.080 -15.172 -3.388 333 HG SER 40 HG SER 40 -1.464 -17.133 -4.156 334 H PHE 41 HN PHE 41 -5.087 -15.575 -4.178 335 HA PHE 41 HA PHE 41 -5.770 -15.222 -1.386 336 1HB PHE 41 HB2 PHE 41 -7.218 -16.668 -3.610 337 2HB PHE 41 HB1 PHE 41 -7.855 -16.419 -1.990 338 HD1 PHE 41 HD1 PHE 41 -6.240 -14.267 -4.600 339 HD2 PHE 41 HD2 PHE 41 -9.460 -14.811 -1.870 340 HE1 PHE 41 HE1 PHE 41 -7.185 -12.112 -5.295 341 HE2 PHE 41 HE2 PHE 41 -10.414 -12.654 -2.566 342 HZ PHE 41 HZ PHE 41 -9.277 -11.301 -4.280 343 H LEU 42 HN LEU 42 -5.432 -16.624 0.216 344 HA LEU 42 HA LEU 42 -4.436 -19.301 -0.460 345 1HB LEU 42 HB2 LEU 42 -4.286 -17.832 2.176 346 2HB LEU 42 HB1 LEU 42 -3.560 -19.385 1.817 347 HG LEU 42 HG LEU 42 -2.791 -16.735 0.599 348 1HD1 LEU 42 HD11 LEU 42 -0.814 -18.361 2.023 349 2HD1 LEU 42 HD12 LEU 42 -2.107 -17.720 3.038 350 3HD1 LEU 42 HD13 LEU 42 -1.114 -16.624 2.078 351 1HD2 LEU 42 HD21 LEU 42 -1.831 -19.535 0.047 352 2HD2 LEU 42 HD22 LEU 42 -0.927 -18.088 -0.401 353 3HD2 LEU 42 HD23 LEU 42 -2.522 -18.381 -1.093 354 H GLY 43 HN GLY 43 -5.350 -21.157 0.428 355 1HA GLY 43 HA2 GLY 43 -8.099 -21.264 0.689 356 2HA GLY 43 HA1 GLY 43 -7.005 -22.499 1.286 357 H GLU 44 HN GLU 44 -8.744 -22.755 2.867 358 HA GLU 44 HA GLU 44 -9.496 -22.630 5.003 359 1HB GLU 44 HB2 GLU 44 -7.139 -20.777 5.389 360 2HB GLU 44 HB1 GLU 44 -8.108 -21.468 6.683 361 1HG GLU 44 HG2 GLU 44 -7.410 -23.709 6.008 362 2HG GLU 44 HG1 GLU 44 -6.438 -23.012 4.712 363 H ASP 45 HN ASP 45 -8.223 -19.337 4.611 364 HA ASP 45 HA ASP 45 -10.476 -17.967 3.893 365 1HB ASP 45 HB2 ASP 45 -11.375 -17.111 6.042 366 2HB ASP 45 HB1 ASP 45 -11.632 -18.840 5.858 367 H GLU 46 HN GLU 46 -7.835 -17.629 3.411 368 HA GLU 46 HA GLU 46 -7.402 -14.960 4.452 369 1HB GLU 46 HB2 GLU 46 -5.382 -17.160 4.904 370 2HB GLU 46 HB1 GLU 46 -5.077 -15.451 5.165 371 1HG GLU 46 HG2 GLU 46 -6.819 -15.412 6.883 372 2HG GLU 46 HG1 GLU 46 -7.090 -17.135 6.632 373 H LEU 47 HN LEU 47 -6.178 -13.675 3.179 374 HA LEU 47 HA LEU 47 -4.914 -14.892 0.824 375 1HB LEU 47 HB2 LEU 47 -5.686 -13.004 -0.568 376 2HB LEU 47 HB1 LEU 47 -6.993 -14.020 0.001 377 HG LEU 47 HG LEU 47 -7.502 -12.315 1.742 378 1HD1 LEU 47 HD11 LEU 47 -5.768 -10.949 2.196 379 2HD1 LEU 47 HD12 LEU 47 -6.448 -9.990 0.882 380 3HD1 LEU 47 HD13 LEU 47 -5.098 -11.082 0.571 381 1HD2 LEU 47 HD21 LEU 47 -7.612 -11.728 -1.185 382 2HD2 LEU 47 HD22 LEU 47 -8.243 -10.559 -0.026 383 3HD2 LEU 47 HD23 LEU 47 -8.910 -12.191 -0.086 384 H LYS 48 HN LYS 48 -3.033 -13.846 0.094 385 HA LYS 48 HA LYS 48 -2.106 -11.646 1.802 386 1HB LYS 48 HB2 LYS 48 0.005 -12.724 2.194 387 2HB LYS 48 HB1 LYS 48 -1.284 -13.819 2.659 388 1HG LYS 48 HG2 LYS 48 0.182 -15.215 1.568 389 2HG LYS 48 HG1 LYS 48 -0.977 -14.820 0.299 390 1HD LYS 48 HD2 LYS 48 0.543 -13.170 -0.618 391 2HD LYS 48 HD1 LYS 48 1.672 -13.431 0.710 392 1HE LYS 48 HE2 LYS 48 0.854 -15.483 -1.343 393 2HE LYS 48 HE1 LYS 48 2.371 -14.584 -1.337 394 1HZ LYS 48 HZ1 LYS 48 2.710 -16.750 -0.393 395 2HZ LYS 48 HZ2 LYS 48 1.459 -16.519 0.722 396 3HZ LYS 48 HZ3 LYS 48 2.871 -15.594 0.832 397 H VAL 49 HN VAL 49 -0.369 -10.405 1.012 398 HA VAL 49 HA VAL 49 0.047 -10.602 -1.892 399 HB VAL 49 HB VAL 49 -1.420 -8.650 -1.095 400 1HG1 VAL 49 HG11 VAL 49 0.264 -8.188 0.829 401 2HG1 VAL 49 HG12 VAL 49 -0.528 -6.840 0.015 402 3HG1 VAL 49 HG13 VAL 49 1.132 -7.267 -0.397 403 1HG2 VAL 49 HG21 VAL 49 -0.576 -8.639 -3.305 404 2HG2 VAL 49 HG22 VAL 49 1.046 -8.212 -2.759 405 3HG2 VAL 49 HG23 VAL 49 -0.265 -7.041 -2.630 406 H SER 50 HN SER 50 2.116 -11.056 -2.333 407 HA SER 50 HA SER 50 4.147 -10.678 -0.295 408 1HB SER 50 HB2 SER 50 4.076 -12.780 -1.612 409 2HB SER 50 HB1 SER 50 4.389 -11.856 -3.079 410 HG SER 50 HG SER 50 6.409 -11.319 -2.283 411 H TYR 51 HN TYR 51 4.842 -8.599 -0.128 412 HA TYR 51 HA TYR 51 5.353 -7.175 -2.622 413 1HB TYR 51 HB2 TYR 51 5.440 -5.121 -1.315 414 2HB TYR 51 HB1 TYR 51 3.941 -5.986 -1.023 415 HD1 TYR 51 HD1 TYR 51 3.211 -6.191 1.137 416 HD2 TYR 51 HD2 TYR 51 7.368 -5.615 0.444 417 HE1 TYR 51 HE1 TYR 51 3.580 -5.994 3.555 418 HE2 TYR 51 HE2 TYR 51 7.751 -5.430 2.866 419 HH TYR 51 HH TYR 51 5.804 -4.674 4.980 420 H ALA 52 HN ALA 52 7.282 -6.811 -3.371 421 HA ALA 52 HA ALA 52 9.583 -7.400 -1.630 422 1HB ALA 52 HB1 ALA 52 9.329 -9.035 -3.416 423 2HB ALA 52 HB2 ALA 52 10.783 -8.072 -3.667 424 3HB ALA 52 HB3 ALA 52 9.336 -7.745 -4.620 425 H VAL 53 HN VAL 53 10.482 -5.525 -1.004 426 HA VAL 53 HA VAL 53 10.384 -3.220 -2.756 427 HB VAL 53 HB VAL 53 11.397 -1.985 -0.888 428 1HG1 VAL 53 HG11 VAL 53 9.352 -3.239 0.686 429 2HG1 VAL 53 HG12 VAL 53 8.833 -3.124 -0.996 430 3HG1 VAL 53 HG13 VAL 53 9.336 -1.675 -0.126 431 1HG2 VAL 53 HG21 VAL 53 11.946 -4.681 0.058 432 2HG2 VAL 53 HG22 VAL 53 11.216 -3.656 1.292 433 3HG2 VAL 53 HG23 VAL 53 12.704 -3.149 0.494 434 HA PRO 54 HA PRO 54 14.615 -4.173 -3.993 435 1HB PRO 54 HB2 PRO 54 14.367 -3.346 -6.519 436 2HB PRO 54 HB1 PRO 54 13.599 -4.837 -5.963 437 1HG PRO 54 HG2 PRO 54 12.379 -2.245 -6.653 438 2HG PRO 54 HG1 PRO 54 11.647 -3.856 -6.613 439 1HD PRO 54 HD2 PRO 54 11.561 -1.782 -4.595 440 2HD PRO 54 HD1 PRO 54 10.727 -3.348 -4.610 441 H LYS 55 HN LYS 55 16.450 -2.976 -4.644 442 HA LYS 55 HA LYS 55 16.743 -0.417 -5.469 443 1HB LYS 55 HB2 LYS 55 15.681 -0.393 -2.812 444 2HB LYS 55 HB1 LYS 55 17.306 0.265 -2.771 445 1HG LYS 55 HG2 LYS 55 15.076 1.210 -4.561 446 2HG LYS 55 HG1 LYS 55 15.626 2.007 -3.086 447 1HD LYS 55 HD2 LYS 55 17.857 2.287 -4.102 448 2HD LYS 55 HD1 LYS 55 17.254 1.547 -5.587 449 1HE LYS 55 HE2 LYS 55 16.238 4.095 -4.329 450 2HE LYS 55 HE1 LYS 55 17.269 3.983 -5.754 451 1HZ LYS 55 HZ1 LYS 55 15.290 4.107 -6.796 452 2HZ LYS 55 HZ2 LYS 55 14.416 3.492 -5.485 453 3HZ LYS 55 HZ3 LYS 55 15.253 2.439 -6.510 454 HA PRO 56 HA PRO 56 20.476 -3.124 -4.546 455 1HB PRO 56 HB2 PRO 56 21.455 -2.831 -7.114 456 2HB PRO 56 HB1 PRO 56 20.462 -4.183 -6.562 457 1HG PRO 56 HG2 PRO 56 19.656 -1.723 -8.056 458 2HG PRO 56 HG1 PRO 56 19.107 -3.396 -8.268 459 1HD PRO 56 HD2 PRO 56 17.602 -1.582 -6.991 460 2HD PRO 56 HD1 PRO 56 17.652 -3.278 -6.466 461 H ASN 57 HN ASN 57 20.277 -0.179 -6.554 462 HA ASN 57 HA ASN 57 22.924 0.652 -6.135 463 1HB ASN 57 HB2 ASN 57 22.104 2.899 -6.849 464 2HB ASN 57 HB1 ASN 57 21.641 1.595 -7.938 465 1HD2 ASN 57 HD21 ASN 57 19.636 1.663 -8.610 466 2HD2 ASN 57 HD22 ASN 57 18.299 2.371 -7.776 467 H GLY 58 HN GLY 58 23.909 1.330 -4.378 468 1HA GLY 58 HA2 GLY 58 24.229 1.977 -2.188 469 2HA GLY 58 HA1 GLY 58 23.237 3.339 -2.678 470 H CYS 59 HN CYS 59 21.968 0.085 -2.575 471 HA CYS 59 HA CYS 59 20.865 0.313 0.061 472 1HB CYS 59 HB2 CYS 59 19.156 0.850 -2.356 473 2HB CYS 59 HB1 CYS 59 18.447 0.139 -0.912 474 H ARG 60 HN ARG 60 18.527 -1.469 -0.962 475 HA ARG 60 HA ARG 60 19.841 -3.820 -1.961 476 1HB ARG 60 HB2 ARG 60 18.784 -3.867 0.877 477 2HB ARG 60 HB1 ARG 60 19.458 -5.229 -0.004 478 1HG ARG 60 HG2 ARG 60 21.628 -4.071 -0.084 479 2HG ARG 60 HG1 ARG 60 20.938 -2.766 0.882 480 1HD ARG 60 HD2 ARG 60 20.454 -4.359 2.678 481 2HD ARG 60 HD1 ARG 60 21.155 -5.657 1.713 482 HE ARG 60 HE ARG 60 23.198 -4.992 2.453 483 1HH1 ARG 60 HH11 ARG 60 21.023 -2.274 2.729 484 2HH1 ARG 60 HH12 ARG 60 22.226 -1.221 3.393 485 1HH2 ARG 60 HH21 ARG 60 24.776 -3.607 3.334 486 2HH2 ARG 60 HH22 ARG 60 24.354 -1.977 3.738 487 H LYS 61 HN LYS 61 17.690 -5.406 -0.374 488 HA LYS 61 HA LYS 61 15.226 -4.443 -1.485 489 1HB LYS 61 HB2 LYS 61 14.809 -6.597 -2.742 490 2HB LYS 61 HB1 LYS 61 15.978 -5.507 -3.467 491 1HG LYS 61 HG2 LYS 61 16.870 -7.670 -3.688 492 2HG LYS 61 HG1 LYS 61 17.777 -6.904 -2.386 493 1HD LYS 61 HD2 LYS 61 16.504 -8.104 -0.730 494 2HD LYS 61 HD1 LYS 61 15.438 -8.763 -1.969 495 1HE LYS 61 HE2 LYS 61 18.394 -9.297 -1.700 496 2HE LYS 61 HE1 LYS 61 17.101 -10.404 -1.241 497 1HZ LYS 61 HZ1 LYS 61 17.628 -11.160 -3.320 498 2HZ LYS 61 HZ2 LYS 61 18.020 -9.628 -3.919 499 3HZ LYS 61 HZ3 LYS 61 16.400 -10.065 -3.713 500 H TRP 62 HN TRP 62 13.353 -5.776 -0.797 501 HA TRP 62 HA TRP 62 13.880 -7.791 1.219 502 1HB TRP 62 HB2 TRP 62 14.112 -5.713 2.506 503 2HB TRP 62 HB1 TRP 62 12.507 -5.215 1.993 504 HD1 TRP 62 HD1 TRP 62 10.964 -5.411 4.023 505 HE1 TRP 62 HE1 TRP 62 10.531 -7.171 5.850 506 HE3 TRP 62 HE3 TRP 62 14.593 -8.797 2.776 507 HZ2 TRP 62 HZ2 TRP 62 11.586 -9.660 6.658 508 HZ3 TRP 62 HZ3 TRP 62 14.812 -10.841 4.128 509 HH2 TRP 62 HH2 TRP 62 13.339 -11.262 6.029 510 H GLU 63 HN GLU 63 12.053 -8.980 1.863 511 HA GLU 63 HA GLU 63 9.579 -8.439 0.383 512 1HB GLU 63 HB2 GLU 63 10.903 -11.151 0.569 513 2HB GLU 63 HB1 GLU 63 9.379 -10.791 -0.231 514 1HG GLU 63 HG2 GLU 63 10.555 -9.362 -1.822 515 2HG GLU 63 HG1 GLU 63 12.082 -9.738 -1.029 516 H THR 64 HN THR 64 7.700 -9.021 1.411 517 HA THR 64 HA THR 64 7.765 -10.600 3.832 518 HB THR 64 HB THR 64 6.999 -7.677 3.891 519 HG1 THR 64 HG1 THR 64 8.943 -9.142 5.342 520 1HG2 THR 64 HG21 THR 64 5.395 -8.855 5.236 521 2HG2 THR 64 HG22 THR 64 6.540 -8.019 6.285 522 3HG2 THR 64 HG23 THR 64 6.679 -9.759 6.036 523 H THR 65 HN THR 65 5.831 -11.566 4.255 524 HA THR 65 HA THR 65 3.752 -11.131 2.246 525 HB THR 65 HB THR 65 4.374 -13.439 4.079 526 HG1 THR 65 HG1 THR 65 4.310 -13.243 1.253 527 1HG2 THR 65 HG21 THR 65 2.553 -14.391 2.276 528 2HG2 THR 65 HG22 THR 65 1.866 -12.837 2.747 529 3HG2 THR 65 HG23 THR 65 2.244 -14.044 3.977 530 H PHE 66 HN PHE 66 2.035 -9.975 2.749 531 HA PHE 66 HA PHE 66 1.176 -9.824 5.559 532 1HB PHE 66 HB2 PHE 66 0.709 -8.064 3.166 533 2HB PHE 66 HB1 PHE 66 -0.406 -8.014 4.526 534 HD1 PHE 66 HD1 PHE 66 3.204 -8.602 4.934 535 HD2 PHE 66 HD2 PHE 66 0.051 -5.747 5.109 536 HE1 PHE 66 HE1 PHE 66 4.696 -7.030 6.101 537 HE2 PHE 66 HE2 PHE 66 1.538 -4.171 6.274 538 HZ PHE 66 HZ PHE 66 3.863 -4.811 6.771 539 H LYS 67 HN LYS 67 -0.689 -10.839 6.197 540 HA LYS 67 HA LYS 67 -2.607 -11.673 4.158 541 1HB LYS 67 HB2 LYS 67 -0.933 -13.471 4.271 542 2HB LYS 67 HB1 LYS 67 -1.227 -13.630 5.992 543 1HG LYS 67 HG2 LYS 67 -3.508 -14.330 5.575 544 2HG LYS 67 HG1 LYS 67 -3.279 -14.104 3.840 545 1HD LYS 67 HD2 LYS 67 -3.087 -16.463 4.482 546 2HD LYS 67 HD1 LYS 67 -1.574 -15.841 3.823 547 1HE LYS 67 HE2 LYS 67 -0.702 -15.553 6.087 548 2HE LYS 67 HE1 LYS 67 -2.219 -16.157 6.752 549 1HZ LYS 67 HZ1 LYS 67 -0.191 -17.648 5.195 550 2HZ LYS 67 HZ2 LYS 67 -1.757 -18.241 5.434 551 3HZ LYS 67 HZ3 LYS 67 -0.747 -17.964 6.762 552 H LYS 68 HN LYS 68 -4.643 -12.144 4.881 553 HA LYS 68 HA LYS 68 -5.440 -12.696 7.461 554 1HB LYS 68 HB2 LYS 68 -4.501 -10.379 7.866 555 2HB LYS 68 HB1 LYS 68 -5.834 -9.770 6.899 556 1HG LYS 68 HG2 LYS 68 -6.468 -9.573 9.183 557 2HG LYS 68 HG1 LYS 68 -7.395 -10.910 8.500 558 1HD LYS 68 HD2 LYS 68 -5.842 -12.510 9.475 559 2HD LYS 68 HD1 LYS 68 -4.856 -11.189 10.106 560 1HE LYS 68 HE2 LYS 68 -7.717 -11.774 10.861 561 2HE LYS 68 HE1 LYS 68 -6.296 -12.142 11.838 562 1HZ LYS 68 HZ1 LYS 68 -7.442 -9.504 11.175 563 2HZ LYS 68 HZ2 LYS 68 -5.828 -9.651 11.658 564 3HZ LYS 68 HZ3 LYS 68 -7.068 -10.147 12.695 565 H THR 69 HN THR 69 -7.629 -10.277 6.684 566 HA THR 69 HA THR 69 -9.161 -12.152 4.992 567 HB THR 69 HB THR 69 -11.207 -11.305 6.073 568 HG1 THR 69 HG1 THR 69 -9.374 -9.869 7.690 569 1HG2 THR 69 HG21 THR 69 -9.142 -12.794 7.482 570 2HG2 THR 69 HG22 THR 69 -10.867 -13.117 7.314 571 3HG2 THR 69 HG23 THR 69 -10.296 -12.000 8.553 572 H SER 70 HN SER 70 -10.965 -11.123 3.745 573 HA SER 70 HA SER 70 -10.545 -8.343 2.987 574 1HB SER 70 HB2 SER 70 -10.332 -8.867 0.597 575 2HB SER 70 HB1 SER 70 -9.012 -9.590 1.517 576 HG SER 70 HG SER 70 -10.565 -10.833 -0.121 577 H ASP 71 HN ASP 71 -12.327 -7.411 1.858 578 HA ASP 71 HA ASP 71 -14.813 -8.944 2.163 579 1HB ASP 71 HB2 ASP 71 -15.979 -6.819 2.158 580 2HB ASP 71 HB1 ASP 71 -14.659 -6.755 3.321 581 H ASP 72 HN ASP 72 -16.545 -8.554 0.545 582 HA ASP 72 HA ASP 72 -15.529 -9.014 -2.111 583 1HB ASP 72 HB2 ASP 72 -17.616 -10.052 -0.877 584 2HB ASP 72 HB1 ASP 72 -18.442 -8.636 -1.516 585 H GLY 73 HN GLY 73 -17.572 -7.803 -3.679 586 1HA GLY 73 HA2 GLY 73 -18.086 -5.839 -4.758 587 2HA GLY 73 HA1 GLY 73 -17.889 -5.036 -3.207 588 H GLU 74 HN GLU 74 -15.548 -4.800 -2.521 589 HA GLU 74 HA GLU 74 -13.857 -4.109 -4.835 590 1HB GLU 74 HB2 GLU 74 -14.921 -2.202 -3.362 591 2HB GLU 74 HB1 GLU 74 -13.668 -2.652 -2.214 592 1HG GLU 74 HG2 GLU 74 -12.954 -0.788 -3.572 593 2HG GLU 74 HG1 GLU 74 -11.960 -2.206 -3.906 594 H VAL 75 HN VAL 75 -11.868 -3.380 -2.383 595 HA VAL 75 HA VAL 75 -11.454 -6.089 -1.453 596 HB VAL 75 HB VAL 75 -10.196 -6.368 -3.391 597 1HG1 VAL 75 HG11 VAL 75 -9.696 -3.524 -3.162 598 2HG1 VAL 75 HG12 VAL 75 -9.699 -4.564 -4.584 599 3HG1 VAL 75 HG13 VAL 75 -8.247 -4.429 -3.594 600 1HG2 VAL 75 HG21 VAL 75 -7.844 -6.481 -2.627 601 2HG2 VAL 75 HG22 VAL 75 -8.988 -7.146 -1.462 602 3HG2 VAL 75 HG23 VAL 75 -8.291 -5.549 -1.201 603 H TYR 76 HN TYR 76 -11.875 -5.318 0.568 604 HA TYR 76 HA TYR 76 -9.862 -3.501 1.723 605 1HB TYR 76 HB2 TYR 76 -12.709 -4.096 2.527 606 2HB TYR 76 HB1 TYR 76 -11.581 -3.303 3.611 607 HD1 TYR 76 HD1 TYR 76 -11.183 -2.451 0.122 608 HD2 TYR 76 HD2 TYR 76 -13.308 -1.497 3.676 609 HE1 TYR 76 HE1 TYR 76 -11.794 -0.278 -0.840 610 HE2 TYR 76 HE2 TYR 76 -13.923 0.686 2.727 611 HH TYR 76 HH TYR 76 -12.436 2.044 0.130 612 H TYR 77 HN TYR 77 -8.361 -4.527 2.966 613 HA TYR 77 HA TYR 77 -9.217 -7.054 4.205 614 1HB TYR 77 HB2 TYR 77 -6.990 -7.949 3.901 615 2HB TYR 77 HB1 TYR 77 -7.630 -7.411 2.356 616 HD1 TYR 77 HD1 TYR 77 -5.510 -6.145 5.168 617 HD2 TYR 77 HD2 TYR 77 -6.232 -6.190 0.974 618 HE1 TYR 77 HE1 TYR 77 -3.459 -4.839 4.807 619 HE2 TYR 77 HE2 TYR 77 -4.182 -4.882 0.603 620 HH TYR 77 HH TYR 77 -1.918 -4.573 1.978 621 H SER 78 HN SER 78 -8.792 -7.456 6.269 622 HA SER 78 HA SER 78 -7.625 -5.280 7.860 623 1HB SER 78 HB2 SER 78 -9.891 -6.027 8.505 624 2HB SER 78 HB1 SER 78 -9.281 -7.668 8.728 625 HG SER 78 HG SER 78 -8.359 -5.389 10.141 626 H GLU 79 HN GLU 79 -6.048 -5.865 9.553 627 HA GLU 79 HA GLU 79 -4.968 -8.485 9.676 628 1HB GLU 79 HB2 GLU 79 -4.215 -7.776 7.407 629 2HB GLU 79 HB1 GLU 79 -3.300 -6.477 8.157 630 1HG GLU 79 HG2 GLU 79 -1.903 -8.085 9.310 631 2HG GLU 79 HG1 GLU 79 -2.866 -9.414 8.663 632 H GLU 80 HN GLU 80 -2.898 -8.580 10.911 633 HA GLU 80 HA GLU 80 -1.663 -8.120 12.747 634 1HB GLU 80 HB2 GLU 80 -2.268 -5.257 11.993 635 2HB GLU 80 HB1 GLU 80 -1.131 -5.732 13.245 636 1HG GLU 80 HG2 GLU 80 -0.927 -6.427 10.327 637 2HG GLU 80 HG1 GLU 80 0.000 -5.183 11.165 638 H ALA 81 HN ALA 81 -1.906 -6.324 14.832 639 HA ALA 81 HA ALA 81 -3.918 -7.410 16.400 640 1HB ALA 81 HB1 ALA 81 -3.578 -5.059 17.652 641 2HB ALA 81 HB2 ALA 81 -2.143 -5.060 16.628 642 3HB ALA 81 HB3 ALA 81 -2.424 -6.390 17.751 643 H LYS 82 HN LYS 82 -4.000 -3.943 15.602 644 HA LYS 82 HA LYS 82 -6.832 -4.270 14.890 645 1HB LYS 82 HB2 LYS 82 -5.663 -2.145 16.694 646 2HB LYS 82 HB1 LYS 82 -7.303 -2.120 16.064 647 1HG LYS 82 HG2 LYS 82 -6.135 -4.228 17.870 648 2HG LYS 82 HG1 LYS 82 -7.230 -2.934 18.358 649 1HD LYS 82 HD2 LYS 82 -8.953 -3.844 16.860 650 2HD LYS 82 HD1 LYS 82 -7.854 -5.144 16.396 651 1HE LYS 82 HE2 LYS 82 -7.794 -5.918 18.719 652 2HE LYS 82 HE1 LYS 82 -8.895 -4.620 19.181 653 1HZ LYS 82 HZ1 LYS 82 -9.441 -7.057 17.637 654 2HZ LYS 82 HZ2 LYS 82 -10.377 -5.680 17.342 655 3HZ LYS 82 HZ3 LYS 82 -10.335 -6.357 18.892 656 H LYS 83 HN LYS 83 -5.020 -4.250 12.932 657 HA LYS 83 HA LYS 83 -4.824 -1.484 11.980 658 1HB LYS 83 HB2 LYS 83 -2.763 -2.816 11.927 659 2HB LYS 83 HB1 LYS 83 -3.551 -4.003 10.905 660 1HG LYS 83 HG2 LYS 83 -3.814 -2.336 9.147 661 2HG LYS 83 HG1 LYS 83 -3.025 -1.136 10.171 662 1HD LYS 83 HD2 LYS 83 -1.453 -2.061 8.555 663 2HD LYS 83 HD1 LYS 83 -0.991 -2.506 10.198 664 1HE LYS 83 HE2 LYS 83 -2.018 -4.704 9.892 665 2HE LYS 83 HE1 LYS 83 -2.489 -4.258 8.252 666 1HZ LYS 83 HZ1 LYS 83 -0.096 -3.957 7.758 667 2HZ LYS 83 HZ2 LYS 83 -0.504 -5.550 8.153 668 3HZ LYS 83 HZ3 LYS 83 0.273 -4.570 9.292 669 H LYS 84 HN LYS 84 -6.469 -0.792 10.794 670 HA LYS 84 HA LYS 84 -8.025 -2.720 9.238 671 1HB LYS 84 HB2 LYS 84 -8.564 0.190 9.869 672 2HB LYS 84 HB1 LYS 84 -9.646 -0.869 8.976 673 1HG LYS 84 HG2 LYS 84 -8.807 -1.218 11.849 674 2HG LYS 84 HG1 LYS 84 -10.363 -0.608 11.284 675 1HD LYS 84 HD2 LYS 84 -10.804 -2.751 10.185 676 2HD LYS 84 HD1 LYS 84 -9.245 -3.360 10.745 677 1HE LYS 84 HE2 LYS 84 -11.539 -2.477 12.495 678 2HE LYS 84 HE1 LYS 84 -11.070 -4.145 12.168 679 1HZ LYS 84 HZ1 LYS 84 -9.805 -2.162 13.893 680 2HZ LYS 84 HZ2 LYS 84 -8.776 -3.221 13.068 681 3HZ LYS 84 HZ3 LYS 84 -9.967 -3.833 14.103 682 H VAL 85 HN VAL 85 -7.484 -3.022 7.170 683 HA VAL 85 HA VAL 85 -6.355 -0.736 5.701 684 HB VAL 85 HB VAL 85 -5.728 -3.662 5.297 685 1HG1 VAL 85 HG11 VAL 85 -3.901 -2.264 3.839 686 2HG1 VAL 85 HG12 VAL 85 -5.369 -1.316 3.593 687 3HG1 VAL 85 HG13 VAL 85 -5.349 -3.030 3.185 688 1HG2 VAL 85 HG21 VAL 85 -3.852 -3.382 6.498 689 2HG2 VAL 85 HG22 VAL 85 -4.707 -2.005 7.193 690 3HG2 VAL 85 HG23 VAL 85 -3.572 -1.760 5.865 691 H GLU 86 HN GLU 86 -7.137 -0.256 3.709 692 HA GLU 86 HA GLU 86 -9.147 -2.010 2.521 693 1HB GLU 86 HB2 GLU 86 -9.644 0.899 3.151 694 2HB GLU 86 HB1 GLU 86 -10.750 -0.179 2.313 695 1HG GLU 86 HG2 GLU 86 -11.042 -1.505 4.293 696 2HG GLU 86 HG1 GLU 86 -9.807 -0.577 5.142 697 H VAL 87 HN VAL 87 -8.563 -2.270 0.458 698 HA VAL 87 HA VAL 87 -7.276 -0.007 -0.890 699 HB VAL 87 HB VAL 87 -5.803 -1.875 -0.943 700 1HG1 VAL 87 HG11 VAL 87 -6.427 -4.031 -1.958 701 2HG1 VAL 87 HG12 VAL 87 -8.096 -3.477 -1.990 702 3HG1 VAL 87 HG13 VAL 87 -7.269 -3.679 -0.449 703 1HG2 VAL 87 HG21 VAL 87 -5.473 -2.210 -3.303 704 2HG2 VAL 87 HG22 VAL 87 -6.004 -0.552 -3.024 705 3HG2 VAL 87 HG23 VAL 87 -7.143 -1.751 -3.638 706 H LEU 88 HN LEU 88 -8.216 1.002 -2.468 707 HA LEU 88 HA LEU 88 -10.643 -0.158 -3.662 708 1HB LEU 88 HB2 LEU 88 -11.617 2.055 -3.753 709 2HB LEU 88 HB1 LEU 88 -11.161 1.672 -2.107 710 HG LEU 88 HG LEU 88 -9.421 3.354 -3.903 711 1HD1 LEU 88 HD11 LEU 88 -11.917 4.124 -3.253 712 2HD1 LEU 88 HD12 LEU 88 -10.560 5.239 -3.421 713 3HD1 LEU 88 HD13 LEU 88 -11.041 4.669 -1.823 714 1HD2 LEU 88 HD21 LEU 88 -9.149 2.261 -1.281 715 2HD2 LEU 88 HD22 LEU 88 -9.232 4.017 -1.163 716 3HD2 LEU 88 HD23 LEU 88 -8.015 3.258 -2.188 717 H ASP 89 HN ASP 89 -10.766 2.383 -5.357 718 HA ASP 89 HA ASP 89 -9.989 3.197 -7.343 719 1HB ASP 89 HB2 ASP 89 -7.695 3.017 -6.282 720 2HB ASP 89 HB1 ASP 89 -7.560 1.442 -7.041 721 H THR 90 HN THR 90 -9.648 -0.245 -6.715 722 HA THR 90 HA THR 90 -10.859 -1.925 -7.746 723 HB THR 90 HB THR 90 -10.975 -0.160 -10.190 724 HG1 THR 90 HG1 THR 90 -12.751 -0.589 -8.038 725 1HG2 THR 90 HG21 THR 90 -11.337 -2.283 -11.021 726 2HG2 THR 90 HG22 THR 90 -12.966 -1.719 -10.654 727 3HG2 THR 90 HG23 THR 90 -12.150 -2.832 -9.555 728 H ASP 91 HN ASP 91 -9.061 -3.201 -7.552 729 HA ASP 91 HA ASP 91 -7.011 -3.154 -9.614 730 1HB ASP 91 HB2 ASP 91 -6.050 -5.071 -8.344 731 2HB ASP 91 HB1 ASP 91 -6.272 -3.639 -7.351 732 H TYR 92 HN TYR 92 -9.758 -3.719 -10.369 733 HA TYR 92 HA TYR 92 -9.747 -6.556 -11.000 734 1HB TYR 92 HB2 TYR 92 -11.877 -4.440 -11.359 735 2HB TYR 92 HB1 TYR 92 -12.072 -6.136 -11.784 736 HD1 TYR 92 HD1 TYR 92 -13.626 -7.031 -10.323 737 HD2 TYR 92 HD2 TYR 92 -10.560 -4.530 -8.753 738 HE1 TYR 92 HE1 TYR 92 -14.385 -7.532 -8.039 739 HE2 TYR 92 HE2 TYR 92 -11.310 -5.029 -6.471 740 HH TYR 92 HH TYR 92 -12.565 -6.862 -5.305 741 H LYS 93 HN LYS 93 -8.971 -3.558 -12.507 742 HA LYS 93 HA LYS 93 -8.917 -4.980 -15.076 743 1HB LYS 93 HB2 LYS 93 -9.513 -2.900 -16.243 744 2HB LYS 93 HB1 LYS 93 -10.781 -3.476 -15.174 745 1HG LYS 93 HG2 LYS 93 -10.066 -1.814 -13.492 746 2HG LYS 93 HG1 LYS 93 -8.886 -1.199 -14.654 747 1HD LYS 93 HD2 LYS 93 -10.726 -0.739 -16.235 748 2HD LYS 93 HD1 LYS 93 -11.881 -1.282 -15.018 749 1HE LYS 93 HE2 LYS 93 -9.992 1.051 -14.767 750 2HE LYS 93 HE1 LYS 93 -11.727 1.146 -15.059 751 1HZ LYS 93 HZ1 LYS 93 -10.347 0.215 -12.611 752 2HZ LYS 93 HZ2 LYS 93 -11.988 -0.082 -12.895 753 3HZ LYS 93 HZ3 LYS 93 -11.426 1.508 -12.772 754 H SER 94 HN SER 94 -7.390 -2.293 -13.216 755 HA SER 94 HA SER 94 -4.855 -3.058 -14.244 756 1HB SER 94 HB2 SER 94 -4.403 -1.035 -15.624 757 2HB SER 94 HB1 SER 94 -5.620 -2.115 -16.304 758 HG SER 94 HG SER 94 -7.190 -0.693 -15.793 759 H TYR 95 HN TYR 95 -6.708 -0.822 -12.306 760 HA TYR 95 HA TYR 95 -4.172 -0.063 -11.038 761 1HB TYR 95 HB2 TYR 95 -5.147 2.271 -10.744 762 2HB TYR 95 HB1 TYR 95 -4.564 1.831 -12.345 763 HD1 TYR 95 HD1 TYR 95 -5.889 2.368 -14.143 764 HD2 TYR 95 HD2 TYR 95 -7.746 1.744 -10.370 765 HE1 TYR 95 HE1 TYR 95 -8.055 3.012 -15.110 766 HE2 TYR 95 HE2 TYR 95 -9.919 2.389 -11.325 767 HH TYR 95 HH TYR 95 -10.513 4.022 -13.604 768 H ALA 96 HN ALA 96 -4.177 0.353 -8.870 769 HA ALA 96 HA ALA 96 -6.679 0.219 -7.389 770 1HB