NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
500838 | 2l4t | 17255 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 HT1 MET 1 16.331 27.658 -1.596 2 H2 MET 1 HT2 MET 1 14.661 27.507 -1.335 3 H3 MET 1 HT3 MET 1 15.235 28.538 -2.550 4 HA MET 1 HA MET 1 14.379 26.511 -3.500 5 HB2 MET 1 HB2 MET 1 17.392 26.761 -3.595 6 HB3 MET 1 HB1 MET 1 16.444 25.780 -4.707 7 HG2 MET 1 HG2 MET 1 15.288 27.783 -5.488 8 HG3 MET 1 HG1 MET 1 16.239 28.763 -4.376 9 HE1 MET 1 HE1 MET 1 16.358 26.426 -7.537 10 HE2 MET 1 HE2 MET 1 17.499 25.660 -6.432 11 HE3 MET 1 HE3 MET 1 18.083 26.430 -7.905 12 H SER 2 HN SER 2 14.897 24.188 -3.906 13 HA SER 2 HA SER 2 15.165 22.045 -3.240 14 HB2 SER 2 HB2 SER 2 17.244 23.262 -1.407 15 HB3 SER 2 HB1 SER 2 17.026 21.529 -1.650 16 HG SER 2 HG SER 2 17.716 21.702 -3.711 17 H TYR 3 HN TYR 3 13.226 21.548 -2.445 18 HA TYR 3 HA TYR 3 11.772 20.666 -0.959 19 HB2 TYR 3 HB2 TYR 3 13.880 21.256 1.130 20 HB3 TYR 3 HB1 TYR 3 12.433 20.285 1.389 21 HD1 TYR 3 HD1 TYR 3 12.176 18.129 0.097 22 HD2 TYR 3 HD2 TYR 3 15.817 20.322 0.169 23 HE1 TYR 3 HE1 TYR 3 13.387 16.139 -0.695 24 HE2 TYR 3 HE2 TYR 3 17.038 18.345 -0.623 25 HH TYR 3 HH TYR 3 16.810 15.929 -0.696 26 H ILE 4 HN ILE 4 9.965 21.657 -0.537 27 HA ILE 4 HA ILE 4 9.986 24.198 0.916 28 HB ILE 4 HB ILE 4 8.343 23.666 -1.573 29 HG12 ILE 4 HG12 ILE 4 10.650 25.585 -1.171 30 HG13 ILE 4 HG11 ILE 4 10.742 24.064 -2.049 31 HG21 ILE 4 HG21 ILE 4 7.121 25.051 -0.040 32 HG22 ILE 4 HG22 ILE 4 7.728 26.066 -1.350 33 HG23 ILE 4 HG23 ILE 4 8.530 26.083 0.221 34 HD11 ILE 4 HD11 ILE 4 10.541 25.950 -3.565 35 HD12 ILE 4 HD12 ILE 4 9.020 26.415 -2.802 36 HD13 ILE 4 HD13 ILE 4 9.139 24.888 -3.677 37 HA PRO 5 HA PRO 5 7.131 21.463 3.074 38 HB2 PRO 5 HB2 PRO 5 7.259 23.620 5.086 39 HB3 PRO 5 HB1 PRO 5 7.668 21.907 5.247 40 HG2 PRO 5 HG2 PRO 5 9.593 23.747 5.220 41 HG3 PRO 5 HG1 PRO 5 9.809 22.201 4.366 42 HD2 PRO 5 HD2 PRO 5 8.992 24.866 3.240 43 HD3 PRO 5 HD1 PRO 5 10.249 23.745 2.663 44 H GLY 6 HN GLY 6 4.972 21.430 3.021 45 HA2 GLY 6 HA2 GLY 6 2.834 22.466 3.460 46 HA3 GLY 6 HA1 GLY 6 3.520 23.993 2.906 47 H GLN 7 HN GLN 7 4.851 22.286 0.706 48 HA GLN 7 HA GLN 7 2.567 22.446 -1.105 49 HB2 GLN 7 HB2 GLN 7 5.515 22.271 -1.744 50 HB3 GLN 7 HB1 GLN 7 4.214 22.593 -2.877 51 HG2 GLN 7 HG2 GLN 7 5.042 24.362 -0.597 52 HG3 GLN 7 HG1 GLN 7 5.404 24.631 -2.299 53 HE21 GLN 7 HE21 GLN 7 2.832 23.803 -3.268 54 HE22 GLN 7 HE22 GLN 7 1.700 25.049 -2.826 55 HA PRO 8 HA PRO 8 2.384 18.018 -0.979 56 HB2 PRO 8 HB2 PRO 8 0.643 18.279 -3.329 57 HB3 PRO 8 HB1 PRO 8 0.276 17.633 -1.728 58 HG2 PRO 8 HG2 PRO 8 -0.717 19.986 -2.564 59 HG3 PRO 8 HG1 PRO 8 -0.271 19.702 -0.872 60 HD2 PRO 8 HD2 PRO 8 1.237 21.168 -3.008 61 HD3 PRO 8 HD1 PRO 8 1.009 21.590 -1.290 62 H VAL 9 HN VAL 9 3.617 16.500 -1.874 63 HA VAL 9 HA VAL 9 4.834 17.006 -4.472 64 HB VAL 9 HB VAL 9 6.122 16.322 -2.358 65 HG11 VAL 9 HG11 VAL 9 4.730 14.490 -1.655 66 HG12 VAL 9 HG12 VAL 9 6.356 13.902 -2.000 67 HG13 VAL 9 HG13 VAL 9 5.056 13.628 -3.158 68 HG21 VAL 9 HG21 VAL 9 7.176 16.433 -4.541 69 HG22 VAL 9 HG22 VAL 9 6.581 14.819 -4.928 70 HG23 VAL 9 HG23 VAL 9 7.773 15.032 -3.647 71 H THR 10 HN THR 10 2.333 15.652 -3.235 72 HA THR 10 HA THR 10 0.559 14.545 -4.020 73 HB THR 10 HB THR 10 0.186 14.270 -6.351 74 HG1 THR 10 HG1 THR 10 1.730 13.802 -7.743 75 HG21 THR 10 HG21 THR 10 2.010 16.636 -5.886 76 HG22 THR 10 HG22 THR 10 0.260 16.586 -5.624 77 HG23 THR 10 HG23 THR 10 0.908 16.453 -7.260 78 H ALA 11 HN ALA 11 3.234 13.026 -5.589 79 HA ALA 11 HA ALA 11 3.113 10.625 -4.049 80 HB1 ALA 11 HB1 ALA 11 2.366 9.086 -5.748 81 HB2 ALA 11 HB2 ALA 11 2.161 10.401 -6.905 82 HB3 ALA 11 HB3 ALA 11 1.122 10.307 -5.482 83 H VAL 12 HN VAL 12 5.128 10.305 -3.813 84 HA VAL 12 HA VAL 12 7.053 10.710 -5.932 85 HB VAL 12 HB VAL 12 7.440 9.369 -3.287 86 HG11 VAL 12 HG11 VAL 12 9.787 10.016 -3.538 87 HG12 VAL 12 HG12 VAL 12 9.409 10.743 -5.101 88 HG13 VAL 12 HG13 VAL 12 9.239 9.002 -4.875 89 HG21 VAL 12 HG21 VAL 12 8.296 11.596 -2.486 90 HG22 VAL 12 HG22 VAL 12 6.551 11.485 -2.719 91 HG23 VAL 12 HG23 VAL 12 7.555 12.303 -3.924 92 H VAL 13 HN VAL 13 7.393 9.195 -7.412 93 HA VAL 13 HA VAL 13 6.496 6.459 -6.874 94 HB VAL 13 HB VAL 13 7.393 7.647 -9.494 95 HG11 VAL 13 HG11 VAL 13 6.357 5.662 -10.488 96 HG12 VAL 13 HG12 VAL 13 6.010 5.044 -8.873 97 HG13 VAL 13 HG13 VAL 13 7.681 5.238 -9.403 98 HG21 VAL 13 HG21 VAL 13 5.360 8.731 -8.721 99 HG22 VAL 13 HG22 VAL 13 4.609 7.161 -8.435 100 HG23 VAL 13 HG23 VAL 13 5.000 7.666 -10.080 101 H GLN 14 HN GLN 14 7.926 5.166 -6.086 102 HA GLN 14 HA GLN 14 10.699 5.325 -6.897 103 HB2 GLN 14 HB2 GLN 14 10.775 6.652 -4.945 104 HB3 GLN 14 HB1 GLN 14 9.596 5.648 -4.113 105 HG2 GLN 14 HG2 GLN 14 11.207 3.860 -3.956 106 HG3 GLN 14 HG1 GLN 14 12.410 4.832 -4.801 107 HE21 GLN 14 HE21 GLN 14 10.172 6.146 -2.478 108 HE22 GLN 14 HE22 GLN 14 11.351 6.499 -1.250 109 H ARG 15 HN ARG 15 11.764 3.363 -6.652 110 HA ARG 15 HA ARG 15 10.015 1.101 -6.303 111 HB2 ARG 15 HB2 ARG 15 12.450 1.626 -7.953 112 HB3 ARG 15 HB1 ARG 15 11.897 -0.003 -7.611 113 HG2 ARG 15 HG2 ARG 15 9.692 0.593 -8.526 114 HG3 ARG 15 HG1 ARG 15 10.347 2.175 -8.974 115 HD2 ARG 15 HD2 ARG 15 11.563 -0.424 -9.830 116 HD3 ARG 15 HD1 ARG 15 