ALA 96 HB1 ALA 96 -6.455 -1.862 -6.661 771 2HB ALA 96 HB2 ALA 96 -4.839 -1.508 -6.057 772 3HB ALA 96 HB3 ALA 96 -5.055 -2.058 -7.717 773 H VAL 97 HN VAL 97 -6.623 1.337 -5.502 774 HA VAL 97 HA VAL 97 -4.023 2.347 -4.570 775 HB VAL 97 HB VAL 97 -4.890 4.513 -4.154 776 1HG1 VAL 97 HG11 VAL 97 -4.989 3.396 -6.760 777 2HG1 VAL 97 HG12 VAL 97 -4.640 5.058 -6.291 778 3HG1 VAL 97 HG13 VAL 97 -6.300 4.564 -6.622 779 1HG2 VAL 97 HG21 VAL 97 -6.981 4.496 -3.294 780 2HG2 VAL 97 HG22 VAL 97 -7.513 3.176 -4.333 781 3HG2 VAL 97 HG23 VAL 97 -7.441 4.818 -4.965 782 H ILE 98 HN ILE 98 -3.705 2.132 -2.374 783 HA ILE 98 HA ILE 98 -6.055 1.279 -0.830 784 HB ILE 98 HB ILE 98 -4.616 -0.628 -1.330 785 1HG1 ILE 98 HG12 ILE 98 -5.893 -0.379 0.861 786 2HG1 ILE 98 HG11 ILE 98 -4.599 -1.570 0.839 787 1HG2 ILE 98 HG21 ILE 98 -2.454 0.066 -1.560 788 2HG2 ILE 98 HG22 ILE 98 -2.406 -0.657 0.047 789 3HG2 ILE 98 HG23 ILE 98 -2.514 1.093 -0.129 790 1HD1 ILE 98 HD11 ILE 98 -4.980 0.615 2.600 791 2HD1 ILE 98 HD12 ILE 98 -3.486 0.883 1.705 792 3HD1 ILE 98 HD13 ILE 98 -3.713 -0.606 2.617 793 H TYR 99 HN TYR 99 -6.369 2.011 1.140 794 HA TYR 99 HA TYR 99 -4.339 3.739 2.365 795 1HB TYR 99 HB2 TYR 99 -6.042 5.333 3.059 796 2HB TYR 99 HB1 TYR 99 -6.080 5.169 1.309 797 HD1 TYR 99 HD1 TYR 99 -7.740 3.834 4.377 798 HD2 TYR 99 HD2 TYR 99 -8.112 4.845 0.263 799 HE1 TYR 99 HE1 TYR 99 -10.151 3.371 4.487 800 HE2 TYR 99 HE2 TYR 99 -10.524 4.382 0.360 801 HH TYR 99 HH TYR 99 -11.983 2.644 2.410 802 H ALA 100 HN ALA 100 -4.057 3.358 4.535 803 HA ALA 100 HA ALA 100 -6.098 1.876 5.986 804 1HB ALA 100 HB1 ALA 100 -3.348 0.726 5.544 805 2HB ALA 100 HB2 ALA 100 -4.846 0.137 4.823 806 3HB ALA 100 HB3 ALA 100 -4.609 0.038 6.568 807 H THR 101 HN THR 101 -6.096 2.219 8.108 808 HA THR 101 HA THR 101 -3.874 3.781 9.242 809 HB THR 101 HB THR 101 -5.527 4.634 10.874 810 HG1 THR 101 HG1 THR 101 -7.318 3.590 11.064 811 1HG2 THR 101 HG21 THR 101 -6.729 6.119 9.474 812 2HG2 THR 101 HG22 THR 101 -6.606 5.023 8.098 813 3HG2 THR 101 HG23 THR 101 -5.166 5.836 8.710 814 H ARG 102 HN ARG 102 -2.613 2.604 10.522 815 HA ARG 102 HA ARG 102 -3.638 0.148 11.695 816 1HB ARG 102 HB2 ARG 102 -1.517 0.001 10.548 817 2HB ARG 102 HB1 ARG 102 -0.848 1.289 11.535 818 1HG ARG 102 HG2 ARG 102 -1.021 -0.128 13.515 819 2HG ARG 102 HG1 ARG 102 -1.697 -1.422 12.527 820 1HD ARG 102 HD2 ARG 102 0.366 -1.481 11.206 821 2HD ARG 102 HD1 ARG 102 1.039 -0.198 12.209 822 HE ARG 102 HE ARG 102 0.256 -2.301 13.878 823 1HH1 ARG 102 HH11 ARG 102 2.627 -1.621 11.410 824 2HH1 ARG 102 HH12 ARG 102 3.793 -2.732 12.048 825 1HH2 ARG 102 HH21 ARG 102 1.786 -3.762 14.718 826 2HH2 ARG 102 HH22 ARG 102 3.315 -3.949 13.926 827 H VAL 103 HN VAL 103 -3.777 -0.304 13.842 828 HA VAL 103 HA VAL 103 -2.829 1.641 15.779 829 HB VAL 103 HB VAL 103 -5.099 2.433 15.289 830 1HG1 VAL 103 HG11 VAL 103 -6.341 0.620 14.569 831 2HG1 VAL 103 HG12 VAL 103 -6.981 0.904 16.188 832 3HG1 VAL 103 HG13 VAL 103 -5.824 -0.397 15.912 833 1HG2 VAL 103 HG21 VAL 103 -4.088 2.564 17.579 834 2HG2 VAL 103 HG22 VAL 103 -5.030 1.135 18.004 835 3HG2 VAL 103 HG23 VAL 103 -5.850 2.625 17.538 836 H LYS 104 HN LYS 104 -2.424 0.773 17.786 837 HA LYS 104 HA LYS 104 -3.185 -1.986 18.322 838 1HB LYS 104 HB2 LYS 104 -1.012 -1.964 17.007 839 2HB LYS 104 HB1 LYS 104 -0.283 -1.163 18.389 840 1HG LYS 104 HG2 LYS 104 -1.579 -3.881 18.455 841 2HG LYS 104 HG1 LYS 104 0.154 -3.582 18.329 842 1HD LYS 104 HD2 LYS 104 0.012 -2.346 20.503 843 2HD LYS 104 HD1 LYS 104 -1.663 -2.885 20.632 844 1HE LYS 104 HE2 LYS 104 -0.190 -4.339 21.907 845 2HE LYS 104 HE1 LYS 104 -0.927 -5.211 20.564 846 1HZ LYS 104 HZ1 LYS 104 1.745 -3.986 20.294 847 2HZ LYS 104 HZ2 LYS 104 1.060 -5.244 19.394 848 3HZ LYS 104 HZ3 LYS 104 1.559 -5.519 20.987 849 H ASP 105 HN ASP 105 -4.246 -1.507 20.123 850 HA ASP 105 HA ASP 105 -4.670 -0.208 22.089 851 1HB ASP 105 HB2 ASP 105 -4.506 -2.632 22.453 852 2HB ASP 105 HB1 ASP 105 -2.780 -2.470 22.760 853 H GLY 106 HN GLY 106 -2.964 1.591 21.082 854 1HA GLY 106 HA2 GLY 106 -1.765 2.749 23.285 855 2HA GLY 106 HA1 GLY 106 -0.512 1.780 22.533 856 H ARG 107 HN ARG 107 -1.065 2.202 19.818 857 HA ARG 107 HA ARG 107 -1.017 5.118 19.529 858 1HB ARG 107 HB2 ARG 107 1.040 5.206 18.368 859 2HB ARG 107 HB1 ARG 107 1.336 4.268 19.821 860 1HG ARG 107 HG2 ARG 107 0.864 3.091 17.090 861 2HG ARG 107 HG1 ARG 107 2.448 3.362 17.813 862 1HD ARG 107 HD2 ARG 107 1.703 1.899 19.722 863 2HD ARG 107 HD1 ARG 107 0.280 1.502 18.761 864 HE ARG 107 HE ARG 107 1.571 0.025 17.619 865 1HH1 ARG 107 HH11 ARG 107 3.673 2.478 18.956 866 2HH1 ARG 107 HH12 ARG 107 5.117 1.764 18.321 867 1HH2 ARG 107 HH21 ARG 107 3.473 -0.919 16.793 868 2HH2 ARG 107 HH22 ARG 107 5.004 -0.166 17.095 869 H THR 108 HN THR 108 -1.652 5.928 17.611 870 HA THR 108 HA THR 108 -2.723 4.009 15.651 871 HB THR 108 HB THR 108 -3.674 6.802 16.330 872 HG1 THR 108 HG1 THR 108 -4.195 5.159 17.872 873 1HG2 THR 108 HG21 THR 108 -5.695 6.058 14.978 874 2HG2 THR 108 HG22 THR 108 -4.631 4.831 14.290 875 3HG2 THR 108 HG23 THR 108 -4.251 6.542 14.088 876 H LEU 109 HN LEU 109 -2.211 4.290 13.496 877 HA LEU 109 HA LEU 109 -0.680 6.666 12.740 878 1HB LEU 109 HB2 LEU 109 1.018 5.295 11.607 879 2HB LEU 109 HB1 LEU 109 1.023 5.066 13.346 880 HG LEU 109 HG LEU 109 -0.471 3.162 11.576 881 1HD1 LEU 109 HD11 LEU 109 2.054 3.577 10.961 882 2HD1 LEU 109 HD12 LEU 109 1.387 1.946 11.030 883 3HD1 LEU 109 HD13 LEU 109 2.331 2.572 12.382 884 1HD2 LEU 109 HD21 LEU 109 -0.577 1.840 13.407 885 2HD2 LEU 109 HD22 LEU 109 -0.363 3.370 14.257 886 3HD2 LEU 109 HD23 LEU 109 1.021 2.317 13.977 887 H HIS 110 HN HIS 110 -0.906 7.299 10.629 888 HA HIS 110 HA HIS 110 -2.892 5.778 9.090 889 1HB HIS 110 HB2 HIS 110 -1.911 8.611 8.686 890 2HB HIS 110 HB1 HIS 110 -3.226 7.833 7.808 891 HD1 HIS 110 HD1 HIS 110 -2.407 8.405 11.485 892 HD2 HIS 110 HD2 HIS 110 -5.614 8.547 8.848 893 HE1 HIS 110 HE1 HIS 110 -4.385 9.105 12.870 894 HE2 HIS 110 HE2 HIS 110 -6.334 9.076 11.275 895 H MET 111 HN MET 111 -2.464 4.952 7.077 896 HA MET 111 HA MET 111 0.014 5.611 5.738 897 1HB MET 111 HB2 MET 111 -0.519 2.823 6.762 898 2HB MET 111 HB1 MET 111 0.720 3.222 5.580 899 1HG MET 111 HG2 MET 111 1.831 4.653 7.209 900 2HG MET 111 HG1 MET 111 0.582 4.280 8.396 901 1HE MET 111 HE1 MET 111 3.402 1.075 6.661 902 2HE MET 111 HE2 MET 111 3.274 2.720 6.039 903 3HE MET 111 HE3 MET 111 1.926 1.599 5.853 904 H MET 112 HN MET 112 -0.071 5.350 3.597 905 HA MET 112 HA MET 112 -2.361 3.916 2.428 906 1HB MET 112 HB2 MET 112 -1.342 6.664 1.812 907 2HB MET 112 HB1 MET 112 -2.190 5.736 0.596 908 1HG MET 112 HG2 MET 112 -4.141 5.620 2.035 909 2HG MET 112 HG1 MET 112 -3.292 6.537 3.276 910 1HE MET 112 HE1 MET 112 -5.604 9.007 2.717 911 2HE MET 112 HE2 MET 112 -5.754 7.252 2.813 912 3HE MET 112 HE3 MET 112 -6.294 8.108 1.368 913 H ARG 113 HN ARG 113 -1.992 3.064 0.325 914 HA ARG 113 HA ARG 113 0.719 3.170 -0.724 915 1HB ARG 113 HB2 ARG 113 0.541 1.248 0.929 916 2HB ARG 113 HB1 ARG 113 -0.607 0.512 -0.173 917 1HG ARG 113 HG2 ARG 113 1.162 0.559 -1.932 918 2HG ARG 113 HG1 ARG 113 2.293 1.101 -0.692 919 1HD ARG 113 HD2 ARG 113 0.752 -1.489 -0.715 920 2HD ARG 113 HD1 ARG 113 2.477 -1.295 -1.005 921 HE ARG 113 HE ARG 113 1.837 -0.245 1.525 922 1HH1 ARG 113 HH11 ARG 113 2.081 -3.300 -0.145 923 2HH1 ARG 113 HH12 ARG 113 2.445 -4.201 1.288 924 1HH2 ARG 113 HH21 ARG 113 2.313 -1.434 3.420 925 2HH2 ARG 113 HH22 ARG 113 2.577 -3.142 3.312 926 H LEU 114 HN LEU 114 0.760 3.050 -2.943 927 HA LEU 114 HA LEU 114 -1.850 2.712 -4.251 928 1HB LEU 114 HB2 LEU 114 -0.833 4.881 -4.601 929 2HB LEU 114 HB1 LEU 114 0.642 4.135 -5.185 930 HG LEU 114 HG LEU 114 -0.521 3.308 -7.163 931 1HD1 LEU 114 HD11 LEU 114 -2.929 4.651 -7.239 932 2HD1 LEU 114 HD12 LEU 114 -2.866 4.000 -5.602 933 3HD1 LEU 114 HD13 LEU 114 -2.703 2.922 -6.987 934 1HD2 LEU 114 HD21 LEU 114 -0.755 6.232 -6.535 935 2HD2 LEU 114 HD22 LEU 114 -1.235 5.585 -8.104 936 3HD2 LEU 114 HD23 LEU 114 0.429 5.406 -7.548 937 H TYR 115 HN TYR 115 -2.220 1.135 -5.667 938 HA TYR 115 HA TYR 115 0.052 -0.583 -6.408 939 1HB TYR 115 HB2 TYR 115 -2.874 -1.298 -6.146 940 2HB TYR 115 HB1 TYR 115 -1.596 -2.403 -6.633 941 HD1 TYR 115 HD1 TYR 115 -3.631 -1.707 -4.019 942 HD2 TYR 115 HD2 TYR 115 0.524 -2.148 -4.820 943 HE1 TYR 115 HE1 TYR 115 -3.245 -2.290 -1.662 944 HE2 TYR 115 HE2 TYR 115 0.922 -2.733 -2.466 945 HH TYR 115 HH TYR 115 -0.321 -3.626 -0.556 946 H SER 116 HN SER 116 0.586 -0.723 -8.475 947 HA SER 116 HA SER 116 -1.432 -0.127 -10.528 948 1HB SER 116 HB2 SER 116 -0.002 1.863 -10.293 949 2HB SER 116 HB1 SER 116 1.433 0.868 -10.538 950 HG SER 116 HG SER 116 0.816 0.501 -12.632 951 H ARG 117 HN ARG 117 -1.557 -1.665 -12.051 952 HA ARG 117 HA ARG 117 0.156 -3.946 -11.850 953 1HB ARG 117 HB2 ARG 117 -2.127 -3.310 -13.713 954 2HB ARG 117 HB1 ARG 117 -1.235 -4.826 -13.759 955 1HG ARG 117 HG2 ARG 117 -3.023 -5.397 -12.441 956 2HG ARG 117 HG1 ARG 117 -1.835 -4.934 -11.223 957 1HD ARG 117 HD2 ARG 117 -2.937 -2.570 -11.509 958 2HD ARG 117 HD1 ARG 117 -4.291 -3.506 -12.130 959 HE ARG 117 HE ARG 117 -4.765 -4.131 -9.990 960 1HH1 ARG 117 HH11 ARG 117 -1.443 -3.093 -10.114 961 2HH1 ARG 117 HH12 ARG 117 -1.220 -3.156 -8.403 962 1HH2 ARG 117 HH21 ARG 117 -4.454 -4.241 -7.722 963 2HH2 ARG 117 HH22 ARG 117 -2.924 -3.807 -7.050 964 H SER 118 HN SER 118 -0.097 -1.232 -14.039 965 HA SER 118 HA SER 118 2.330 -2.213 -15.381 966 1HB SER 118 HB2 SER 118 -0.016 -0.847 -16.725 967 2HB SER 118 HB1 SER 118 1.512 -1.253 -17.508 968 HG SER 118 HG SER 118 1.040 -3.379 -17.360 969 HA PRO 119 HA PRO 119 4.485 1.533 -14.539 970 1HB PRO 119 HB2 PRO 119 4.534 1.895 -17.514 971 2HB PRO 119 HB1 PRO 119 5.846 2.071 -16.343 972 1HG PRO 119 HG2 PRO 119 5.627 -0.125 -17.850 973 2HG PRO 119 HG1 PRO 119 6.177 -0.211 -16.167 974 1HD PRO 119 HD2 PRO 119 3.605 -1.063 -17.354 975 2HD PRO 119 HD1 PRO 119 4.411 -1.628 -15.878 976 H GLU 120 HN GLU 120 2.119 1.720 -17.174 977 HA GLU 120 HA GLU 120 1.582 4.505 -16.810 978 1HB GLU 120 HB2 GLU 120 1.255 3.462 -18.983 979 2HB GLU 120 HB1 GLU 120 0.078 2.348 -18.302 980 1HG GLU 120 HG2 GLU 120 -1.022 4.108 -19.541 981 2HG GLU 120 HG1 GLU 120 -1.421 4.211 -17.827 982 H VAL 121 HN VAL 121 -0.098 5.483 -15.727 983 HA VAL 121 HA VAL 121 -1.892 3.722 -14.195 984 HB VAL 121 HB VAL 121 -0.557 6.220 -13.136 985 1HG1 VAL 121 HG11 VAL 121 -1.591 5.194 -10.955 986 2HG1 VAL 121 HG12 VAL 121 -2.729 4.467 -12.089 987 3HG1 VAL 121 HG13 VAL 121 -2.560 6.221 -12.012 988 1HG2 VAL 121 HG21 VAL 121 1.142 4.789 -12.790 989 2HG2 VAL 121 HG22 VAL 121 0.124 3.368 -13.026 990 3HG2 VAL 121 HG23 VAL 121 0.143 4.190 -11.466 991 H SER 122 HN SER 122 -3.950 4.128 -14.563 992 HA SER 122 HA SER 122 -4.909 6.098 -16.276 993 1HB SER 122 HB2 SER 122 -6.138 4.021 -15.698 994 2HB SER 122 HB1 SER 122 -6.443 4.677 -14.090 995 HG SER 122 HG SER 122 -7.994 5.848 -14.877 996 HA PRO 123 HA PRO 123 -5.112 9.909 -14.056 997 1HB PRO 123 HB2 PRO 123 -7.730 10.621 -14.765 998 2HB PRO 123 HB1 PRO 123 -6.269 11.014 -15.676 999 1HG PRO 123 HG2 PRO 123 -8.223 8.800 -16.089 1000 2HG PRO 123 HG1 PRO 123 -7.354 9.770 -17.292 1001 1HD PRO 123 HD2 PRO 123 -6.594 7.276 -16.746 1002 2HD PRO 123 HD1 PRO 123 -5.387 8.549 -17.030 1003 H ALA 124 HN ALA 124 -7.892 7.717 -13.883 1004 HA ALA 124 HA ALA 124 -9.052 8.793 -11.551 1005 1HB ALA 124 HB1 ALA 124 -9.527 5.969 -11.709 1006 2HB ALA 124 HB2 ALA 124 -9.615 6.679 -13.322 1007 3HB ALA 124 HB3 ALA 124 -10.633 7.305 -12.026 1008 H ALA 125 HN ALA 125 -6.833 6.064 -12.024 1009 HA ALA 125 HA ALA 125 -6.645 5.187 -9.420 1010 1HB ALA 125 HB1 ALA 125 -5.621 4.127 -11.423 1011 2HB ALA 125 HB2 ALA 125 -4.556 4.199 -10.019 1012 3HB ALA 125 HB3 ALA 125 -4.342 5.337 -11.347 1013 H THR 126 HN THR 126 -4.631 7.663 -11.000 1014 HA THR 126 HA THR 126 -3.262 8.328 -8.570 1015 HB THR 126 HB THR 126 -2.252 10.138 -9.894 1016 HG1 THR 126 HG1 THR 126 -2.871 10.470 -12.001 1017 1HG2 THR 126 HG21 THR 126 -2.003 7.392 -10.465 1018 2HG2 THR 126 HG22 THR 126 -0.826 8.682 -10.721 1019 3HG2 THR 126 HG23 THR 126 -1.965 8.259 -12.000 1020 H ALA 127 HN ALA 127 -5.733 9.934 -10.559 1021 HA ALA 127 HA ALA 127 -5.965 12.212 -8.900 1022 1HB ALA 127 HB1 ALA 127 -7.771 12.871 -10.238 1023 2HB ALA 127 HB2 ALA 127 -8.142 11.210 -10.701 1024 3HB ALA 127 HB3 ALA 127 -6.687 11.992 -11.317 1025 H ILE 128 HN ILE 128 -7.964 9.257 -9.120 1026 HA ILE 128 HA ILE 128 -9.842 10.042 -7.200 1027 HB ILE 128 HB ILE 128 -8.972 7.242 -7.923 1028 1HG1 ILE 128 HG12 ILE 128 -11.383 8.864 -8.776 1029 2HG1 ILE 128 HG11 ILE 128 -9.954 8.586 -9.764 1030 1HG2 ILE 128 HG21 ILE 128 -11.359 8.177 -6.337 1031 2HG2 ILE 128 HG22 ILE 128 -10.001 7.229 -5.735 1032 3HG2 ILE 128 HG23 ILE 128 -11.107 6.528 -6.915 1033 1HD1 ILE 128 HD11 ILE 128 -11.791 6.435 -8.744 1034 2HD1 ILE 128 HD12 ILE 128 -10.414 6.222 -9.823 1035 3HD1 ILE 128 HD13 ILE 128 -11.826 7.129 -10.366 1036 H PHE 129 HN PHE 129 -6.856 8.100 -6.796 1037 HA PHE 129 HA PHE 129 -7.059 7.606 -4.072 1038 1HB PHE 129 HB2 PHE 129 -5.243 6.655 -5.383 1039 2HB PHE 129 HB1 PHE 129 -4.588 8.257 -5.703 1040 HD1 PHE 129 HD1 PHE 129 -2.656 8.710 -4.566 1041 HD2 PHE 129 HD2 PHE 129 -5.639 6.334 -2.675 1042 HE1 PHE 129 HE1 PHE 129 -1.242 8.540 -2.560 1043 HE2 PHE 129 HE2 PHE 129 -4.231 6.162 -0.665 1044 HZ PHE 129 HZ PHE 129 -2.031 7.269 -0.605 1045 H ARG 130 HN ARG 130 -5.687 10.396 -5.745 1046 HA ARG 130 HA ARG 130 -5.139 11.911 -3.406 1047 1HB ARG 130 HB2 ARG 130 -3.994 12.410 -5.497 1048 2HB ARG 130 HB1 ARG 130 -5.527 12.734 -6.294 1049 1HG ARG 130 HG2 ARG 130 -5.873 14.671 -4.850 1050 2HG ARG 130 HG1 ARG 130 -4.328 14.356 -4.055 1051 1HD ARG 130 HD2 ARG 130 -4.163 16.110 -5.782 1052 2HD ARG 130 HD1 ARG 130 -3.147 14.715 -6.143 1053 HE ARG 130 HE ARG 130 -5.639 14.391 -7.400 1054 1HH1 ARG 130 HH11 ARG 130 -2.761 16.357 -7.618 1055 2HH1 ARG 130 HH12 ARG 130 -2.929 16.632 -9.319 1056 1HH2 ARG 130 HH21 ARG 130 -5.857 14.749 -9.633 1057 2HH2 ARG 130 HH22 ARG 130 -4.687 15.719 -10.463 1058 H LYS 131 HN LYS 131 -7.862 11.549 -5.577 1059 HA LYS 131 HA LYS 131 -9.448 13.704 -4.784 1060 1HB LYS 131 HB2 LYS 131 -9.884 12.133 -6.720 1061 2HB LYS 131 HB1 LYS 131 -10.458 10.957 -5.549 1062 1HG LYS 131 HG2 LYS 131 -12.272 12.379 -4.907 1063 2HG LYS 131 HG1 LYS 131 -11.644 13.699 -5.894 1064 1HD LYS 131 HD2 LYS 131 -13.501 12.597 -7.015 1065 2HD LYS 131 HD1 LYS 131 -12.002 12.355 -7.913 1066 1HE LYS 131 HE2 LYS 131 -11.782 10.125 -6.910 1067 2HE LYS 131 HE1 LYS 131 -13.299 10.372 -6.048 1068 1HZ LYS 131 HZ1 LYS 131 -14.456 10.516 -8.141 1069 2HZ LYS 131 HZ2 LYS 131 -13.577 9.072 -8.090 1070 3HZ LYS 131 HZ3 LYS 131 -13.007 10.375 -9.005 1071 H LEU 132 HN LEU 132 -9.077 10.449 -3.467 1072 HA LEU 132 HA LEU 132 -11.041 10.514 -1.484 1073 1HB LEU 132 HB2 LEU 132 -8.307 9.226 -1.386 1074 2HB LEU 132 HB1 LEU 132 -9.628 8.865 -0.292 1075 HG LEU 132 HG LEU 132 -9.695 8.374 -3.273 1076 1HD1 LEU 132 HD11 LEU 132 -9.685 6.115 -1.390 1077 2HD1 LEU 132 HD12 LEU 132 -8.166 7.001 -1.519 1078 3HD1 LEU 132 HD13 LEU 132 -8.899 6.293 -2.958 1079 1HD2 LEU 132 HD21 LEU 132 -11.654 6.944 -2.632 1080 2HD2 LEU 132 HD22 LEU 132 -11.911 8.680 -2.455 1081 3HD2 LEU 132 HD23 LEU 132 -11.589 7.687 -1.034 1082 H ALA 133 HN ALA 133 -7.661 11.548 -1.439 1083 HA ALA 133 HA ALA 133 -7.677 12.526 1.229 1084 1HB ALA 133 HB1 ALA 133 -5.856 12.800 -1.118 1085 2HB ALA 133 HB2 ALA 133 -5.529 12.175 0.497 1086 3HB ALA 133 HB3 ALA 133 -5.665 13.912 0.237 1087 H GLY 134 HN GLY 134 -8.438 13.893 -1.912 1088 1HA GLY 134 HA2 GLY 134 -8.563 16.606 -1.152 1089 2HA GLY 134 HA1 GLY 134 -9.372 15.893 -2.538 1090 H GLU 135 HN GLU 135 -10.961 14.019 -1.025 1091 HA GLU 135 HA GLU 135 -13.295 15.396 -0.646 1092 1HB GLU 135 HB2 GLU 135 -12.469 13.002 1.003 1093 2HB GLU 135 HB1 GLU 135 -14.113 13.505 0.632 1094 1HG GLU 135 HG2 GLU 135 -13.578 13.100 -1.787 1095 2HG GLU 135 HG1 GLU 135 -12.061 12.381 -1.250 1096 H ARG 136 HN ARG 136 -11.017 14.448 1.915 1097 HA ARG 136 HA ARG 136 -12.274 16.367 3.726 1098 1HB ARG 136 HB2 ARG 136 -10.960 15.298 5.487 1099 2HB ARG 136 HB1 ARG 136 -11.891 14.107 4.591 1100 1HG ARG 136 HG2 ARG 136 -9.802 13.647 3.255 1101 2HG ARG 136 HG1 ARG 136 -8.939 14.642 4.428 1102 1HD ARG 136 HD2 ARG 136 -10.496 12.123 4.987 1103 2HD ARG 136 HD1 ARG 136 -8.746 12.312 5.041 1104 HE ARG 136 HE ARG 136 -10.574 12.907 7.115 1105 1HH1 ARG 136 HH11 ARG 136 -7.604 14.039 5.671 1106 2HH1 ARG 136 HH12 ARG 136 -7.073 14.850 7.105 1107 1HH2 ARG 136 HH21 ARG 136 -9.871 13.964 8.999 1108 2HH2 ARG 136 HH22 ARG 136 -8.357 14.804 8.996 1109 H ASN 137 HN ASN 137 -10.917 17.474 1.591 1110 HA ASN 137 HA ASN 137 -9.414 19.090 1.080 1111 1HB ASN 137 HB2 ASN 137 -10.167 20.103 3.191 1112 2HB ASN 137 HB1 ASN 137 -8.970 19.163 4.073 1113 1HD2 ASN 137 HD21 ASN 137 -7.312 20.336 4.662 1114 2HD2 ASN 137 HD22 ASN 137 -6.590 21.619 3.758 1115 H TYR 138 HN TYR 138 -7.425 18.933 0.211 1116 HA TYR 138 HA TYR 138 -5.820 16.671 0.537 1117 1HB TYR 138 HB2 TYR 138 -5.704 18.086 -1.446 1118 2HB TYR 138 HB1 TYR 138 -5.075 19.419 -0.487 1119 HD1 TYR 138 HD1 TYR 138 -2.977 19.814 -1.400 1120 HD2 TYR 138 HD2 TYR 138 -4.072 15.825 -0.403 1121 HE1 TYR 138 HE1 TYR 138 -0.685 19.072 -1.879 1122 HE2 TYR 138 HE2 TYR 138 -1.778 15.074 -0.881 1123 HH TYR 138 HH TYR 138 0.464 15.980 -1.008 1124 H THR 139 HN THR 139 -5.442 16.305 2.716 1125 HA THR 139 HA THR 139 -3.907 18.303 4.203 1126 HB THR 139 HB THR 139 -5.842 17.520 5.355 1127 HG1 THR 139 HG1 THR 139 -3.855 17.648 6.589 1128 1HG2 THR 139 HG21 THR 139 -5.146 14.958 4.214 1129 2HG2 THR 139 HG22 THR 139 -6.685 15.537 4.849 1130 3HG2 THR 139 HG23 THR 139 -5.482 14.849 5.941 1131 H ASP 140 HN ASP 140 -1.853 18.033 4.825 1132 HA ASP 140 HA ASP 140 -0.293 15.916 3.731 1133 1HB ASP 140 HB2 ASP 140 1.564 16.901 5.035 1134 2HB ASP 140 HB1 ASP 140 0.693 18.127 4.122 1135 H GLU 141 HN GLU 141 -2.178 16.325 6.557 1136 HA GLU 141 HA GLU 141 -0.963 14.784 8.469 1137 1HB GLU 141 HB2 GLU 141 -3.097 15.988 8.781 1138 2HB GLU 141 HB1 GLU 141 -3.906 14.789 7.792 1139 1HG GLU 141 HG2 GLU 141 -3.313 13.058 9.431 1140 2HG GLU 141 HG1 GLU 141 -2.565 14.295 10.435 1141 H MET 142 HN MET 142 -2.276 13.747 5.436 1142 HA MET 142 HA MET 142 -1.394 11.029 6.005 1143 1HB MET 142 HB2 MET 142 -4.145 11.628 4.892 1144 2HB MET 142 HB1 MET 142 -3.428 10.032 5.074 1145 1HG MET 142 HG2 MET 142 -3.431 10.242 7.462 1146 2HG MET 142 HG1 MET 142 -4.011 11.905 7.349 1147 1HE MET 142 HE1 MET 142 -7.389 11.983 6.428 1148 2HE MET 142 HE2 MET 142 -6.868 11.154 4.962 1149 3HE MET 142 HE3 MET 142 -5.840 12.388 5.691 1150 H VAL 143 HN VAL 143 0.181 12.368 4.622 1151 HA VAL 143 HA VAL 143 -0.330 11.706 1.802 1152 HB VAL 143 HB VAL 143 0.793 14.316 2.843 1153 1HG1 VAL 143 HG11 VAL 143 0.842 13.210 0.036 1154 2HG1 VAL 143 HG12 VAL 143 2.225 13.626 1.044 1155 3HG1 VAL 143 HG13 VAL 143 1.164 14.898 0.444 1156 1HG2 VAL 143 HG21 VAL 143 -1.071 15.356 2.025 1157 2HG2 VAL 143 HG22 VAL 143 -1.776 13.788 2.416 1158 3HG2 VAL 143 HG23 VAL 143 -1.316 14.154 0.755 1159 H ALA 144 HN ALA 144 1.473 11.039 0.618 1160 HA ALA 144 HA ALA 144 4.136 11.295 1.539 1161 1HB ALA 144 HB1 ALA 144 3.451 8.424 1.642 1162 2HB ALA 144 HB2 ALA 144 2.907 9.413 2.996 1163 3HB ALA 144 HB3 ALA 144 4.616 9.355 2.586 1164 H MET 145 HN MET 145 5.452 11.127 -0.145 1165 HA MET 145 HA MET 145 4.533 9.624 -2.511 1166 1HB MET 145 HB2 MET 145 5.824 11.268 -3.866 1167 2HB MET 145 HB1 MET 145 4.490 12.006 -2.989 1168 1HG MET 145 HG2 MET 145 6.111 12.720 -1.247 1169 2HG MET 145 HG1 MET 145 7.408 12.101 -2.265 1170 1HE MET 145 HE1 MET 145 8.678 14.857 -2.685 1171 2HE MET 145 HE2 MET 145 7.773 14.529 -1.207 1172 3HE MET 145 HE3 MET 145 7.459 16.003 -2.124 1173 H LEU 146 HN LEU 146 5.708 7.750 -2.483 1174 HA LEU 146 HA LEU 146 7.494 6.334 -2.289 1175 1HB LEU 146 HB2 LEU 146 7.992 7.981 -4.291 1176 2HB LEU 146 HB1 LEU 146 9.271 8.552 -3.238 1177 HG LEU 146 HG LEU 146 8.948 5.757 -4.332 1178 1HD1 LEU 146 HD11 LEU 146 11.269 7.598 -4.761 1179 2HD1 LEU 146 HD12 LEU 146 9.834 7.696 -5.780 1180 3HD1 LEU 146 HD13 LEU 146 10.764 6.199 -5.709 1181 1HD2 LEU 146 HD21 LEU 146 9.808 5.714 -2.035 1182 2HD2 LEU 146 HD22 LEU 146 11.089 6.832 -2.504 1183 3HD2 LEU 146 HD23 LEU 146 11.027 5.217 -3.209 1184 HA PRO 147 HA PRO 147 8.464 8.970 1.725 1185 1HB PRO 147 HB2 PRO 147 7.773 6.466 3.014 1186 2HB PRO 147 HB1 PRO 147 7.003 8.042 3.183 1187 1HG PRO 147 HG2 PRO 147 6.236 5.752 1.522 1188 2HG PRO 147 HG1 PRO 147 5.270 7.139 2.050 1189 1HD PRO 147 HD2 PRO 147 6.052 6.803 -0.511 1190 2HD PRO 147 HD1 PRO 147 5.871 8.409 