10.298 0.368 -10.763 117 HE ARG 15 HE ARG 15 13.052 1.326 -10.371 118 HH11 ARG 15 HH11 ARG 15 9.912 1.728 -11.886 119 HH12 ARG 15 HH12 ARG 15 10.489 2.855 -13.072 120 HH21 ARG 15 HH21 ARG 15 13.811 2.781 -11.945 121 HH22 ARG 15 HH22 ARG 15 12.711 3.461 -13.102 122 H VAL 16 HN VAL 16 10.462 -0.351 -4.907 123 HA VAL 16 HA VAL 16 12.922 -0.158 -3.401 124 HB VAL 16 HB VAL 16 11.585 1.248 -2.061 125 HG11 VAL 16 HG11 VAL 16 9.444 0.771 -3.115 126 HG12 VAL 16 HG12 VAL 16 9.315 0.716 -1.350 127 HG13 VAL 16 HG13 VAL 16 9.384 -0.785 -2.274 128 HG21 VAL 16 HG21 VAL 16 11.300 -1.490 -0.845 129 HG22 VAL 16 HG22 VAL 16 11.256 0.046 0.029 130 HG23 VAL 16 HG23 VAL 16 12.744 -0.484 -0.763 131 H GLU 17 HN GLU 17 13.669 -2.136 -2.925 132 HA GLU 17 HA GLU 17 11.870 -4.364 -3.473 133 HB2 GLU 17 HB2 GLU 17 14.206 -5.608 -3.529 134 HB3 GLU 17 HB1 GLU 17 13.592 -4.738 -4.931 135 HG2 GLU 17 HG2 GLU 17 14.911 -2.740 -3.998 136 HG3 GLU 17 HG1 GLU 17 15.743 -3.942 -3.012 137 H ILE 18 HN ILE 18 11.019 -5.129 -1.752 138 HA ILE 18 HA ILE 18 12.359 -5.011 0.823 139 HB ILE 18 HB ILE 18 9.439 -5.339 0.099 140 HG12 ILE 18 HG12 ILE 18 10.807 -2.995 1.411 141 HG13 ILE 18 HG11 ILE 18 10.423 -3.079 -0.313 142 HG21 ILE 18 HG21 ILE 18 10.048 -6.498 2.143 143 HG22 ILE 18 HG22 ILE 18 9.044 -5.086 2.488 144 HG23 ILE 18 HG23 ILE 18 10.784 -5.025 2.777 145 HD11 ILE 18 HD11 ILE 18 8.077 -3.494 0.312 146 HD12 ILE 18 HD12 ILE 18 8.684 -1.894 0.754 147 HD13 ILE 18 HD13 ILE 18 8.511 -3.147 1.988 148 H HIS 19 HN HIS 19 13.032 -6.841 1.621 149 HA HIS 19 HA HIS 19 12.076 -9.245 0.322 150 HB2 HIS 19 HB2 HIS 19 14.268 -10.172 0.875 151 HB3 HIS 19 HB1 HIS 19 14.294 -8.819 -0.218 152 HD1 HIS 19 HD1 HIS 19 15.076 -9.588 3.431 153 HD2 HIS 19 HD2 HIS 19 16.011 -6.893 0.410 154 HE1 HIS 19 HE1 HIS 19 16.907 -8.142 4.362 155 HE2 HIS 19 HE2 HIS 19 17.657 -6.756 2.397 156 H LYS 20 HN LYS 20 11.018 -10.683 1.336 157 HA LYS 20 HA LYS 20 10.194 -10.858 3.926 158 HB2 LYS 20 HB2 LYS 20 9.925 -13.313 3.461 159 HB3 LYS 20 HB1 LYS 20 9.195 -12.227 2.292 160 HG2 LYS 20 HG2 LYS 20 11.171 -12.580 0.819 161 HG3 LYS 20 HG1 LYS 20 11.739 -13.802 1.964 162 HD2 LYS 20 HD2 LYS 20 9.701 -15.092 1.631 163 HD3 LYS 20 HD1 LYS 20 9.072 -13.850 0.546 164 HE2 LYS 20 HE2 LYS 20 9.927 -15.676 -0.761 165 HE3 LYS 20 HE1 LYS 20 10.973 -14.273 -0.975 166 HZ1 LYS 20 HZ1 LYS 20 12.271 -16.283 -0.697 167 HZ2 LYS 20 HZ2 LYS 20 11.522 -16.595 0.791 168 HZ3 LYS 20 HZ3 LYS 20 12.521 -15.247 0.619 169 H LEU 21 HN LEU 21 10.838 -12.463 5.664 170 HA LEU 21 HA LEU 21 13.756 -12.424 5.880 171 HB2 LEU 21 HB2 LEU 21 12.874 -10.314 6.819 172 HB3 LEU 21 HB1 LEU 21 11.874 -11.248 7.926 173 HG LEU 21 HG LEU 21 13.874 -12.145 9.003 174 HD11 LEU 21 HD11 LEU 21 15.394 -12.145 7.115 175 HD12 LEU 21 HD12 LEU 21 16.087 -11.243 8.464 176 HD13 LEU 21 HD13 LEU 21 15.394 -10.379 7.093 177 HD21 LEU 21 HD21 LEU 21 12.866 -10.095 9.854 178 HD22 LEU 21 HD22 LEU 21 13.897 -9.136 8.789 179 HD23 LEU 21 HD23 LEU 21 14.614 -10.094 10.085 180 H ARG 22 HN ARG 22 14.478 -13.534 7.797 181 HA ARG 22 HA ARG 22 13.509 -16.173 7.554 182 HB2 ARG 22 HB2 ARG 22 15.944 -15.369 7.795 183 HB3 ARG 22 HB1 ARG 22 15.606 -15.361 9.504 184 HG2 ARG 22 HG2 ARG 22 16.644 -17.421 8.952 185 HG3 ARG 22 HG1 ARG 22 14.946 -17.727 9.365 186 HD2 ARG 22 HD2 ARG 22 14.326 -17.858 7.099 187 HD3 ARG 22 HD1 ARG 22 15.887 -17.221 6.595 188 HE ARG 22 HE ARG 22 16.080 -19.699 8.036 189 HH11 ARG 22 HH11 ARG 22 15.660 -18.284 4.856 190 HH12 ARG 22 HH12 ARG 22 15.938 -19.780 4.011 191 HH21 ARG 22 HH21 ARG 22 16.523 -21.632 6.938 192 HH22 ARG 22 HH22 ARG 22 16.460 -21.682 5.202 193 H GLN 23 HN GLN 23 11.889 -16.944 8.605 194 HA GLN 23 HA GLN 23 12.033 -16.942 11.498 195 HB2 GLN 23 HB2 GLN 23 9.315 -17.247 10.599 196 HB3 GLN 23 HB1 GLN 23 9.987 -16.126 11.769 197 HG2 GLN 23 HG2 GLN 23 10.846 -14.986 9.509 198 HG3 GLN 23 HG1 GLN 23 9.356 -15.730 8.936 199 HE21 GLN 23 HE21 GLN 23 10.081 -12.937 9.233 200 HE22 GLN 23 HE22 GLN 23 8.868 -12.236 10.272 201 H GLY 24 HN GLY 24 13.324 -18.749 10.631 202 HA2 GLY 24 HA2 GLY 24 13.585 -21.032 10.657 203 HA3 GLY 24 HA1 GLY 24 11.868 -21.189 11.010 204 H GLU 25 HN GLU 25 10.637 -22.001 9.473 205 HA GLU 25 HA GLU 25 11.711 -22.413 6.805 206 HB2 GLU 25 HB2 GLU 25 10.086 -23.881 8.389 207 HB3 GLU 25 HB1 GLU 25 8.886 -23.038 7.427 208 HG2 GLU 25 HG2 GLU 25 11.149 -24.611 6.222 209 HG3 GLU 25 HG1 GLU 25 9.571 -25.303 6.580 210 H ASN 26 HN ASN 26 10.437 -19.885 8.366 211 HA ASN 26 HA ASN 26 8.643 -19.119 6.218 212 HB2 ASN 26 HB2 ASN 26 8.976 -17.997 8.983 213 HB3 ASN 26 HB1 ASN 26 7.912 -17.358 7.765 214 HD21 ASN 26 HD21 ASN 26 8.627 -20.037 9.731 215 HD22 ASN 26 HD22 ASN 26 7.022 -20.717 9.805 216 H LEU 27 HN LEU 27 9.201 -17.715 5.023 217 HA LEU 27 HA LEU 27 11.251 -15.744 5.723 218 HB2 LEU 27 HB2 LEU 27 10.618 -17.121 3.143 219 HB3 LEU 27 HB1 LEU 27 11.244 -15.496 3.111 220 HG LEU 27 HG LEU 27 13.028 -17.125 2.778 221 HD11 LEU 27 HD11 LEU 27 14.553 -16.375 4.553 222 HD12 LEU 27 HD12 LEU 27 13.175 -15.717 5.434 223 HD13 LEU 27 HD13 LEU 27 13.616 -15.053 3.861 224 HD21 LEU 27 HD21 LEU 27 12.210 -18.163 5.491 225 HD22 LEU 27 HD22 LEU 27 13.683 -18.625 4.631 226 HD23 LEU 27 HD23 LEU 27 12.103 -19.018 3.949 227 H ILE 28 HN ILE 28 10.157 -14.061 6.383 228 HA ILE 28 HA ILE 28 8.156 -12.834 4.699 229 HB ILE 28 HB ILE 28 6.606 -12.755 6.827 230 HG12 ILE 28 HG12 ILE 28 8.043 -15.417 6.998 231 HG13 ILE 28 HG11 ILE 28 8.062 -14.151 8.217 232 HG21 ILE 28 HG21 ILE 28 5.314 -14.436 5.668 233 HG22 ILE 28 HG22 ILE 28 6.780 -15.007 4.861 234 HG23 ILE 28 HG23 ILE 28 6.163 -13.395 4.516 235 HD11 ILE 28 HD11 ILE 28 5.599 -15.650 7.359 236 HD12 ILE 28 HD12 ILE 28 5.733 -14.501 8.689 237 HD13 ILE 28 HD13 ILE 28 6.579 -16.050 8.773 238 H LEU 29 HN LEU 29 7.151 -10.929 5.725 239 HA LEU 29 HA LEU 29 9.513 -9.363 6.435 240 HB2 LEU 29 HB2 LEU 29 6.917 -8.369 5.258 241 HB3 LEU 29 HB1 LEU 29 8.470 -7.556 5.271 242 HG LEU 29 HG LEU 29 9.283 -9.527 3.798 243 HD11 LEU 29 HD11 LEU 29 7.352 -10.984 4.076 244 HD12 LEU 29 HD12 LEU 29 7.562 -10.536 2.383 245 HD13 LEU 29 HD13 LEU 29 6.309 -9.760 3.353 246 HD21 LEU 29 HD21 LEU 29 7.322 -7.528 2.708 247 HD22 LEU 29 HD22 LEU 29 8.539 -8.406 1.778 248 HD23 LEU 29 HD23 LEU 29 9.036 -7.246 3.009 249 H GLY 30 HN GLY 30 6.003 -9.525 7.076 250 HA2 GLY 30 HA2 GLY 30 5.136 -9.631 9.281 251 HA3 GLY 30 HA1 GLY 30 6.630 -8.940 9.887 252 H PHE 31 HN PHE 31 5.600 -7.180 7.229 253 HA PHE 31 HA PHE 31 4.440 -5.170 9.024 254 HB2 PHE 31 HB2 PHE 31 4.989 -3.497 7.454 255 HB3 PHE 31 HB1 PHE 31 6.387 -4.554 7.531 256 HD1 PHE 31 HD2 PHE 31 6.622 -6.315 5.688 257 HD2 PHE 31 HD1 PHE 31 4.004 -2.979 5.459 258 HE1 PHE 31 HE2 PHE 31 6.562 -6.536 3.243 259 HE2 PHE 31 HE1 PHE 31 3.934 -3.181 3.020 260 HZ PHE 31 HZ PHE 31 5.220 -4.968 1.896 261 H SER 32 HN SER 32 2.615 -3.790 7.770 262 HA SER 32 HA SER 32 0.762 -5.892 6.805 263 HB2 SER 32 HB2 SER 32 0.410 -5.397 9.240 264 HB3 SER 32 HB1 SER 32 -0.010 -3.744 8.792 265 HG SER 32 HG SER 32 -1.948 -4.503 8.524 266 H ILE 33 HN ILE 33 -0.793 -5.301 5.306 267 HA ILE 33 HA ILE 33 -0.599 -2.514 4.401 268 HB ILE 33 HB ILE 33 -0.477 -3.122 2.094 269 HG12 ILE 33 HG12 ILE 33 0.160 -5.760 1.829 270 HG13 ILE 33 HG11 ILE 33 -1.061 -5.832 3.090 271 HG21 ILE 33 HG21 ILE 33 1.639 -2.901 3.195 272 HG22 ILE 33 HG22 ILE 33 1.734 -4.172 1.976 273 HG23 ILE 33 HG23 ILE 33 1.601 -4.595 3.684 274 HD11 ILE 33 HD11 ILE 33 -1.403 -4.560 0.390 275 HD12 ILE 33 HD12 ILE 33 -2.636 -4.671 1.647 276 HD13 ILE 33 HD13 ILE 33 -2.026 -6.137 0.878 277 H GLY 34 HN GLY 34 -2.453 -1.705 3.500 278 HA2 GLY 34 HA2 GLY 34 -4.770 -3.445 3.991 279 HA3 GLY 34 HA1 GLY 34 -4.779 -1.693 4.181 280 H GLY 35 HN GLY 35 -5.768 -4.124 2.240 281 HA2 GLY 35 HA2 GLY 35 -6.021 -2.220 -0.007 282 HA3 GLY 35 HA1 GLY 35 -5.934 -3.977 -0.243 283 H GLY 36 HN GLY 36 -7.764 -1.346 1.051 284 HA2 GLY 36 HA2 GLY 36 -10.273 -1.867 0.703 285 HA3 GLY 36 HA1 GLY 36 -9.909 -3.220 1.775 286 H ILE 37 HN ILE 37 -7.863 -0.973 2.763 287 HA ILE 37 HA ILE 37 -8.723 -0.947 5.314 288 HB ILE 37 HB ILE 37 -7.512 1.155 5.746 289 HG12 ILE 37 HG12 ILE 37 -8.075 2.217 3.496 290 HG13 ILE 37 HG11 ILE 37 -6.419 2.395 4.048 291 HG21 ILE 37 HG21 ILE 37 -6.387 -0.937 5.769 292 HG22 ILE 37 HG22 ILE 37 -5.333 0.256 5.003 293 HG23 ILE 37 HG23 ILE 37 -6.217 -0.912 4.015 294 HD11 ILE 37 HD11 ILE 37 -5.828 0.460 2.553 295 HD12 ILE 37 HD12 ILE 37 -6.338 1.936 1.737 296 HD13 ILE 37 HD13 ILE 37 -7.461 0.585 1.889 297 H ASP 38 HN ASP 38 -9.755 1.539 3.008 298 HA ASP 38 HA ASP 38 -11.708 2.411 5.030 299 HB2 ASP 38 HB2 ASP 38 -11.478 4.651 3.662 300 HB3 ASP 38 HB1 ASP 38 -10.355 4.246 4.949 301 H GLN 39 HN GLN 39 -11.702 0.515 2.669 302 HA GLN 39 HA GLN 39 -13.927 1.808 1.257 303 HB2 GLN 39 HB2 GLN 39 -13.228 0.320 -0.717 304 HB3 GLN 39 HB1 GLN 39 -12.324 1.775 -0.350 305 HG2 GLN 39 HG2 GLN 39 -11.030 -0.117 1.128 306 HG3 GLN 39 HG1 GLN 39 -11.470 -0.985 -0.338 307 HE21 GLN 39 HE21 GLN 39 -9.620 1.562 1.017 308 HE22 GLN 39 HE22 GLN 39 -8.744 1.967 -0.390 309 H ASP 40 HN ASP 40 -14.044 -1.058 -0.202 310 HA ASP 40 HA ASP 40 -15.901 -2.480 1.321 311 HB2 ASP 40 HB2 ASP 40 -16.719 0.043 1.348 312 HB3 ASP 40 HB1 ASP 40 -17.245 -0.305 -0.284 313 HA PRO 41 HA PRO 41 -15.979 -4.292 -2.851 314 HB2 PRO 41 HB2 PRO 41 -18.292 -5.593 -3.040 315 HB3 PRO 41 HB1 PRO 41 -17.104 -6.063 -1.812 316 HG2 PRO 41 HG2 PRO 41 -19.522 -4.305 -1.523 317 HG3 PRO 41 HG1 PRO 41 -19.021 -5.659 -0.513 318 HD2 PRO 41 HD2 PRO 41 -18.509 -3.094 0.150 319 HD3 PRO 41 HD1 PRO 41 -17.409 -4.413 0.592 320 H SER 42 HN SER 42 -18.246 -1.968 -2.036 321 HA SER 42 HA SER 42 -19.907 -2.137 -4.363 322 HB2 SER 42 HB2 SER 42 -19.814 0.050 -2.286 323 HB3 SER 42 HB1 SER 42 -21.155 -0.345 -3.361 324 HG SER 42 HG SER 42 -20.357 -1.540 -1.001 325 H GLN 43 HN GLN 43 -16.870 -0.691 -3.882 326 HA GLN 43 HA GLN 43 -17.405 1.626 -5.548 327 HB2 GLN 43 HB2 GLN 43 -14.846 0.548 -4.403 328 HB3 GLN 43 HB1 GLN 43 -15.078 2.135 -5.103 329 HG2 GLN 43 HG2 GLN 43 -15.071 2.458 -2.839 330 HG3 GLN 43 HG1 GLN 43 -16.772 2.524 -3.262 331 HE21 GLN 43 HE21 GLN 43 -14.213 0.480 -2.016 332 HE22 GLN 43 HE22 GLN 43 -15.239 -0.580 -1.078 333 H ASN 44 HN ASN 44 -16.219 -1.548 -5.809 334 HA ASN 44 HA ASN 44 -14.322 -1.397 -7.803 335 HB2 ASN 44 HB2 ASN 44 -14.689 -3.349 -6.534 336 HB3 ASN 44 HB1 ASN 44 -16.261 -3.609 -7.276 337 HD21 ASN 44 HD21 ASN 44 -16.350 -4.560 -9.302 338 HD22 ASN 44 HD22 ASN 44 -14.964 -5.197 -10.115 339 HA PRO 45 HA PRO 45 -18.019 -1.614 -11.191 340 HB2 PRO 45 HB2 PRO 45 -19.417 0.698 -10.239 341 HB3 PRO 45 HB1 PRO 45 -20.071 -0.914 -10.547 342 HG2 PRO 45 HG2 PRO 45 -19.223 0.323 -8.005 343 HG3 PRO 45 HG1 PRO 45 -20.380 -0.988 -8.293 344 HD2 PRO 45 HD2 PRO 45 -17.962 -1.444 -7.207 345 HD3 PRO 45 HD1 PRO 45 -18.727 -2.611 -8.308 346 H PHE 46 HN PHE 46 -16.468 0.809 -9.217 347 HA PHE 46 HA PHE 46 -15.590 2.213 -11.646 348 HB2 PHE 46 HB2 PHE 46 -16.132 3.265 -8.875 349 HB3 PHE 46 HB1 PHE 46 -15.204 4.161 -10.077 350 HD1 PHE 46 HD2 PHE 46 -16.336 4.722 -12.268 351 HD2 PHE 46 HD1 PHE 46 -18.449 3.316 -8.861 352 HE1 PHE 46 HE2 PHE 46 -18.427 5.614 -13.209 353 HE2 PHE 46 HE1 PHE 46 -20.550 4.203 -9.787 354 HZ PHE 46 HZ PHE 46 -20.543 5.354 -11.963 355 H SER 47 HN SER 47 -14.529 0.266 -9.038 356 HA SER 47 HA SER 47 -12.538 -0.446 -8.401 357 HB2 SER 47 HB2 SER 47 -11.755 1.164 -10.794 358 HB3 SER 47 HB1 SER 47 -10.577 0.374 -9.764 359 HG SER 47 HG SER 47 -12.083 -0.682 -11.705 360 H GLU 48 HN GLU 48 -13.892 1.925 -7.534 361 HA GLU 48 HA GLU 48 -13.684 2.992 -5.553 362 HB2 GLU 48 HB2 GLU 48 -11.589 1.557 -5.353 363 HB3 GLU 48 HB1 GLU 48 -10.705 2.991 -5.871 364 HG2 GLU 48 HG2 GLU 48 -10.614 3.034 -3.535 365 HG3 GLU 48 HG1 GLU 48 -11.847 4.207 -3.994 366 H ASP 49 HN ASP 49 -11.051 4.049 -7.707 367 HA ASP 49 HA ASP 49 -12.514 6.488 -8.314 368 HB2 ASP 49 HB2 ASP 49 -11.089 6.928 -6.251 369 HB3 ASP 49 HB1 ASP 49 -9.681 6.657 -7.271 370 H LYS 50 HN LYS 50 -11.966 4.223 -9.757 371 HA LYS 50 HA LYS 50 -11.173 3.412 -11.710 372 HB2 LYS 50 HB2 LYS 50 -10.065 6.181 -12.008 373 HB3 LYS 50 HB1 LYS 50 -9.744 4.900 -13.170 374 HG2 LYS 50 HG2 LYS 50 -12.437 6.044 -12.455 375 HG3 LYS 50 HG1 LYS 50 -11.550 6.283 -13.962 376 HD2 LYS 50 HD2 LYS 50 -11.632 3.710 -14.150 377 HD3 LYS 50 HD1 LYS 50 -12.907 3.816 -12.935 378 HE2 LYS 50 HE2 LYS 50 -13.960 3.793 -15.068 379 HE3 LYS 50 HE1 LYS 50 -14.086 5.428 -14.430 380 HZ1 LYS 50 HZ1 LYS 50 -12.055 4.525 -16.400 381 HZ2 LYS 50 HZ2 LYS 50 -12.261 6.110 -15.832 382 HZ3 LYS 50 HZ3 LYS 50 -13.466 5.386 -16.775 383 H THR 51 HN THR 51 -9.841 1.870 -11.381 384 HA THR 51 HA THR 51 -7.985 0.655 -11.180 385 HB THR 51 HB THR 51 -5.839 1.538 -12.019 386 HG1 THR 51 HG1 THR 51 -6.979 3.930 -11.491 387 HG21 THR 51 HG21 THR 51 -8.267 2.165 -13.690 388 HG22 THR 51 HG22 THR 51 -7.429 0.616 -13.574 389 HG23 THR 51 HG23 THR 51 -6.621 1.999 -14.310 390 H ASP 52 HN ASP 52 -8.881 2.650 -9.054 391 HA ASP 52 HA ASP 52 -6.626 3.387 -7.515 392 HB2 ASP 52 HB2 ASP 52 -9.149 4.153 -7.455 393 HB3 ASP 52 HB1 ASP 52 -9.293 2.853 -6.269 394 H LYS 53 HN LYS 53 -9.131 1.116 -6.517 395 HA LYS 53 HA LYS 53 -9.113 -0.980 -5.682 396 HB2 LYS 53 HB2 LYS 53 -6.213 -0.881 -6.436 397 HB3 LYS 53 HB1 LYS 53 -6.871 -2.229 -5.513 398 HG2 LYS 53 HG2 LYS 53 -7.709 -1.318 -8.254 399 HG3 LYS 53 HG1 LYS 53 -6.884 -2.819 -7.825 400 HD2 LYS 53 HD2 LYS 53 -8.836 -3.518 -6.519 401 HD3 LYS 53 HD1 LYS 53 -9.651 -2.013 -6.942 402 HE2 LYS 53 HE2 LYS 53 -10.444 -3.835 -8.349 403 HE3 LYS 53 HE1 LYS 53 -9.578 -2.639 -9.308 404 HZ1 LYS 53 HZ1 LYS 53 -7.627 -4.067 -9.264 405 HZ2 LYS 53 HZ2 LYS 53 -8.952 -4.873 -9.947 406 HZ3 LYS 53 HZ3 LYS 53 -8.471 -5.226 -8.362 407 H GLY 54 HN GLY 54 -7.093 1.471 -4.514 408 HA2 GLY 54 HA2 GLY 54 -6.848 2.280 -2.400 409 HA3 GLY 54 HA1 GLY 54 -8.119 1.168 -1.910 410 H ILE 55 HN ILE 55 -4.779 0.867 -3.069 411 HA ILE 55 HA ILE 55 -4.252 -1.068 -0.921 412 HB ILE 55 HB ILE 55 -2.793 -0.628 -3.532 413 HG12 ILE 55 HG12 ILE 55 -4.936 -1.638 -3.919 414 HG13 ILE 55 HG11 ILE 55 -3.714 -2.904 -4.057 415 HG21 ILE 55 HG21 ILE 55 -1.613 -2.759 -2.948 416 HG22 ILE 55 HG22 ILE 55 -2.303 -2.626 -1.328 417 HG23 ILE 55 HG23 ILE 55 -1.199 -1.384 -1.920 418 HD11 ILE 55 HD11 ILE 55 -5.389 -2.391 -1.580 419 HD12 ILE 55 HD12 ILE 55 -4.250 -3.721 -1.860 420 HD13 ILE 55 HD13 ILE 55 -5.726 -3.619 -2.816 421 H TYR 56 HN TYR 56 -2.958 -0.489 0.685 422 HA TYR 56 HA TYR 56 -1.017 1.636 0.461 423 HB2 TYR 56 HB2 TYR 56 -2.876 3.030 0.510 424 HB3 TYR 56 HB1 TYR 56 -3.744 1.994 1.623 425 HD1 TYR 56 HD2 TYR 56 -1.226 4.633 1.323 426 HD2 TYR 56 HD1 TYR 56 -3.462 2.221 4.012 427 HE1 TYR 56 HE2 TYR 56 -0.671 6.169 3.152 428 HE2 TYR 56 HE1 TYR 56 -2.923 3.759 5.855 429 HH TYR 56 HH TYR 56 -1.112 5.464 6.389 430 H VAL 57 HN VAL 57 0.537 1.315 1.946 431 HA VAL 57 HA VAL 57 0.307 -0.763 3.845 432 HB VAL 57 HB VAL 57 2.415 0.182 2.589 433 HG11 VAL 57 HG11 VAL 57 3.011 2.188 3.270 434 HG12 VAL 57 HG12 VAL 57 3.693 1.325 4.648 435 HG13 VAL 57 HG13 VAL 57 2.093 2.056 4.772 436 HG21 VAL 57 HG21 VAL 57 2.622 -0.727 5.412 437 HG22 VAL 57 HG22 VAL 57 3.801 -0.959 4.118 438 HG23 VAL 57 HG23 VAL 57 2.241 -1.781 4.052 439 H THR 58 HN THR 58 -0.203 -0.684 5.872 440 HA THR 58 HA THR 58 -0.812 1.945 7.046 441 HB THR 58 HB THR 58 -2.839 0.692 6.569 442 HG1 THR 58 HG1 THR 58 -2.103 0.980 9.288 443 HG21 THR 58 HG21 THR 58 -1.912 -1.568 6.600 444 HG22 THR 58 HG22 THR 58 -3.325 -1.440 7.648 445 HG23 THR 58 HG23 THR 58 -1.707 -1.461 8.351 446 H ARG 59 HN ARG 59 1.303 -0.602 7.244 447 HA ARG 59 HA ARG 59 2.435 0.454 9.614 448 HB2 ARG 59 HB2 ARG 59 1.856 -0.962 11.260 449 HB3 ARG 59 HB1 ARG 59 0.519 -1.371 10.224 450 HG2 ARG 59 HG2 ARG 59 1.673 -3.290 9.364 451 HG3 ARG 59 HG1 ARG 59 3.113 -2.856 10.284 452 HD2 ARG 59 HD2 ARG 59 0.480 -3.334 11.630 453 HD3 ARG 59 HD1 ARG 59 1.561 -4.667 11.237 454 HE ARG 59 HE ARG 59 2.633 -2.437 12.809 455 HH11 ARG 59 HH11 ARG 59 1.411 -5.707 12.723 456 HH12 ARG 59 HH12 ARG 59 2.138 -6.174 14.227 457 HH21 ARG 59 HH21 ARG 59 3.612 -3.038 14.808 458 HH22 ARG 59 HH22 ARG 59 3.421 -4.665 15.402 459 H VAL 60 HN VAL 60 4.234 -0.998 10.377 460 HA VAL 60 HA VAL 60 5.479 -2.550 8.291 461 HB VAL 60 HB VAL 60 6.696 0.004 9.363 462 HG11 VAL 60 HG11 VAL 60 8.687 -0.608 8.068 463 HG12 VAL 60 HG12 VAL 60 7.932 -2.157 7.676 464 HG13 VAL 60 HG13 VAL 60 8.325 -1.766 9.347 465 HG21 VAL 60 HG21 VAL 60 5.176 0.352 7.491 466 HG22 VAL 60 HG22 VAL 60 6.055 -0.849 6.545 467 HG23 VAL 60 HG23 VAL 60 6.847 0.655 7.016 468 H SER 61 HN SER 61 6.657 -4.172 9.208 469 HA SER 61 HA SER 61 7.235 -4.196 12.004 470 HB2 SER 61 HB2 SER 61 8.974 -5.979 11.145 471 HB3 SER 61 HB1 SER 61 7.245 -6.324 11.170 472 HG SER 61 HG SER 61 8.218 -6.868 9.150 473 H GLU 62 HN GLU 62 8.443 -2.641 12.778 474 HA GLU 62 HA GLU 62 10.145 -1.148 11.132 475 HB2 GLU 62 HB2 GLU 62 9.268 -0.969 13.966 476 HB3 GLU 62 HB1 GLU 62 10.528 0.049 13.347 477 HG2 GLU 62 HG2 GLU 62 9.045 0.932 11.651 478 HG3 GLU 62 HG1 GLU 62 7.773 -0.139 12.218 479 H GLY 63 HN GLY 63 12.129 -0.698 11.403 480 HA2 GLY 63 HA2 GLY 63 14.370 -1.257 11.407 481 HA3 GLY 63 HA1 GLY 63 14.063 -2.036 12.965 482 H GLY 64 HN GLY 64 12.390 -2.926 9.991 483 HA2 GLY 64 HA2 GLY 64 13.607 -5.583 10.338 484 HA3 GLY 64 HA1 GLY 64 11.943 -5.295 9.821 485 HA PRO 65 HA PRO 65 13.884 -5.742 5.854 486 HB2 PRO 65 HB2 PRO 65 11.746 -6.751 4.665 487 HB3 PRO 65 HB1 PRO 65 12.707 -7.687 5.803 488 HG2 PRO 65 HG2 PRO 65 10.008 -6.586 6.106 489 HG3 PRO 65 HG1 PRO 65 10.793 -7.883 7.017 490 HD2 PRO 65 HD2 PRO 65 10.471 -5.103 7.752 491 HD3 PRO 65 HD1 PRO 65 11.178 -6.433 8.704 492 H ALA 66 HN ALA 66 10.731 -4.182 6.277 493 HA ALA 66 HA ALA 66 10.518 -3.627 3.430 494 HB1 ALA 66 HB1 ALA 66 8.815 -2.883 5.809 495 HB2 ALA 66 HB2 ALA 66 8.452 -4.042 4.530 496 HB3 ALA 66 HB3 ALA 66 8.478 -2.310 4.171 497 H GLU 67 HN GLU 67 11.433 -2.023 6.353 498 HA GLU 67 HA GLU 67 10.903 0.554 5.166 499 HB2 GLU 67 HB2 GLU 67 11.571 1.327 7.452 500 HB3 GLU 67 HB1 GLU 67 10.138 0.305 7.384 501 HG2 GLU 67 HG2 GLU 67 11.111 -1.373 8.479 502 HG3 GLU 67 HG1 GLU 67 12.652 -1.089 7.675 503 H ILE 68 HN ILE 68 13.408 -1.697 5.822 504 HA ILE 68 HA ILE 68 15.468 0.228 5.818 505 HB ILE 68 HB ILE 68 16.919 -1.673 5.620 506 HG12 ILE 68 HG12 ILE 68 14.511 -3.400 5.952 507 HG13 ILE 68 HG11 ILE 68 15.255 -3.089 4.385 508 HG21 ILE 68 HG21 ILE 68 16.401 -0.844 7.793 509 HG22 ILE 68 HG22 ILE 68 16.399 -2.607 7.878 510 HG23 ILE 68 HG23 ILE 68 14.874 -1.724 7.789 511 HD11 ILE 68 HD11 ILE 68 17.329 -4.042 5.183 512 HD12 ILE 68 HD12 ILE 68 15.992 -5.191 5.310 513 HD13 ILE 68 HD13 ILE 68 16.584 -4.354 6.747 514 H ALA 69 HN ALA 69 13.809 -1.912 3.754 515 HA ALA 69 HA ALA 69 15.387 -1.613 1.444 516 HB1 ALA 69 HB1 ALA 69 13.693 -3.359 1.608 517 HB2 ALA 69 HB2 ALA 69 13.368 -2.324 0.214 518 HB3 ALA 69 HB3 ALA 69 12.424 -2.134 1.689 519 H GLY 70 HN GLY 70 13.104 0.324 3.117 520 HA2 GLY 70 HA2 GLY 70 13.211 2.766 2.611 521 HA3 GLY 70 HA1 GLY 70 13.188 2.326 0.901 522 H LEU 71 HN LEU 71 11.249 1.114 3.578 523 HA LEU 71 HA LEU 71 8.828 2.160 2.308 524 HB2 LEU 71 HB2 LEU 71 9.312 -0.334 2.081 525 HB3 LEU 71 HB1 LEU 71 9.173 -0.437 3.820 526 HG LEU 71 HG LEU 71 7.212 -1.164 2.348 527 HD11 LEU 71 HD11 LEU 71 7.207 -0.964 4.781 528 HD12 LEU 71 HD12 LEU 71 5.640 -0.582 4.066 529 HD13 LEU 71 HD13 LEU 71 6.702 0.717 4.623 530 HD21 LEU 71 HD21 LEU 71 7.088 0.788 0.917 531 HD22 LEU 71 HD22 LEU 71 6.765 1.814 2.316 532 HD23 LEU 71 HD23 LEU 71 5.588 0.595 1.827 533 H GLN 72 HN GLN 72 7.120 2.355 4.007 534 HA GLN 72 HA GLN 72 7.779 2.595 6.677 535 HB2 GLN 72 HB2 GLN 72 7.669 5.120 6.835 536 HB3 GLN 72 HB1 GLN 72 9.121 4.421 6.169 537 HG2 GLN 72 HG2 GLN 72 8.520 6.432 5.010 538 HG3 GLN 72 HG1 GLN 72 8.478 5.031 3.945 539 HE21 GLN 72 HE21 GLN 72 6.608 4.369 3.095 540 HE22 GLN 72 HE22 GLN 72 5.135 5.256 3.248 541 H ILE 73 HN ILE 73 5.953 4.341 7.603 542 HA ILE 73 HA ILE 73 3.617 2.783 6.980 543 HB ILE 73 HB ILE 73 3.338 5.042 8.850 544 HG12 ILE 73 HG12 ILE 73 5.672 4.539 9.351 545 HG13 ILE 73 HG11 ILE 73 4.652 3.945 10.653 546 HG21 ILE 73 HG21 ILE 73 1.677 3.314 8.615 547 HG22 ILE 73 HG22 ILE 73 2.367 3.276 10.238 548 HG23 ILE 73 HG23 ILE 73 2.872 2.094 9.034 549 HD11 ILE 73 HD11 ILE 73 5.879 2.284 8.451 550 HD12 ILE 73 HD12 ILE 73 4.825 1.673 9.738 551 HD13 ILE 73 HD13 ILE 73 6.405 2.350 10.144 552 H GLY 74 HN GLY 74 2.447 3.387 5.232 553 HA2 GLY 74 HA2 GLY 74 0.534 4.916 4.852 554 HA3 GLY 74 HA1 GLY 74 1.633 6.245 5.230 555 H ASP 75 HN ASP 75 1.676 3.394 3.126 556 HA ASP 75 HA ASP 75 2.774 5.151 1.013 557 HB2 ASP 75 HB2 ASP 75 4.286 3.353 2.511 558 HB3 ASP 75 HB1 ASP 75 3.940 2.475 1.022 559 H LYS 76 HN LYS 76 2.007 4.677 -1.051 560 HA LYS 76 HA LYS 76 -0.057 2.595 -1.038 561 HB2 LYS 76 HB2 LYS 76 0.224 4.707 -3.162 562 HB3 LYS 76 HB1 LYS 76 -1.190 3.753 -2.754 563 HG2 LYS 76 HG2 LYS 76 -1.776 5.770 -1.858 564 HG3 LYS 76 HG1 LYS 76 -1.001 5.024 -0.458 565 HD2 LYS 76 HD2 LYS 76 1.074 6.197 -0.977 566 HD3 LYS 76 HD1 LYS 76 