0.223 1191 H ARG 148 HN ARG 148 9.294 6.770 3.639 1192 HA ARG 148 HA ARG 148 11.084 5.396 4.096 1193 1HB ARG 148 HB2 ARG 148 12.187 6.050 1.368 1194 2HB ARG 148 HB1 ARG 148 12.622 4.705 2.412 1195 1HG ARG 148 HG2 ARG 148 10.860 3.456 1.770 1196 2HG ARG 148 HG1 ARG 148 9.789 4.846 1.607 1197 1HD ARG 148 HD2 ARG 148 10.911 5.452 -0.483 1198 2HD ARG 148 HD1 ARG 148 11.968 4.051 -0.319 1199 HE ARG 148 HE ARG 148 10.319 2.839 -1.295 1200 1HH1 ARG 148 HH11 ARG 148 8.810 5.551 0.297 1201 2HH1 ARG 148 HH12 ARG 148 7.207 5.082 -0.152 1202 1HH2 ARG 148 HH21 ARG 148 8.222 2.223 -1.894 1203 2HH2 ARG 148 HH22 ARG 148 6.872 3.190 -1.402 1204 H GLN 149 HN GLN 149 13.364 5.667 4.608 1205 HA GLN 149 HA GLN 149 14.628 8.205 4.153 1206 1HB GLN 149 HB2 GLN 149 13.162 8.835 6.006 1207 2HB GLN 149 HB1 GLN 149 13.750 7.477 6.955 1208 1HG GLN 149 HG2 GLN 149 14.792 9.542 7.678 1209 2HG GLN 149 HG1 GLN 149 15.985 8.449 6.981 1210 1HE2 GLN 149 HE21 GLN 149 17.416 9.419 5.748 1211 2HE2 GLN 149 HE22 GLN 149 17.154 10.837 4.795 1212 H GLU 150 HN GLU 150 16.262 6.979 3.290 1213 HA GLU 150 HA GLU 150 18.115 5.813 5.191 1214 1HB GLU 150 HB2 GLU 150 17.103 4.169 2.855 1215 2HB GLU 150 HB1 GLU 150 18.299 3.674 4.044 1216 1HG GLU 150 HG2 GLU 150 15.433 4.291 4.706 1217 2HG GLU 150 HG1 GLU 150 16.044 2.680 4.346 1218 H GLU 151 HN GLU 151 19.436 4.439 2.801 1219 HA GLU 151 HA GLU 151 21.038 6.658 2.012 1220 1HB GLU 151 HB2 GLU 151 21.027 3.837 0.929 1221 2HB GLU 151 HB1 GLU 151 22.291 5.034 0.688 1222 1HG GLU 151 HG2 GLU 151 21.479 3.804 3.313 1223 2HG GLU 151 HG1 GLU 151 22.939 3.446 2.391 1224 H CYS 152 HN CYS 152 18.289 5.040 0.691 1225 HA CYS 152 HA CYS 152 18.342 6.857 -1.609 1226 1HB CYS 152 HB2 CYS 152 17.522 5.048 -3.075 1227 2HB CYS 152 HB1 CYS 152 19.121 4.687 -2.431 1228 H THR 153 HN THR 153 16.797 8.117 -0.401 1229 HA THR 153 HA THR 153 14.088 7.148 -0.748 1230 HB THR 153 HB THR 153 13.454 7.548 1.599 1231 HG1 THR 153 HG1 THR 153 15.035 8.963 2.269 1232 1HG2 THR 153 HG21 THR 153 15.753 5.612 1.415 1233 2HG2 THR 153 HG22 THR 153 14.090 5.261 0.944 1234 3HG2 THR 153 HG23 THR 153 14.475 5.617 2.628 1235 H VAL 154 HN VAL 154 12.462 8.822 -0.048 1236 HA VAL 154 HA VAL 154 13.067 11.285 -1.300 1237 HB VAL 154 HB VAL 154 10.833 12.029 -0.531 1238 1HG1 VAL 154 HG11 VAL 154 11.298 9.505 -2.013 1239 2HG1 VAL 154 HG12 VAL 154 10.590 11.025 -2.558 1240 3HG1 VAL 154 HG13 VAL 154 9.644 9.904 -1.586 1241 1HG2 VAL 154 HG21 VAL 154 9.958 9.456 0.470 1242 2HG2 VAL 154 HG22 VAL 154 9.728 11.065 1.152 1243 3HG2 VAL 154 HG23 VAL 154 11.204 10.162 1.496 1244 H ASP 155 HN ASP 155 14.860 12.079 -0.151 1245 HA ASP 155 HA ASP 155 14.922 12.640 2.599 1246 1HB ASP 155 HB2 ASP 155 16.906 12.643 1.120 1247 2HB ASP 155 HB1 ASP 155 16.311 14.104 0.341 1248 H GLU 156 HN GLU 156 14.331 14.432 3.798 1249 HA GLU 156 HA GLU 156 13.193 16.735 2.445 1250 1HB GLU 156 HB2 GLU 156 11.051 16.641 3.484 1251 2HB GLU 156 HB1 GLU 156 11.322 15.078 2.730 1252 1HG GLU 156 HG2 GLU 156 11.788 15.627 5.649 1253 2HG GLU 156 HG1 GLU 156 10.278 15.002 4.994 1254 H VAL 157 HN VAL 157 13.434 18.592 3.574 1255 HA VAL 157 HA VAL 157 14.127 20.030 5.200 1256 HB VAL 157 HB VAL 157 13.564 17.760 7.115 1257 1HG1 VAL 157 HG11 VAL 157 14.749 19.270 8.381 1258 2HG1 VAL 157 HG12 VAL 157 13.102 19.858 8.606 1259 3HG1 VAL 157 HG13 VAL 157 14.174 20.659 7.459 1260 1HG2 VAL 157 HG21 VAL 157 11.432 19.263 7.437 1261 2HG2 VAL 157 HG22 VAL 157 11.501 18.049 6.158 1262 3HG2 VAL 157 HG23 VAL 157 11.792 19.747 5.779 Start of MODEL 19 1 1H MET 1 HT1 MET 1 -20.090 -19.484 -17.408 2 2H MET 1 HT2 MET 1 -20.790 -19.462 -18.947 3 3H MET 1 HT3 MET 1 -21.602 -20.200 -17.659 4 HA MET 1 HA MET 1 -22.357 -17.887 -18.391 5 1HB MET 1 HB2 MET 1 -23.127 -19.061 -16.383 6 2HB MET 1 HB1 MET 1 -21.693 -18.536 -15.511 7 1HG MET 1 HG2 MET 1 -22.407 -16.213 -15.731 8 2HG MET 1 HG1 MET 1 -23.842 -16.737 -16.608 9 1HE MET 1 HE1 MET 1 -22.623 -18.709 -13.043 10 2HE MET 1 HE2 MET 1 -22.791 -17.149 -12.236 11 3HE MET 1 HE3 MET 1 -21.718 -17.312 -13.626 12 H THR 2 HN THR 2 -21.813 -15.789 -18.596 13 HA THR 2 HA THR 2 -19.133 -14.983 -18.543 14 HB THR 2 HB THR 2 -20.785 -13.876 -19.947 15 HG1 THR 2 HG1 THR 2 -19.712 -12.110 -18.006 16 1HG2 THR 2 HG21 THR 2 -22.770 -13.278 -19.196 17 2HG2 THR 2 HG22 THR 2 -22.002 -12.051 -18.188 18 3HG2 THR 2 HG23 THR 2 -22.294 -13.667 -17.543 19 H VAL 3 HN VAL 3 -17.866 -14.038 -17.050 20 HA VAL 3 HA VAL 3 -18.944 -12.797 -14.688 21 HB VAL 3 HB VAL 3 -17.778 -14.250 -13.077 22 1HG1 VAL 3 HG11 VAL 3 -19.659 -15.906 -14.742 23 2HG1 VAL 3 HG12 VAL 3 -20.195 -14.575 -13.717 24 3HG1 VAL 3 HG13 VAL 3 -19.399 -15.975 -12.998 25 1HG2 VAL 3 HG21 VAL 3 -17.172 -16.582 -13.961 26 2HG2 VAL 3 HG22 VAL 3 -16.048 -15.260 -14.275 27 3HG2 VAL 3 HG23 VAL 3 -17.129 -15.818 -15.551 28 HA PRO 4 HA PRO 4 -15.261 -10.384 -15.267 29 1HB PRO 4 HB2 PRO 4 -15.417 -10.009 -12.320 30 2HB PRO 4 HB1 PRO 4 -15.333 -8.799 -13.606 31 1HG PRO 4 HG2 PRO 4 -17.620 -9.255 -12.326 32 2HG PRO 4 HG1 PRO 4 -17.602 -8.949 -14.073 33 1HD PRO 4 HD2 PRO 4 -17.913 -11.536 -12.604 34 2HD PRO 4 HD1 PRO 4 -18.724 -10.970 -14.079 35 H ASP 5 HN ASP 5 -15.528 -12.921 -12.892 36 HA ASP 5 HA ASP 5 -14.044 -14.464 -12.125 37 1HB ASP 5 HB2 ASP 5 -12.161 -13.253 -14.166 38 2HB ASP 5 HB1 ASP 5 -11.877 -14.746 -13.280 39 H ARG 6 HN ARG 6 -13.102 -14.366 -10.195 40 HA ARG 6 HA ARG 6 -12.216 -11.910 -9.102 41 1HB ARG 6 HB2 ARG 6 -11.564 -13.245 -7.134 42 2HB ARG 6 HB1 ARG 6 -13.196 -13.607 -7.673 43 1HG ARG 6 HG2 ARG 6 -12.356 -15.635 -8.785 44 2HG ARG 6 HG1 ARG 6 -10.739 -15.276 -8.175 45 1HD ARG 6 HD2 ARG 6 -11.587 -15.401 -5.877 46 2HD ARG 6 HD1 ARG 6 -13.196 -15.773 -6.494 47 HE ARG 6 HE ARG 6 -11.397 -17.654 -7.524 48 1HH1 ARG 6 HH11 ARG 6 -12.796 -16.716 -4.466 49 2HH1 ARG 6 HH12 ARG 6 -12.687 -18.304 -3.785 50 1HH2 ARG 6 HH21 ARG 6 -11.254 -19.747 -6.627 51 2HH2 ARG 6 HH22 ARG 6 -11.811 -20.025 -5.011 52 H SER 7 HN SER 7 -10.596 -14.603 -10.606 53 HA SER 7 HA SER 7 -7.989 -14.266 -9.788 54 1HB SER 7 HB2 SER 7 -7.336 -15.288 -11.937 55 2HB SER 7 HB1 SER 7 -8.710 -16.123 -11.213 56 HG SER 7 HG SER 7 -9.984 -15.421 -12.774 57 H GLU 8 HN GLU 8 -9.848 -12.314 -12.018 58 HA GLU 8 HA GLU 8 -7.960 -10.991 -13.476 59 1HB GLU 8 HB2 GLU 8 -9.460 -9.088 -13.573 60 2HB GLU 8 HB1 GLU 8 -10.393 -10.576 -13.647 61 1HG GLU 8 HG2 GLU 8 -10.809 -10.314 -11.184 62 2HG GLU 8 HG1 GLU 8 -10.076 -8.717 -11.309 63 H ILE 9 HN ILE 9 -8.898 -10.311 -10.129 64 HA ILE 9 HA ILE 9 -7.190 -8.080 -9.809 65 HB ILE 9 HB ILE 9 -8.213 -9.897 -7.623 66 1HG1 ILE 9 HG12 ILE 9 -9.489 -7.611 -9.116 67 2HG1 ILE 9 HG11 ILE 9 -10.148 -9.210 -8.791 68 1HG2 ILE 9 HG21 ILE 9 -6.382 -7.891 -7.436 69 2HG2 ILE 9 HG22 ILE 9 -7.452 -8.398 -6.129 70 3HG2 ILE 9 HG23 ILE 9 -7.888 -7.022 -7.141 71 1HD1 ILE 9 HD11 ILE 9 -11.303 -8.198 -7.180 72 2HD1 ILE 9 HD12 ILE 9 -10.259 -6.778 -7.200 73 3HD1 ILE 9 HD13 ILE 9 -9.789 -8.204 -6.275 74 H ALA 10 HN ALA 10 -6.710 -11.521 -9.543 75 HA ALA 10 HA ALA 10 -4.288 -11.494 -8.082 76 1HB ALA 10 HB1 ALA 10 -5.132 -13.518 -10.156 77 2HB ALA 10 HB2 ALA 10 -5.701 -13.511 -8.486 78 3HB ALA 10 HB3 ALA 10 -3.989 -13.755 -8.835 79 H GLY 11 HN GLY 11 -2.150 -11.307 -8.758 80 1HA GLY 11 HA2 GLY 11 -0.955 -11.576 -11.136 81 2HA GLY 11 HA1 GLY 11 -1.800 -10.055 -11.368 82 H LYS 12 HN LYS 12 -0.110 -8.655 -11.481 83 HA LYS 12 HA LYS 12 1.754 -8.628 -9.200 84 1HB LYS 12 HB2 LYS 12 2.160 -7.655 -12.028 85 2HB LYS 12 HB1 LYS 12 3.292 -7.359 -10.719 86 1HG LYS 12 HG2 LYS 12 4.132 -9.190 -11.943 87 2HG LYS 12 HG1 LYS 12 3.468 -9.851 -10.448 88 1HD LYS 12 HD2 LYS 12 1.502 -10.610 -11.581 89 2HD LYS 12 HD1 LYS 12 1.964 -9.765 -13.058 90 1HE LYS 12 HE2 LYS 12 2.412 -12.156 -13.233 91 2HE LYS 12 HE1 LYS 12 3.907 -11.223 -13.289 92 1HZ LYS 12 HZ1 LYS 12 3.119 -13.238 -11.449 93 2HZ LYS 12 HZ2 LYS 12 3.499 -11.808 -10.629 94 3HZ LYS 12 HZ3 LYS 12 4.635 -12.518 -11.661 95 H TRP 13 HN TRP 13 1.931 -6.889 -7.958 96 HA TRP 13 HA TRP 13 0.343 -4.501 -8.639 97 1HB TRP 13 HB2 TRP 13 1.089 -5.781 -6.013 98 2HB TRP 13 HB1 TRP 13 0.579 -4.100 -6.087 99 HD1 TRP 13 HD1 TRP 13 -1.336 -6.029 -8.578 100 HE1 TRP 13 HE1 TRP 13 -3.682 -6.594 -7.679 101 HE3 TRP 13 HE3 TRP 13 -0.638 -4.878 -3.639 102 HZ2 TRP 13 HZ2 TRP 13 -5.049 -6.568 -5.227 103 HZ3 TRP 13 HZ3 TRP 13 -2.521 -5.187 -2.083 104 HH2 TRP 13 HH2 TRP 13 -4.681 -6.016 -2.864 105 H TYR 14 HN TYR 14 1.447 -2.639 -9.037 106 HA TYR 14 HA TYR 14 4.271 -2.526 -8.196 107 1HB TYR 14 HB2 TYR 14 4.018 -2.402 -10.621 108 2HB TYR 14 HB1 TYR 14 2.887 -1.060 -10.457 109 HD1 TYR 14 HD1 TYR 14 4.048 0.648 -11.617 110 HD2 TYR 14 HD2 TYR 14 6.033 -1.550 -8.563 111 HE1 TYR 14 HE1 TYR 14 5.921 2.244 -11.691 112 HE2 TYR 14 HE2 TYR 14 7.908 0.036 -8.629 113 HH TYR 14 HH TYR 14 8.510 2.078 -11.053 114 H VAL 15 HN VAL 15 4.217 -1.565 -6.225 115 HA VAL 15 HA VAL 15 2.572 0.816 -5.909 116 HB VAL 15 HB VAL 15 2.098 -0.576 -4.141 117 1HG1 VAL 15 HG11 VAL 15 3.460 -2.340 -3.961 118 2HG1 VAL 15 HG12 VAL 15 4.277 -1.367 -2.737 119 3HG1 VAL 15 HG13 VAL 15 4.891 -1.408 -4.388 120 1HG2 VAL 15 HG21 VAL 15 3.006 0.458 -2.114 121 2HG2 VAL 15 HG22 VAL 15 2.566 1.668 -3.319 122 3HG2 VAL 15 HG23 VAL 15 4.258 1.244 -3.073 123 H VAL 16 HN VAL 16 3.235 2.765 -5.354 124 HA VAL 16 HA VAL 16 5.954 3.393 -4.690 125 HB VAL 16 HB VAL 16 6.274 4.966 -6.619 126 1HG1 VAL 16 HG11 VAL 16 7.251 2.614 -6.402 127 2HG1 VAL 16 HG12 VAL 16 7.248 3.349 -8.005 128 3HG1 VAL 16 HG13 VAL 16 6.038 2.136 -7.592 129 1HG2 VAL 16 HG21 VAL 16 3.795 4.876 -7.261 130 2HG2 VAL 16 HG22 VAL 16 4.187 3.350 -8.055 131 3HG2 VAL 16 HG23 VAL 16 4.976 4.839 -8.570 132 H ALA 17 HN ALA 17 2.716 4.457 -5.563 133 HA ALA 17 HA ALA 17 3.070 7.091 -4.415 134 1HB ALA 17 HB1 ALA 17 1.277 5.886 -6.232 135 2HB ALA 17 HB2 ALA 17 1.375 7.580 -5.757 136 3HB ALA 17 HB3 ALA 17 0.322 6.477 -4.872 137 H LEU 18 HN LEU 18 2.733 7.629 -2.333 138 HA LEU 18 HA LEU 18 0.920 5.991 -0.692 139 1HB LEU 18 HB2 LEU 18 3.712 6.869 0.028 140 2HB LEU 18 HB1 LEU 18 2.537 6.372 1.231 141 HG LEU 18 HG LEU 18 2.411 4.149 0.155 142 1HD1 LEU 18 HD11 LEU 18 4.656 3.901 -1.355 143 2HD1 LEU 18 HD12 LEU 18 4.093 5.506 -1.824 144 3HD1 LEU 18 HD13 LEU 18 3.028 4.111 -1.999 145 1HD2 LEU 18 HD21 LEU 18 4.938 3.617 0.657 146 2HD2 LEU 18 HD22 LEU 18 3.821 4.062 1.947 147 3HD2 LEU 18 HD23 LEU 18 4.922 5.266 1.279 148 H ALA 19 HN ALA 19 0.528 7.245 1.539 149 HA ALA 19 HA ALA 19 0.803 10.064 1.488 150 1HB ALA 19 HB1 ALA 19 -0.878 10.723 0.218 151 2HB ALA 19 HB2 ALA 19 -2.017 9.891 1.278 152 3HB ALA 19 HB3 ALA 19 -1.307 9.043 -0.096 153 H SER 20 HN SER 20 1.024 10.509 3.528 154 HA SER 20 HA SER 20 -0.111 11.039 5.588 155 1HB SER 20 HB2 SER 20 -1.133 8.202 5.404 156 2HB SER 20 HB1 SER 20 -1.292 9.208 6.829 157 HG SER 20 HG SER 20 -2.875 9.101 4.717 158 H ASN 21 HN ASN 21 0.450 10.091 7.840 159 HA ASN 21 HA ASN 21 3.039 8.698 7.649 160 1HB ASN 21 HB2 ASN 21 2.359 11.085 9.378 161 2HB ASN 21 HB1 ASN 21 3.844 10.153 9.510 162 1HD2 ASN 21 HD21 ASN 21 3.593 9.917 6.408 163 2HD2 ASN 21 HD22 ASN 21 4.288 11.397 5.866 164 H THR 22 HN THR 22 3.631 7.369 9.339 165 HA THR 22 HA THR 22 1.582 6.851 11.392 166 HB THR 22 HB THR 22 2.158 4.446 11.250 167 HG1 THR 22 HG1 THR 22 3.365 3.775 9.411 168 1HG2 THR 22 HG21 THR 22 1.521 4.666 8.490 169 2HG2 THR 22 HG22 THR 22 0.625 5.885 9.392 170 3HG2 THR 22 HG23 THR 22 0.491 4.182 9.833 171 H GLU 23 HN GLU 23 2.331 6.741 13.440 172 HA GLU 23 HA GLU 23 4.823 7.672 14.159 173 1HB GLU 23 HB2 GLU 23 2.867 7.495 15.679 174 2HB GLU 23 HB1 GLU 23 3.123 5.757 15.765 175 1HG GLU 23 HG2 GLU 23 5.290 6.096 16.785 176 2HG GLU 23 HG1 GLU 23 5.109 7.843 16.636 177 H PHE 24 HN PHE 24 3.858 4.461 13.254 178 HA PHE 24 HA PHE 24 6.223 3.162 14.240 179 1HB PHE 24 HB2 PHE 24 4.046 2.267 12.349 180 2HB PHE 24 HB1 PHE 24 5.407 1.249 12.797 181 HD1 PHE 24 HD1 PHE 24 3.134 3.488 14.757 182 HD2 PHE 24 HD2 PHE 24 4.724 -0.418 14.186 183 HE1 PHE 24 HE1 PHE 24 1.902 2.701 16.731 184 HE2 PHE 24 HE2 PHE 24 3.494 -1.212 16.161 185 HZ PHE 24 HZ PHE 24 2.081 0.347 17.436 186 H PHE 25 HN PHE 25 6.235 5.467 12.115 187 HA PHE 25 HA PHE 25 7.152 4.560 9.683 188 1HB PHE 25 HB2 PHE 25 8.370 6.725 9.524 189 2HB PHE 25 HB1 PHE 25 6.701 6.905 10.054 190 HD1 PHE 25 HD1 PHE 25 6.276 8.287 11.828 191 HD2 PHE 25 HD2 PHE 25 10.117 6.485 11.503 192 HE1 PHE 25 HE1 PHE 25 7.033 9.554 13.797 193 HE2 PHE 25 HE2 PHE 25 10.879 7.744 13.473 194 HZ PHE 25 HZ PHE 25 9.337 9.281 14.623 195 H LEU 26 HN LEU 26 8.789 4.644 12.760 196 HA LEU 26 HA LEU 26 11.445 4.446 11.994 197 1HB LEU 26 HB2 LEU 26 10.711 4.678 14.321 198 2HB LEU 26 HB1 LEU 26 10.056 3.052 14.285 199 HG LEU 26 HG LEU 26 12.314 2.138 13.991 200 1HD1 LEU 26 HD11 LEU 26 12.993 5.022 13.792 201 2HD1 LEU 26 HD12 LEU 26 13.644 3.640 12.911 202 3HD1 LEU 26 HD13 LEU 26 14.151 3.945 14.572 203 1HD2 LEU 26 HD21 LEU 26 11.590 3.831 16.321 204 2HD2 LEU 26 HD22 LEU 26 13.223 3.166 16.254 205 3HD2 LEU 26 HD23 LEU 26 11.829 2.087 16.218 206 H ARG 27 HN ARG 27 9.034 1.872 12.363 207 HA ARG 27 HA ARG 27 10.744 -0.272 11.691 208 1HB ARG 27 HB2 ARG 27 8.596 -0.604 12.825 209 2HB ARG 27 HB1 ARG 27 7.742 -0.025 11.401 210 1HG ARG 27 HG2 ARG 27 7.672 -2.449 11.551 211 2HG ARG 27 HG1 ARG 27 8.563 -1.927 10.121 212 1HD ARG 27 HD2 ARG 27 9.701 -3.772 11.237 213 2HD ARG 27 HD1 ARG 27 10.672 -2.302 11.292 214 HE ARG 27 HE ARG 27 9.144 -2.441 13.631 215 1HH1 ARG 27 HH11 ARG 27 11.786 -4.118 12.087 216 2HH1 ARG 27 HH12 ARG 27 12.492 -4.638 13.580 217 1HH2 ARG 27 HH21 ARG 27 10.072 -3.124 15.596 218 2HH2 ARG 27 HH22 ARG 27 11.519 -4.075 15.572 219 H GLU 28 HN GLU 28 8.688 1.858 9.802 220 HA GLU 28 HA GLU 28 9.051 0.489 7.329 221 1HB GLU 28 HB2 GLU 28 7.098 1.911 7.781 222 2HB GLU 28 HB1 GLU 28 8.143 3.322 7.865 223 1HG GLU 28 HG2 GLU 28 8.705 3.108 5.540 224 2HG GLU 28 HG1 GLU 28 7.813 1.592 5.426 225 H LYS 29 HN LYS 29 11.170 2.328 9.147 226 HA LYS 29 HA LYS 29 12.477 3.856 7.169 227 1HB LYS 29 HB2 LYS 29 12.751 4.237 9.594 228 2HB LYS 29 HB1 LYS 29 13.608 2.708 9.727 229 1HG LYS 29 HG2 LYS 29 15.404 3.542 8.349 230 2HG LYS 29 HG1 LYS 29 14.526 5.046 8.065 231 1HD LYS 29 HD2 LYS 29 14.633 5.561 10.455 232 2HD LYS 29 HD1 LYS 29 15.503 4.054 10.745 233 1HE LYS 29 HE2 LYS 29 16.456 6.356 9.040 234 2HE LYS 29 HE1 LYS 29 17.027 5.964 10.661 235 1HZ LYS 29 HZ1 LYS 29 18.570 5.112 9.072 236 2HZ LYS 29 HZ2 LYS 29 17.350 4.312 8.217 237 3HZ LYS 29 HZ3 LYS 29 17.769 3.797 9.772 238 H ASP 30 HN ASP 30 13.017 0.580 8.392 239 HA ASP 30 HA ASP 30 15.379 0.060 6.953 240 1HB ASP 30 HB2 ASP 30 14.629 -1.301 8.863 241 2HB ASP 30 HB1 ASP 30 13.275 -1.895 7.907 242 H LYS 31 HN LYS 31 11.979 -0.648 6.184 243 HA LYS 31 HA LYS 31 12.652 -1.726 3.590 244 1HB LYS 31 HB2 LYS 31 10.232 -1.991 3.314 245 2HB LYS 31 HB1 LYS 31 10.775 -2.646 4.853 246 1HG LYS 31 HG2 LYS 31 9.997 -0.622 5.985 247 2HG LYS 31 HG1 LYS 31 9.436 0.020 4.442 248 1HD LYS 31 HD2 LYS 31 8.459 -2.509 5.768 249 2HD LYS 31 HD1 LYS 31 7.599 -0.969 5.718 250 1HE LYS 31 HE2 LYS 31 7.531 -1.105 3.266 251 2HE LYS 31 HE1 LYS 31 8.358 -2.661 3.338 252 1HZ LYS 31 HZ1 LYS 31 6.446 -3.437 4.737 253 2HZ LYS 31 HZ2 LYS 31 6.069 -3.110 3.121 254 3HZ LYS 31 HZ3 LYS 31 5.643 -2.005 4.328 255 H MET 32 HN MET 32 13.710 0.746 3.616 256 HA MET 32 HA MET 32 11.821 2.570 2.344 257 1HB MET 32 HB2 MET 32 13.681 4.217 2.543 258 2HB MET 32 HB1 MET 32 13.141 3.551 4.075 259 1HG MET 32 HG2 MET 32 15.053 2.022 4.075 260 2HG MET 32 HG1 MET 32 15.604 2.724 2.556 261 1HE MET 32 HE1 MET 32 18.248 3.738 3.906 262 2HE MET 32 HE2 MET 32 17.423 2.324 4.561 263 3HE MET 32 HE3 MET 32 17.912 3.635 5.634 264 H LYS 33 HN LYS 33 11.650 1.305 0.360 265 HA LYS 33 HA LYS 33 13.638 2.147 -1.590 266 1HB LYS 33 HB2 LYS 33 12.865 -0.758 -1.566 267 2HB LYS 33 HB1 LYS 33 14.169 0.013 -2.437 268 1HG LYS 33 HG2 LYS 33 15.281 -1.132 -0.787 269 2HG LYS 33 HG1 LYS 33 15.144 0.481 -0.088 270 1HD LYS 33 HD2 LYS 33 13.232 -0.222 1.233 271 2HD LYS 33 HD1 LYS 33 13.254 -1.804 0.463 272 1HE LYS 33 HE2 LYS 33 15.530 -0.686 2.086 273 2HE LYS 33 HE1 LYS 33 14.279 -1.742 2.738 274 1HZ LYS 33 HZ1 LYS 33 15.193 -3.531 1.797 275 2HZ LYS 33 HZ2 LYS 33 16.589 -2.587 1.660 276 3HZ LYS 33 HZ3 LYS 33 15.536 -2.734 0.346 277 H MET 34 HN MET 34 12.871 1.149 -3.870 278 HA MET 34 HA MET 34 10.313 2.214 -4.410 279 1HB MET 34 HB2 MET 34 12.038 1.916 -6.157 280 2HB MET 34 HB1 MET 34 11.890 0.170 -6.005 281 1HG MET 34 HG2 MET 34 9.585 0.288 -6.779 282 2HG MET 34 HG1 MET 34 9.712 2.042 -6.907 283 1HE MET 34 HE1 MET 34 12.534 -0.568 -7.837 284 2HE MET 34 HE2 MET 34 12.115 -0.910 -9.516 285 3HE MET 34 HE3 MET 34 11.022 -1.393 -8.218 286 H ALA 35 HN ALA 35 8.241 1.122 -4.678 287 HA ALA 35 HA ALA 35 8.258 -1.432 -3.245 288 1HB ALA 35 HB1 ALA 35 5.804 0.201 -3.698 289 2HB ALA 35 HB2 ALA 35 6.955 0.602 -2.430 290 3HB ALA 35 HB3 ALA 35 6.152 -0.967 -2.428 291 H MET 36 HN MET 36 7.705 -3.241 -4.063 292 HA MET 36 HA MET 36 6.177 -3.372 -6.573 293 1HB MET 36 HB2 MET 36 8.566 -3.880 -7.019 294 2HB MET 36 HB1 MET 36 8.519 -5.135 -5.789 295 1HG MET 36 HG2 MET 36 6.856 -6.354 -7.099 296 2HG MET 36 HG1 MET 36 6.916 -5.099 -8.335 297 1HE MET 36 HE1 MET 36 10.311 -8.030 -7.311 298 2HE MET 36 HE2 MET 36 8.832 -7.777 -6.385 299 3HE MET 36 HE3 MET 36 10.113 -6.566 -6.347 300 H ALA 37 HN ALA 37 4.711 -5.235 -6.635 301 HA ALA 37 HA ALA 37 4.600 -6.812 -4.188 302 1HB ALA 37 HB1 ALA 37 3.320 -5.013 -3.447 303 2HB ALA 37 HB2 ALA 37 2.137 -6.224 -3.943 304 3HB ALA 37 HB3 ALA 37 2.490 -4.853 -4.994 305 H ARG 38 HN ARG 38 3.280 -8.610 -4.198 306 HA ARG 38 HA ARG 38 2.285 -9.484 -6.831 307 1HB ARG 38 HB2 ARG 38 4.314 -10.697 -6.385 308 2HB ARG 38 HB1 ARG 38 3.816 -11.038 -4.736 309 1HG ARG 38 HG2 ARG 38 3.621 -13.009 -6.131 310 2HG ARG 38 HG1 ARG 38 2.032 -12.483 -5.570 311 1HD ARG 38 HD2 ARG 38 1.664 -11.369 -7.722 312 2HD ARG 38 HD1 ARG 38 3.234 -11.939 -8.280 313 HE ARG 38 HE ARG 38 1.756 -14.157 -7.452 314 1HH1 ARG 38 HH11 ARG 38 1.650 -11.712 -9.938 315 2HH1 ARG 38 HH12 ARG 38 0.866 -12.738 -11.091 316 1HH2 ARG 38 HH21 ARG 38 0.720 -15.509 -8.968 317 2HH2 ARG 38 HH22 ARG 38 0.336 -14.893 -10.540 318 H ILE 39 HN ILE 39 0.128 -9.726 -6.756 319 HA ILE 39 HA ILE 39 -1.179 -10.166 -4.181 320 HB ILE 39 HB ILE 39 -2.111 -8.377 -5.494 321 1HG1 ILE 39 HG12 ILE 39 -3.910 -10.812 -5.458 322 2HG1 ILE 39 HG11 ILE 39 -3.705 -9.638 -4.163 323 1HG2 ILE 39 HG21 ILE 39 -3.278 -9.866 -7.667 324 2HG2 ILE 39 HG22 ILE 39 -1.520 -9.990 -7.678 325 3HG2 ILE 39 HG23 ILE 39 -2.291 -8.407 -7.704 326 1HD1 ILE 39 HD11 ILE 39 -5.480 -9.591 -6.418 327 2HD1 ILE 39 HD12 ILE 39 -4.470 -8.146 -6.386 328 3HD1 ILE 39 HD13 ILE 39 -5.454 -8.566 -4.984 329 H SER 40 HN SER 40 -2.289 -11.943 -3.618 330 HA SER 40 HA SER 40 -3.122 -13.942 -5.498 331 1HB SER 40 HB2 SER 40 -0.756 -14.534 -5.354 332 2HB SER 40 HB1 SER 40 -0.852 -14.579 -3.594 333 HG SER 40 HG SER 40 -1.663 -16.436 -5.463 334 H PHE 41 HN PHE 41 -4.808 -15.083 -4.694 335 HA PHE 41 HA PHE 41 -5.732 -14.417 -2.026 336 1HB PHE 41 HB2 PHE 41 -7.013 -16.092 -4.200 337 2HB PHE 41 HB1 PHE 41 -7.782 -15.643 -2.683 338 HD1 PHE 41 HD1 PHE 41 -9.367 -14.020 -2.912 339 HD2 PHE 41 HD2 PHE 41 -5.890 -13.825 -5.360 340 HE1 PHE 41 HE1 PHE 41 -10.211 -11.955 -3.948 341 HE2 PHE 41 HE2 PHE 41 -6.725 -11.762 -6.392 342 HZ PHE 41 HZ PHE 41 -8.889 -10.822 -5.689 343 H LEU 42 HN LEU 42 -5.366 -15.617 -0.271 344 HA LEU 42 HA LEU 42 -4.269 -18.287 -0.562 345 1HB LEU 42 HB2 LEU 42 -4.755 -16.590 1.879 346 2HB LEU 42 HB1 LEU 42 -4.010 -18.174 1.910 347 HG LEU 42 HG LEU 42 -2.896 -15.743 0.507 348 1HD1 LEU 42 HD11 LEU 42 -1.111 -16.466 2.432 349 2HD1 LEU 42 HD12 LEU 42 -2.650 -16.780 3.233 350 3HD1 LEU 42 HD13 LEU 42 -2.303 -15.176 2.586 351 1HD2 LEU 42 HD21 LEU 42 -2.152 -17.635 -0.686 352 2HD2 LEU 42 HD22 LEU 42 -1.912 -18.571 0.790 353 3HD2 LEU 42 HD23 LEU 42 -0.838 -17.223 0.415 354 H GLY 43 HN GLY 43 -5.376 -20.095 -0.408 355 1HA GLY 43 HA2 GLY 43 -8.169 -20.191 -0.220 356 2HA GLY 43 HA1 GLY 43 -7.097 -21.573 -0.101 357 H GLU 44 HN GLU 44 -9.576 -21.023 1.266 358 HA GLU 44 HA GLU 44 -10.201 -21.982 3.325 359 1HB GLU 44 HB2 GLU 44 -7.725 -20.666 4.448 360 2HB GLU 44 HB1 GLU 44 -8.912 -21.551 5.389 361 1HG GLU 44 HG2 GLU 44 -8.400 -23.586 4.171 362 2HG GLU 44 HG1 GLU 44 -7.243 -22.714 3.169 363 H ASP 45 HN ASP 45 -8.670 -18.792 3.857 364 HA ASP 45 HA ASP 45 -10.999 -17.294 3.651 365 1HB ASP 45 HB2 ASP 45 -11.786 -18.600 5.596 366 2HB ASP 45 HB1 ASP 45 -10.392 -18.053 6.521 367 H GLU 46 HN GLU 46 -8.424 -16.807 2.844 368 HA GLU 46 HA GLU 46 -7.990 -14.286 4.100 369 1HB GLU 46 HB2 GLU 46 -5.597 -14.723 4.729 370 2HB GLU 46 HB1 GLU 46 -6.799 -15.476 5.769 371 1HG GLU 46 HG2 GLU 46 -5.444 -16.925 3.522 372 2HG GLU 46 HG1 GLU 46 -4.810 -16.885 5.165 373 H LEU 47 HN LEU 47 -6.866 -12.880 2.929 374 HA LEU 47 HA LEU 47 -5.709 -13.839 0.395 375 1HB LEU 47 HB2 LEU 47 -7.919 -12.715 0.111 376 2HB LEU 47 HB1 LEU 47 -7.246 -11.273 0.845 377 HG LEU 47 HG LEU 47 -6.114 -12.474 -1.675 378 1HD1 LEU 47 HD11 LEU 47 -8.585 -11.819 -1.791 379 2HD1 LEU 47 HD12 LEU 47 -7.493 -11.112 -2.980 380 3HD1 LEU 47 HD13 LEU 47 -8.022 -10.159 -1.594 381 1HD2 LEU 47 HD21 LEU 47 -5.721 -9.760 -1.698 382 2HD2 LEU 47 HD22 LEU 47 -4.531 -10.961 -1.197 383 3HD2 LEU 47 HD23 LEU 47 -5.532 -10.156 0.011 384 H LYS 48 HN LYS 48 -3.758 -12.863 -0.215 385 HA LYS 48 HA LYS 48 -2.768 -10.695 1.455 386 1HB LYS 48 HB2 LYS 48 -0.798 -11.841 2.174 387 2HB LYS 48 HB1 LYS 48 -2.184 -12.834 2.587 388 1HG LYS 48 HG2 LYS 48 -0.676 -14.375 1.790 389 2HG LYS 48 HG1 LYS 48 -1.673 -14.057 0.369 390 1HD LYS 48 HD2 LYS 48 0.009 -12.556 -0.514 391 2HD LYS 48 HD1 LYS 48 0.970 -12.721 0.954 392 1HE LYS 48 HE2 LYS 48 0.300 -14.943 -0.968 393 2HE LYS 48 HE1 LYS 48 1.839 -14.086 -0.893 394 1HZ LYS 48 HZ1 LYS 48 2.074 -14.873 1.409 395 2HZ LYS 48 HZ2 LYS 48 2.005 -16.146 0.299 396 3HZ LYS 48 HZ3 LYS 48 0.652 -15.771 1.242 397 H VAL 49 HN VAL 49 -0.888 -9.670 0.716 398 HA VAL 49 HA VAL 49 0.003 -10.326 -1.984 399 HB VAL 49 HB VAL 49 -1.746 -8.657 -2.304 400 1HG1 VAL 49 HG11 VAL 49 -2.118 -7.022 -0.863 401 2HG1 VAL 49 HG12 VAL 49 -0.540 -6.324 -1.216 402 3HG1 VAL 49 HG13 VAL 49 -0.705 -7.520 0.069 403 1HG2 VAL 49 HG21 VAL 49 0.104 -6.754 -3.043 404 2HG2 VAL 49 HG22 VAL 49 -0.415 -8.137 -4.007 405 3HG2 VAL 49 HG23 VAL 49 1.039 -8.248 -3.016 406 H SER 50 HN SER 50 2.129 -10.456 -1.961 407 HA SER 50 HA SER 50 3.624 -9.328 0.251 408 1HB SER 50 HB2 SER 50 4.538 -11.044 -2.069 409 2HB SER 50 HB1 SER 50 5.518 -10.610 -0.671 410 HG SER 50 HG SER 50 3.032 -11.835 -0.249 411 H TYR 51 HN TYR 51 5.050 -7.634 0.125 412 HA TYR 51 HA TYR 51 5.305 -6.378 -2.527 413 1HB TYR 51 HB2 TYR 51 5.641 -4.817 0.005 414 2HB TYR 51 HB1 TYR 51 5.185 -4.248 -1.595 415 HD1 TYR 51 HD1 TYR 51 2.966 -3.693 -1.974 416 HD2 TYR 51 HD2 TYR 51 3.893 -6.434 1.146 417 HE1 TYR 51 HE1 TYR 51 0.606 -3.699 -1.282 418 HE2 TYR 51 HE2 TYR 51 1.535 -6.452 1.839 419 HH TYR 51 HH TYR 51 -0.949 -4.801 -0.017 420 H ALA 52 HN ALA 52 7.294 -6.481 -3.338 421 HA ALA 52 HA ALA 52 9.561 -6.787 -1.499 422 1HB ALA 52 HB1 ALA 52 9.545 -7.164 -4.491 423 2HB ALA 52 HB2 ALA 52 9.274 -8.460 -3.326 424 3HB ALA 52 HB3 ALA 52 10.823 -7.619 -3.366 425 H VAL 53 HN VAL 53 10.505 -4.921 -0.944 426 HA VAL 53 HA VAL 53 10.530 -2.741 -2.894 427 HB VAL 53 HB VAL 53 11.156 -1.295 -0.936 428 1HG1 VAL 53 HG11 VAL 53 8.594 -2.639 -1.421 429 2HG1 VAL 53 HG12 VAL 53 8.975 -0.920 -1.309 430 3HG1 VAL 53 HG13 VAL 53 8.736 -1.868 0.159 431 1HG2 VAL 53 HG21 VAL 53 11.411 -2.094 1.153 432 2HG2 VAL 53 HG22 VAL 53 11.721 -3.625 0.336 433 3HG2 VAL 53 HG23 VAL 53 10.115 -3.274 0.970 434 HA PRO 54 HA PRO 54 15.004 -3.499 -3.035 435 1HB PRO 54 HB2 PRO 54 15.202 -3.598 -5.670 436 2HB PRO 54 HB1 PRO 54 14.350 -4.887 -4.808 437 1HG PRO 54 HG2 PRO 54 13.258 -2.708 -6.492 438 2HG PRO 54 HG1 PRO 54 12.569 -4.298 -6.128 439 1HD PRO 54 HD2 PRO 54 12.032 -1.749 -4.840 440 2HD PRO 54 HD1 PRO 54 11.238 -3.316 -4.572 441 H LYS 55 HN LYS 55 16.755 -2.096 -3.397 442 HA LYS 55 HA LYS 55 16.909 0.028 -5.157 443 1HB LYS 55 HB2 LYS 55 15.018 0.917 -3.704 444 2HB LYS 55 HB1 LYS 55 16.198 1.074 -2.415 445 1HG LYS 55 HG2 LYS 55 16.430 2.429 -5.093 446 2HG LYS 55 HG1 LYS 55 15.711 3.172 -3.666 447 1HD LYS 55 HD2 LYS 55 17.890 2.788 -2.483 448 2HD LYS 55 HD1 LYS 55 18.564 2.277 -4.030 449 1HE LYS 55 HE2 LYS 55 19.077 4.617 -3.581 450 2HE LYS 55 HE1 LYS 55 18.041 4.448 -4.997 451 1HZ LYS 55 HZ1 LYS 55 16.331 5.476 -3.980 452 2HZ LYS 55 HZ2 LYS 55 17.556 6.164 -3.039 453 3HZ LYS 55 HZ3 LYS 55 16.687 4.837 -2.454 454 HA PRO 56 HA PRO 56 20.982 -0.621 -3.376 455 1HB PRO 56 HB2 PRO 56 21.981 1.241 -5.389 456 2HB PRO 56 HB1 PRO 56 22.259 -0.496 -5.249 457 1HG PRO 56 HG2 PRO 56 20.771 0.600 -7.231 458 2HG PRO 56 HG1 PRO 56 20.469 -1.023 -6.583 459 1HD PRO 56 HD2 PRO 56 19.049 1.550 -5.990 460 2HD PRO 56 HD1 PRO 56 18.379 -0.075 -6.252 461 H ASN 57 HN ASN 57 22.924 1.514 -3.729 462 HA ASN 57 HA ASN 57 23.735 3.281 -2.551 463 1HB ASN 57 HB2 ASN 57 20.920 4.300 -2.974 464 2HB ASN 57 HB1 ASN 57 22.294 5.287 -2.485 465 1HD2 ASN 57 HD21 ASN 57 20.447 4.470 -5.029 466 2HD2 ASN 57 HD22 ASN 57 21.564 4.744 -6.319 467 H GLY 58 HN GLY 58 23.126 1.237 -0.872 468 1HA GLY 58 HA2 GLY 58 22.943 0.855 1.388 469 2HA GLY 58 HA1 GLY 58 22.804 2.591 1.606 470 H CYS 59 HN CYS 59 20.691 0.374 -0.186 471 HA CYS 59 HA CYS 59 18.570 0.923 1.770 472 1HB CYS 59 HB2 CYS 59 18.556 1.465 -1.135 473 2HB CYS 59 HB1 CYS 59 17.109 0.695 -0.502 474 H ARG 60 HN ARG 60 19.728 -1.183 -0.835 475 HA ARG 60 HA ARG 60 19.657 -3.444 -1.088 476 1HB ARG 60 HB2 ARG 60 18.464 -3.521 1.691 477 2HB ARG 60 HB1 ARG 60 19.203 -4.861 0.829 478 1HG ARG 60 HG2 ARG 60 20.661 -2.366 1.668 479 2HG ARG 60 HG1 ARG 60 20.651 -3.881 2.572 480 1HD ARG 60 HD2 ARG 60 22.653 -3.854 1.299 481 2HD ARG 60 HD1 ARG 60 21.565 -4.994 0.512 482 HE ARG 60 HE ARG 60 21.284 -2.446 -0.659 483 1HH1 ARG 60 HH11 ARG 60 23.530 -5.109 -0.477 484 2HH1 ARG 60 HH12 ARG 60 24.237 -4.782 -2.024 485 1HH2 ARG 60 HH21 ARG 60 22.211 -2.014 -2.694 486 2HH2 ARG 60 HH22 ARG 60 23.488 -3.025 -3.283 487 H LYS 61 HN LYS 61 17.406 -5.024 0.356 488 HA LYS 61 HA LYS 61 15.060 -4.036 -1.038 489 1HB LYS 61 HB2 LYS 61 14.672 -6.176 -2.185 490 2HB LYS 61 HB1 LYS 61 16.152 -5.402 -2.735 491 1HG LYS 61 HG2 LYS 61 17.462 -6.890 -1.307 492 2HG LYS 61 HG1 LYS 61 15.975 -7.668 -0.759 493 1HD LYS 61 HD2 LYS 61 15.495 -8.371 -3.051 494 2HD LYS 61 HD1 LYS 61 16.974 -7.583 -3.606 495 1HE LYS 61 HE2 LYS 61 18.297 -9.081 -2.191 496 2HE LYS 61 HE1 LYS 61 16.818 -9.870 -1.643 497 1HZ LYS 61 HZ1 LYS 61 16.422 -10.726 -3.788 498 2HZ LYS 61 HZ2 LYS 61 18.058 -11.020 -3.477 499 3HZ LYS 61 HZ3 LYS 61 17.608 -9.748 -4.496 500 H TRP 62 HN TRP 62 13.084 -4.906 -0.226 501 HA TRP 62 HA TRP 62 13.324 -6.839 1.962 502 1HB TRP 62 HB2 TRP 62 13.470 -4.629 3.032 503 2HB TRP 62 HB1 TRP 62 11.939 -4.173 2.296 504 HD1 TRP 62 HD1 TRP 62 10.066 -4.254 4.024 505 HE1 TRP 62 HE1 TRP 62 9.447 -5.751 6.024 506 HE3 TRP 62 HE3 TRP 62 14.015 -7.504 3.866 507 HZ2 TRP 62 HZ2 TRP 62 10.491 -8.007 7.358 508 HZ3 TRP 62 HZ3 TRP 62 14.127 -9.303 5.541 509 HH2 TRP 62 HH2 TRP 62 12.402 -9.548 7.251 510 H GLU 63 HN GLU 63 11.354 -7.856 2.584 511 HA GLU 63 HA GLU 63 9.120 -7.495 0.713 512 1HB GLU 63 HB2 GLU 63 8.842 -9.925 0.549 513 2HB GLU 63 HB1 GLU 63 10.408 -9.417 -0.068 514 1HG GLU 63 HG2 GLU 63 11.453 -10.100 2.034 515 2HG GLU 63 HG1 GLU 63 9.881 -10.619 2.639 516 H THR 64 HN THR 64 7.079 -7.883 1.535 517 HA THR 64 HA THR 64 6.805 -8.837 4.273 518 HB THR 64 HB THR 64 7.108 -6.371 4.452 519 HG1 THR 64 HG1 THR 64 5.343 -6.087 5.786 520 1HG2 THR 64 HG21 THR 64 5.423 -4.851 3.700 521 2HG2 THR 64 HG22 THR 64 4.489 -6.167 2.992 522 3HG2 THR 64 HG23 THR 64 6.055 -5.732 2.309 523 H THR 65 HN THR 65 4.857 -9.822 4.661 524 HA THR 65 HA THR 65 3.040 -9.988 2.349 525 HB THR 65 HB THR 65 3.755 -12.012 4.469 526 HG1 THR 65 HG1 THR 65 5.205 -12.303 2.962 527 1HG2 THR 65 HG21 THR 65 2.317 -13.439 2.698 528 2HG2 THR 65 HG22 THR 65 1.405 -11.929 2.716 529 3HG2 THR 65 HG23 THR 65 1.683 -12.810 4.218 530 H PHE 66 HN PHE 66 1.245 -8.820 2.663 531 HA PHE 66 HA PHE 66 0.125 -8.529 5.353 532 1HB PHE 66 HB2 PHE 66 -0.529 -7.270 2.680 533 2HB PHE 66 HB1 PHE 66 -1.560 -7.058 4.089 534 HD1 PHE 66 HD1 PHE 66 2.158 -7.150 4.010 535 HD2 PHE 66 HD2 PHE 66 -1.336 -4.770 4.524 536 HE1 PHE 66 HE1 PHE 66 3.551 -5.272 4.764 537 HE2 PHE 66 HE2 PHE 66 0.057 -2.887 5.276 538 HZ PHE 66 HZ PHE 66 2.503 -3.137 5.397 539 H LYS 67 HN LYS 67 -1.453 -9.939 6.072 540 HA LYS 67 HA LYS 67 -3.229 -11.169 4.094 541 1HB LYS 67 HB2 LYS 67 -1.260 -12.603 4.167 542 2HB LYS 67 HB1 LYS 67 -1.401 -12.743 5.904 543 1HG LYS 67 HG2 LYS 67 -3.617 -13.655 4.111 544 2HG LYS 67 HG1 LYS 67 -2.214 -14.675 4.417 545 1HD LYS 67 HD2 LYS 67 -4.160 -13.612 6.467 546 2HD LYS 67 HD1 LYS 67 -3.984 -15.277 5.931 547 1HE LYS 67 HE2 LYS 67 -1.690 -15.302 6.833 548 2HE LYS 67 HE1 LYS 67 -1.930 -13.660 7.433 549 1HZ LYS 67 HZ1 LYS 67 -3.847 -15.742 8.206 550 2HZ LYS 67 HZ2 LYS 67 -3.360 -14.362 9.053 551 3HZ LYS 67 HZ3 LYS 67 -2.337 -15.707 8.970 552 H LYS 68 HN LYS 68 -5.180 -11.749 4.795 553 HA LYS 68 HA LYS 68 -6.017 -12.768 7.130 554 1HB LYS 68 HB2 LYS 68 -5.190 -10.771 8.315 555 2HB LYS 68 HB1 LYS 68 -6.315 -9.783 7.396 556 1HG LYS 68 HG2 LYS 68 -8.185 -11.120 8.335 557 2HG LYS 68 HG1 LYS 68 -7.015 -11.989 9.321 558 1HD LYS 68 HD2 LYS 68 -6.410 -9.919 10.450 559 2HD LYS 68 HD1 LYS 68 -7.540 -9.021 9.434 560 1HE LYS 68 HE2 LYS 68 -8.505 -9.486 11.623 561 2HE LYS 68 HE1 LYS 68 -9.394 -10.316 10.346 562 1HZ LYS 68 HZ1 LYS 68 -8.922 -11.680 12.363 563 2HZ LYS 68 HZ2 LYS 68 -7.279 -11.618 11.964 564 3HZ LYS 68 HZ3 LYS 68 -8.375 -12.360 10.912 565 H THR 69 HN THR 69 -8.066 -10.030 6.729 566 HA THR 69 HA THR 69 -9.649 -11.528 4.750 567 HB THR 69 HB THR 69 -11.701 -10.910 5.988 568 HG1 THR 69 HG1 THR 69 -9.825 -9.899 7.852 569 1HG2 THR 69 HG21 THR 69 -11.380 -12.997 6.698 570 2HG2 THR 69 HG22 THR 69 -10.885 -12.233 8.209 571 3HG2 THR 69 HG23 THR 69 -9.669 -12.732 7.032 572 H SER 70 HN SER 70 -11.413 -10.238 3.740 573 HA SER 70 HA SER 70 -11.207 -7.369 3.678 574 1HB SER 70 HB2 SER 70 -10.593 -8.710 1.069 575 2HB SER 70 HB1 SER 70 -10.223 -7.062 1.590 576 HG SER 70 HG SER 70 -8.448 -8.715 1.512 577 H ASP 71 HN ASP 71 -13.029 -6.424 2.705 578 HA ASP 71 HA ASP 71 -15.304 -8.096 2.405 579 1HB ASP 71 HB2 ASP 71 -14.867 -5.186 1.752 580 2HB ASP 71 HB1 ASP 71 -16.414 -5.989 1.526 581 H ASP 72 HN ASP 72 -16.519 -8.657 0.612 582 HA ASP 72 HA ASP 72 -15.294 -9.665 -1.581 583 1HB ASP 72 HB2 ASP 72 -18.086 -8.508 -1.493 584 2HB ASP 72 HB1 ASP 72 -17.485 -9.612 -2.727 585 H GLY 73 HN GLY 73 -14.850 -9.076 -3.684 586 1HA GLY 73 HA2 GLY 73 -14.215 -7.683 -5.393 587 2HA GLY 73 HA1 GLY 73 -15.489 -6.598 -4.851 588 H GLU 74 HN GLU 74 -14.546 -4.656 -4.845 589 HA GLU 74 HA GLU 74 -11.884 -4.343 -3.662 590 1HB GLU 74 HB2 GLU 74 -12.293 -3.366 -5.877 591 2HB GLU 74 HB1 GLU 74 -13.609 -2.407 -5.213 592 1HG GLU 74 HG2 GLU 74 -12.023 -1.254 -3.758 593 2HG GLU 74 HG1 GLU 74 -10.708 -2.189 -4.470 594 H VAL 75 HN VAL 75 -11.674 -3.629 -1.596 595 HA VAL 75 HA VAL 75 -13.411 -1.608 -0.526 596 HB VAL 75 HB VAL 75 -13.516 -4.302 0.829 597 1HG1 VAL 75 HG11 VAL 75 -14.001 -1.714 1.793 598 2HG1 VAL 75 HG12 VAL 75 -14.379 -3.246 2.580 599 3HG1 VAL 75 HG13 VAL 75 -15.587 -2.454 1.569 600 1HG2 VAL 75 HG21 VAL 75 -15.602 -2.951 -0.874 601 2HG2 VAL 75 HG22 VAL 75 -15.901 -4.346 0.160 602 3HG2 VAL 75 HG23 VAL 75 -14.787 -4.482 -1.199 603 H TYR 76 HN TYR 76 -12.231 -3.854 1.839 604 HA TYR 76 HA TYR 76 -9.650 -2.570 2.134 605 1HB TYR 76 HB2 TYR 76 -10.070 -1.841 4.436 606 2HB TYR 76 HB1 TYR 76 -11.172 -1.039 3.327 607 HD1 TYR 76 HD1 TYR 76 -11.087 -4.163 5.410 608 HD2 TYR 76 HD2 TYR 76 -13.365 -0.845 4.024 609 HE1 TYR 76 HE1 TYR 76 -12.993 -4.917 6.759 610 HE2 TYR 76 HE2 TYR 76 -15.279 -1.591 5.380 611 HH TYR 76 HH TYR 76 -15.784 -4.425 6.448 612 H TYR 77 HN TYR 77 -8.204 -3.728 3.504 613 HA TYR 77 HA TYR 77 -9.257 -6.255 4.552 614 1HB TYR 77 HB2 TYR 77 -7.591 -7.592 3.619 615 2HB TYR 77 HB1 TYR 77 -8.042 -6.527 2.302 616 HD1 TYR 77 HD1 TYR 77 -5.512 -6.773 5.056 617 HD2 TYR 77 HD2 TYR 77 -6.350 -5.574 1.060 618 HE1 TYR 77 HE1 TYR 77 -3.137 -6.243 4.723 619 HE2 TYR 77 HE2 TYR 77 -3.974 -5.035 0.718 620 HH TYR 77 HH TYR 77 -1.997 -4.465 2.068 621 H SER 78 HN SER 78 -8.759 -6.612 6.564 622 HA SER 78 HA SER 78 -6.660 -4.986 7.830 623 1HB SER 78 HB2 SER 78 -7.818 -5.557 9.959 624 2HB SER 78 HB1 SER 78 -8.874 -4.713 8.825 625 HG SER 78 HG SER 78 -9.909 -6.597 8.382 626 H GLU 79 HN GLU 79 -5.282 -6.061 9.457 627 HA GLU 79 HA GLU 79 -5.242 -8.952 9.390 628 1HB GLU 79 HB2 GLU 79 -2.950 -9.154 8.602 629 2HB GLU 79 HB1 GLU 79 -3.981 -8.407 7.387 630 1HG GLU 79 HG2 GLU 79 -3.112 -6.222 7.963 631 2HG GLU 79 HG1 GLU 79 -2.113 -6.948 9.220 632 H GLU 80 HN GLU 80 -4.611 -9.809 11.207 633 HA GLU 80 HA GLU 80 -4.028 -10.068 13.354 634 1HB GLU 80 HB2 GLU 80 -1.786 -9.414 14.016 635 2HB GLU 80 HB1 GLU 80 -1.782 -10.066 12.390 636 1HG GLU 80 HG2 GLU 80 -1.649 -7.787 11.500 637 2HG GLU 80 HG1 GLU 80 -1.604 -7.155 13.145 638 H ALA 81 HN ALA 81 -3.356 -6.658 12.636 639 HA ALA 81 HA ALA 81 -5.333 -5.419 13.993 640 1HB ALA 81 HB1 ALA 81 -3.240 -6.422 15.871 641 2HB ALA 81 HB2 ALA 81 -4.976 -6.229 16.120 642 3HB ALA 81 HB3 ALA 81 -3.917 -4.820 16.159 643 H LYS 82 HN LYS 82 -2.005 -4.824 14.958 644 HA LYS 82 HA LYS 82 -1.725 -2.240 14.319 645 1HB LYS 82 HB2 LYS 82 0.687 -2.646 14.017 646 2HB LYS 82 HB1 LYS 82 0.031 -3.483 15.417 647 1HG LYS 82 HG2 LYS 82 -0.030 -5.568 14.157 648 2HG LYS 82 HG1 LYS 82 0.599 -4.732 12.736 649 1HD LYS 82 HD2 LYS 82 2.379 -5.923 13.902 650 2HD LYS 82 HD1 LYS 82 2.642 -4.179 13.971 651 1HE LYS 82 HE2 LYS 82 1.698 -4.133 16.230 652 2HE LYS 82 HE1 LYS 82 1.442 -5.875 16.158 653 1HZ LYS 82 HZ1 LYS 82 3.992 -5.859 15.641 654 2HZ LYS 82 HZ2 LYS 82 3.432 -5.781 17.235 655 3HZ LYS 82 HZ3 LYS 82 3.940 -4.373 16.449 656 H LYS 83 HN LYS 83 -1.906 -4.866 11.962 657 HA LYS 83 HA LYS 83 -1.295 -2.887 9.867 658 1HB LYS 83 HB2 LYS 83 -1.065 -5.887 9.885 659 2HB LYS 83 HB1 LYS 83 -0.966 -4.939 8.407 660 1HG LYS 83 HG2 LYS 83 0.966 -3.745 9.320 661 2HG LYS 83 HG1 LYS 83 0.860 -4.712 10.792 662 1HD LYS 83 HD2 LYS 83 1.245 -6.744 9.481 663 2HD LYS 83 HD1 LYS 83 1.354 -5.774 8.010 664 1HE LYS 83 HE2 LYS 83 3.183 -5.588 10.402 665 2HE LYS 83 HE1 LYS 83 3.571 -6.350 8.860 666 1HZ LYS 83 HZ1 LYS 83 2.913 -3.977 7.975 667 2HZ LYS 83 HZ2 LYS 83 4.476 -4.309 8.529 668 3HZ LYS 83 HZ3 LYS 83 3.375 -3.512 9.535 669 H LYS 84 HN LYS 84 -2.964 -2.086 8.848 670 HA LYS 84 HA LYS 84 -5.135 -3.769 7.925 671 1HB LYS 84 HB2 LYS 84 -5.652 -1.397 9.738 672 2HB LYS 84 HB1 LYS 84 -6.884 -2.286 8.855 673 1HG LYS 84 HG2 LYS 84 -6.407 -4.281 10.131 674 2HG LYS 84 HG1 LYS 84 -5.092 -3.460 10.965 675 1HD LYS 84 HD2 LYS 84 -7.027 -3.512 12.400 676 2HD LYS 84 HD1 LYS 84 -6.734 -1.851 11.887 677 1HE LYS 84 HE2 LYS 84 -8.703 -3.674 10.523 678 2HE LYS 84 HE1 LYS 84 -9.141 -2.616 11.861 679 1HZ LYS 84 HZ1 LYS 84 -8.772 -1.986 9.106 680 2HZ LYS 84 HZ2 LYS 84 -7.821 -0.994 10.093 681 3HZ LYS 84 HZ3 LYS 84 -9.492 -1.068 10.331 682 H VAL 85 HN VAL 85 -5.889 -3.024 5.964 683 HA VAL 85 HA VAL 85 -5.296 -0.252 5.221 684 HB VAL 85 HB VAL 85 -4.256 -0.881 3.124 685 1HG1 VAL 85 HG11 VAL 85 -3.067 -1.102 5.600 686 2HG1 VAL 85 HG12 VAL 85 -2.235 -1.018 4.051 687 3HG1 VAL 85 HG13 VAL 85 -2.583 -2.584 4.780 688 1HG2 VAL 85 HG21 VAL 85 -4.412 -3.739 4.052 689 2HG2 VAL 85 HG22 VAL 85 -3.763 -3.147 2.524 690 3HG2 VAL 85 HG23 VAL 85 -5.490 -3.024 2.856 691 H GLU 86 HN GLU 86 -6.444 0.514 3.352 692 HA GLU 86 HA GLU 86 -8.877 -1.040 2.789 693 1HB GLU 86 HB2 GLU 86 -8.444 1.946 2.632 694 2HB GLU 86 HB1 GLU 86 -9.948 1.114 2.261 695 1HG GLU 86 HG2 GLU 86 -10.090 0.346 4.578 696 2HG GLU 86 HG1 GLU 86 -8.587 1.190 4.946 697 H VAL 87 HN VAL 87 -8.869 -1.975 0.844 698 HA VAL 87 HA VAL 87 -7.245 -0.887 -1.320 699 HB VAL 87 HB VAL 87 -8.907 -3.407 -1.331 700 1HG1 VAL 87 HG11 VAL 87 -8.398 -3.286 -3.508 701 2HG1 VAL 87 HG12 VAL 87 -6.800 -3.828 -2.997 702 3HG1 VAL 87 HG13 VAL 87 -7.109 -2.110 -3.246 703 1HG2 VAL 87 HG21 VAL 87 -7.145 -3.290 0.492 704 2HG2 VAL 87 HG22 VAL 87 -5.952 -3.290 -0.807 705 3HG2 VAL 87 HG23 VAL 87 -7.050 -4.657 -0.618 706 H LEU 88 HN LEU 88 -8.186 0.665 -2.505 707 HA LEU 88 HA LEU 88 -10.903 0.164 -3.480 708 1HB LEU 88 HB2 LEU 88 -11.499 2.500 -3.240 709 2HB LEU 88 HB1 LEU 88 -11.066 1.810 -1.690 710 HG LEU 88 HG LEU 88 -9.187 3.492 -3.343 711 1HD1 LEU 88 HD11 LEU 88 -11.347 4.225 -1.468 712 2HD1 LEU 88 HD12 LEU 88 -10.644 5.136 -2.805 713 3HD1 LEU 88 HD13 LEU 88 -9.806 5.056 -1.255 714 1HD2 LEU 88 HD21 LEU 88 -8.406 3.696 -0.758 715 2HD2 LEU 88 HD22 LEU 88 -7.744 2.530 -1.904 716 3HD2 LEU 88 HD23 LEU 88 -9.019 2.043 -0.790 717 H ASP 89 HN ASP 89 -10.932 2.701 -4.967 718 HA ASP 89 HA ASP 89 -10.310 3.551 -6.974 719 1HB ASP 89 HB2 ASP 89 -8.064 3.690 -5.871 720 2HB ASP 89 HB1 ASP 89 -7.679 2.118 -6.560 721 H THR 90 HN THR 90 -8.124 1.267 -8.190 722 HA THR 90 HA THR 90 -10.249 -0.477 -9.191 723 HB THR 90 HB THR 90 -8.265 0.934 -10.983 724 HG1 THR 90 HG1 THR 90 -9.866 2.217 -11.524 725 1HG2 THR 90 HG21 THR 90 -10.363 -1.125 -11.574 726 2HG2 THR 90 HG22 THR 90 -8.645 -1.165 -11.971 727 3HG2 THR 90 HG23 THR 90 -9.716 -0.035 -12.800 728 H ASP 91 HN ASP 91 -9.393 -2.140 -7.933 729 HA ASP 91 HA ASP 91 -6.637 -2.960 -8.419 730 1HB ASP 91 HB2 ASP 91 -7.079 -4.640 -6.646 731 2HB ASP 91 HB1 ASP 91 -7.389 -2.991 -6.110 732 H TYR 92 HN TYR 92 -8.555 -3.151 -10.583 733 HA TYR 92 HA TYR 92 -8.837 -6.060 -10.859 734 1HB TYR 92 HB2 TYR 92 -10.256 -3.770 -12.204 735 2HB TYR 92 HB1 TYR 92 -10.350 -5.418 -12.810 736 HD1 TYR 92 HD1 TYR 92 -10.423 -4.117 -9.308 737 HD2 TYR 92 HD2 TYR 92 -12.509 -6.144 -12.411 738 HE1 TYR 92 HE1 TYR 92 -12.262 -4.590 -7.751 739 HE2 TYR 92 HE2 TYR 92 -14.358 -6.620 -10.864 740 HH TYR 92 HH TYR 92 -14.649 -5.115 -7.829 741 H LYS 93 HN LYS 93 -8.633 -3.621 -13.437 742 HA LYS 93 HA LYS 93 -6.095 -4.779 -14.297 743 1HB LYS 93 HB2 LYS 93 -7.133 -4.689 -16.706 744 2HB LYS 93 HB1 LYS 93 -7.350 -6.096 -15.678 745 1HG LYS 93 HG2 LYS 93 -9.412 -5.504 -16.802 746 2HG LYS 93 HG1 LYS 93 -9.572 -5.311 -15.058 747 1HD LYS 93 HD2 LYS 93 -9.299 -2.907 -15.275 748 2HD LYS 93 HD1 LYS 93 -9.034 -3.075 -17.013 749 1HE LYS 93 HE2 LYS 93 -11.285 -3.969 -17.282 750 2HE LYS 93 HE1 LYS 93 -11.550 -3.859 -15.543 751 1HZ LYS 93 HZ1 LYS 93 -11.855 -1.638 -15.639 752 2HZ LYS 93 HZ2 LYS 93 -12.313 -1.980 -17.230 753 3HZ LYS 93 HZ3 LYS 93 -10.755 -1.408 -16.904 754 H SER 94 HN SER 94 -5.584 -2.579 -13.355 755 HA SER 94 HA SER 94 -4.858 -0.847 -15.431 756 1HB SER 94 HB2 SER 94 -6.277 1.130 -14.818 757 2HB SER 94 HB1 SER 94 -7.178 -0.191 -15.561 758 HG SER 94 HG SER 94 -7.846 0.931 -13.398 759 H TYR 95 HN TYR 95 -6.075 0.175 -12.270 760 HA TYR 95 HA TYR 95 -3.500 0.069 -11.016 761 1HB TYR 95 HB2 TYR 95 -3.601 2.646 -10.580 762 2HB TYR 95 HB1 TYR 95 -2.892 2.042 -12.072 763 HD1 TYR 95 HD1 TYR 95 -3.445 3.192 -13.969 764 HD2 TYR 95 HD2 TYR 95 -6.305 3.007 -10.826 765 HE1 TYR 95 HE1 TYR 95 -4.968 4.608 -15.278 766 HE2 TYR 95 HE2 TYR 95 -7.839 4.418 -12.129 767 HH TYR 95 HH TYR 95 -8.140 4.895 -14.738 768 H ALA 96 HN ALA 96 -3.682 0.018 -8.835 769 HA ALA 96 HA ALA 96 -6.316 0.715 -7.709 770 1HB ALA 96 HB1 ALA 96 -5.087 -1.327 -6.143 771 2HB ALA 96 HB2 ALA 96 -5.111 -1.836 -7.832 772 3HB ALA 96 HB3 ALA 96 -6.610 -1.377 -7.029 773 H VAL 97 HN VAL 97 -6.361 1.367 -5.521 774 HA VAL 97 HA VAL 97 -3.771 2.323 -4.503 775 HB VAL 97 HB VAL 97 -4.719 4.338 -3.750 776 1HG1 VAL 97 HG11 VAL 97 -4.426 4.843 -5.941 777 2HG1 VAL 97 HG12 VAL 97 -6.172 5.047 -5.874 778 3HG1 VAL 97 HG13 VAL 97 -5.483 3.550 -6.500 779 1HG2 VAL 97 HG21 VAL 97 -7.324 4.625 -4.235 780 2HG2 VAL 97 HG22 VAL 97 -6.706 3.990 -2.711 781 3HG2 VAL 97 HG23 VAL 97 -7.291 2.883 -3.955 782 H ILE 98 HN ILE 98 -3.348 1.960 -2.353 783 HA ILE 98 HA ILE 98 -5.491 0.716 -0.771 784 HB ILE 98 HB ILE 98 -4.192 -1.101 -1.623 785 1HG1 ILE 98 HG12 ILE 98 -3.270 -2.084 0.474 786 2HG1 ILE 98 HG11 ILE 98 -3.473 -0.518 1.253 787 1HG2 ILE 98 HG21 ILE 98 -1.632 -0.652 -0.433 788 2HG2 ILE 98 HG22 ILE 98 -2.045 0.690 -1.498 789 3HG2 ILE 98 HG23 ILE 98 -2.048 -0.959 -2.118 790 1HD1 ILE 98 HD11 ILE 98 -5.929 -1.257 0.028 791 2HD1 ILE 98 HD12 ILE 98 -5.568 -1.023 1.737 792 3HD1 ILE 98 HD13 ILE 98 -5.338 -2.605 0.994 793 H TYR 99 HN TYR 99 -5.847 2.095 0.833 794 HA TYR 99 HA TYR 99 -3.730 3.689 1.997 795 1HB TYR 99 HB2 TYR 99 -5.900 4.738 1.727 796 2HB TYR 99 HB1 TYR 99 -6.683 3.439 2.619 797 HD1 TYR 99 HD1 TYR 99 -7.610 4.446 4.491 798 HD2 TYR 99 HD2 TYR 99 -3.592 5.359 3.446 799 HE1 TYR 99 HE1 TYR 99 -7.356 5.712 6.582 800 HE2 TYR 99 HE2 TYR 99 -3.327 6.627 5.533 801 HH TYR 99 HH TYR 99 -5.277 7.888 7.176 802 H ALA 100 HN ALA 100 -2.560 3.099 3.734 803 HA ALA 100 HA ALA 100 -3.458 0.729 5.212 804 1HB ALA 100 HB1 ALA 100 -1.074 1.150 4.024 805 2HB ALA 100 HB2 ALA 100 -1.323 0.059 5.387 806 3HB ALA 100 HB3 ALA 100 -0.723 1.689 5.664 807 H THR 101 HN THR 101 -3.951 0.771 7.272 808 HA THR 101 HA THR 