0.331 6.911 -2.406 567 HE2 LYS 76 HE2 LYS 76 0.331 8.546 -0.657 568 HE3 LYS 76 HE1 LYS 76 -1.328 8.008 -0.909 569 HZ1 LYS 76 HZ1 LYS 76 -0.825 8.168 1.442 570 HZ2 LYS 76 HZ2 LYS 76 0.485 7.106 1.265 571 HZ3 LYS 76 HZ3 LYS 76 -1.091 6.552 1.018 572 H ILE 77 HN ILE 77 0.691 0.781 -1.707 573 HA ILE 77 HA ILE 77 2.873 0.542 -3.583 574 HB ILE 77 HB ILE 77 1.231 -1.687 -2.383 575 HG12 ILE 77 HG12 ILE 77 3.794 -0.533 -1.276 576 HG13 ILE 77 HG11 ILE 77 2.200 -0.082 -0.677 577 HG21 ILE 77 HG21 ILE 77 4.046 -1.614 -3.466 578 HG22 ILE 77 HG22 ILE 77 2.645 -2.322 -4.269 579 HG23 ILE 77 HG23 ILE 77 3.247 -3.022 -2.765 580 HD11 ILE 77 HD11 ILE 77 3.385 -2.846 -0.645 581 HD12 ILE 77 HD12 ILE 77 1.781 -2.399 -0.060 582 HD13 ILE 77 HD13 ILE 77 3.219 -1.758 0.734 583 H MET 78 HN MET 78 2.578 0.484 -5.696 584 HA MET 78 HA MET 78 -0.120 -0.031 -6.722 585 HB2 MET 78 HB2 MET 78 2.235 1.153 -8.186 586 HB3 MET 78 HB1 MET 78 0.551 1.166 -8.693 587 HG2 MET 78 HG2 MET 78 1.453 2.476 -6.157 588 HG3 MET 78 HG1 MET 78 1.547 3.305 -7.708 589 HE1 MET 78 HE1 MET 78 -0.617 2.242 -4.735 590 HE2 MET 78 HE2 MET 78 -1.254 1.022 -5.837 591 HE3 MET 78 HE3 MET 78 -2.277 2.358 -5.319 592 H GLN 79 HN GLN 79 3.098 -1.329 -6.748 593 HA GLN 79 HA GLN 79 2.201 -3.742 -7.890 594 HB2 GLN 79 HB2 GLN 79 4.072 -3.584 -9.689 595 HB3 GLN 79 HB1 GLN 79 2.412 -3.123 -10.020 596 HG2 GLN 79 HG2 GLN 79 3.164 -0.775 -9.475 597 HG3 GLN 79 HG1 GLN 79 4.792 -1.448 -9.562 598 HE21 GLN 79 HE21 GLN 79 5.649 -2.073 -11.416 599 HE22 GLN 79 HE22 GLN 79 4.969 -1.688 -12.976 600 H VAL 80 HN VAL 80 3.652 -5.309 -8.129 601 HA VAL 80 HA VAL 80 6.061 -5.007 -6.426 602 HB VAL 80 HB VAL 80 4.803 -5.996 -4.837 603 HG11 VAL 80 HG11 VAL 80 3.127 -7.314 -6.952 604 HG12 VAL 80 HG12 VAL 80 2.769 -5.766 -6.175 605 HG13 VAL 80 HG13 VAL 80 2.785 -7.260 -5.220 606 HG21 VAL 80 HG21 VAL 80 6.429 -7.710 -5.240 607 HG22 VAL 80 HG22 VAL 80 5.521 -8.337 -6.621 608 HG23 VAL 80 HG23 VAL 80 4.883 -8.522 -4.977 609 H ASN 81 HN ASN 81 7.820 -6.023 -7.148 610 HA ASN 81 HA ASN 81 9.258 -7.037 -8.555 611 HB2 ASN 81 HB2 ASN 81 7.003 -9.036 -8.698 612 HB3 ASN 81 HB1 ASN 81 8.600 -9.297 -9.410 613 HD21 ASN 81 HD21 ASN 81 6.848 -10.174 -6.992 614 HD22 ASN 81 HD22 ASN 81 8.025 -10.370 -5.728 615 H GLY 82 HN GLY 82 7.176 -5.195 -9.421 616 HA2 GLY 82 HA2 GLY 82 6.946 -4.018 -11.446 617 HA3 GLY 82 HA1 GLY 82 7.569 -5.424 -12.301 618 H TRP 83 HN TRP 83 5.085 -6.295 -10.123 619 HA TRP 83 HA TRP 83 3.314 -6.703 -12.391 620 HB2 TRP 83 HB2 TRP 83 3.024 -7.803 -9.622 621 HB3 TRP 83 HB1 TRP 83 2.193 -8.317 -11.062 622 HD1 TRP 83 HD1 TRP 83 5.884 -7.806 -10.639 623 HE1 TRP 83 HE1 TRP 83 7.049 -10.003 -10.836 624 HE3 TRP 83 HE3 TRP 83 1.852 -10.855 -11.264 625 HZ2 TRP 83 HZ2 TRP 83 6.483 -12.693 -11.301 626 HZ3 TRP 83 HZ3 TRP 83 2.273 -13.265 -11.602 627 HH2 TRP 83 HH2 TRP 83 4.563 -14.141 -11.616 628 H ASP 84 HN ASP 84 2.677 -4.402 -12.251 629 HA ASP 84 HA ASP 84 1.267 -2.947 -10.657 630 HB2 ASP 84 HB2 ASP 84 1.043 -2.614 -13.051 631 HB3 ASP 84 HB1 ASP 84 0.054 -4.062 -13.197 632 H MET 85 HN MET 85 0.328 -3.441 -8.844 633 HA MET 85 HA MET 85 -1.305 -5.780 -8.491 634 HB2 MET 85 HB2 MET 85 -1.152 -3.454 -6.579 635 HB3 MET 85 HB1 MET 85 -1.481 -5.143 -6.218 636 HG2 MET 85 HG2 MET 85 0.828 -5.699 -6.843 637 HG3 MET 85 HG1 MET 85 1.136 -3.995 -7.145 638 HE1 MET 85 HE1 MET 85 0.914 -6.838 -4.459 639 HE2 MET 85 HE2 MET 85 -0.683 -6.077 -4.325 640 HE3 MET 85 HE3 MET 85 0.476 -5.922 -3.009 641 H THR 86 HN THR 86 -2.085 -2.823 -9.899 642 HA THR 86 HA THR 86 -4.500 -2.278 -8.475 643 HB THR 86 HB THR 86 -4.917 -0.491 -10.008 644 HG1 THR 86 HG1 THR 86 -2.891 -1.658 -11.659 645 HG21 THR 86 HG21 THR 86 -1.938 -0.731 -9.576 646 HG22 THR 86 HG22 THR 86 -3.102 -0.109 -8.404 647 HG23 THR 86 HG23 THR 86 -2.818 0.759 -9.914 648 H MET 87 HN MET 87 -3.762 -3.979 -11.457 649 HA MET 87 HA MET 87 -6.622 -4.294 -11.989 650 HB2 MET 87 HB2 MET 87 -4.190 -5.076 -13.587 651 HB3 MET 87 HB1 MET 87 -5.837 -5.444 -14.078 652 HG2 MET 87 HG2 MET 87 -6.288 -2.961 -13.940 653 HG3 MET 87 HG1 MET 87 -4.543 -2.752 -13.792 654 HE1 MET 87 HE1 MET 87 -6.378 -5.515 -15.951 655 HE2 MET 87 HE2 MET 87 -6.612 -4.637 -17.463 656 HE3 MET 87 HE3 MET 87 -7.455 -4.120 -16.004 657 H VAL 88 HN VAL 88 -4.515 -5.800 -10.063 658 HA VAL 88 HA VAL 88 -5.482 -8.506 -10.641 659 HB VAL 88 HB VAL 88 -3.111 -7.843 -8.905 660 HG11 VAL 88 HG11 VAL 88 -3.931 -10.206 -10.553 661 HG12 VAL 88 HG12 VAL 88 -3.764 -10.109 -8.799 662 HG13 VAL 88 HG13 VAL 88 -2.337 -10.027 -9.827 663 HG21 VAL 88 HG21 VAL 88 -2.783 -6.656 -11.022 664 HG22 VAL 88 HG22 VAL 88 -3.072 -8.155 -11.906 665 HG23 VAL 88 HG23 VAL 88 -1.660 -8.008 -10.861 666 H THR 89 HN THR 89 -5.431 -9.854 -8.301 667 HA THR 89 HA THR 89 -7.285 -8.227 -6.708 668 HB THR 89 HB THR 89 -7.208 -11.026 -7.602 669 HG1 THR 89 HG1 THR 89 -9.534 -10.632 -7.485 670 HG21 THR 89 HG21 THR 89 -8.308 -10.398 -4.883 671 HG22 THR 89 HG22 THR 89 -6.981 -11.496 -5.280 672 HG23 THR 89 HG23 THR 89 -8.621 -11.876 -5.801 673 H HIS 90 HN HIS 90 -7.341 -8.898 -4.348 674 HA HIS 90 HA HIS 90 -4.855 -8.193 -3.230 675 HB2 HIS 90 HB2 HIS 90 -7.067 -7.670 -2.235 676 HB3 HIS 90 HB1 HIS 90 -7.293 -9.370 -1.880 677 HD1 HIS 90 HD1 HIS 90 -5.922 -10.374 0.078 678 HD2 HIS 90 HD2 HIS 90 -5.459 -6.269 -0.433 679 HE1 HIS 90 HE1 HIS 90 -4.832 -9.546 2.179 680 HE2 HIS 90 HE2 HIS 90 -4.836 -7.042 1.955 681 H ASP 91 HN ASP 91 -6.542 -11.252 -3.485 682 HA ASP 91 HA ASP 91 -4.682 -12.807 -2.009 683 HB2 ASP 91 HB2 ASP 91 -7.039 -13.486 -2.526 684 HB3 ASP 91 HB1 ASP 91 -6.546 -13.711 -4.213 685 H GLN 92 HN GLN 92 -5.124 -12.062 -5.409 686 HA GLN 92 HA GLN 92 -3.052 -13.569 -6.512 687 HB2 GLN 92 HB2 GLN 92 -3.535 -10.836 -7.545 688 HB3 GLN 92 HB1 GLN 92 -3.277 -12.330 -8.425 689 HG2 GLN 92 HG2 GLN 92 -5.776 -11.626 -6.941 690 HG3 GLN 92 HG1 GLN 92 -5.539 -11.394 -8.659 691 HE21 GLN 92 HE21 GLN 92 -4.076 -13.793 -8.983 692 HE22 GLN 92 HE22 GLN 92 -5.238 -15.064 -8.900 693 H ALA 93 HN ALA 93 -3.166 -10.397 -5.073 694 HA ALA 93 HA ALA 93 -0.493 -9.647 -5.563 695 HB1 ALA 93 HB1 ALA 93 -0.914 -7.989 -3.755 696 HB2 ALA 93 HB2 ALA 93 -2.467 -8.769 -3.455 697 HB3 ALA 93 HB3 ALA 93 -2.158 -7.990 -5.005 698 H ARG 94 HN ARG 94 -2.211 -11.171 -2.902 699 HA ARG 94 HA ARG 94 -0.163 -11.405 -1.079 700 HB2 ARG 94 HB2 ARG 94 -2.656 -12.950 -1.625 701 HB3 ARG 94 HB1 ARG 94 -1.493 -13.635 -0.492 702 HG2 ARG 94 HG2 ARG 94 -2.940 -11.001 -0.268 703 HG3 ARG 94 HG1 ARG 94 -3.171 -12.445 0.714 704 HD2 ARG 94 HD2 ARG 94 -1.866 -11.244 2.132 705 HD3 ARG 94 HD1 ARG 94 -0.614 -12.105 1.228 706 HE ARG 94 HE ARG 94 -0.745 -9.900 -0.204 707 HH11 ARG 94 HH11 ARG 94 -0.796 -10.275 3.271 708 HH12 ARG 94 HH12 ARG 94 -0.066 -8.734 3.585 709 HH21 ARG 94 HH21 ARG 94 0.209 -7.846 0.209 710 HH22 ARG 94 HH22 ARG 94 0.504 -7.354 1.845 711 H LYS 95 HN LYS 95 -0.997 -13.460 -3.802 712 HA LYS 95 HA LYS 95 0.723 -15.595 -3.338 713 HB2 LYS 95 HB2 LYS 95 -0.044 -14.451 -6.027 714 HB3 LYS 95 HB1 LYS 95 0.565 -16.068 -5.727 715 HG2 LYS 95 HG2 LYS 95 -1.447 -16.588 -4.432 716 HG3 LYS 95 HG1 LYS 95 -2.062 -14.965 -4.760 717 HD2 LYS 95 HD2 LYS 95 -1.843 -15.508 -7.213 718 HD3 LYS 95 HD1 LYS 95 -1.524 -17.175 -6.730 719 HE2 LYS 95 HE2 LYS 95 -4.028 -15.577 -6.184 720 HE3 LYS 95 HE1 LYS 95 -3.854 -16.918 -7.314 721 HZ1 LYS 95 HZ1 LYS 95 -4.689 -18.049 -5.574 722 HZ2 LYS 95 HZ2 LYS 95 -4.132 -16.942 -4.419 723 HZ3 LYS 95 HZ3 LYS 95 -3.068 -18.093 -5.076 724 H ARG 96 HN ARG 96 1.363 -12.555 -5.139 725 HA ARG 96 HA ARG 96 3.980 -13.608 -5.859 726 HB2 ARG 96 HB2 ARG 96 4.150 -11.484 -7.163 727 HB3 ARG 96 HB1 ARG 96 2.950 -12.665 -7.664 728 HG2 ARG 96 HG2 ARG 96 1.191 -11.378 -6.964 729 HG3 ARG 96 HG1 ARG 96 2.193 -10.455 -5.827 730 HD2 ARG 96 HD2 ARG 96 3.397 -9.510 -7.661 731 HD3 ARG 96 HD1 ARG 96 2.401 -10.384 -8.824 732 HE ARG 96 HE ARG 96 1.484 -8.179 -7.098 733 HH11 ARG 96 HH11 ARG 96 1.008 -10.303 -9.831 734 HH12 ARG 96 HH12 ARG 96 -0.307 -9.385 -10.488 735 HH21 ARG 96 HH21 ARG 96 -0.250 -6.949 -7.968 736 HH22 ARG 96 HH22 ARG 96 -1.012 -7.469 -9.434 737 H LEU 97 HN LEU 97 2.725 -11.642 -3.432 738 HA LEU 97 HA LEU 97 5.181 -10.296 -2.826 739 HB2 LEU 97 HB2 LEU 97 2.790 -10.902 -1.093 740 HB3 LEU 97 HB1 LEU 97 4.057 -9.733 -0.738 741 HG LEU 97 HG LEU 97 2.272 -9.579 -3.155 742 HD11 LEU 97 HD11 LEU 97 1.174 -7.736 -1.911 743 HD12 LEU 97 HD12 LEU 97 2.046 -8.252 -0.461 744 HD13 LEU 97 HD13 LEU 97 0.888 -9.339 -1.237 745 HD21 LEU 97 HD21 LEU 97 3.159 -7.343 -3.312 746 HD22 LEU 97 HD22 LEU 97 4.465 -8.534 -3.308 747 HD23 LEU 97 HD23 LEU 97 4.117 -7.595 -1.854 748 H THR 98 HN THR 98 3.611 -13.247 -1.886 749 HA THR 98 HA THR 98 5.979 -13.975 -0.315 750 HB THR 98 HB THR 98 4.294 -15.100 1.309 751 HG1 THR 98 HG1 THR 98 2.572 -14.053 -0.317 752 HG21 THR 98 HG21 THR 98 4.666 -12.100 1.274 753 HG22 THR 98 HG22 THR 98 5.784 -13.280 1.962 754 HG23 THR 98 HG23 THR 98 4.186 -13.059 2.675 755 H LYS 99 HN LYS 99 5.793 -14.992 -2.802 756 HA LYS 99 HA LYS 99 4.838 -17.718 -2.344 757 HB2 LYS 99 HB2 LYS 99 5.486 -18.100 -4.727 758 HB3 LYS 99 HB1 LYS 99 4.235 -16.892 -4.504 759 HG2 LYS 99 HG2 LYS 99 6.086 -15.168 -4.659 760 HG3 LYS 99 HG1 LYS 99 7.113 -16.484 -5.225 761 HD2 LYS 99 HD2 LYS 99 4.552 -15.538 -6.499 762 HD3 LYS 99 HD1 LYS 99 6.185 -15.268 -7.106 763 HE2 LYS 99 HE2 LYS 99 6.451 -17.752 -7.261 764 HE3 LYS 99 HE1 LYS 99 4.743 -17.902 -6.849 765 HZ1 LYS 99 HZ1 LYS 99 4.178 -16.664 -8.835 766 HZ2 LYS 99 HZ2 LYS 99 5.114 -18.013 -9.240 767 HZ3 LYS 99 HZ3 LYS 99 5.820 -16.468 -9.223 768 H ARG 100 HN ARG 100 6.930 -18.825 -4.105 769 HA ARG 100 HA ARG 100 9.268 -18.561 -2.340 770 HB2 ARG 100 HB2 ARG 100 7.985 -21.059 -3.411 771 HB3 ARG 100 HB1 ARG 100 9.639 -21.034 -2.817 772 HG2 ARG 100 HG2 ARG 100 7.258 -20.200 -1.176 773 HG3 ARG 100 HG1 ARG 100 7.956 -21.821 -1.157 774 HD2 ARG 100 HD2 ARG 100 9.980 -21.053 -0.238 775 HD3 ARG 100 HD1 ARG 100 9.603 -19.372 -0.612 776 HE ARG 100 HE ARG 100 7.927 -19.451 1.144 777 HH11 ARG 100 HH11 ARG 100 10.310 -22.026 1.139 778 HH12 ARG 100 HH12 ARG 100 10.099 -22.388 2.837 779 HH21 ARG 100 HH21 ARG 100 7.695 -19.887 3.366 780 HH22 ARG 100 HH22 ARG 100 8.645 -21.144 4.107 781 H SER 101 HN SER 101 8.636 -17.313 -4.855 782 HA SER 101 HA SER 101 10.662 -18.525 -6.613 783 HB2 SER 101 HB2 SER 101 8.389 -16.674 -7.342 784 HB3 SER 101 HB1 SER 101 9.526 -17.420 -8.456 785 HG SER 101 HG SER 101 8.597 -19.357 -8.164 786 H GLU 102 HN GLU 102 10.038 -15.966 -4.573 787 HA GLU 102 HA GLU 102 