101 -3.237 3.101 8.909 809 HB THR 101 HB THR 101 -5.463 2.995 9.984 810 HG1 THR 101 HG1 THR 101 -6.158 0.954 9.620 811 1HG2 THR 101 HG21 THR 101 -4.952 3.986 7.399 812 2HG2 THR 101 HG22 THR 101 -6.166 4.524 8.560 813 3HG2 THR 101 HG23 THR 101 -6.565 3.274 7.380 814 H ARG 102 HN ARG 102 -2.368 2.557 10.836 815 HA ARG 102 HA ARG 102 -2.266 -0.292 11.473 816 1HB ARG 102 HB2 ARG 102 -0.622 1.912 12.713 817 2HB ARG 102 HB1 ARG 102 -0.315 0.185 12.785 818 1HG ARG 102 HG2 ARG 102 -0.191 1.886 10.302 819 2HG ARG 102 HG1 ARG 102 1.193 1.317 11.234 820 1HD ARG 102 HD2 ARG 102 0.583 -0.994 10.744 821 2HD ARG 102 HD1 ARG 102 -0.830 -0.441 9.846 822 HE ARG 102 HE ARG 102 0.534 -0.134 8.053 823 1HH1 ARG 102 HH11 ARG 102 2.508 -0.026 10.932 824 2HH1 ARG 102 HH12 ARG 102 3.987 0.195 10.058 825 1HH2 ARG 102 HH21 ARG 102 2.482 0.140 6.907 826 2HH2 ARG 102 HH22 ARG 102 3.972 0.290 7.776 827 H VAL 103 HN VAL 103 -2.864 -1.158 13.422 828 HA VAL 103 HA VAL 103 -3.967 0.633 15.450 829 HB VAL 103 HB VAL 103 -5.907 0.013 14.134 830 1HG1 VAL 103 HG11 VAL 103 -5.050 -2.819 14.677 831 2HG1 VAL 103 HG12 VAL 103 -5.193 -2.018 13.113 832 3HG1 VAL 103 HG13 VAL 103 -6.638 -2.367 14.060 833 1HG2 VAL 103 HG21 VAL 103 -5.780 -0.017 16.784 834 2HG2 VAL 103 HG22 VAL 103 -6.255 -1.697 16.532 835 3HG2 VAL 103 HG23 VAL 103 -7.266 -0.392 15.911 836 H LYS 104 HN LYS 104 -3.238 0.149 17.378 837 HA LYS 104 HA LYS 104 -2.896 -2.579 18.266 838 1HB LYS 104 HB2 LYS 104 -0.801 -2.202 17.048 839 2HB LYS 104 HB1 LYS 104 -0.499 -0.753 17.997 840 1HG LYS 104 HG2 LYS 104 -0.394 -2.158 20.028 841 2HG LYS 104 HG1 LYS 104 -0.579 -3.585 19.008 842 1HD LYS 104 HD2 LYS 104 1.474 -2.994 17.810 843 2HD LYS 104 HD1 LYS 104 1.658 -1.565 18.829 844 1HE LYS 104 HE2 LYS 104 1.850 -2.991 20.800 845 2HE LYS 104 HE1 LYS 104 1.641 -4.422 19.792 846 1HZ LYS 104 HZ1 LYS 104 3.732 -4.262 18.966 847 2HZ LYS 104 HZ2 LYS 104 4.012 -3.527 20.463 848 3HZ LYS 104 HZ3 LYS 104 3.791 -2.575 19.082 849 H ASP 105 HN ASP 105 -3.133 -2.741 20.436 850 HA ASP 105 HA ASP 105 -3.902 -2.059 22.485 851 1HB ASP 105 HB2 ASP 105 -2.232 -0.870 23.798 852 2HB ASP 105 HB1 ASP 105 -1.453 -2.070 22.774 853 H GLY 106 HN GLY 106 -5.104 -0.585 20.362 854 1HA GLY 106 HA2 GLY 106 -6.605 1.157 20.234 855 2HA GLY 106 HA1 GLY 106 -6.173 1.589 21.880 856 H ARG 107 HN ARG 107 -4.296 1.471 18.844 857 HA ARG 107 HA ARG 107 -3.858 4.367 19.082 858 1HB ARG 107 HB2 ARG 107 -1.515 4.200 18.776 859 2HB ARG 107 HB1 ARG 107 -1.910 3.036 20.029 860 1HG ARG 107 HG2 ARG 107 -1.962 1.300 18.161 861 2HG ARG 107 HG1 ARG 107 -1.175 2.526 17.171 862 1HD ARG 107 HD2 ARG 107 -0.149 1.459 19.797 863 2HD ARG 107 HD1 ARG 107 0.448 1.009 18.202 864 HE ARG 107 HE ARG 107 0.622 3.783 18.431 865 1HH1 ARG 107 HH11 ARG 107 2.032 0.932 19.875 866 2HH1 ARG 107 HH12 ARG 107 3.536 1.708 20.239 867 1HH2 ARG 107 HH21 ARG 107 2.599 4.803 18.905 868 2HH2 ARG 107 HH22 ARG 107 3.859 3.909 19.688 869 H THR 108 HN THR 108 -3.969 5.437 17.171 870 HA THR 108 HA THR 108 -4.371 3.782 14.774 871 HB THR 108 HB THR 108 -5.372 6.567 15.379 872 HG1 THR 108 HG1 THR 108 -6.403 4.849 16.533 873 1HG2 THR 108 HG21 THR 108 -6.589 6.542 13.390 874 2HG2 THR 108 HG22 THR 108 -6.281 4.827 13.118 875 3HG2 THR 108 HG23 THR 108 -4.975 5.996 12.932 876 H LEU 109 HN LEU 109 -3.380 4.231 12.866 877 HA LEU 109 HA LEU 109 -1.487 6.467 12.731 878 1HB LEU 109 HB2 LEU 109 -0.817 3.628 11.937 879 2HB LEU 109 HB1 LEU 109 0.222 5.024 11.739 880 HG LEU 109 HG LEU 109 1.011 3.790 13.618 881 1HD1 LEU 109 HD11 LEU 109 1.408 5.621 14.804 882 2HD1 LEU 109 HD12 LEU 109 -0.284 5.775 15.274 883 3HD1 LEU 109 HD13 LEU 109 0.272 6.454 13.744 884 1HD2 LEU 109 HD21 LEU 109 -1.238 4.053 15.411 885 2HD2 LEU 109 HD22 LEU 109 -0.286 2.628 14.998 886 3HD2 LEU 109 HD23 LEU 109 -1.655 3.095 13.991 887 H HIS 110 HN HIS 110 -1.210 7.303 10.614 888 HA HIS 110 HA HIS 110 -3.020 6.105 8.613 889 1HB HIS 110 HB2 HIS 110 -2.411 9.033 9.023 890 2HB HIS 110 HB1 HIS 110 -3.503 8.362 7.817 891 HD1 HIS 110 HD1 HIS 110 -3.192 7.971 11.599 892 HD2 HIS 110 HD2 HIS 110 -6.053 8.695 8.673 893 HE1 HIS 110 HE1 HIS 110 -5.377 8.153 12.825 894 HE2 HIS 110 HE2 HIS 110 -7.088 8.637 11.041 895 H MET 111 HN MET 111 -2.149 5.507 6.769 896 HA MET 111 HA MET 111 -0.068 6.990 5.475 897 1HB MET 111 HB2 MET 111 1.599 5.243 5.397 898 2HB MET 111 HB1 MET 111 1.241 5.634 7.073 899 1HG MET 111 HG2 MET 111 -0.035 3.651 7.349 900 2HG MET 111 HG1 MET 111 0.023 3.312 5.618 901 1HE MET 111 HE1 MET 111 2.133 3.236 4.359 902 2HE MET 111 HE2 MET 111 3.451 2.168 4.847 903 3HE MET 111 HE3 MET 111 3.541 3.896 5.192 904 H MET 112 HN MET 112 -0.424 6.853 3.334 905 HA MET 112 HA MET 112 -2.259 4.793 2.396 906 1HB MET 112 HB2 MET 112 -1.474 7.464 1.366 907 2HB MET 112 HB1 MET 112 -2.030 6.271 0.219 908 1HG MET 112 HG2 MET 112 -4.106 6.030 1.497 909 2HG MET 112 HG1 MET 112 -3.546 7.284 2.602 910 1HE MET 112 HE1 MET 112 -6.420 7.394 0.543 911 2HE MET 112 HE2 MET 112 -6.335 9.142 0.764 912 3HE MET 112 HE3 MET 112 -5.928 8.064 2.099 913 H ARG 113 HN ARG 113 -1.959 3.799 0.347 914 HA ARG 113 HA ARG 113 0.749 3.575 -0.665 915 1HB ARG 113 HB2 ARG 113 0.375 1.858 1.202 916 2HB ARG 113 HB1 ARG 113 -0.765 1.084 0.110 917 1HG ARG 113 HG2 ARG 113 1.027 0.802 -1.539 918 2HG ARG 113 HG1 ARG 113 2.164 1.535 -0.404 919 1HD ARG 113 HD2 ARG 113 1.509 -0.266 1.235 920 2HD ARG 113 HD1 ARG 113 0.649 -1.047 -0.091 921 HE ARG 113 HE ARG 113 2.648 -1.834 -0.826 922 1HH1 ARG 113 HH11 ARG 113 3.252 0.982 1.146 923 2HH1 ARG 113 HH12 ARG 113 4.974 0.846 1.033 924 1HH2 ARG 113 HH21 ARG 113 4.909 -2.019 -0.972 925 2HH2 ARG 113 HH22 ARG 113 5.917 -0.860 -0.172 926 H LEU 114 HN LEU 114 0.760 2.853 -2.844 927 HA LEU 114 HA LEU 114 -1.833 2.240 -4.055 928 1HB LEU 114 HB2 LEU 114 -1.470 4.726 -4.028 929 2HB LEU 114 HB1 LEU 114 -0.067 4.477 -5.045 930 HG LEU 114 HG LEU 114 -2.895 3.754 -5.818 931 1HD1 LEU 114 HD11 LEU 114 -2.416 5.717 -7.454 932 2HD1 LEU 114 HD12 LEU 114 -1.235 6.202 -6.238 933 3HD1 LEU 114 HD13 LEU 114 -2.938 6.063 -5.805 934 1HD2 LEU 114 HD21 LEU 114 -1.685 2.416 -7.207 935 2HD2 LEU 114 HD22 LEU 114 -0.247 3.434 -7.119 936 3HD2 LEU 114 HD23 LEU 114 -1.609 3.915 -8.132 937 H TYR 115 HN TYR 115 -1.638 0.669 -5.506 938 HA TYR 115 HA TYR 115 0.978 0.255 -6.783 939 1HB TYR 115 HB2 TYR 115 0.527 -2.180 -6.714 940 2HB TYR 115 HB1 TYR 115 0.630 -1.469 -5.107 941 HD1 TYR 115 HD1 TYR 115 -1.791 -2.605 -7.687 942 HD2 TYR 115 HD2 TYR 115 -1.132 -1.708 -3.584 943 HE1 TYR 115 HE1 TYR 115 -4.004 -3.523 -7.139 944 HE2 TYR 115 HE2 TYR 115 -3.344 -2.625 -3.020 945 HH TYR 115 HH TYR 115 -5.387 -4.150 -5.474 946 H SER 116 HN SER 116 0.966 0.278 -8.938 947 HA SER 116 HA SER 116 -1.605 0.310 -10.323 948 1HB SER 116 HB2 SER 116 -0.052 2.122 -10.838 949 2HB SER 116 HB1 SER 116 1.183 0.957 -11.316 950 HG SER 116 HG SER 116 -1.345 0.966 -12.562 951 H ARG 117 HN ARG 117 -2.246 -1.174 -11.806 952 HA ARG 117 HA ARG 117 -1.256 -3.790 -11.677 953 1HB ARG 117 HB2 ARG 117 -3.565 -2.962 -12.439 954 2HB ARG 117 HB1 ARG 117 -2.819 -2.701 -14.005 955 1HG ARG 117 HG2 ARG 117 -3.950 -4.823 -13.987 956 2HG ARG 117 HG1 ARG 117 -2.208 -5.077 -14.095 957 1HD ARG 117 HD2 ARG 117 -3.385 -6.612 -12.511 958 2HD ARG 117 HD1 ARG 117 -2.072 -5.678 -11.795 959 HE ARG 117 HE ARG 117 -4.320 -4.191 -11.331 960 1HH1 ARG 117 HH11 ARG 117 -3.388 -7.475 -10.645 961 2HH1 ARG 117 HH12 ARG 117 -4.266 -7.546 -9.156 962 1HH2 ARG 117 HH21 ARG 117 -5.451 -4.265 -9.353 963 2HH2 ARG 117 HH22 ARG 117 -5.428 -5.720 -8.413 964 H SER 118 HN SER 118 -0.721 -1.197 -13.995 965 HA SER 118 HA SER 118 1.617 -2.637 -15.008 966 1HB SER 118 HB2 SER 118 -0.480 -1.318 -16.752 967 2HB SER 118 HB1 SER 118 1.046 -1.990 -17.327 968 HG SER 118 HG SER 118 0.346 -4.017 -16.825 969 HA PRO 119 HA PRO 119 4.072 0.994 -14.705 970 1HB PRO 119 HB2 PRO 119 4.266 0.907 -17.692 971 2HB PRO 119 HB1 PRO 119 5.544 1.116 -16.490 972 1HG PRO 119 HG2 PRO 119 5.163 -1.237 -17.681 973 2HG PRO 119 HG1 PRO 119 5.607 -1.139 -15.967 974 1HD PRO 119 HD2 PRO 119 3.008 -1.841 -17.209 975 2HD PRO 119 HD1 PRO 119 3.684 -2.335 -15.646 976 H GLU 120 HN GLU 120 1.531 0.956 -17.128 977 HA GLU 120 HA GLU 120 1.455 3.708 -17.709 978 1HB GLU 120 HB2 GLU 120 0.411 2.018 -19.127 979 2HB GLU 120 HB1 GLU 120 -0.736 1.634 -17.854 980 1HG GLU 120 HG2 GLU 120 -1.732 3.008 -19.597 981 2HG GLU 120 HG1 GLU 120 -1.731 3.830 -18.040 982 H VAL 121 HN VAL 121 1.782 4.166 -15.215 983 HA VAL 121 HA VAL 121 -0.593 4.153 -13.614 984 HB VAL 121 HB VAL 121 1.975 5.695 -13.197 985 1HG1 VAL 121 HG11 VAL 121 0.227 6.702 -11.905 986 2HG1 VAL 121 HG12 VAL 121 1.220 5.736 -10.814 987 3HG1 VAL 121 HG13 VAL 121 -0.344 5.127 -11.354 988 1HG2 VAL 121 HG21 VAL 121 2.006 3.709 -11.367 989 2HG2 VAL 121 HG22 VAL 121 2.785 3.604 -12.945 990 3HG2 VAL 121 HG23 VAL 121 1.185 2.902 -12.703 991 H SER 122 HN SER 122 -2.174 5.234 -14.777 992 HA SER 122 HA SER 122 -1.904 7.742 -15.998 993 1HB SER 122 HB2 SER 122 -3.767 6.245 -16.494 994 2HB SER 122 HB1 SER 122 -4.372 6.425 -14.848 995 HG SER 122 HG SER 122 -5.510 7.831 -16.119 996 HA PRO 123 HA PRO 123 -1.782 10.795 -12.816 997 1HB PRO 123 HB2 PRO 123 -3.761 12.504 -13.828 998 2HB PRO 123 HB1 PRO 123 -2.039 12.564 -14.223 999 1HG PRO 123 HG2 PRO 123 -4.290 11.312 -15.730 1000 2HG PRO 123 HG1 PRO 123 -2.862 12.164 -16.346 1001 1HD PRO 123 HD2 PRO 123 -3.010 9.506 -16.447 1002 2HD PRO 123 HD1 PRO 123 -1.480 10.315 -16.046 1003 H ALA 124 HN ALA 124 -4.897 9.526 -13.880 1004 HA ALA 124 HA ALA 124 -6.482 10.504 -11.787 1005 1HB ALA 124 HB1 ALA 124 -8.092 9.472 -12.922 1006 2HB ALA 124 HB2 ALA 124 -7.372 7.896 -12.597 1007 3HB ALA 124 HB3 ALA 124 -6.860 8.826 -14.004 1008 H ALA 125 HN ALA 125 -4.930 7.330 -12.149 1009 HA ALA 125 HA ALA 125 -5.681 6.198 -9.750 1010 1HB ALA 125 HB1 ALA 125 -4.081 5.469 -11.837 1011 2HB ALA 125 HB2 ALA 125 -4.322 4.532 -10.362 1012 3HB ALA 125 HB3 ALA 125 -2.924 5.597 -10.511 1013 H THR 126 HN THR 126 -2.769 8.124 -10.425 1014 HA THR 126 HA THR 126 -1.927 8.075 -7.686 1015 HB THR 126 HB THR 126 -1.016 9.795 -9.984 1016 HG1 THR 126 HG1 THR 126 0.074 7.417 -8.892 1017 1HG2 THR 126 HG21 THR 126 0.067 9.430 -7.224 1018 2HG2 THR 126 HG22 THR 126 -0.168 10.912 -8.152 1019 3HG2 THR 126 HG23 THR 126 1.135 9.803 -8.577 1020 H ALA 127 HN ALA 127 -3.322 10.604 -9.784 1021 HA ALA 127 HA ALA 127 -3.372 12.590 -7.763 1022 1HB ALA 127 HB1 ALA 127 -3.479 12.916 -10.288 1023 2HB ALA 127 HB2 ALA 127 -4.500 13.955 -9.293 1024 3HB ALA 127 HB3 ALA 127 -5.200 12.570 -10.138 1025 H ILE 128 HN ILE 128 -5.952 10.473 -9.045 1026 HA ILE 128 HA ILE 128 -7.989 11.492 -7.424 1027 HB ILE 128 HB ILE 128 -7.743 8.687 -8.523 1028 1HG1 ILE 128 HG12 ILE 128 -9.288 11.076 -9.555 1029 2HG1 ILE 128 HG11 ILE 128 -7.753 10.522 -10.209 1030 1HG2 ILE 128 HG21 ILE 128 -10.136 10.132 -7.390 1031 2HG2 ILE 128 HG22 ILE 128 -9.315 8.747 -6.673 1032 3HG2 ILE 128 HG23 ILE 128 -10.179 8.566 -8.200 1033 1HD1 ILE 128 HD11 ILE 128 -9.694 9.797 -11.532 1034 2HD1 ILE 128 HD12 ILE 128 -10.277 8.886 -10.138 1035 3HD1 ILE 128 HD13 ILE 128 -8.749 8.449 -10.904 1036 H PHE 129 HN PHE 129 -5.692 8.834 -6.830 1037 HA PHE 129 HA PHE 129 -6.776 7.998 -4.381 1038 1HB PHE 129 HB2 PHE 129 -4.978 6.778 -5.605 1039 2HB PHE 129 HB1 PHE 129 -3.850 8.050 -5.162 1040 HD1 PHE 129 HD1 PHE 129 -6.456 6.721 -2.921 1041 HD2 PHE 129 HD2 PHE 129 -2.324 6.695 -3.942 1042 HE1 PHE 129 HE1 PHE 129 -5.950 5.533 -0.828 1043 HE2 PHE 129 HE2 PHE 129 -1.811 5.507 -1.849 1044 HZ PHE 129 HZ PHE 129 -3.626 4.926 -0.289 1045 H ARG 130 HN ARG 130 -4.274 10.397 -5.122 1046 HA ARG 130 HA ARG 130 -3.931 11.305 -2.464 1047 1HB ARG 130 HB2 ARG 130 -2.257 11.763 -4.192 1048 2HB ARG 130 HB1 ARG 130 -3.425 12.715 -5.098 1049 1HG ARG 130 HG2 ARG 130 -3.512 14.354 -3.314 1050 2HG ARG 130 HG1 ARG 130 -2.399 13.388 -2.347 1051 1HD ARG 130 HD2 ARG 130 -1.222 15.231 -3.414 1052 2HD ARG 130 HD1 ARG 130 -0.663 13.691 -4.058 1053 HE ARG 130 HE ARG 130 -2.047 15.780 -5.479 1054 1HH1 ARG 130 HH11 ARG 130 -1.089 12.424 -5.485 1055 2HH1 ARG 130 HH12 ARG 130 -1.398 12.213 -7.174 1056 1HH2 ARG 130 HH21 ARG 130 -2.426 15.507 -7.701 1057 2HH2 ARG 130 HH22 ARG 130 -2.146 13.964 -8.435 1058 H LYS 131 HN LYS 131 -6.116 12.073 -5.079 1059 HA LYS 131 HA LYS 131 -7.234 14.458 -4.128 1060 1HB LYS 131 HB2 LYS 131 -7.634 13.469 -6.400 1061 2HB LYS 131 HB1 LYS 131 -8.673 12.271 -5.646 1062 1HG LYS 131 HG2 LYS 131 -10.217 13.966 -4.937 1063 2HG LYS 131 HG1 LYS 131 -9.144 15.239 -5.520 1064 1HD LYS 131 HD2 LYS 131 -10.958 14.854 -7.096 1065 2HD LYS 131 HD1 LYS 131 -9.410 14.409 -7.813 1066 1HE LYS 131 HE2 LYS 131 -9.862 12.056 -7.307 1067 2HE LYS 131 HE1 LYS 131 -11.415 12.507 -6.604 1068 1HZ LYS 131 HZ1 LYS 131 -12.282 13.052 -8.660 1069 2HZ LYS 131 HZ2 LYS 131 -11.339 11.696 -9.026 1070 3HZ LYS 131 HZ3 LYS 131 -10.764 13.246 -9.383 1071 H LEU 132 HN LEU 132 -8.037 11.065 -3.510 1072 HA LEU 132 HA LEU 132 -10.294 11.393 -1.919 1073 1HB LEU 132 HB2 LEU 132 -8.049 9.389 -1.598 1074 2HB LEU 132 HB1 LEU 132 -9.613 9.271 -0.816 1075 HG LEU 132 HG LEU 132 -9.103 9.134 -3.791 1076 1HD1 LEU 132 HD11 LEU 132 -9.987 7.018 -1.835 1077 2HD1 LEU 132 HD12 LEU 132 -8.380 7.148 -2.550 1078 3HD1 LEU 132 HD13 LEU 132 -9.777 6.810 -3.573 1079 1HD2 LEU 132 HD21 LEU 132 -11.235 10.172 -3.422 1080 2HD2 LEU 132 HD22 LEU 132 -11.660 8.971 -2.202 1081 3HD2 LEU 132 HD23 LEU 132 -11.509 8.495 -3.893 1082 H ALA 133 HN ALA 133 -6.862 11.514 -1.135 1083 HA ALA 133 HA ALA 133 -7.197 12.084 1.637 1084 1HB ALA 133 HB1 ALA 133 -5.059 11.382 1.330 1085 2HB ALA 133 HB2 ALA 133 -4.762 13.108 1.129 1086 3HB ALA 133 HB3 ALA 133 -4.947 12.073 -0.288 1087 H GLY 134 HN GLY 134 -6.978 13.975 -1.309 1088 1HA GLY 134 HA2 GLY 134 -6.695 16.526 -0.142 1089 2HA GLY 134 HA1 GLY 134 -7.332 16.198 -1.746 1090 H GLU 135 HN GLU 135 -9.559 14.623 -1.006 1091 HA GLU 135 HA GLU 135 -11.599 16.399 -0.750 1092 1HB GLU 135 HB2 GLU 135 -11.551 13.634 0.477 1093 2HB GLU 135 HB1 GLU 135 -12.997 14.564 0.107 1094 1HG GLU 135 HG2 GLU 135 -11.016 13.415 -1.838 1095 2HG GLU 135 HG1 GLU 135 -12.695 12.939 -1.598 1096 H ARG 136 HN ARG 136 -9.926 14.759 1.895 1097 HA ARG 136 HA ARG 136 -11.281 16.395 3.884 1098 1HB ARG 136 HB2 ARG 136 -9.151 14.263 4.217 1099 2HB ARG 136 HB1 ARG 136 -10.019 15.054 5.526 1100 1HG ARG 136 HG2 ARG 136 -12.104 14.084 4.770 1101 2HG ARG 136 HG1 ARG 136 -11.281 13.340 3.399 1102 1HD ARG 136 HD2 ARG 136 -10.676 12.780 6.303 1103 2HD ARG 136 HD1 ARG 136 -11.673 11.765 5.263 1104 HE ARG 136 HE ARG 136 -8.852 11.771 5.402 1105 1HH1 ARG 136 HH11 ARG 136 -11.472 11.474 3.112 1106 2HH1 ARG 136 HH12 ARG 136 -10.538 10.562 1.976 1107 1HH2 ARG 136 HH21 ARG 136 -7.630 10.561 3.909 1108 2HH2 ARG 136 HH22 ARG 136 -8.362 10.040 2.428 1109 H ASN 137 HN ASN 137 -9.938 18.007 2.217 1110 HA ASN 137 HA ASN 137 -8.476 19.743 2.167 1111 1HB ASN 137 HB2 ASN 137 -9.080 20.053 4.540 1112 2HB ASN 137 HB1 ASN 137 -7.826 18.909 5.005 1113 1HD2 ASN 137 HD21 ASN 137 -6.116 19.869 5.792 1114 2HD2 ASN 137 HD22 ASN 137 -5.459 21.382 5.278 1115 H TYR 138 HN TYR 138 -6.631 19.739 1.034 1116 HA TYR 138 HA TYR 138 -5.007 17.456 0.771 1117 1HB TYR 138 HB2 TYR 138 -5.221 19.220 -0.961 1118 2HB TYR 138 HB1 TYR 138 -4.309 20.317 0.072 1119 HD1 TYR 138 HD1 TYR 138 -2.334 20.712 -1.110 1120 HD2 TYR 138 HD2 TYR 138 -3.702 16.712 -0.631 1121 HE1 TYR 138 HE1 TYR 138 -0.236 19.882 -2.088 1122 HE2 TYR 138 HE2 TYR 138 -1.610 15.872 -1.608 1123 HH TYR 138 HH TYR 138 1.002 17.168 -1.749 1124 H THR 139 HN THR 139 -4.543 16.948 2.979 1125 HA THR 139 HA THR 139 -2.682 18.709 4.374 1126 HB THR 139 HB THR 139 -4.530 17.872 5.678 1127 HG1 THR 139 HG1 THR 139 -2.619 18.012 6.832 1128 1HG2 THR 139 HG21 THR 139 -3.613 15.152 4.799 1129 2HG2 THR 139 HG22 THR 139 -5.207 15.883 4.619 1130 3HG2 THR 139 HG23 THR 139 -4.630 15.409 6.217 1131 H ASP 140 HN ASP 140 -0.580 18.259 4.753 1132 HA ASP 140 HA ASP 140 0.760 16.305 3.220 1133 1HB ASP 140 HB2 ASP 140 1.890 18.325 4.133 1134 2HB ASP 140 HB1 ASP 140 1.714 17.668 5.757 1135 H GLU 141 HN GLU 141 -0.863 16.292 6.264 1136 HA GLU 141 HA GLU 141 0.267 14.052 7.492 1137 1HB GLU 141 HB2 GLU 141 -1.295 15.605 8.603 1138 2HB GLU 141 HB1 GLU 141 -2.597 15.000 7.594 1139 1HG GLU 141 HG2 GLU 141 -2.257 12.751 8.570 1140 2HG GLU 141 HG1 GLU 141 -1.056 13.447 9.652 1141 H MET 142 HN MET 142 -1.477 14.291 4.605 1142 HA MET 142 HA MET 142 -1.751 11.395 4.479 1143 1HB MET 142 HB2 MET 142 -3.905 13.329 3.592 1144 2HB MET 142 HB1 MET 142 -3.925 11.587 3.343 1145 1HG MET 142 HG2 MET 142 -3.994 11.218 5.730 1146 2HG MET 142 HG1 MET 142 -3.916 12.956 6.016 1147 1HE MET 142 HE1 MET 142 -5.644 12.226 7.566 1148 2HE MET 142 HE2 MET 142 -6.880 11.062 7.090 1149 3HE MET 142 HE3 MET 142 -7.280 12.776 7.205 1150 H VAL 143 HN VAL 143 0.349 12.676 3.536 1151 HA VAL 143 HA VAL 143 0.013 12.451 0.637 1152 HB VAL 143 HB VAL 143 1.474 14.758 1.949 1153 1HG1 VAL 143 HG11 VAL 143 1.944 15.505 -0.346 1154 2HG1 VAL 143 HG12 VAL 143 1.173 14.046 -0.969 1155 3HG1 VAL 143 HG13 VAL 143 2.649 13.922 -0.016 1156 1HG2 VAL 143 HG21 VAL 143 -0.602 15.330 -0.046 1157 2HG2 VAL 143 HG22 VAL 143 -0.273 16.111 1.498 1158 3HG2 VAL 143 HG23 VAL 143 -1.209 14.618 1.447 1159 H ALA 144 HN ALA 144 1.747 11.528 -0.396 1160 HA ALA 144 HA ALA 144 4.353 11.427 0.722 1161 1HB ALA 144 HB1 ALA 144 3.469 8.656 0.618 1162 2HB ALA 144 HB2 ALA 144 2.669 9.595 1.876 1163 3HB ALA 144 HB3 ALA 144 4.426 9.497 1.835 1164 H MET 145 HN MET 145 5.829 10.985 -0.807 1165 HA MET 145 HA MET 145 4.959 9.612 -3.252 1166 1HB MET 145 HB2 MET 145 6.243 11.232 -4.607 1167 2HB MET 145 HB1 MET 145 4.898 11.987 -3.766 1168 1HG MET 145 HG2 MET 145 6.497 12.768 -2.034 1169 2HG MET 145 HG1 MET 145 7.808 12.125 -3.022 1170 1HE MET 145 HE1 MET 145 7.723 12.450 -5.493 1171 2HE MET 145 HE2 MET 145 8.179 14.087 -5.967 1172 3HE MET 145 HE3 MET 145 6.545 13.502 -6.279 1173 H LEU 146 HN LEU 146 6.174 7.826 -3.363 1174 HA LEU 146 HA LEU 146 7.983 6.446 -3.343 1175 1HB LEU 146 HB2 LEU 146 9.480 9.066 -3.575 1176 2HB LEU 146 HB1 LEU 146 10.213 7.489 -3.761 1177 HG LEU 146 HG LEU 146 8.755 7.055 -5.715 1178 1HD1 LEU 146 HD11 LEU 146 7.746 9.780 -5.020 1179 2HD1 LEU 146 HD12 LEU 146 6.844 8.325 -5.445 1180 3HD1 LEU 146 HD13 LEU 146 7.719 9.217 -6.690 1181 1HD2 LEU 146 HD21 LEU 146 9.840 8.711 -7.235 1182 2HD2 LEU 146 HD22 LEU 146 10.958 7.874 -6.159 1183 3HD2 LEU 146 HD23 LEU 146 10.470 9.532 -5.808 1184 HA PRO 147 HA PRO 147 9.621 5.498 0.643 1185 1HB PRO 147 HB2 PRO 147 12.290 6.434 -0.367 1186 2HB PRO 147 HB1 PRO 147 11.908 5.022 0.627 1187 1HG PRO 147 HG2 PRO 147 12.308 4.796 -2.003 1188 2HG PRO 147 HG1 PRO 147 11.087 3.820 -1.170 1189 1HD PRO 147 HD2 PRO 147 10.733 6.050 -3.056 1190 2HD PRO 147 HD1 PRO 147 9.590 4.777 -2.595 1191 H ARG 148 HN ARG 148 10.392 6.501 2.635 1192 HA ARG 148 HA ARG 148 10.852 9.392 2.494 1193 1HB ARG 148 HB2 ARG 148 8.660 8.109 4.123 1194 2HB ARG 148 HB1 ARG 148 9.152 9.793 4.253 1195 1HG ARG 148 HG2 ARG 148 8.524 10.156 1.921 1196 2HG ARG 148 HG1 ARG 148 8.021 8.469 1.799 1197 1HD ARG 148 HD2 ARG 148 6.859 10.518 3.679 1198 2HD ARG 148 HD1 ARG 148 6.126 9.979 2.171 1199 HE ARG 148 HE ARG 148 6.629 7.745 3.800 1200 1HH1 ARG 148 HH11 ARG 148 4.553 10.541 3.636 1201 2HH1 ARG 148 HH12 ARG 148 3.258 9.790 4.505 1202 1HH2 ARG 148 HH21 ARG 148 4.929 6.752 4.958 1203 2HH2 ARG 148 HH22 ARG 148 3.474 7.640 5.263 1204 H GLN 149 HN GLN 149 13.006 8.381 3.105 1205 HA GLN 149 HA GLN 149 13.221 8.406 6.028 1206 1HB GLN 149 HB2 GLN 149 14.458 6.378 4.178 1207 2HB GLN 149 HB1 GLN 149 15.122 6.711 5.766 1208 1HG GLN 149 HG2 GLN 149 13.706 4.757 5.823 1209 2HG GLN 149 HG1 GLN 149 13.015 6.053 6.796 1210 1HE2 GLN 149 HE21 GLN 149 10.901 5.999 6.668 1211 2HE2 GLN 149 HE22 GLN 149 9.969 5.733 5.238 1212 H GLU 150 HN GLU 150 15.392 8.966 6.801 1213 HA GLU 150 HA GLU 150 16.423 11.193 5.381 1214 1HB GLU 150 HB2 GLU 150 17.481 9.755 7.816 1215 2HB GLU 150 HB1 GLU 150 18.108 11.284 7.209 1216 1HG GLU 150 HG2 GLU 150 15.322 10.767 8.229 1217 2HG GLU 150 HG1 GLU 150 16.593 11.680 9.044 1218 H GLU 151 HN GLU 151 17.025 7.912 4.983 1219 HA GLU 151 HA GLU 151 19.780 8.282 4.107 1220 1HB GLU 151 HB2 GLU 151 18.066 5.791 4.189 1221 2HB GLU 151 HB1 GLU 151 19.769 5.837 3.762 1222 1HG GLU 151 HG2 GLU 151 18.631 6.635 6.431 1223 2HG GLU 151 HG1 GLU 151 19.380 5.082 6.064 1224 H CYS 152 HN CYS 152 18.532 5.867 2.231 1225 HA CYS 152 HA CYS 152 18.425 7.616 -0.100 1226 1HB CYS 152 HB2 CYS 152 18.268 5.243 -1.257 1227 2HB CYS 152 HB1 CYS 152 19.806 5.860 -0.669 1228 H THR 153 HN THR 153 16.442 8.530 -0.299 1229 HA THR 153 HA THR 153 14.212 6.821 -0.944 1230 HB THR 153 HB THR 153 12.724 7.742 0.808 1231 HG1 THR 153 HG1 THR 153 15.093 8.776 1.954 1232 1HG2 THR 153 HG21 THR 153 15.098 6.568 2.189 1233 2HG2 THR 153 HG22 THR 153 14.033 5.605 1.164 1234 3HG2 THR 153 HG23 THR 153 13.390 6.412 2.592 1235 H VAL 154 HN VAL 154 12.292 9.040 -0.243 1236 HA VAL 154 HA VAL 154 12.358 10.419 -2.713 1237 HB VAL 154 HB VAL 154 10.269 9.914 -1.455 1238 1HG1 VAL 154 HG11 VAL 154 9.600 11.214 0.429 1239 2HG1 VAL 154 HG12 VAL 154 11.022 12.249 0.295 1240 3HG1 VAL 154 HG13 VAL 154 11.200 10.563 0.778 1241 1HG2 VAL 154 HG21 VAL 154 9.285 12.285 -1.762 1242 2HG2 VAL 154 HG22 VAL 154 9.933 11.446 -3.170 1243 3HG2 VAL 154 HG23 VAL 154 10.881 12.698 -2.375 1244 H ASP 155 HN ASP 155 12.643 12.608 -3.147 1245 HA ASP 155 HA ASP 155 14.759 13.877 -1.719 1246 1HB ASP 155 HB2 ASP 155 14.518 14.104 -4.147 1247 2HB ASP 155 HB1 ASP 155 12.967 14.908 -3.931 1248 H GLU 156 HN GLU 156 13.096 13.627 0.282 1249 HA GLU 156 HA GLU 156 12.602 16.215 1.209 1250 1HB GLU 156 HB2 GLU 156 10.138 16.237 1.290 1251 2HB GLU 156 HB1 GLU 156 10.743 16.260 -0.361 1252 1HG GLU 156 HG2 GLU 156 10.280 13.876 -0.571 1253 2HG GLU 156 HG1 GLU 156 9.691 13.840 1.091 1254 H VAL 157 HN VAL 157 12.476 16.183 3.374 1255 HA VAL 157 HA VAL 157 12.696 15.303 5.471 1256 HB VAL 157 HB VAL 157 10.248 15.496 5.250 1257 1HG1 VAL 157 HG11 VAL 157 10.494 12.693 4.211 1258 2HG1 VAL 157 HG12 VAL 157 9.647 14.068 3.502 1259 3HG1 VAL 157 HG13 VAL 157 9.002 13.282 4.943 1260 1HG2 VAL 157 HG21 VAL 157 9.859 14.541 7.268 1261 2HG2 VAL 157 HG22 VAL 157 11.611 14.341 7.236 1262 3HG2 VAL 157 HG23 VAL 157 10.562 12.993 6.797 Start of MODEL 20 1 1H MET 1 HT1 MET 1 -10.963 -14.905 -21.995 2 2H MET 1 HT2 MET 1 -11.302 -15.198 -20.364 3 3H MET 1 HT3 MET 1 -9.701 -15.007 -20.874 4 HA MET 1 HA MET 1 -10.335 -13.002 -19.816 5 1HB MET 1 HB2 MET 1 -8.963 -12.816 -21.836 6 2HB MET 1 HB1 MET 1 -10.411 -12.753 -22.831 7 1HG MET 1 HG2 MET 1 -9.452 -10.547 -22.541 8 2HG MET 1 HG1 MET 1 -11.047 -10.645 -21.798 9 1HE MET 1 HE1 MET 1 -7.166 -10.627 -21.142 10 2HE MET 1 HE2 MET 1 -7.699 -12.132 -20.392 11 3HE MET 1 HE3 MET 1 -7.114 -10.805 -19.388 12 H THR 2 HN THR 2 -12.605 -13.833 -22.419 13 HA THR 2 HA THR 2 -14.461 -11.791 -21.966 14 HB THR 2 HB THR 2 -16.071 -13.250 -23.146 15 HG1 THR 2 HG1 THR 2 -15.766 -15.289 -22.710 16 1HG2 THR 2 HG21 THR 2 -14.394 -13.908 -25.098 17 2HG2 THR 2 HG22 THR 2 -13.353 -12.796 -24.208 18 3HG2 THR 2 HG23 THR 2 -14.918 -12.249 -24.809 19 H VAL 3 HN VAL 3 -14.338 -15.100 -20.679 20 HA VAL 3 HA VAL 3 -16.659 -14.740 -19.041 21 HB VAL 3 HB VAL 3 -16.044 -16.958 -19.878 22 1HG1 VAL 3 HG11 VAL 3 -14.054 -17.961 -19.564 23 2HG1 VAL 3 HG12 VAL 3 -13.884 -17.348 -17.919 24 3HG1 VAL 3 HG13 VAL 3 -13.488 -16.313 -19.290 25 1HG2 VAL 3 HG21 VAL 3 -16.367 -18.206 -17.807 26 2HG2 VAL 3 HG22 VAL 3 -17.395 -16.773 -17.845 27 3HG2 VAL 3 HG23 VAL 3 -15.927 -16.780 -16.868 28 HA PRO 4 HA PRO 4 -14.847 -12.622 -15.585 29 1HB PRO 4 HB2 PRO 4 -16.726 -14.273 -13.977 30 2HB PRO 4 HB1 PRO 4 -16.521 -12.518 -14.018 31 1HG PRO 4 HG2 PRO 4 -18.620 -13.672 -15.182 32 2HG PRO 4 HG1 PRO 4 -17.813 -12.280 -15.928 33 1HD PRO 4 HD2 PRO 4 -17.647 -15.177 -16.643 34 2HD PRO 4 HD1 PRO 4 -17.662 -13.750 -17.700 35 H ASP 5 HN ASP 5 -13.291 -13.002 -14.057 36 HA ASP 5 HA ASP 5 -12.890 -15.634 -12.942 37 1HB ASP 5 HB2 ASP 5 -10.814 -14.442 -14.794 38 2HB ASP 5 HB1 ASP 5 -10.582 -15.874 -13.796 39 H ARG 6 HN ARG 6 -12.190 -15.405 -10.921 40 HA ARG 6 HA ARG 6 -11.546 -12.869 -9.833 41 1HB ARG 6 HB2 ARG 6 -12.612 -14.659 -8.514 42 2HB ARG 6 HB1 ARG 6 -11.148 -15.624 -8.643 43 1HG ARG 6 HG2 ARG 6 -9.915 -13.989 -7.356 44 2HG ARG 6 HG1 ARG 6 -11.331 -12.938 -7.292 45 1HD ARG 6 HD2 ARG 6 -11.133 -15.710 -6.114 46 2HD ARG 6 HD1 ARG 6 -11.040 -14.199 -5.211 47 HE ARG 6 HE ARG 6 -13.435 -14.217 -6.657 48 1HH1 ARG 6 HH11 ARG 6 -11.942 -15.902 -3.988 49 2HH1 ARG 6 HH12 ARG 6 -13.449 -16.272 -3.217 50 1HH2 ARG 6 HH21 ARG 6 -15.416 -14.703 -5.643 51 2HH2 ARG 6 HH22 ARG 6 -15.419 -15.592 -4.156 52 H SER 7 HN SER 7 -9.653 -15.564 -10.989 53 HA SER 7 HA SER 7 -7.171 -15.062 -9.911 54 1HB SER 7 HB2 SER 7 -6.242 -16.183 -11.902 55 2HB SER 7 HB1 SER 7 -7.660 -17.028 -11.284 56 HG SER 7 HG SER 7 -8.748 -16.514 -13.034 57 H GLU 8 HN GLU 8 -8.827 -13.323 -12.460 58 HA GLU 8 HA GLU 8 -6.809 -12.005 -13.754 59 1HB GLU 8 HB2 GLU 8 -8.363 -10.216 -14.207 60 2HB GLU 8 HB1 GLU 8 -9.236 -11.742 -14.240 61 1HG GLU 8 HG2 GLU 8 -9.949 -11.274 -11.884 62 2HG GLU 8 HG1 GLU 8 -9.242 -9.671 -12.062 63 H ILE 9 HN ILE 9 -8.224 -11.180 -10.618 64 HA ILE 9 HA ILE 9 -6.758 -8.826 -10.161 65 HB ILE 9 HB ILE 9 -7.794 -10.775 -8.094 66 1HG1 ILE 9 HG12 ILE 9 -9.583 -10.079 -9.600 67 2HG1 ILE 9 HG11 ILE 9 -9.787 -9.314 -8.028 68 1HG2 ILE 9 HG21 ILE 9 -7.346 -9.260 -6.485 69 2HG2 ILE 9 HG22 ILE 9 -7.679 -7.884 -7.537 70 3HG2 ILE 9 HG23 ILE 9 -6.127 -8.713 -7.636 71 1HD1 ILE 9 HD11 ILE 9 -9.819 -7.323 -8.983 72 2HD1 ILE 9 HD12 ILE 9 -9.681 -8.097 -10.561 73 3HD1 ILE 9 HD13 ILE 9 -8.229 -7.605 -9.691 74 H ALA 10 HN ALA 10 -6.064 -12.220 -9.496 75 HA ALA 10 HA ALA 10 -3.750 -11.873 -7.950 76 1HB ALA 10 HB1 ALA 10 -3.612 -14.119 -7.994 77 2HB ALA 10 HB2 ALA 10 -3.764 -14.197 -9.750 78 3HB ALA 10 HB3 ALA 10 -5.204 -14.016 -8.746 79 H GLY 11 HN GLY 11 -1.723 -11.253 -8.458 80 1HA GLY 11 HA2 GLY 11 -0.251 -11.844 -10.685 81 2HA GLY 11 HA1 GLY 11 -1.156 -10.414 -11.151 82 H LYS 12 HN LYS 12 0.412 -8.905 -11.250 83 HA LYS 12 HA LYS 12 2.066 -8.526 -8.844 84 1HB LYS 12 HB2 LYS 12 3.697 -7.400 -10.304 85 2HB LYS 12 HB1 LYS 12 3.417 -9.069 -10.775 86 1HG LYS 12 HG2 LYS 12 1.969 -8.335 -12.586 87 2HG LYS 12 HG1 LYS 12 2.202 -6.654 -12.101 88 1HD LYS 12 HD2 LYS 12 3.643 -7.232 -13.988 89 2HD LYS 12 HD1 LYS 12 4.598 -6.852 -12.553 90 1HE LYS 12 HE2 LYS 12 4.882 -9.232 -12.101 91 2HE LYS 12 HE1 LYS 12 3.901 -9.627 -13.512 92 1HZ LYS 12 HZ1 LYS 12 6.416 -9.693 -13.765 93 2HZ LYS 12 HZ2 LYS 12 6.359 -8.003 -13.749 94 3HZ LYS 12 HZ3 LYS 12 5.544 -8.864 -14.955 95 H TRP 13 HN TRP 13 1.801 -6.775 -7.707 96 HA TRP 13 HA TRP 13 0.367 -4.484 -8.882 97 1HB TRP 13 HB2 TRP 13 0.458 -5.536 -6.046 98 2HB TRP 13 HB1 TRP 13 -0.201 -3.966 -6.467 99 HD1 TRP 13 HD1 TRP 13 -1.080 -6.517 -9.036 100 HE1 TRP 13 HE1 TRP 13 -3.525 -7.260 -8.739 101 HE3 TRP 13 HE3 TRP 13 -2.005 -4.467 -4.444 102 HZ2 TRP 13 HZ2 TRP 13 -5.571 -7.012 -6.818 103 HZ3 TRP 13 HZ3 TRP 13 -4.231 -4.768 -3.446 104 HH2 TRP 13 HH2 TRP 13 -5.978 -6.016 -4.610 105 H TYR 14 HN TYR 14 1.462 -2.548 -8.937 106 HA TYR 14 HA TYR 14 4.120 -2.516 -7.682 107 1HB TYR 14 HB2 TYR 14 2.975 -0.824 -9.909 108 2HB TYR 14 HB1 TYR 14 4.580 -0.607 -9.226 109 HD1 TYR 14 HD1 TYR 14 2.568 -3.507 -10.492 110 HD2 TYR 14 HD2 TYR 14 6.264 -1.402 -10.555 111 HE1 TYR 14 HE1 TYR 14 3.467 -5.143 -12.089 112 HE2 TYR 14 HE2 TYR 14 7.174 -3.033 -12.155 113 HH TYR 14 HH TYR 14 5.651 -4.830 -14.009 114 H VAL 15 HN VAL 15 4.179 -1.563 -5.734 115 HA VAL 15 HA VAL 15 2.322 0.545 -5.051 116 HB VAL 15 HB VAL 15 4.571 -0.706 -3.484 117 1HG1 VAL 15 HG11 VAL 15 4.148 1.669 -2.837 118 2HG1 VAL 15 HG12 VAL 15 3.824 0.509 -1.553 119 3HG1 VAL 15 HG13 VAL 15 2.487 1.217 -2.458 120 1HG2 VAL 15 HG21 VAL 15 3.040 -2.336 -3.313 121 2HG2 VAL 15 HG22 VAL 15 1.720 -1.283 -3.818 122 3HG2 VAL 15 HG23 VAL 15 2.277 -1.256 -2.146 123 H VAL 16 HN VAL 16 2.682 2.642 -5.470 124 HA VAL 16 HA VAL 16 5.445 3.634 -5.437 125 HB VAL 16 HB VAL 16 4.834 3.109 -7.776 126 1HG1 VAL 16 HG11 VAL 16 3.022 5.420 -7.995 127 2HG1 VAL 16 HG12 VAL 16 2.358 3.998 -7.192 128 3HG1 VAL 16 HG13 VAL 16 2.993 3.867 -8.829 129 1HG2 VAL 16 HG21 VAL 16 6.242 4.722 -8.315 130 2HG2 VAL 16 HG22 VAL 16 5.963 5.464 -6.740 131 3HG2 VAL 16 HG23 VAL 16 4.980 5.938 -8.127 132 H ALA 17 HN ALA 17 1.994 4.432 -5.434 133 HA ALA 17 HA ALA 17 2.600 7.118 -4.442 134 1HB ALA 17 HB1 ALA 17 -0.215 6.531 -4.599 135 2HB ALA 17 HB2 ALA 17 0.597 6.084 -6.100 136 3HB ALA 17 HB3 ALA 17 0.730 7.730 -5.482 137 H LEU 18 HN LEU 18 2.711 7.454 -2.287 138 HA LEU 18 HA LEU 18 0.915 5.918 -0.548 139 1HB LEU 18 HB2 LEU 18 3.883 6.264 -0.092 140 2HB LEU 18 HB1 LEU 18 2.764 5.607 1.087 141 HG LEU 18 HG LEU 18 2.250 3.785 -0.589 142 1HD1 LEU 18 HD11 LEU 18 2.995 4.058 -2.657 143 2HD1 LEU 18 HD12 LEU 18 4.615 3.738 -2.041 144 3HD1 LEU 18 HD13 LEU 18 4.034 5.398 -2.175 145 1HD2 LEU 18 HD21 LEU 18 4.987 4.095 0.604 146 2HD2 LEU 18 HD22 LEU 18 4.433 2.602 -0.154 147 3HD2 LEU 18 HD23 LEU 18 3.599 3.235 1.266 148 H ALA 19 HN ALA 19 0.848 6.964 1.738 149 HA ALA 19 HA ALA 19 1.784 9.630 1.969 150 1HB ALA 19 HB1 ALA 19 0.193 10.874 1.057 151 2HB ALA 19 HB2 ALA 19 -1.085 9.951 1.845 152 3HB ALA 19 HB3 ALA 19 -0.409 9.394 0.315 153 H SER 20 HN SER 20 2.176 9.800 4.020 154 HA SER 20 HA SER 20 1.412 10.250 6.209 155 1HB SER 20 HB2 SER 20 -0.616 8.051 5.824 156 2HB SER 20 HB1 SER 20 -0.411 9.034 7.267 157 HG SER 20 HG SER 20 -2.105 9.668 5.699 158 H ASN 21 HN ASN 21 1.845 9.102 8.207 159 HA ASN 21 HA ASN 21 2.979 6.461 8.056 160 1HB ASN 21 HB2 ASN 21 4.732 8.846 8.662 161 2HB ASN 21 HB1 ASN 21 5.211 7.162 8.854 162 1HD2 ASN 21 HD21 ASN 21 5.758 9.647 7.005 163 2HD2 ASN 21 HD22 ASN 21 5.938 8.904 5.457 164 H THR 22 HN THR 22 4.633 7.710 10.539 165 HA THR 22 HA THR 22 2.765 8.435 12.470 166 HB THR 22 HB THR 22 1.792 6.238 12.210 167 HG1 THR 22 HG1 THR 22 2.004 7.060 14.350 168 1HG2 THR 22 HG21 THR 22 4.259 5.317 11.571 169 2HG2 THR 22 HG22 THR 22 2.879 4.306 11.991 170 3HG2 THR 22 HG23 THR 22 4.075 4.719 13.219 171 H GLU 23 HN GLU 23 5.718 6.600 11.844 172 HA GLU 23 HA GLU 23 7.175 8.315 13.652 173 1HB GLU 23 HB2 GLU 23 7.000 5.340 14.158 174 2HB GLU 23 HB1 GLU 23 8.128 6.431 14.954 175 1HG GLU 23 HG2 GLU 23 6.233 7.669 15.903 176 2HG GLU 23 HG1 GLU 23 5.125 6.531 15.138 177 H PHE 24 HN PHE 24 9.001 8.802 12.674 178 HA PHE 24 HA PHE 24 9.927 7.214 10.439 179 1HB PHE 24 HB2 PHE 24 11.533 9.074 10.101 180 2HB PHE 24 HB1 PHE 24 9.861 9.618 10.166 181 HD1 PHE 24 HD1 PHE 24 9.414 11.497 11.386 182 HD2 PHE 24 HD2 PHE 24 12.743 9.086 12.491 183 HE1 PHE 24 HE1 PHE 24 10.006 13.121 13.136 184 HE2 PHE 24 HE2 PHE 24 13.335 10.701 14.247 185 HZ PHE 24 HZ PHE 24 11.968 12.723 14.571 186 H PHE 25 HN PHE 25 10.831 7.801 13.744 187 HA PHE 25 HA PHE 25 13.484 7.285 13.871 188 1HB PHE 25 HB2 PHE 25 12.094 7.730 15.839 189 2HB PHE 25 HB1 PHE 25 11.393 6.119 15.717 190 HD1 PHE 25 HD1 PHE 25 12.072 5.045 17.659 191 HD2 PHE 25 HD2 PHE 25 14.936 7.168 15.335 192 HE1 PHE 25 HE1 PHE 25 13.877 4.154 19.076 193 HE2 PHE 25 HE2 PHE 25 16.745 6.282 16.746 194 HZ PHE 25 HZ PHE 25 16.217 4.772 18.619 195 H LEU 26 HN LEU 26 10.981 4.737 13.708 196 HA LEU 26 HA LEU 26 13.067 2.723 13.394 197 1HB LEU 26 HB2 LEU 26 10.067 2.444 13.577 198 2HB LEU 26 HB1 LEU 26 11.195 1.106 13.478 199 HG LEU 26 HG LEU 26 10.493 1.375 15.762 200 1HD1 LEU 26 HD11 LEU 26 13.206 2.576 15.870 201 2HD1 LEU 26 HD12 LEU 26 13.007 1.033 15.039 202 3HD1 LEU 26 HD13 LEU 26 12.545 1.189 16.734 203 1HD2 LEU 26 HD21 LEU 26 11.650 4.143 15.802 204 2HD2 LEU 26 HD22 LEU 26 10.612 3.361 16.994 205 3HD2 LEU 26 HD23 LEU 26 9.950 3.849 15.434 206 H ARG 27 HN ARG 27 10.298 3.992 11.594 207 HA ARG 27 HA ARG 27 10.508 2.306 9.362 208 1HB ARG 27 HB2 ARG 27 9.430 5.125 9.429 209 2HB ARG 27 HB1 ARG 27 9.043 3.880 8.249 210 1HG ARG 27 HG2 ARG 27 8.375 3.786 11.184 211 2HG ARG 27 HG1 ARG 27 7.253 4.167 9.877 212 1HD ARG 27 HD2 ARG 27 8.748 1.566 10.182 213 2HD ARG 27 HD1 ARG 27 7.072 1.832 10.660 214 HE ARG 27 HE ARG 27 7.358 2.550 7.969 215 1HH1 ARG 27 HH11 ARG 27 7.444 -0.300 9.982 216 2HH1 ARG 27 HH12 ARG 27 6.898 -1.357 8.724 217 1HH2 ARG 27 HH21 ARG 27 6.634 1.162 6.316 218 2HH2 ARG 27 HH22 ARG 27 6.439 -0.528 6.643 219 H GLU 28 HN GLU 28 12.156 5.296 10.151 220 HA GLU 28 HA GLU 28 13.029 6.219 7.747 221 1HB GLU 28 HB2 GLU 28 15.043 7.052 8.907 222 2HB GLU 28 HB1 GLU 28 13.568 7.349 9.814 223 1HG GLU 28 HG2 GLU 28 14.078 5.370 11.205 224 2HG GLU 28 HG1 GLU 28 15.595 5.189 10.329 225 H LYS 29 HN LYS 29 14.621 3.615 9.600 226 HA LYS 29 HA LYS 29 16.497 3.189 7.437 227 1HB LYS 29 HB2 LYS 29 16.104 1.736 10.055 228 2HB LYS 29 HB1 LYS 29 17.363 1.352 8.891 229 1HG LYS 29 HG2 LYS 29 17.035 3.964 10.354 230 2HG LYS 29 HG1 LYS 29 18.236 2.718 10.691 231 1HD LYS 29 HD2 LYS 29 19.195 3.038 8.462 232 2HD LYS 29 HD1 LYS 29 17.990 4.281 8.120 233 1HE LYS 29 HE2 LYS 29 20.116 5.284 8.759 234 2HE LYS 29 HE1 LYS 29 18.868 5.640 9.952 235 1HZ LYS 29 HZ1 LYS 29 19.783 4.119 11.457 236 2HZ LYS 29 HZ2 LYS 29 21.119 4.941 10.825 237 3HZ LYS 29 HZ3 LYS 29 20.752 3.382 10.281 238 H ASP 30 HN ASP 30 13.631 1.631 8.740 239 HA ASP 30 HA ASP 30 13.919 -0.752 7.195 240 1HB ASP 30 HB2 ASP 30 12.720 -0.731 9.327 241 2HB ASP 30 HB1 ASP 30 11.506 0.347 8.643 242 H LYS 31 HN LYS 31 11.353 1.754 7.003 243 HA LYS 31 HA LYS 31 10.555 0.802 4.425 244 1HB LYS 31 HB2 LYS 31 9.100 1.868 6.271 245 2HB LYS 31 HB1 LYS 31 9.643 3.404 5.612 246 1HG LYS 31 HG2 LYS 31 7.483 2.789 4.693 247 2HG LYS 31 HG1 LYS 31 8.709 2.792 3.425 248 1HD LYS 31 HD2 LYS 31 8.877 0.378 3.540 249 2HD LYS 31 HD1 LYS 31 7.737 0.338 4.886 250 1HE LYS 31 HE2 LYS 31 7.146 1.284 2.084 251 2HE LYS 31 HE1 LYS 31 6.646 -0.254 2.785 252 1HZ LYS 31 HZ1 LYS 31 4.798 0.841 3.331 253 2HZ LYS 31 HZ2 LYS 31 5.497 2.363 3.100 254 3HZ LYS 31 HZ3 LYS 31 5.713 1.549 4.566 255 H MET 32 HN MET 32 10.068 3.939 3.844 256 HA MET 32 HA MET 32 10.842 5.262 2.179 257 1HB MET 32 HB2 MET 32 13.246 6.078 2.640 258 2HB MET 32 HB1 MET 32 11.984 6.421 3.806 259 1HG MET 32 HG2 MET 32 13.746 5.797 5.129 260 2HG MET 32 HG1 MET 32 12.823 4.307 5.010 261 1HE MET 32 HE1 MET 32 16.706 5.641 3.404 262 2HE MET 32 HE2 MET 32 15.148 6.407 3.097 263 3HE MET 32 HE3 MET 32 15.807 5.252 1.938 264 H LYS 33 HN LYS 33 10.612 3.768 0.491 265 HA LYS 33 HA LYS 33 12.844 3.441 -1.152 266 1HB LYS 33 HB2 LYS 33 12.936 0.872 -1.001 267 2HB LYS 33 HB1 LYS 33 13.744 1.798 0.259 268 1HG LYS 33 HG2 LYS 33 11.896 1.443 1.765 269 2HG LYS 33 HG1 LYS 33 10.982 0.623 0.500 270 1HD LYS 33 HD2 LYS 33 12.013 -0.963 2.060 271 2HD LYS 33 HD1 LYS 33 12.651 -1.150 0.426 272 1HE LYS 33 HE2 LYS 33 14.627 0.135 1.042 273 2HE LYS 33 HE1 LYS 33 13.981 0.371 2.666 274 1HZ LYS 33 HZ1 LYS 33 13.950 -2.154 2.785 275 2HZ LYS 33 HZ2 LYS 33 15.461 -1.399 2.861 276 3HZ LYS 33 HZ3 LYS 33 14.953 -2.128 1.422 277 H MET 34 HN MET 34 12.373 2.095 -3.112 278 HA MET 34 HA MET 34 9.784 2.586 -4.102 279 1HB MET 34 HB2 MET 34 11.837 2.246 -5.496 280 2HB MET 34 HB1 MET 34 11.783 0.536 -5.097 281 1HG MET 34 HG2 MET 34 9.486 1.919 -6.433 282 2HG MET 34 HG1 MET 34 10.847 1.277 -7.348 283 1HE MET 34 HE1 MET 34 8.749 0.530 -8.456 284 2HE MET 34 HE2 MET 34 7.496 -0.458 -7.706 285 3HE MET 34 HE3 MET 34 8.824 -1.229 -8.573 286 H ALA 35 HN ALA 35 7.964 1.139 -4.423 287 HA ALA 35 HA ALA 35 8.195 -1.304 -2.784 288 1HB ALA 35 HB1 ALA 35 5.887 0.614 -2.918 289 2HB ALA 35 HB2 ALA 35 6.975 0.354 -1.556 290 3HB ALA 35 HB3 ALA 35 5.871 -0.926 -2.062 291 H MET 36 HN MET 36 7.648 -3.128 -3.668 292 HA MET 36 HA MET 36 6.042 -3.147 -6.142 293 1HB MET 36 HB2 MET 36 8.137 -5.143 -5.235 294 2HB MET 36 HB1 MET 36 7.209 -5.238 -6.726 295 1HG MET 36 HG2 MET 36 8.240 -3.154 -7.492 296 2HG MET 36 HG1 MET 36 9.183 -3.084 -6.006 297 1HE MET 36 HE1 MET 36 10.783 -4.845 -5.246 298 2HE MET 36 HE2 MET 36 11.681 -5.941 -6.295 299 3HE MET 36 HE3 MET 36 10.064 -6.376 -5.743 300 H ALA 37 HN ALA 37 4.702 -5.254 -6.349 301 HA ALA 37 HA ALA 37 4.134 -6.564 -3.832 302 1HB ALA 37 HB1 ALA 37 2.025 -4.824 -5.083 303 2HB ALA 37 HB2 ALA 37 2.905 -4.478 -3.595 304 3HB ALA 37 HB3 ALA 37 1.817 -5.863 -3.675 305 H ARG 38 HN ARG 38 2.759 -8.332 -3.924 306 HA ARG 38 HA ARG 38 1.921 -9.282 -6.577 307 1HB ARG 38 HB2 ARG 38 3.560 -10.817 -4.549 308 2HB ARG 38 HB1 ARG 38 2.782 -11.554 -5.942 309 1HG ARG 38 HG2 ARG 38 4.752 -9.313 -6.235 310 2HG ARG 38 HG1 ARG 38 5.260 -11.000 -6.121 311 1HD ARG 38 HD2 ARG 38 3.811 -11.526 -8.053 312 2HD ARG 38 HD1 ARG 38 3.408 -9.815 -8.185 313 HE ARG 38 HE ARG 38 6.151 -9.924 -8.273 314 1HH1 ARG 38 HH11 ARG 38 3.546 -11.324 -10.130 315 2HH1 ARG 38 HH12 ARG 38 4.438 -11.323 -11.614 316 1HH2 ARG 38 HH21 ARG 38 7.324 -9.927 -10.228 317 2HH2 ARG 38 HH22 ARG 38 6.580 -10.532 -11.670 318 H ILE 39 HN ILE 39 -0.260 -9.521 -6.356 319 HA ILE 39 HA ILE 39 -1.357 -10.235 -3.755 320 HB ILE 39 HB ILE 39 -2.501 -8.458 -4.917 321 1HG1 ILE 39 HG12 ILE 39 -4.163 -10.990 -4.905 322 2HG1 ILE 39 HG11 ILE 39 -3.848 -9.965 -3.509 323 1HG2 ILE 39 HG21 ILE 39 -3.715 -8.884 -7.027 324 2HG2 ILE 39 HG22 ILE 39 -2.934 -10.462 -7.119 325 3HG2 ILE 39 HG23 ILE 39 -1.963 -8.994 -7.198 326 1HD1 ILE 39 HD11 ILE 39 -6.090 -9.726 -4.696 327 2HD1 ILE 39 HD12 ILE 39 -5.186 -8.894 -5.962 328 3HD1 ILE 39 HD13 ILE 39 -5.200 -8.252 -4.320 329 H SER 40 HN SER 40 -2.392 -12.060 -3.231 330 HA SER 40 HA SER 40 -3.128 -14.075 -5.145 331 1HB SER 40 HB2 SER 40 -0.721 -14.543 -4.962 332 2HB SER 40 HB1 SER 40 -0.861 -14.634 -3.206 333 HG SER 40 HG SER 40 -2.020 -16.366 -5.129 334 H PHE 41 HN PHE 41 -4.857 -15.140 -4.371 335 HA PHE 41 HA PHE 41 -5.718 -14.588 -1.658 336 1HB PHE 41 HB2 PHE 41 -7.081 -16.074 -3.910 337 2HB PHE 41 HB1 PHE 41 -7.816 -15.718 -2.351 338 HD1 PHE 41 HD1 PHE 41 -9.370 -14.053 -2.458 339 HD2 PHE 41 HD2 PHE 41 -5.893 -13.748 -4.894 340 HE1 PHE 41 HE1 PHE 41 -10.163 -11.891 -3.321 341 HE2 PHE 41 HE2 PHE 41 -6.677 -11.588 -5.755 342 HZ PHE 41 HZ PHE 41 -8.816 -10.655 -4.971 343 H LEU 42 HN LEU 42 -5.430 -15.878 0.031 344 HA LEU 42 HA LEU 42 -4.249 -18.468 -0.275 345 1HB LEU 42 HB2 LEU 42 -5.372 -17.113 2.178 346 2HB LEU 42 HB1 LEU 42 -4.485 -18.622 2.190 347 HG LEU 42 HG LEU 42 -3.007 -16.874 2.885 348 1HD1 LEU 42 HD11 LEU 42 -1.226 -17.479 1.641 349 2HD1 LEU 42 HD12 LEU 42 -2.042 -17.158 0.111 350 3HD1 LEU 42 HD13 LEU 42 -2.376 -18.649 0.992 351 1HD2 LEU 42 HD21 LEU 42 -2.736 -14.833 1.893 352 2HD2 LEU 42 HD22 LEU 42 -4.438 -15.132 1.543 353 3HD2 LEU 42 HD23 LEU 42 -3.219 -15.417 0.301 354 H GLY 43 HN GLY 43 -5.333 -20.156 -0.913 355 1HA GLY 43 HA2 GLY 43 -8.104 -20.402 -1.096 356 2HA GLY 43 HA1 GLY 43 -6.958 -21.721 -1.224 357 H GLU 44 HN GLU 44 -8.431 -19.672 1.280 358 HA GLU 44 HA GLU 44 -9.451 -21.966 2.674 359 1HB GLU 44 HB2 GLU 44 -7.220 -20.329 3.893 360 2HB GLU 44 HB1 GLU 44 -8.286 -21.363 4.832 361 1HG GLU 44 HG2 GLU 44 -6.439 -22.273 2.635 362 2HG GLU 44 HG1 GLU 44 -6.155 -22.436 4.365 363 H ASP 45 HN ASP 45 -8.395 -18.776 3.719 364 HA ASP 45 HA ASP 45 -10.908 -17.506 3.485 365 1HB ASP 45 HB2 ASP 45 -10.089 -18.427 6.257 366 2HB ASP 45 HB1 ASP 45 -11.262 -17.147 5.967 367 H GLU 46 HN GLU 46 -8.257 -17.004 2.687 368 HA GLU 46 HA GLU 46 -7.885 -14.422 3.960 369 1HB GLU 46 HB2 GLU 46 -5.713 -16.517 4.008 370 2HB GLU 46 HB1 GLU 46 -5.480 -14.823 4.409 371 1HG GLU 46 HG2 GLU 46 -7.032 -15.037 6.270 372 2HG GLU 46 HG1 GLU 46 -7.296 -16.731 5.861 373 H LEU 47 HN LEU 47 -6.498 -13.025 2.884 374 HA LEU 47 HA LEU 47 -5.588 -13.775 0.201 375 1HB LEU 47 HB2 LEU 47 -7.669 -12.754 -0.282 376 2HB LEU 47 HB1 LEU 47 -7.450 -11.528 0.950 377 HG LEU 47 HG LEU 47 -5.772 -10.410 -0.396 378 1HD1 LEU 47 HD11 LEU 47 -4.603 -12.039 -1.551 379 2HD1 LEU 47 HD12 LEU 47 -5.561 -11.283 -2.825 380 3HD1 LEU 47 HD13 LEU 47 -6.072 -12.820 -2.132 381 1HD2 LEU 47 HD21 LEU 47 -8.430 -11.036 -1.582 382 2HD2 LEU 47 HD22 LEU 47 -7.283 -10.072 -2.513 383 3HD2 LEU 47 HD23 LEU 47 -7.817 -9.518 -0.925 384 H LYS 48 HN LYS 48 -3.562 -12.973 -0.199 385 HA LYS 48 HA LYS 48 -2.623 -10.776 1.508 386 1HB LYS 48 HB2 LYS 48 -0.594 -11.933 2.064 387 2HB LYS 48 HB1 LYS 48 -1.959 -12.956 2.482 388 1HG LYS 48 HG2 LYS 48 -0.512 -14.456 1.518 389 2HG LYS 48 HG1 LYS 48 -1.555 -14.029 0.161 390 1HD LYS 48 HD2 LYS 48 0.109 -12.498 -0.691 391 2HD LYS 48 HD1 LYS 48 1.122 -12.755 0.728 392 1HE LYS 48 HE2 LYS 48 1.388 -15.105 0.099 393 2HE LYS 48 HE1 LYS 48 0.375 -14.839 -1.320 394 1HZ LYS 48 HZ1 LYS 48 3.089 -13.814 -0.777 395 2HZ LYS 48 HZ2 LYS 48 2.086 -13.055 -1.909 396 3HZ LYS 48 HZ3 LYS 48 2.531 -14.673 -2.124 397 H VAL 49 HN VAL 49 -0.792 -9.632 0.773 398 HA VAL 49 HA VAL 49 -0.149 -10.011 -2.070 399 HB VAL 49 HB VAL 49 -1.697 -8.060 -1.696 400 1HG1 VAL 49 HG11 VAL 49 -0.217 -7.508 0.481 401 2HG1 VAL 49 HG12 VAL 49 -1.218 -6.318 -0.347 402 3HG1 VAL 49 HG13 VAL 49 0.513 -6.400 -0.675 403 1HG2 VAL 49 HG21 VAL 49 0.976 -7.888 -2.973 404 2HG2 VAL 49 HG22 VAL 49 0.005 -6.418 -2.875 405 3HG2 VAL 49 HG23 VAL 49 -0.633 -7.843 -3.693 406 H SER 50 HN SER 50 1.965 -10.504 -2.230 407 HA SER 50 HA SER 50 3.760 -9.832 -0.064 408 1HB SER 50 HB2 SER 50 3.871 -12.048 -1.184 409 2HB SER 50 HB1 SER 50 4.358 -11.246 -2.677 410 HG SER 50 HG SER 50 5.891 -12.012 -0.651 411 H TYR 51 HN TYR 51 4.509 -7.787 0.013 412 HA TYR 51 HA TYR 51 5.268 -6.562 -2.536 413 1HB TYR 51 HB2 TYR 51 5.363 -4.431 -0.962 414 2HB TYR 51 HB1 TYR 51 3.877 -4.971 -1.722 415 HD1 TYR 51 HD1 TYR 51 5.647 -6.126 1.390 416 HD2 TYR 51 HD2 TYR 51 2.144 -4.463 -0.351 417 HE1 TYR 51 HE1 TYR 51 4.536 -6.168 3.584 418 HE2 TYR 51 HE2 TYR 51 1.027 -4.500 1.834 419 HH TYR 51 HH TYR 51 2.188 -4.494 4.485 420 H ALA 52 HN ALA 52 7.268 -6.317 -3.049 421 HA ALA 52 HA ALA 52 9.324 -6.580 -0.952 422 1HB ALA 52 HB1 ALA 52 9.547 -7.092 -3.922 423 2HB ALA 52 HB2 ALA 52 9.406 -8.323 -2.667 424 3HB ALA 52 HB3 ALA 52 10.839 -7.299 -2.741 425 H VAL 53 HN VAL 53 10.033 -4.627 -0.335 426 HA VAL 53 HA VAL 53 10.099 -2.449 -2.268 427 HB VAL 53 HB VAL 53 10.698 -1.053 -0.258 428 1HG1 VAL 53 HG11 VAL 53 8.512 -0.722 -0.712 429 2HG1 VAL 53 HG12 VAL 53 8.278 -1.639 0.776 430 3HG1 VAL 53 HG13 VAL 53 8.155 -2.447 -0.787 431 1HG2 VAL 53 HG21 VAL 53 11.575 -2.903 1.124 432 2HG2 VAL 53 HG22 VAL 53 9.944 -3.559 1.244 433 3HG2 VAL 53 HG23 VAL 53 10.314 -1.985 1.944 434 HA PRO 54 HA PRO 54 14.555 -3.107 -2.465 435 1HB PRO 54 HB2 PRO 54 14.761 -2.272 -5.063 436 2HB PRO 54 HB1 PRO 54 14.306 -3.906 -4.585 437 1HG PRO 54 HG2 PRO 54 12.687 -1.892 -5.863 438 2HG PRO 54 HG1 PRO 54 12.266 -3.569 -5.487 439 1HD PRO 54 HD2 PRO 54 11.608 -1.100 -4.026 440 2HD PRO 54 HD1 PRO 54 10.833 -2.696 -3.954 441 H LYS 55 HN LYS 55 16.299 -1.793 -2.364 442 HA LYS 55 HA LYS 55 16.708 0.732 -3.356 443 1HB LYS 55 HB2 LYS 55 15.295 0.775 -0.727 444 2HB LYS 55 HB1 LYS 55 16.581 1.938 -0.996 445 1HG LYS 55 HG2 LYS 55 13.949 1.693 -2.390 446 2HG LYS 55 HG1 LYS 55 14.649 3.079 -1.571 447 1HD LYS 55 HD2 LYS 55 15.031 3.745 -3.706 448 2HD LYS 55 HD1 LYS 55 16.483 2.767 -3.486 449 1HE LYS 55 HE2 LYS 55 15.356 0.862 -4.538 450 2HE LYS 55 HE1 LYS 55 13.902 1.835 -4.742 451 1HZ LYS 55 HZ1 LYS 55 15.283 1.683 -6.760 452 2HZ LYS 55 HZ2 LYS 55 16.532 2.487 -5.951 453 3HZ LYS 55 HZ3 LYS 55 15.062 3.276 -6.234 454 HA PRO 56 HA PRO 56 20.250 -1.688 -1.523 455 1HB PRO 56 HB2 PRO 56 21.928 -0.607 -3.499 456 2HB PRO 56 HB1 PRO 56 21.193 -2.211 -3.513 457 1HG PRO 56 HG2 PRO 56 20.315 0.292 -4.869 458 2HG PRO 56 HG1 PRO 56 20.202 -1.389 -5.422 459 1HD PRO 56 HD2 PRO 56 18.055 -0.082 -4.511 460 2HD PRO 56 HD1 PRO 56 18.299 -1.806 -4.158 461 H ASN 57 HN ASN 57 22.724 -0.491 -1.720 462 HA ASN 57 HA ASN 57 24.059 1.073 -0.745 463 1HB ASN 57 HB2 ASN 57 22.906 2.585 -2.388 464 2HB ASN 57 HB1 ASN 57 21.742 2.982 -1.129 465 1HD2 ASN 57 HD21 ASN 57 24.429 4.024 -2.634 466 2HD2 ASN 57 HD22 ASN 57 25.098 5.033 -1.401 467 H GLY 58 HN GLY 58 23.032 -0.581 1.013 468 1HA GLY 58 HA2 GLY 58 22.954 -0.655 3.348 469 2HA GLY 58 HA1 GLY 58 22.662 1.077 3.372 470 H CYS 59 HN CYS 59 20.419 1.369 1.870 471 HA CYS 59 HA CYS 59 18.386 0.590 3.649 472 1HB CYS 59 HB2 CYS 59 18.377 1.832 0.911 473 2HB CYS 59 HB1 CYS 59 16.869 1.394 1.711 474 H ARG 60 HN ARG 60 19.690 -0.909 0.805 475 HA ARG 60 HA ARG 60 19.170 -2.798 -0.360 476 1HB ARG 60 HB2 ARG 60 18.840 -4.777 1.096 477 2HB ARG 60 HB1 ARG 60 20.155 -3.741 1.619 478 1HG ARG 60 HG2 ARG 60 18.734 -2.791 3.356 479 2HG ARG 60 HG1 ARG 60 17.396 -3.813 2.824 480 1HD ARG 60 HD2 ARG 60 20.059 -4.846 3.790 481 2HD ARG 60 HD1 ARG 60 18.629 -4.684 4.808 482 HE ARG 60 HE ARG 60 19.181 -6.782 2.980 483 1HH1 ARG 60 HH11 ARG 60 16.577 -4.874 4.306 484 2HH1 ARG 60 HH12 ARG 60 15.371 -6.078 3.999 485 1HH2 ARG 60 HH21 ARG 60 17.595 -8.370 2.578 486 2HH2 ARG 60 HH22 ARG 60 15.949 -8.063 3.019 487 H LYS 61 HN LYS 61 17.331 -4.879 0.180 488 HA LYS 61 HA LYS 61 14.786 -3.546 -0.450 489 1HB LYS 61 HB2 LYS 61 15.647 -4.777 -2.353 490 2HB LYS 61 HB1 LYS 61 15.873 -6.216 -1.369 491 1HG LYS 61 HG2 LYS 61 13.351 -6.153 -0.997 492 2HG LYS 61 HG1 LYS 61 13.305 -4.986 -2.316 493 1HD LYS 61 HD2 LYS 61 14.532 -7.732 -2.529 494 2HD LYS 61 HD1 LYS 61 12.874 -7.357 -2.996 495 1HE LYS 61 HE2 LYS 61 14.252 -7.340 -4.958 496 2HE LYS 61 HE1 LYS 61 13.759 -5.688 -4.600 497 1HZ LYS 61 HZ1 LYS 61 15.864 -5.062 -4.219 498 2HZ LYS 61 HZ2 LYS 61 16.276 -6.439 -5.107 499 3HZ LYS 61 HZ3 LYS 61 16.274 -6.495 -3.417 500 H TRP 62 HN TRP 62 12.832 -4.452 0.400 501 HA TRP 62 HA TRP 62 13.202 -6.495 2.480 502 1HB TRP 62 HB2 TRP 62 13.188 -4.333 3.621 503 2HB TRP 62 HB1 TRP 62 11.659 -3.923 2.853 504 HD1 TRP 62 HD1 TRP 62 9.868 -3.997 4.676 505 HE1 TRP 62 HE1 TRP 62 9.212 -5.624 6.558 506 HE3 TRP 62 HE3 TRP 62 13.665 -7.394 4.181 507 HZ2 TRP 62 HZ2 TRP 62 10.173 -8.024 7.685 508 HZ3 TRP 62 HZ3 TRP 62 13.719 -9.327 5.703 509 HH2 TRP 62 HH2 TRP 62 12.009 -9.634 7.418 510 H GLU 63 HN GLU 63 11.653 -8.002 2.595 511 HA GLU 63 HA GLU 63 9.283 -7.649 0.880 512 1HB GLU 63 HB2 GLU 63 10.732 -10.208 1.589 513 2HB GLU 63 HB1 GLU 63 9.279 -10.100 0.605 514 1HG GLU 63 HG2 GLU 63 10.495 -8.790 -1.054 515 2HG GLU 63 HG1 GLU 63 11.953 -8.895 -0.070 516 H THR 64 HN THR 64 7.277 -8.208 1.682 517 HA THR 64 HA THR 64 7.024 -9.484 4.260 518 HB THR 64 HB THR 64 6.315 -6.576 3.878 519 HG1 THR 64 HG1 THR 64 7.991 -7.947 5.700 520 1HG2 THR 64 HG21 THR 64 4.490 -7.777 5.065 521 2HG2 THR 64 HG22 THR 64 5.297 -6.540 6.028 522 3HG2 THR 64 HG23 THR 64 5.667 -8.244 6.291 523 H THR 65 HN THR 65 5.155 -10.557 4.442 524 HA THR 65 HA THR 65 3.280 -10.409 2.224 525 HB THR 65 HB THR 65 3.532 -12.350 4.526 526 HG1 THR 65 HG1 THR 65 4.081 -12.730 1.774 527 1HG2 THR 65 HG21 THR 65 2.143 -13.581 2.471 528 2HG2 THR 65 HG22 THR 65 1.376 -12.002 2.651 529 3HG2 THR 65 HG23 THR 65 1.508 -13.084 4.039 530 H PHE 66 HN PHE 66 1.435 -9.331 2.320 531 HA PHE 66 HA PHE 66 0.414 -8.429 4.925 532 1HB PHE 66 HB2 PHE 66 0.890 -6.890 2.860 533 2HB PHE 66 HB1 PHE 66 -0.636 -7.521 2.264 534 HD1 PHE 66 HD1 PHE 66 -2.124 -5.767 2.364 535 HD2 PHE 66 HD2 PHE 66 0.366 -6.578 5.717 536 HE1 PHE 66 HE1 PHE 66 -3.332 -4.068 3.667 537 HE2 PHE 66 HE2 PHE 66 -0.841 -4.882 7.028 538 HZ PHE 66 HZ PHE 66 -2.693 -3.624 6.003 539 H LYS 67 HN LYS 67 -0.443 -10.626 5.358 540 HA LYS 67 HA LYS 67 -2.756 -11.352 3.705 541 1HB LYS 67 HB2 LYS 67 -1.027 -13.072 4.087 542 2HB LYS 67 HB1 LYS 67 -1.325 -12.962 5.815 543 1HG LYS 67 HG2 LYS 67 -3.574 -13.780 5.531 544 2HG LYS 67 HG1 LYS 67 -3.385 -13.775 3.778 545 1HD LYS 67 HD2 LYS 67 -3.147 -16.029 4.679 546 2HD LYS 67 HD1 LYS 67 -1.639 -15.475 3.955 547 1HE LYS 67 HE2 LYS 67 -2.217 -15.290 6.903 548 2HE LYS 67 HE1 LYS 67 -1.442 -16.689 6.164 549 1HZ LYS 67 HZ1 LYS 67 0.461 -15.610 6.436 550 2HZ LYS 67 HZ2 LYS 67 -0.316 -14.175 6.875 551 3HZ LYS 67 HZ3 LYS 67 -0.034 -14.518 5.243 552 H LYS 68 HN LYS 68 -4.751 -11.105 4.367 553 HA LYS 68 HA LYS 68 -5.599 -11.419 7.072 554 1HB LYS 68 HB2 LYS 68 -5.735 -8.639 5.873 555 2HB LYS 68 HB1 LYS 68 -6.557 -9.138 7.342 556 1HG LYS 68 HG2 LYS 68 -3.574 -9.131 6.956 557 2HG LYS 68 HG1 LYS 68 -4.491 -7.888 7.776 558 1HD LYS 68 HD2 LYS 68 -5.247 -9.504 9.438 559 2HD LYS 68 HD1 LYS 68 -4.341 -10.776 8.614 560 1HE LYS 68 HE2 LYS 68 -2.259 -9.562 9.025 561 2HE LYS 68 HE1 LYS 68 -3.160 -8.281 9.836 562 1HZ LYS 68 HZ1 LYS 68 -3.562 -9.590 11.653 563 2HZ LYS 68 HZ2 LYS 68 -2.037 -10.168 11.203 564 3HZ LYS 68 HZ3 LYS 68 -3.427 -11.042 10.796 565 H THR 69 HN THR 69 -7.979 -9.482 6.258 566 HA THR 69 HA THR 69 -9.243 -11.460 4.466 567 HB THR 69 HB THR 69 -10.250 -11.537 6.652 568 HG1 THR 69 HG1 THR 69 -11.625 -11.570 4.739 569 1HG2 THR 69 HG21 THR 69 -11.597 -9.078 6.866 570 2HG2 THR 69 HG22 THR 69 -9.882 -8.722 6.661 571 3HG2 THR 69 HG23 THR 69 -10.414 -9.782 7.967 572 H SER 70 HN SER 70 -10.609 -10.744 2.790 573 HA SER 70 HA SER 70 -10.671 -7.855 2.292 574 1HB SER 70 HB2 SER 70 -10.034 -8.216 -0.069 575 2HB SER 70 HB1 SER 70 -8.752 -8.686 1.047 576 HG SER 70 HG SER 70 -10.232 -10.221 -0.687 577 H ASP 71 HN ASP 71 -12.465 -7.084 1.293 578 HA ASP 71 HA ASP 71 -14.716 -8.904 1.028 579 1HB ASP 71 HB2 ASP 71 -16.071 -6.898 0.778 580 2HB ASP 71 HB1 ASP 71 -14.988 -6.720 2.155 581 H ASP 72 HN ASP 72 -16.155 -8.840 -0.858 582 HA ASP 72 HA ASP 72 -14.671 -9.125 -3.297 583 1HB ASP 72 HB2 ASP 72 -17.645 -9.304 -2.775 584 2HB ASP 72 HB1 ASP 72 -16.850 -9.769 -4.276 585 H GLY 73 HN GLY 73 -16.364 -8.252 -5.287 586 1HA GLY 73 HA2 GLY 73 -16.878 -6.398 -6.556 587 2HA GLY 73 HA1 GLY 73 -17.248 -5.576 -5.044 588 H GLU 74 HN GLU 74 -15.310 -4.913 -3.763 589 HA GLU 74 HA GLU 74 -13.125 -3.970 -5.502 590 1HB GLU 74 HB2 GLU 74 -14.318 -2.578 -3.084 591 2HB GLU 74 HB1 GLU 74 -12.967 -1.985 -4.040 592 1HG GLU 74 HG2 GLU 74 -15.779 -2.379 -5.043 593 2HG GLU 74 HG1 GLU 74 -15.060 -0.839 -4.574 594 H VAL 75 HN VAL 75 -11.961 -2.960 -2.703 595 HA VAL 75 HA VAL 75 -11.495 -5.568 -1.510 596 HB VAL 75 HB VAL 75 -9.264 -3.996 -2.779 597 1HG1 VAL 75 HG11 VAL 75 -8.580 -4.601 -0.506 598 2HG1 VAL 75 HG12 VAL 75 -7.697 -5.547 -1.704 599 3HG1 VAL 75 HG13 VAL 75 -9.032 -6.277 -0.810 600 1HG2 VAL 75 HG21 VAL 75 -10.029 -5.471 -4.369 601 2HG2 VAL 75 HG22 VAL 75 -10.504 -6.681 -3.181 602 3HG2 VAL 75 HG23 VAL 75 -8.800 -6.448 -3.566 603 H TYR 76 HN TYR 76 -12.024 -5.202 0.495 604 HA TYR 76 HA TYR 76 -10.922 -2.847 1.883 605 1HB TYR 76 HB2 TYR 76 -13.323 -2.749 1.986 606 2HB TYR 76 HB1 TYR 76 -13.434 -4.448 2.431 607 HD1 TYR 76 HD1 TYR 76 -11.079 -1.961 3.863 608 HD2 TYR 76 HD2 TYR 76 -14.597 -4.272 4.476 609 HE1 TYR 76 HE1 TYR 76 -11.070 -1.331 6.241 610 HE2 TYR 76 HE2 TYR 76 -14.599 -3.648 6.852 611 HH TYR 76 HH TYR 76 -12.699 -1.159 8.109 612 H TYR 77 HN TYR 77 -9.396 -3.275 3.364 613 HA TYR 77 HA TYR 77 -8.980 -6.090 4.061 614 1HB TYR 77 HB2 TYR 77 -7.256 -4.251 3.021 615 2HB TYR 77 HB1 TYR 77 -6.863 -4.179 4.734 616 HD1 TYR 77 HD1 TYR 77 -4.807 -5.275 4.933 617 HD2 TYR 77 HD2 TYR 77 -7.908 -7.085 2.648 618 HE1 TYR 77 HE1 TYR 77 -3.432 -7.297 4.678 619 HE2 TYR 77 HE2 TYR 77 -6.541 -9.112 2.391 620 HH TYR 77 HH TYR 77 -3.870 -9.549 2.462 621 H SER 78 HN SER 78 -9.740 -6.707 5.943 622 HA SER 78 HA SER 78 -9.650 -4.848 8.213 623 1HB SER 78 HB2 SER 78 -11.877 -5.780 7.784 624 2HB SER 78 HB1 SER 78 -11.232 -7.416 7.872 625 HG SER 78 HG SER 78 -11.117 -7.276 9.994 626 H GLU 79 HN GLU 79 -8.232 -5.221 9.850 627 HA GLU 79 HA GLU 79 -7.007 -7.868 10.066 628 1HB GLU 79 HB2 GLU 79 -5.202 -5.505 10.061 629 2HB GLU 79 HB1 GLU 79 -4.841 -7.169 9.647 630 1HG GLU 79 HG2 GLU 79 -5.983 -6.910 7.530 631 2HG GLU 79 HG1 GLU 79 -6.478 -5.279 7.966 632 H GLU 80 HN GLU 80 -8.776 -6.862 11.854 633 HA GLU 80 HA GLU 80 -9.152 -6.121 13.980 634 1HB GLU 80 HB2 GLU 80 -7.908 -7.431 15.646 635 2HB GLU 80 HB1 GLU 80 -8.470 -8.410 14.303 636 1HG GLU 80 HG2 GLU 80 -6.346 -9.207 14.651 637 2HG GLU 80 HG1 GLU 80 -6.100 -8.050 13.350 638 H ALA 81 HN ALA 81 -8.930 -4.269 14.943 639 HA ALA 81 HA ALA 81 -7.966 -2.129 15.168 640 1HB ALA 81 HB1 ALA 81 -8.217 -2.799 17.341 641 2HB ALA 81 HB2 ALA 81 -6.504 -2.384 17.294 642 3HB ALA 81 HB3 ALA 81 -7.005 -4.073 17.209 643 H LYS 82 HN LYS 82 -5.081 -3.759 16.268 644 HA LYS 82 HA LYS 82 -3.117 -2.194 15.580 645 1HB LYS 82 HB2 LYS 82 -3.124 -5.155 15.025 646 2HB LYS 82 HB1 LYS 82 -1.676 -4.162 15.122 647 1HG LYS 82 HG2 LYS 82 -2.231 -3.614 17.450 648 2HG LYS 82 HG1 LYS 82 -3.651 -4.656 17.339 649 1HD LYS 82 HD2 LYS 82 -1.807 -5.828 18.412 650 2HD LYS 82 HD1 LYS 82 -2.200 -6.572 16.861 651 1HE LYS 82 HE2 LYS 82 0.216 -6.391 17.172 652 2HE LYS 82 HE1 LYS 82 -0.330 -5.409 15.815 653 1HZ LYS 82 HZ1 LYS 82 1.309 -4.464 17.606 654 2HZ LYS 82 HZ2 LYS 82 -0.123 -4.139 18.446 655 3HZ LYS 82 HZ3 LYS 82 0.123 -3.479 16.908 656 H LYS 83 HN LYS 83 -4.762 -4.170 13.128 657 HA LYS 83 HA LYS 83 -3.455 -2.489 11.109 658 1HB LYS 83 HB2 LYS 83 -3.713 -5.495 11.029 659 2HB LYS 83 HB1 LYS 83 -3.254 -4.515 9.648 660 1HG LYS 83 HG2 LYS 83 -1.271 -3.747 10.848 661 2HG LYS 83 HG1 LYS 83 -1.739 -4.727 12.240 662 1HD LYS 83 HD2 LYS 83 -1.589 -6.750 10.848 663 2HD LYS 83 HD1 LYS 83 -1.092 -5.759 9.476 664 1HE LYS 83 HE2 LYS 83 0.831 -6.811 10.543 665 2HE LYS 83 HE1 LYS 83 0.902 -5.056 10.697 666 1HZ LYS 83 HZ1 LYS 83 -0.196 -6.786 12.834 667 2HZ LYS 83 HZ2 LYS 83 0.297 -5.172 12.946 668 3HZ LYS 83 HZ3 LYS 83 1.448 -6.395 12.746 669 H LYS 84 HN LYS 84 -4.691 -1.791 9.489 670 HA LYS 84 HA LYS 84 -7.077 -3.053 8.600 671 1HB LYS 84 HB2 LYS 84 -8.665 -1.285 9.266 672 2HB LYS 84 HB1 LYS 84 -8.004 -2.135 10.656 673 1HG LYS 84 HG2 LYS 84 -6.548 -0.312 11.166 674 2HG LYS 84 HG1 LYS 84 -6.976 0.513 9.667 675 1HD LYS 84 HD2 LYS 84 -8.123 1.477 11.616 676 2HD LYS 84 HD1 LYS 84 -9.256 0.802 10.444 677 1HE LYS 84 HE2 LYS 84 -9.869 0.246 12.757 678 2HE LYS 84 HE1 LYS 84 -9.518 -1.190 11.797 679 1HZ LYS 84 HZ1 LYS 84 -7.163 -0.279 13.062 680 2HZ LYS 84 HZ2 LYS 84 -7.953 -1.764 13.232 681 3HZ LYS 84 HZ3 LYS 84 -8.387 -0.459 14.216 682 H VAL 85 HN VAL 85 -7.274 -2.522 6.503 683 HA VAL 85 HA VAL 85 -6.525 0.155 5.625 684 HB VAL 85 HB VAL 85 -4.861 -0.474 4.104 685 1HG1 VAL 85 HG11 VAL 85 -4.249 -0.663 6.566 686 2HG1 VAL 85 HG12 VAL 85 -3.159 -1.425 5.412 687 3HG1 VAL 85 HG13 VAL 85 -4.299 -2.407 6.331 688 1HG2 VAL 85 HG21 VAL 85 -5.137 -3.410 4.544 689 2HG2 VAL 85 HG22 VAL 85 -4.480 -2.538 3.162 690 3HG2 VAL 85 HG23 VAL 85 -6.221 -2.609 3.410 691 H GLU 86 HN GLU 86 -7.623 0.852 3.817 692 HA GLU 86 HA GLU 86 -9.597 -1.037 2.709 693 1HB GLU 86 HB2 GLU 86 -9.703 1.986 2.765 694 2HB GLU 86 HB1 GLU 86 -10.971 0.914 2.190 695 1HG GLU 86 HG2 GLU 86 -11.233 0.015 4.447 696 2HG GLU 86 HG1 GLU 86 -9.963 1.091 5.022 697 H VAL 87 HN VAL 87 -9.024 -1.791 0.740 698 HA VAL 87 HA VAL 87 -7.290 -0.215 -0.978 699 HB VAL 87 HB VAL 87 -8.520 -2.890 -1.614 700 1HG1 VAL 87 HG11 VAL 87 -7.650 -2.284 -3.612 701 2HG1 VAL 87 HG12 VAL 87 -6.167 -2.885 -2.877 702 3HG1 VAL 87 HG13 VAL 87 -6.500 -1.155 -2.891 703 1HG2 VAL 87 HG21 VAL 87 -5.789 -2.454 -0.446 704 2HG2 VAL 87 HG22 VAL 87 -6.644 -3.978 -0.689 705 3HG2 VAL 87 HG23 VAL 87 -7.204 -2.840 0.536 706 H LEU 88 HN LEU 88 -8.251 1.404 -1.960 707 HA LEU 88 HA LEU 88 -10.910 1.061 -3.139 708 1HB LEU 88 HB2 LEU 88 -9.342 3.620 -2.848 709 2HB LEU 88 HB1 LEU 88 -11.062 3.443 -3.137 710 HG LEU 88 HG LEU 88 -9.636 2.692 -0.585 711 1HD1 LEU 88 HD11 LEU 88 -11.572 4.946 -1.060 712 2HD1 LEU 88 HD12 LEU 88 -9.820 5.143 -1.092 713 3HD1 LEU 88 HD13 LEU 88 -10.621 4.620 0.389 714 1HD2 LEU 88 HD21 LEU 88 -12.245 2.802 0.050 715 2HD2 LEU 88 HD22 LEU 88 -11.419 1.317 -0.422 716 3HD2 LEU 88 HD23 LEU 88 -12.360 2.218 -1.610 717 H ASP 89 HN ASP 89 -10.522 3.314 -4.965 718 HA ASP 89 HA ASP 89 -10.032 3.679 -7.144 719 1HB ASP 89 HB2 ASP 89 -7.725 3.792 -5.987 720 2HB ASP 89 HB1 ASP 89 -7.434 2.226 -6.727 721 H THR 90 HN THR 90 -8.029 1.517 -8.427 722 HA THR 90 HA THR 90 -10.183 -0.407 -8.990 723 HB THR 90 HB THR 90 -8.019 0.594 -10.850 724 HG1 THR 90 HG1 THR 90 -9.562 2.106 -10.849 725 1HG2 THR 90 HG21 THR 90 -8.371 -1.584 -11.576 726 2HG2 THR 90 HG22 THR 90 -9.453 -0.616 -12.577 727 3HG2 THR 90 HG23 THR 90 -10.094 -1.529 -11.211 728 H ASP 91 HN ASP 91 -9.753 -2.282 -8.041 729 HA ASP 91 HA ASP 91 -6.971 -3.101 -7.673 730 1HB ASP 91 HB2 ASP 91 -7.888 -4.847 -6.198 731 2HB ASP 91 HB1 ASP 91 -8.420 -3.241 -5.710 732 H TYR 92 HN TYR 92 -8.348 -3.142 -10.284 733 HA TYR 92 HA TYR 92 -8.220 -6.020 -10.836 734 1HB TYR 92 HB2 TYR 92 -9.797 -3.822 -12.162 735 2HB TYR 92 HB1 TYR 92 -9.503 -5.358 -12.967 736 HD1 TYR 92 HD1 TYR 92 -10.404 -4.508 -9.430 737 HD2 TYR 92 HD2 TYR 92 -11.462 -6.572 -12.997 738 HE1 TYR 92 HE1 TYR 92 -12.336 -5.495 -8.278 739 HE2 TYR 92 HE2 TYR 92 -13.401 -7.561 -11.854 740 HH TYR 92 HH TYR 92 -13.775 -7.559 -8.539 741 H LYS 93 HN LYS 93 -8.188 -4.033 -13.627 742 HA LYS 93 HA LYS 93 -5.260 -4.345 -13.830 743 1HB LYS 93 HB2 LYS 93 -6.714 -5.892 -15.256 744 2HB LYS 93 HB1 LYS 93 -7.169 -4.458 -16.162 745 1HG LYS 93 HG2 LYS 93 -4.383 -5.579 -15.875 746 2HG LYS 93 HG1 LYS 93 -5.413 -5.671 -17.303 747 1HD LYS 93 HD2 LYS 93 -5.375 -3.197 -17.441 748 2HD LYS 93 HD1 LYS 93 -4.266 -3.168 -16.070 749 1HE LYS 93 HE2 LYS 93 -3.072 -2.952 -18.187 750 2HE LYS 93 HE1 LYS 93 -2.624 -4.430 -17.336 751 1HZ LYS 93 HZ1 LYS 93 -4.802 -4.632 -19.259 752 2HZ LYS 93 HZ2 LYS 93 -3.561 -5.727 -18.911 753 3HZ LYS 93 HZ3 LYS 93 -3.254 -4.387 -19.897 754 H SER 94 HN SER 94 -4.751 -2.229 -13.248 755 HA SER 94 HA SER 94 -4.498 -0.300 -15.178 756 1HB SER 94 HB2 SER 94 -6.226 1.387 -14.526 757 2HB SER 94 HB1 SER 94 -6.908 -0.052 -15.279 758 HG SER 94 HG SER 94 -7.106 -0.775 -12.947 759 H TYR 95 HN TYR 95 -5.878 0.452 -12.005 760 HA TYR 95 HA TYR 95 -3.339 0.747 -10.714 761 1HB TYR 95 HB2 TYR 95 -3.952 3.310 -10.299 762 2HB TYR 95 HB1 TYR 95 -2.953 2.800 -11.655 763 HD1 TYR 95 HD1 TYR 95 -3.409 3.931 -13.593 764 HD2 TYR 95 HD2 TYR 95 -6.645 3.029 -10.982 765 HE1 TYR 95 HE1 TYR 95 -4.968 5.002 -15.161 766 HE2 TYR 95 HE2 TYR 95 -8.211 4.095 -12.546 767 HH TYR 95 HH TYR 95 -7.316 6.125 -14.953 768 H ALA 96 HN ALA 96 -3.559 0.624 -8.543 769 HA ALA 96 HA ALA 96 -6.272 0.977 -7.448 770 1HB ALA 96 HB1 ALA 96 -4.487 -1.035 -6.205 771 2HB ALA 96 HB2 ALA 96 -5.217 -1.437 -7.759 772 3HB ALA 96 HB3 ALA 96 -6.242 -1.032 -6.384 773 H VAL 97 HN VAL 97 -6.444 1.675 -5.288 774 HA VAL 97 HA VAL 97 -3.952 2.690 -4.105 775 HB VAL 97 HB VAL 97 -4.954 4.729 -3.447 776 1HG1 VAL 97 HG11 VAL 97 -4.400 5.336 -5.530 777 2HG1 VAL 97 HG12 VAL 97 -6.135 5.310 -5.843 778 3HG1 VAL 97 HG13 VAL 97 -5.147 3.908 -6.246 779 1HG2 VAL 97 HG21 VAL 97 -7.513 3.352 -4.070 780 2HG2 VAL 97 HG22 VAL 97 -7.439 5.104 -4.267 781 3HG2 VAL 97 HG23 VAL 97 -7.086 4.370 -2.701 782 H ILE 98 HN ILE 98 -3.644 2.171 -2.037 783 HA ILE 98 HA ILE 98 -5.928 1.194 -0.466 784 HB ILE 98 HB ILE 98 -4.904 -0.799 -1.182 785 1HG1 ILE 98 HG12 ILE 98 -3.921 -1.778 0.848 786 2HG1 ILE 98 HG11 ILE 98 -3.703 -0.166 1.523 787 1HG2 ILE 98 HG21 ILE 98 -2.494 0.793 -1.156 788 2HG2 ILE 98 HG22 ILE 98 -2.886 -0.657 -2.079 789 3HG2 ILE 98 HG23 ILE 98 -2.245 -0.799 -0.442 790 1HD1 ILE 98 HD11 ILE 98 -5.721 -0.298 2.400 791 2HD1 ILE 98 HD12 ILE 98 -5.970 -1.868 1.639 792 3HD1 ILE 98 HD13 ILE 98 -6.399 -0.394 0.778 793 H TYR 99 HN TYR 99 -6.141 2.452 1.250 794 HA TYR 99 HA TYR 99 -3.832 3.827 2.388 795 1HB TYR 99 HB2 TYR 99 -5.809 5.185 2.020 796 2HB TYR 99 HB1 TYR 99 -6.800 4.051 2.928 797 HD1 TYR 99 HD1 TYR 99 -3.503 5.645 3.701 798 HD2 TYR 99 HD2 TYR 99 -7.567 5.115 4.829 799 HE1 TYR 99 HE1 TYR 99 -3.091 6.932 5.752 800 HE2 TYR 99 HE2 TYR 99 -7.167 6.405 6.883 801 HH TYR 99 HH TYR 99 -5.374 8.283 7.566 802 H ALA 100 HN ALA 100 -2.737 2.879 3.971 803 HA ALA 100 HA ALA 100 -4.068 0.835 5.574 804 1HB ALA 100 HB1 ALA 100 -1.948 0.282 4.389 805 2HB ALA 100 HB2 ALA 100 -1.900 0.001 6.130 806 3HB ALA 100 HB3 ALA 100 -1.123 1.429 5.445 807 H THR 101 HN THR 101 -4.212 0.891 7.769 808 HA THR 101 HA THR 101 -2.973 3.056 9.253 809 HB THR 101 HB THR 101 -5.119 3.756 10.272 810 HG1 THR 101 HG1 THR 101 -6.221 2.049 8.300 811 1HG2 THR 101 HG21 THR 101 -4.858 4.066 7.306 812 2HG2 THR 101 HG22 THR 101 -4.463 5.221 8.577 813 3HG2 THR 101 HG23 THR 101 -6.147 4.837 8.227 814 H ARG 102 HN ARG 102 -2.287 2.320 11.142 815 HA ARG 102 HA ARG 102 -3.290 -0.259 12.089 816 1HB ARG 102 HB2 ARG 102 -0.828 1.307 12.886 817 2HB ARG 102 HB1 ARG 102 -1.269 -0.270 13.523 818 1HG ARG 102 HG2 ARG 102 -1.072 -1.232 11.284 819 2HG ARG 102 HG1 ARG 102 -0.624 0.353 10.647 820 1HD ARG 102 HD2 ARG 102 1.339 -1.063 11.037 821 2HD ARG 102 HD1 ARG 102 1.357 0.380 12.049 822 HE ARG 102 HE ARG 102 0.158 -1.695 13.490 823 1HH1 ARG 102 HH11 ARG 102 3.282 -0.827 12.202 824 2HH1 ARG 102 HH12 ARG 102 4.162 -1.689 13.419 825 1HH2 ARG 102 HH21 ARG 102 1.311 -2.828 15.091 826 2HH2 ARG 102 HH22 ARG 102 3.043 -2.826 15.060 827 H VAL 103 HN VAL 103 -4.072 -0.550 14.200 828 HA VAL 103 HA VAL 103 -4.425 1.878 15.800 829 HB VAL 103 HB VAL 103 -6.688 0.005 15.111 830 1HG1 VAL 103 HG11 VAL 103 -7.885 2.102 16.254 831 2HG1 VAL 103 HG12 VAL 103 -6.351 2.150 17.124 832 3HG1 VAL 103 HG13 VAL 103 -7.348 0.695 17.170 833 1HG2 VAL 103 HG21 VAL 103 -7.645 1.911 13.928 834 2HG2 VAL 103 HG22 VAL 103 -6.074 1.478 13.254 835 3HG2 VAL 103 HG23 VAL 103 -6.223 2.879 14.316 836 H LYS 104 HN LYS 104 -4.143 1.611 17.886 837 HA LYS 104 HA LYS 104 -4.592 -0.951 19.172 838 1HB LYS 104 HB2 LYS 104 -2.251 -1.102 18.410 839 2HB LYS 104 HB1 LYS 104 -1.887 0.407 19.236 840 1HG LYS 104 HG2 LYS 104 -1.113 -1.481 20.533 841 2HG LYS 104 HG1 LYS 104 -2.413 -0.646 21.384 842 1HD LYS 104 HD2 LYS 104 -4.005 -2.338 20.607 843 2HD LYS 104 HD1 LYS 104 -2.705 -3.167 19.749 844 1HE LYS 104 HE2 LYS 104 -3.193 -4.244 21.889 845 2HE LYS 104 HE1 LYS 104 -1.559 -3.585 21.855 846 1HZ LYS 104 HZ1 LYS 104 -2.657 -3.106 23.948 847 2HZ LYS 104 HZ2 LYS 104 -3.913 -2.310 23.143 848 3HZ LYS 104 HZ3 LYS 104 -2.347 -1.671 23.107 849 H ASP 105 HN ASP 105 -4.817 -0.752 21.446 850 HA ASP 105 HA ASP 105 -5.948 1.673 22.296 851 1HB ASP 105 HB2 ASP 105 -4.954 -0.637 23.981 852 2HB ASP 105 HB1 ASP 105 -6.038 0.639 24.528 853 H GLY 106 HN GLY 106 -3.932 2.940 21.511 854 1HA GLY 106 HA2 GLY 106 -2.765 4.266 23.590 855 2HA GLY 106 HA1 GLY 106 -1.672 2.930 23.285 856 H ARG 107 HN ARG 107 -2.104 2.945 20.375 857 HA ARG 107 HA ARG 107 -1.036 5.571 19.634 858 1HB ARG 107 HB2 ARG 107 0.836 4.556 18.418 859 2HB ARG 107 HB1 ARG 107 0.914 4.211 20.139 860 1HG ARG 107 HG2 ARG 107 -0.226 1.992 19.553 861 2HG ARG 107 HG1 ARG 107 0.219 2.363 17.886 862 1HD ARG 107 HD2 ARG 107 2.138 2.209 20.209 863 2HD ARG 107 HD1 ARG 107 1.873 0.928 19.029 864 HE ARG 107 HE ARG 107 3.516 3.224 18.713 865 1HH1 ARG 107 HH11 ARG 107 1.403 1.076 16.952 866 2HH1 ARG 107 HH12 ARG 107 2.211 1.319 15.442 867 1HH2 ARG 107 HH21 ARG 107 4.581 3.543 16.728 868 2HH2 ARG 107 HH22 ARG 107 4.015 2.722 15.312 869 H THR 108 HN THR 108 -1.425 6.234 17.584 870 HA THR 108 HA THR 108 -3.039 4.446 15.883 871 HB THR 108 HB THR 108 -3.200 7.455 16.158 872 HG1 THR 108 HG1 THR 108 -4.932 5.372 16.979 873 1HG2 THR 108 HG21 THR 108 -5.060 5.689 14.602 874 2HG2 THR 108 HG22 THR 108 -3.725 6.577 13.868 875 3HG2 THR 108 HG23 THR 108 -5.029 7.451 14.672 876 H LEU 109 HN LEU 109 -2.620 4.425 13.657 877 HA LEU 109 HA LEU 109 -0.333 6.028 12.744 878 1HB LEU 109 HB2 LEU 109 -0.663 3.086 12.170 879 2HB LEU 109 HB1 LEU 109 0.637 4.116 11.609 880 HG LEU 109 HG LEU 109 1.310 4.441 14.008 881 1HD1 LEU 109 HD11 LEU 109 0.262 2.135 15.166 882 2HD1 LEU 109 HD12 LEU 109 -1.117 2.941 14.422 883 3HD1 LEU 109 HD13 LEU 109 -0.114 3.805 15.587 884 1HD2 LEU 109 HD21 LEU 109 1.966 2.488 12.236 885 2HD2 LEU 109 HD22 LEU 109 1.474 1.539 13.638 886 3HD2 LEU 109 HD23 LEU 109 2.755 2.741 13.792 887 H HIS 110 HN HIS 110 -0.569 6.905 10.797 888 HA HIS 110 HA HIS 110 -2.742 5.917 9.071 889 1HB HIS 110 HB2 HIS 110 -1.807 8.756 9.510 890 2HB HIS 110 HB1 HIS 110 -2.935 8.276 8.247 891 HD1 HIS 110 HD1 HIS 110 -4.143 10.251 9.973 892 HD2 HIS 110 HD2 HIS 110 -4.071 6.251 11.091 893 HE1 HIS 110 HE1 HIS 110 -5.986 9.991 11.665 894 HE2 HIS 110 HE2 HIS 110 -5.878 7.577 12.377 895 H MET 111 HN MET 111 -2.127 5.280 7.087 896 HA MET 111 HA MET 111 0.172 6.478 5.791 897 1HB MET 111 HB2 MET 111 0.139 3.497 6.248 898 2HB MET 111 HB1 MET 111 1.425 4.462 5.535 899 1HG MET 111 HG2 MET 111 1.651 5.617 7.736 900 2HG MET 111 HG1 MET 111 0.535 4.434 8.400 901 1HE MET 111 HE1 MET 111 2.485 4.682 9.956 902 2HE MET 111 HE2 MET 111 4.156 4.257 9.585 903 3HE MET 111 HE3 MET 111 3.056 3.033 10.218 904 H MET 112 HN MET 112 -0.137 6.588 3.660 905 HA MET 112 HA MET 112 -2.343 5.045 2.517 906 1HB MET 112 HB2 MET 112 -1.073 7.639 1.744 907 2HB MET 112 HB1 MET 112 -1.921 6.696 0.536 908 1HG MET 112 HG2 MET 112 -3.920 6.729 1.999 909 2HG MET 112 HG1 MET 112 -3.054 7.817 3.081 910 1HE MET 112 HE1 MET 112 -5.298 10.006 2.400 911 2HE MET 112 HE2 MET 112 -5.642 8.283 2.252 912 3HE MET 112 HE3 MET 112 -6.006 9.375 0.914 913 H ARG 113 HN ARG 113 -2.131 3.893 0.628 914 HA ARG 113 HA ARG 113 0.553 3.505 -0.448 915 1HB ARG 113 HB2 ARG 113 -0.135 1.842 1.468 916 2HB ARG 113 HB1 ARG 113 -1.102 1.093 0.206 917 1HG ARG 113 HG2 ARG 113 0.882 0.699 -1.124 918 2HG ARG 113 HG1 ARG 113 1.873 1.534 0.076 919 1HD ARG 113 HD2 ARG 113 1.237 -0.140 1.756 920 2HD ARG 113 HD1 ARG 113 0.271 -0.981 0.548 921 HE ARG 113 HE ARG 113 2.181 -1.976 -0.183 922 1HH1 ARG 113 HH11 ARG 113 3.064 0.945 1.510 923 2HH1 ARG 113 HH12 ARG 113 4.766 0.668 1.355 924 1HH2 ARG 113 HH21 ARG 113 4.414 -2.346 -0.381 925 2HH2 ARG 113 HH22 ARG 113 5.534 -1.204 0.283 926 H LEU 114 HN LEU 114 0.535 2.848 -2.634 927 HA LEU 114 HA LEU 114 -2.100 2.418 -3.846 928 1HB LEU 114 HB2 LEU 114 -1.513 4.836 -3.952 929 2HB LEU 114 HB1 LEU 114 -0.085 4.411 -4.872 930 HG LEU 114 HG LEU 114 -2.896 3.830 -5.803 931 1HD1 LEU 114 HD11 LEU 114 -2.082 6.316 -5.477 932 2HD1 LEU 114 HD12 LEU 114 -2.985 5.825 -6.910 933 3HD1 LEU 114 HD13 LEU 114 -1.231 5.989 -6.987 934 1HD2 LEU 114 HD21 LEU 114 -1.564 3.847 -8.033 935 2HD2 LEU 114 HD22 LEU 114 -1.518 2.415 -7.005 936 3HD2 LEU 114 HD23 LEU 114 -0.169 3.551 -6.996 937 H TYR 115 HN TYR 115 -2.063 0.696 -5.093 938 HA TYR 115 HA TYR 115 0.512 -0.225 -6.158 939 1HB TYR 115 HB2 TYR 115 -2.068 -1.746 -5.730 940 2HB TYR 115 HB1 TYR 115 -0.576 -2.427 -6.355 941 HD1 TYR 115 HD1 TYR 115 -1.200 -0.152 -3.447 942 HD2 TYR 115 HD2 TYR 115 0.206 -3.941 -4.766 943 HE1 TYR 115 HE1 TYR 115 -0.496 -0.690 -1.164 944 HE2 TYR 115 HE2 TYR 115 0.905 -4.486 -2.483 945 HH TYR 115 HH TYR 115 0.048 -3.598 -0.041 946 H SER 116 HN SER 116 0.848 0.349 -8.208 947 HA SER 116 HA SER 116 -1.409 0.686 -10.028 948 1HB SER 116 HB2 SER 116 0.305 2.456 -9.976 949 2HB SER 116 HB1 SER 116 1.537 1.278 -10.427 950 HG SER 116 HG SER 116 -0.753 1.837 -12.001 951 H ARG 117 HN ARG 117 -1.842 -0.659 -11.701 952 HA ARG 117 HA ARG 117 -0.438 -3.186 -11.769 953 1HB ARG 117 HB2 ARG 117 -2.846 -2.188 -13.293 954 2HB ARG 117 HB1 ARG 117 -2.168 -3.799 -13.483 955 1HG ARG 117 HG2 ARG 117 -3.887 -4.161 -11.994 956 2HG ARG 117 HG1 ARG 117 -2.499 -3.978 -10.922 957 1HD ARG 117 HD2 ARG 117 -3.208 -1.466 -10.904 958 2HD ARG 117 HD1 ARG 117 -4.760 -2.094 -11.441 959 HE ARG 117 HE ARG 117 -5.141 -2.751 -9.304 960 1HH1 ARG 117 HH11 ARG 117 -1.688 -2.570 -9.776 961 2HH1 ARG 117 HH12 ARG 117 -1.317 -2.906 -8.119 962 1HH2 ARG 117 HH21 ARG 117 -4.652 -3.194 -7.121 963 2HH2 ARG 117 HH22 ARG 117 -2.999 -3.238 -6.612 964 H SER 118 HN SER 118 -0.941 -0.413 -13.881 965 HA SER 118 HA SER 118 1.279 -1.385 -15.546 966 1HB SER 118 HB2 SER 118 -1.235 -0.012 -16.529 967 2HB SER 118 HB1 SER 118 0.156 -0.432 -17.530 968 HG SER 118 HG SER 118 -1.285 -2.347 -16.021 969 HA PRO 119 HA PRO 119 3.447 2.368 -14.750 970 1HB PRO 119 HB2 PRO 119 3.716 2.466 -17.730 971 2HB PRO 119 HB1 PRO 119 4.952 2.675 -16.483 972 1HG PRO 119 HG2 PRO 119 4.745 0.384 -17.827 973 2HG PRO 119 HG1 PRO 119 5.140 0.398 -16.099 974 1HD PRO 119 HD2 PRO 119 2.610 -0.360 -17.454 975 2HD PRO 119 HD1 PRO 119 3.288 -0.937 -15.920 976 H GLU 120 HN GLU 120 0.995 2.276 -17.267 977 HA GLU 120 HA GLU 120 0.708 5.056 -17.656 978 1HB GLU 120 HB2 GLU 120 -0.125 3.411 -19.253 979 2HB GLU 120 HB1 GLU 120 -1.282 2.822 -18.071 980 1HG GLU 120 HG2 GLU 120 -2.442 4.957 -18.116 981 2HG GLU 120 HG1 GLU 120 -1.260 5.586 -19.263 982 H VAL 121 HN VAL 121 0.871 5.393 -15.145 983 HA VAL 121 HA VAL 121 -1.545 5.003 -13.660 984 HB VAL 121 HB VAL 121 0.771 6.843 -13.033 985 1HG1 VAL 121 HG11 VAL 121 -1.278 5.688 -11.149 986 2HG1 VAL 121 HG12 VAL 121 -1.389 7.305 -11.843 987 3HG1 VAL 121 HG13 VAL 121 -0.038 6.890 -10.790 988 1HG2 VAL 121 HG21 VAL 121 0.400 3.936 -12.789 989 2HG2 VAL 121 HG22 VAL 121 1.019 4.738 -11.346 990 3HG2 VAL 121 HG23 VAL 121 1.881 4.888 -12.878 991 H SER 122 HN SER 122 -3.263 5.958 -14.648 992 HA SER 122 HA SER 122 -3.308 8.479 -15.864 993 1HB SER 122 HB2 SER 122 -5.041 6.782 -16.245 994 2HB SER 122 HB1 SER 122 -5.584 6.959 -14.575 995 HG SER 122 HG SER 122 -6.148 8.489 -16.750 996 HA PRO 123 HA PRO 123 -3.325 11.547 -12.692 997 1HB PRO 123 HB2 PRO 123 -5.543 13.018 -13.583 998 2HB PRO 123 HB1 PRO 123 -3.866 13.272 -14.075 999 1HG PRO 123 HG2 PRO 123 -6.039 11.765 -15.454 1000 2HG PRO 123 HG1 PRO 123 -4.756 12.774 -16.148 1001 1HD PRO 123 HD2 PRO 123 -4.599 10.118 -16.252 1002 2HD PRO 123 HD1 PRO 123 -3.153 11.096 -15.924 1003 H ALA 124 HN ALA 124 -6.344 9.963 -13.595 1004 HA ALA 124 HA ALA 124 -7.891 10.731 -11.384 1005 1HB ALA 124 HB1 ALA 124 -8.104 8.801 -13.542 1006 2HB ALA 124 HB2 ALA 124 -9.362 9.724 -12.724 1007 3HB ALA 124 HB3 ALA 124 -8.800 8.200 -12.037 1008 H ALA 125 HN ALA 125 -5.985 7.775 -11.923 1009 HA ALA 125 HA ALA 125 -6.492 6.492 -9.534 1010 1HB ALA 125 HB1 ALA 125 -4.825 6.080 -11.692 1011 2HB ALA 125 HB2 ALA 125 -5.003 5.021 -10.294 1012 3HB ALA 125 HB3 ALA 125 -3.713 6.222 -10.330 1013 H THR 126 HN THR 126 -3.855 8.766 -10.250 1014 HA THR 126 HA THR 126 -2.915 8.782 -7.549 1015 HB THR 126 HB THR 126 -2.333 10.660 -9.837 1016 HG1 THR 126 HG1 THR 126 -0.569 9.372 -10.169 1017 1HG2 THR 126 HG21 THR 126 -1.126 10.411 -7.117 1018 2HG2 THR 126 HG22 THR 126 -1.591 11.857 -8.011 1019 3HG2 THR 126 HG23 THR 126 -0.156 10.948 -8.489 1020 H ALA 127 HN ALA 127 -4.722 11.133 -9.525 1021 HA ALA 127 HA ALA 127 -4.970 13.059 -7.464 1022 1HB ALA 127 HB1 ALA 127 -6.287 14.290 -8.928 1023 2HB ALA 127 HB2 ALA 127 -6.896 12.849 -9.742 1024 3HB ALA 127 HB3 ALA 127 -5.230 13.365 -9.998 1025 H ILE 128 HN ILE 128 -7.292 10.633 -8.705 1026 HA ILE 128 HA ILE 128 -9.406 11.321 -7.028 1027 HB ILE 128 HB ILE 128 -8.745 8.585 -8.127 1028 1HG1 ILE 128 HG12 ILE 128 -10.690 10.693 -9.099 1029 2HG1 ILE 128 HG11 ILE 128 -9.115 10.377 -9.815 1030 1HG2 ILE 128 HG21 ILE 128 -11.149 8.102 -7.744 1031 2HG2 ILE 128 HG22 ILE 128 -11.275 9.622 -6.859 1032 3HG2 ILE 128 HG23 ILE 128 -10.233 8.334 -6.255 1033 1HD1 ILE 128 HD11 ILE 128 -10.696 9.288 -11.168 1034 2HD1 ILE 128 HD12 ILE 128 -11.522 8.587 -9.775 1035 3HD1 ILE 128 HD13 ILE 128 -9.911 8.025 -10.224 1036 H PHE 129 HN PHE 129 -6.783 8.959 -6.478 1037 HA PHE 129 HA PHE 129 -7.641 7.970 -4.028 1038 1HB PHE 129 HB2 PHE 129 -5.668 7.093 -5.229 1039 2HB PHE 129 HB1 PHE 129 -4.788 8.569 -4.860 1040 HD1 PHE 129 HD1 PHE 129 -2.997 7.596 -3.647 1041 HD2 PHE 129 HD2 PHE 129 -7.024 6.814 -2.511 1042 HE1 PHE 129 HE1 PHE 129 -2.205 6.601 -1.540 1043 HE2 PHE 129 HE2 PHE 129 -6.239 5.819 -0.403 1044 HZ PHE 129 HZ PHE 129 -3.828 5.713 0.086 1045 H ARG 130 HN ARG 130 -5.730 10.835 -4.765 1046 HA ARG 130 HA ARG 130 -5.547 11.752 -2.069 1047 1HB ARG 130 HB2 ARG 130 -3.902 12.446 -3.734 1048 2HB ARG 130 HB1 ARG 130 -5.165 13.177 -4.713 1049 1HG ARG 130 HG2 ARG 130 -5.591 14.807 -2.937 1050 2HG ARG 130 HG1 ARG 130 -4.297 14.088 -1.975 1051 1HD ARG 130 HD2 ARG 130 -3.543 16.098 -3.171 1052 2HD ARG 130 HD1 ARG 130 -2.675 14.657 -3.699 1053 HE ARG 130 HE ARG 130 -4.890 15.067 -5.378 1054 1HH1 ARG 130 HH11 ARG 130 -1.782 16.484 -4.650 1055 2HH1 ARG 130 HH12 ARG 130 -1.579 17.153 -6.234 1056 1HH2 ARG 130 HH21 ARG 130 -4.622 15.943 -7.455 1057 2HH2 ARG 130 HH22 ARG 130 -3.191 16.846 -7.827 1058 H LYS 131 HN LYS 131 -7.711 12.235 -4.778 1059 HA LYS 131 HA LYS 131 -9.204 14.417 -3.859 1060 1HB LYS 131 HB2 LYS 131 -9.281 13.346 -6.161 1061 2HB LYS 131 HB1 LYS 131 -10.288 12.093 -5.454 1062 1HG LYS 131 HG2 LYS 131 -12.012 13.675 -4.941 1063 2HG LYS 131 HG1 LYS 131 -10.983 15.020 -5.436 1064 1HD LYS 131 HD2 LYS 131 -12.601 14.496 -7.175 1065 2HD LYS 131 HD1 LYS 131 -10.964 14.153 -7.731 1066 1HE LYS 131 HE2 LYS 131 -11.307 11.775 -7.227 1067 2HE LYS 131 HE1 LYS 131 -12.952 12.131 -6.704 1068 1HZ LYS 131 HZ1 LYS 131 -13.041 11.348 -8.931 1069 2HZ LYS 131 HZ2 LYS 131 -11.839 12.424 -9.439 1070 3HZ LYS 131 HZ3 LYS 131 -13.358 13.009 -8.980 1071 H LEU 132 HN LEU 132 -9.589 10.933 -3.370 1072 HA LEU 132 HA LEU 132 -11.960 10.984 -1.881 1073 1HB LEU 132 HB2 LEU 132 -9.602 9.103 -1.687 1074 2HB LEU 132 HB1 LEU 132 -11.154 8.826 -0.920 1075 HG LEU 132 HG LEU 132 -10.679 9.003 -3.898 1076 1HD1 LEU 132 HD11 LEU 132 -9.977 6.943 -2.324 1077 2HD1 LEU 132 HD12 LEU 132 -10.554 6.753 -3.980 1078 3HD1 LEU 132 HD13 LEU 132 -11.665 6.533 -2.628 1079 1HD2 LEU 132 HD21 LEU 132 -13.174 8.377 -2.321 1080 2HD2 LEU 132 HD22 LEU 132 -13.006 8.220 -4.069 1081 3HD2 LEU 132 HD23 LEU 132 -12.891 9.809 -3.312 1082 H ALA 133 HN ALA 133 -8.583 11.372 -0.980 1083 HA ALA 133 HA ALA 133 -8.953 11.502 1.816 1084 1HB ALA 133 HB1 ALA 133 -6.796 12.092 -0.081 1085 2HB ALA 133 HB2 ALA 133 -6.737 11.314 1.500 1086 3HB ALA 133 HB3 ALA 133 -6.762 13.073 1.385 1087 H GLY 134 HN GLY 134 -8.990 13.967 -0.733 1088 1HA GLY 134 HA2 GLY 134 -9.166 16.220 0.940 1089 2HA GLY 134 HA1 GLY 134 -9.719 16.147 -0.725 1090 H GLU 135 HN GLU 135 -11.761 14.314 -0.583 1091 HA GLU 135 HA GLU 135 -13.927 15.820 0.245 1092 1HB GLU 135 HB2 GLU 135 -13.780 12.810 -0.006 1093 2HB GLU 135 HB1 GLU 135 -15.260 13.759 0.028 1094 1HG GLU 135 HG2 GLU 135 -13.115 13.916 -2.079 1095 2HG GLU 135 HG1 GLU 135 -14.667 13.096 -2.234 1096 H ARG 136 HN ARG 136 -12.293 13.178 1.967 1097 HA ARG 136 HA ARG 136 -13.956 13.458 4.298 1098 1HB ARG 136 HB2 ARG 136 -12.438 11.794 5.310 1099 2HB ARG 136 HB1 ARG 136 -13.045 11.268 3.747 1100 1HG ARG 136 HG2 ARG 136 -10.913 12.003 2.721 1101 2HG ARG 136 HG1 ARG 136 -10.315 12.394 4.334 1102 1HD ARG 136 HD2 ARG 136 -9.521 10.209 3.616 1103 2HD ARG 136 HD1 ARG 136 -10.593 10.063 5.009 1104 HE ARG 136 HE ARG 136 -12.114 9.764 2.676 1105 1HH1 ARG 136 HH11 ARG 136 -9.626 8.079 4.457 1106 2HH1 ARG 136 HH12 ARG 136 -10.128 6.512 3.917 1107 1HH2 ARG 136 HH21 ARG 136 -12.771 7.704 1.967 1108 2HH2 ARG 136 HH22 ARG 136 -11.912 6.299 2.503 1109 H ASN 137 HN ASN 137 -10.556 14.147 3.533 1110 HA ASN 137 HA ASN 137 -10.322 16.580 4.766 1111 1HB ASN 137 HB2 ASN 137 -10.902 15.524 6.890 1112 2HB ASN 137 HB1 ASN 137 -9.633 14.325 6.674 1113 1HD2 ASN 137 HD21 ASN 137 -7.940 14.691 7.880 1114 2HD2 ASN 137 HD22 ASN 137 -7.328 16.236 8.351 1115 H TYR 138 HN TYR 138 -8.403 17.416 4.111 1116 HA TYR 138 HA TYR 138 -6.668 15.935 2.503 1117 1HB TYR 138 HB2 TYR 138 -6.948 18.455 2.537 1118 2HB TYR 138 HB1 TYR 138 -5.895 18.472 3.950 1119 HD1 TYR 138 HD1 TYR 138 -3.859 19.390 3.291 1120 HD2 TYR 138 HD2 TYR 138 -5.736 16.511 0.782 1121 HE1 TYR 138 HE1 TYR 138 -1.895 19.404 1.810 1122 HE2 TYR 138 HE2 TYR 138 -3.776 16.517 -0.704 1123 HH TYR 138 HH TYR 138 -1.404 17.069 -0.623 1124 H THR 139 HN THR 139 -4.899 14.705 2.887 1125 HA THR 139 HA THR 139 -4.321 13.897 5.565 1126 HB THR 139 HB THR 139 -4.171 12.331 3.668 1127 HG1 THR 139 HG1 THR 139 -2.546 11.290 4.582 1128 1HG2 THR 139 HG21 THR 139 -2.744 12.495 1.923 1129 2HG2 THR 139 HG22 THR 139 -1.529 13.369 2.852 1130 3HG2 THR 139 HG23 THR 139 -2.946 14.220 2.236 1131 H ASP 140 HN ASP 140 -3.787 16.573 5.646 1132 HA ASP 140 HA ASP 140 -1.212 17.408 5.031 1133 1HB ASP 140 HB2 ASP 140 -3.001 18.922 5.836 1134 2HB ASP 140 HB1 ASP 140 -2.859 18.214 7.442 1135 H GLU 141 HN GLU 141 -2.382 15.419 7.644 1136 HA GLU 141 HA GLU 141 -0.474 15.469 9.561 1137 1HB GLU 141 HB2 GLU 141 -2.278 13.978 9.827 1138 2HB GLU 141 HB1 GLU 141 -1.914 13.130 8.330 1139 1HG GLU 141 HG2 GLU 141 0.114 12.211 9.361 1140 2HG GLU 141 HG1 GLU 141 -0.293 13.032 10.870 1141 H MET 142 HN MET 142 -0.240 13.234 6.807 1142 HA MET 142 HA MET 142 2.548 13.777 6.456 1143 1HB MET 142 HB2 MET 142 2.819 12.318 8.330 1144 2HB MET 142 HB1 MET 142 1.665 11.164 7.688 1145 1HG MET 142 HG2 MET 142 3.909 10.318 7.434 1146 2HG MET 142 HG1 MET 142 3.221 10.658 5.849 1147 1HE MET 142 HE1 MET 142 6.476 12.705 8.155 1148 2HE MET 142 HE2 MET 142 4.901 12.180 8.749 1149 3HE MET 142 HE3 MET 142 5.095 13.800 8.080 1150 H VAL 143 HN VAL 143 3.258 13.141 4.477 1151 HA VAL 143 HA VAL 143 1.333 11.714 2.746 1152 HB VAL 143 HB VAL 143 3.173 13.997 1.970 1153 1HG1 VAL 143 HG11 VAL 143 1.530 14.010 -0.046 1154 2HG1 VAL 143 HG12 VAL 143 1.235 12.337 0.419 1155 3HG1 VAL 143 HG13 VAL 143 2.865 12.856 -0.010 1156 1HG2 VAL 143 HG21 VAL 143 0.242 14.348 1.882 1157 2HG2 VAL 143 HG22 VAL 143 1.510 15.494 2.315 1158 3HG2 VAL 143 HG23 VAL 143 0.973 14.288 3.485 1159 H ALA 144 HN ALA 144 2.670 11.145 0.543 1160 HA ALA 144 HA ALA 144 5.394 10.452 0.873 1161 1HB ALA 144 HB1 ALA 144 4.159 7.903 0.471 1162 2HB ALA 144 HB2 ALA 144 3.564 8.616 1.968 1163 3HB ALA 144 HB3 ALA 144 5.296 8.406 1.722 1164 H MET 145 HN MET 145 6.315 10.222 -1.122 1165 HA MET 145 HA MET 145 4.560 9.546 -3.376 1166 1HB MET 145 HB2 MET 145 5.548 11.369 -4.722 1167 2HB MET 145 HB1 MET 145 4.609 11.966 -3.359 1168 1HG MET 145 HG2 MET 145 6.673 12.330 -2.102 1169 2HG MET 145 HG1 MET 145 7.609 11.734 -3.471 1170 1HE MET 145 HE1 MET 145 5.325 15.660 -3.105 1171 2HE MET 145 HE2 MET 145 5.037 14.153 -2.235 1172 3HE MET 145 HE3 MET 145 4.408 14.362 -3.870 1173 H LEU 146 HN LEU 146 5.450 8.320 -4.899 1174 HA LEU 146 HA LEU 146 7.291 6.569 -4.903 1175 1HB LEU 146 HB2 LEU 146 6.113 7.367 -6.936 1176 2HB LEU 146 HB1 LEU 146 7.314 8.627 -7.106 1177 HG LEU 146 HG LEU 146 7.941 5.675 -7.224 1178 1HD1 LEU 146 HD11 LEU 146 8.126 7.330 -9.650 1179 2HD1 LEU 146 HD12 LEU 146 6.491 6.993 -9.081 1180 3HD1 LEU 146 HD13 LEU 146 7.590 5.663 -9.447 1181 1HD2 LEU 146 HD21 LEU 146 9.544 8.146 -7.311 1182 2HD2 LEU 146 HD22 LEU 146 9.929 6.939 -8.537 1183 3HD2 LEU 146 HD23 LEU 146 9.998 6.511 -6.828 1184 HA PRO 147 HA PRO 147 11.198 8.005 -3.342 1185 1HB PRO 147 HB2 PRO 147 12.737 6.122 -4.718 1186 2HB PRO 147 HB1 PRO 147 12.011 5.902 -3.124 1187 1HG PRO 147 HG2 PRO 147 11.020 5.026 -5.801 1188 2HG PRO 147 HG1 PRO 147 10.952 4.179 -4.244 1189 1HD PRO 147 HD2 PRO 147 8.788 5.367 -5.236 1190 2HD PRO 147 HD1 PRO 147 9.145 5.449 -3.496 1191 H ARG 148 HN ARG 148 12.380 9.663 -4.007 1192 HA ARG 148 HA ARG 148 12.603 10.243 -6.852 1193 1HB ARG 148 HB2 ARG 148 13.461 12.421 -6.121 1194 2HB ARG 148 HB1 ARG 148 11.931 12.044 -5.338 1195 1HG ARG 148 HG2 ARG 148 13.115 11.379 -3.316 1196 2HG ARG 148 HG1 ARG 148 14.657 11.722 -4.101 1197 1HD ARG 148 HD2 ARG 148 12.470 13.721 -3.543 1198 2HD ARG 148 HD1 ARG 148 13.973 13.552 -2.637 1199 HE ARG 148 HE ARG 148 14.597 13.955 -5.337 1200 1HH1 ARG 148 HH11 ARG 148 13.225 15.682 -2.635 1201 2HH1 ARG 148 HH12 ARG 148 13.750 17.233 -3.198 1202 1HH2 ARG 148 HH21 ARG 148 15.289 15.996 -6.081 1203 2HH2 ARG 148 HH22 ARG 148 14.921 17.412 -5.154 1204 H GLN 149 HN GLN 149 14.198 8.071 -5.472 1205 HA GLN 149 HA GLN 149 16.697 8.666 -6.753 1206 1HB GLN 149 HB2 GLN 149 16.618 8.342 -3.750 1207 2HB GLN 149 HB1 GLN 149 18.082 8.282 -4.721 1208 1HG GLN 149 HG2 GLN 149 17.645 10.590 -5.463 1209 2HG GLN 149 HG1 GLN 149 16.242 10.636 -4.398 1210 1HE2 GLN 149 HE21 GLN 149 16.604 11.641 -2.576 1211 2HE2 GLN 149 HE22 GLN 149 18.095 11.682 -1.705 1212 H GLU 150 HN GLU 150 18.126 6.844 -6.842 1213 HA GLU 150 HA GLU 150 16.654 4.332 -6.609 1214 1HB GLU 150 HB2 GLU 150 19.154 5.002 -8.162 1215 2HB GLU 150 HB1 GLU 150 18.343 3.439 -8.168 1216 1HG GLU 150 HG2 GLU 150 16.324 4.504 -9.065 1217 2HG GLU 150 HG1 GLU 150 17.169 6.050 -9.102 1218 H GLU 151 HN GLU 151 17.233 4.970 -4.223 1219 HA GLU 151 HA GLU 151 18.795 2.941 -3.161 1220 1HB GLU 151 HB2 GLU 151 20.667 4.355 -2.181 1221 2HB GLU 151 HB1 GLU 151 20.777 4.017 -3.901 1222 1HG GLU 151 HG2 GLU 151 19.852 6.238 -4.382 1223 2HG GLU 151 HG1 GLU 151 19.814 6.581 -2.653 1224 H CYS 152 HN CYS 152 19.609 5.285 -1.009 1225 HA CYS 152 HA CYS 152 17.238 4.800 0.549 1226 1HB CYS 152 HB2 CYS 152 19.753 6.379 1.093 1227 2HB CYS 152 HB1 CYS 152 18.412 6.303 2.233 1228 H THR 153 HN THR 153 15.680 5.746 -0.789 1229 HA THR 153 HA THR 153 15.702 8.451 -1.602 1230 HB THR 153 HB THR 153 13.459 8.045 -2.350 1231 HG1 THR 153 HG1 THR 153 13.523 5.827 -0.585 1232 1HG2 THR 153 HG21 THR 153 13.927 5.386 -2.964 1233 2HG2 THR 153 HG22 THR 153 15.530 6.114 -2.839 1234 3HG2 THR 153 HG23 THR 153 14.333 6.797 -3.938 1235 H VAL 154 HN VAL 154 12.846 8.935 -0.830 1236 HA VAL 154 HA VAL 154 13.169 10.757 1.190 1237 HB VAL 154 HB VAL 154 10.710 10.657 1.519 1238 1HG1 VAL 154 HG11 VAL 154 11.503 12.077 -0.203 1239 2HG1 VAL 154 HG12 VAL 154 10.136 11.189 -0.873 1240 3HG1 VAL 154 HG13 VAL 154 11.781 10.716 -1.291 1241 1HG2 VAL 154 HG21 VAL 154 10.270 8.788 -0.687 1242 2HG2 VAL 154 HG22 VAL 154 9.420 8.951 0.847 1243 3HG2 VAL 154 HG23 VAL 154 10.922 8.033 0.767 1244 H ASP 155 HN ASP 155 14.356 9.972 2.903 1245 HA ASP 155 HA ASP 155 13.616 7.661 4.395 1246 1HB ASP 155 HB2 ASP 155 15.919 8.493 4.370 1247 2HB ASP 155 HB1 ASP 155 15.401 9.990 5.139 1248 H GLU 156 HN GLU 156 11.261 8.560 4.378 1249 HA GLU 156 HA GLU 156 10.646 9.312 7.056 1250 1HB GLU 156 HB2 GLU 156 9.505 11.433 6.548 1251 2HB GLU 156 HB1 GLU 156 11.232 11.528 6.232 1252 1HG GLU 156 HG2 GLU 156 10.827 11.241 3.850 1253 2HG GLU 156 HG1 GLU 156 9.096 11.107 4.153 1254 H VAL 157 HN VAL 157 9.951 7.123 5.554 1255 HA VAL 157 HA VAL 157 7.171 7.024 5.879 1256 HB VAL 157 HB VAL 157 7.064 8.421 3.886 1257 1HG1 VAL 157 HG11 VAL 157 8.075 7.962 1.863 1258 2HG1 VAL 157 HG12 VAL 157 8.268 6.247 2.226 1259 3HG1 VAL 157 HG13 VAL 157 9.306 7.438 3.013 1260 1HG2 VAL 157 HG21 VAL 157 5.910 5.784 4.105 1261 2HG2 VAL 157 HG22 VAL 157 6.056 6.278 2.418 1262 3HG2 VAL 157 HG23 VAL 157 5.176 7.291 3.562
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