12.169 -14.339 -5.724 788 HB2 GLU 102 HB2 GLU 102 11.042 -12.370 -5.058 789 HB3 GLU 102 HB1 GLU 102 9.804 -13.352 -5.827 790 HG2 GLU 102 HG2 GLU 102 10.224 -13.215 -2.849 791 HG3 GLU 102 HG1 GLU 102 9.099 -12.191 -3.734 792 H GLU 103 HN GLU 103 12.901 -12.853 -3.879 793 HA GLU 103 HA GLU 103 12.868 -14.134 -1.258 794 HB2 GLU 103 HB2 GLU 103 15.324 -13.229 -2.752 795 HB3 GLU 103 HB1 GLU 103 15.302 -13.494 -1.009 796 HG2 GLU 103 HG2 GLU 103 14.591 -15.543 -3.066 797 HG3 GLU 103 HG1 GLU 103 16.175 -15.418 -2.283 798 H VAL 104 HN VAL 104 11.753 -11.961 -2.905 799 HA VAL 104 HA VAL 104 11.962 -9.725 -1.190 800 HB VAL 104 HB VAL 104 14.281 -9.946 -1.917 801 HG11 VAL 104 HG11 VAL 104 14.036 -10.904 -4.101 802 HG12 VAL 104 HG12 VAL 104 14.895 -9.368 -4.246 803 HG13 VAL 104 HG13 VAL 104 13.188 -9.470 -4.681 804 HG21 VAL 104 HG21 VAL 104 13.408 -7.751 -1.368 805 HG22 VAL 104 HG22 VAL 104 12.906 -7.528 -3.042 806 HG23 VAL 104 HG23 VAL 104 14.618 -7.648 -2.643 807 H VAL 105 HN VAL 105 10.630 -8.056 -1.857 808 HA VAL 105 HA VAL 105 9.305 -8.528 -4.455 809 HB VAL 105 HB VAL 105 7.321 -7.356 -3.497 810 HG11 VAL 105 HG11 VAL 105 8.191 -9.894 -2.125 811 HG12 VAL 105 HG12 VAL 105 7.378 -9.766 -3.683 812 HG13 VAL 105 HG13 VAL 105 6.535 -9.295 -2.208 813 HG21 VAL 105 HG21 VAL 105 8.840 -7.639 -0.901 814 HG22 VAL 105 HG22 VAL 105 7.111 -7.299 -1.015 815 HG23 VAL 105 HG23 VAL 105 8.283 -6.147 -1.659 816 H ARG 106 HN ARG 106 9.783 -7.083 -5.926 817 HA ARG 106 HA ARG 106 10.920 -4.530 -5.175 818 HB2 ARG 106 HB2 ARG 106 11.249 -6.213 -7.313 819 HB3 ARG 106 HB1 ARG 106 10.229 -4.914 -7.938 820 HG2 ARG 106 HG2 ARG 106 11.757 -3.275 -7.297 821 HG3 ARG 106 HG1 ARG 106 12.780 -4.461 -6.471 822 HD2 ARG 106 HD2 ARG 106 12.852 -5.605 -8.784 823 HD3 ARG 106 HD1 ARG 106 12.317 -4.040 -9.390 824 HE ARG 106 HE ARG 106 14.617 -3.826 -7.683 825 HH11 ARG 106 HH11 ARG 106 13.567 -4.573 -10.946 826 HH12 ARG 106 HH12 ARG 106 15.102 -4.214 -11.665 827 HH21 ARG 106 HH21 ARG 106 16.646 -3.359 -8.630 828 HH22 ARG 106 HH22 ARG 106 16.853 -3.502 -10.352 829 H LEU 107 HN LEU 107 9.734 -2.779 -4.945 830 HA LEU 107 HA LEU 107 6.930 -3.046 -5.749 831 HB2 LEU 107 HB2 LEU 107 7.972 -1.238 -3.606 832 HB3 LEU 107 HB1 LEU 107 6.309 -1.699 -3.913 833 HG LEU 107 HG LEU 107 8.505 -3.335 -2.685 834 HD11 LEU 107 HD11 LEU 107 6.942 -3.503 -0.878 835 HD12 LEU 107 HD12 LEU 107 5.718 -2.649 -1.838 836 HD13 LEU 107 HD13 LEU 107 7.179 -1.809 -1.322 837 HD21 LEU 107 HD21 LEU 107 7.308 -4.712 -4.377 838 HD22 LEU 107 HD22 LEU 107 5.802 -4.377 -3.520 839 HD23 LEU 107 HD23 LEU 107 7.102 -5.266 -2.714 840 H LEU 108 HN LEU 108 5.866 -1.518 -6.790 841 HA LEU 108 HA LEU 108 7.238 1.055 -7.233 842 HB2 LEU 108 HB2 LEU 108 4.987 -0.292 -8.683 843 HB3 LEU 108 HB1 LEU 108 5.170 1.446 -8.739 844 HG LEU 108 HG LEU 108 6.087 0.341 -10.719 845 HD11 LEU 108 HD11 LEU 108 6.977 2.486 -9.968 846 HD12 LEU 108 HD12 LEU 108 8.206 1.506 -10.765 847 HD13 LEU 108 HD13 LEU 108 8.196 1.643 -9.007 848 HD21 LEU 108 HD21 LEU 108 6.803 -1.757 -9.699 849 HD22 LEU 108 HD22 LEU 108 8.067 -0.899 -8.817 850 HD23 LEU 108 HD23 LEU 108 8.128 -0.987 -10.578 851 H VAL 109 HN VAL 109 6.734 2.433 -5.651 852 HA VAL 109 HA VAL 109 4.082 2.272 -4.476 853 HB VAL 109 HB VAL 109 5.993 1.323 -3.094 854 HG11 VAL 109 HG11 VAL 109 6.720 4.226 -2.838 855 HG12 VAL 109 HG12 VAL 109 7.699 2.958 -3.574 856 HG13 VAL 109 HG13 VAL 109 7.370 2.922 -1.844 857 HG21 VAL 109 HG21 VAL 109 4.345 3.536 -1.941 858 HG22 VAL 109 HG22 VAL 109 5.163 2.280 -1.011 859 HG23 VAL 109 HG23 VAL 109 3.867 1.850 -2.129 860 H THR 110 HN THR 110 3.708 4.238 -3.228 861 HA THR 110 HA THR 110 4.726 6.607 -4.649 862 HB THR 110 HB THR 110 2.333 7.548 -4.350 863 HG1 THR 110 HG1 THR 110 1.885 4.741 -4.198 864 HG21 THR 110 HG21 THR 110 2.858 5.367 -6.365 865 HG22 THR 110 HG22 THR 110 3.375 7.048 -6.516 866 HG23 THR 110 HG23 THR 110 1.657 6.647 -6.509 867 H ARG 111 HN ARG 111 5.763 7.809 -3.298 868 HA ARG 111 HA ARG 111 5.221 7.668 -0.441 869 HB2 ARG 111 HB2 ARG 111 7.461 8.844 -2.077 870 HB3 ARG 111 HB1 ARG 111 7.320 9.119 -0.349 871 HG2 ARG 111 HG2 ARG 111 7.446 6.370 -1.529 872 HG3 ARG 111 HG1 ARG 111 8.882 7.300 -1.096 873 HD2 ARG 111 HD2 ARG 111 7.722 7.578 1.187 874 HD3 ARG 111 HD1 ARG 111 6.736 6.210 0.673 875 HE ARG 111 HE ARG 111 8.591 4.820 0.799 876 HH11 ARG 111 HH11 ARG 111 9.468 8.145 1.471 877 HH12 ARG 111 HH12 ARG 111 11.042 7.756 2.092 878 HH21 ARG 111 HH21 ARG 111 10.702 4.309 1.569 879 HH22 ARG 111 HH22 ARG 111 11.747 5.584 2.144 880 H GLN 112 HN GLN 112 4.870 9.451 0.841 881 HA GLN 112 HA GLN 112 3.790 11.789 -0.484 882 HB2 GLN 112 HB2 GLN 112 3.689 10.867 2.356 883 HB3 GLN 112 HB1 GLN 112 2.876 12.277 1.730 884 HG2 GLN 112 HG2 GLN 112 2.381 9.404 1.005 885 HG3 GLN 112 HG1 GLN 112 1.317 10.465 1.911 886 HE21 GLN 112 HE21 GLN 112 2.617 9.682 -1.189 887 HE22 GLN 112 HE22 GLN 112 1.512 10.621 -2.136 888 H SER 113 HN SER 113 6.391 10.737 1.196 889 HA SER 113 HA SER 113 8.474 11.651 1.438 890 HB2 SER 113 HB2 SER 113 7.012 14.211 1.002 891 HB3 SER 113 HB1 SER 113 8.737 14.143 1.364 892 HG SER 113 HG SER 113 8.126 14.232 -0.934 893 H LEU 114 HN LEU 114 5.815 11.903 3.093 894 HA LEU 114 HA LEU 114 7.022 13.061 5.473 895 HB2 LEU 114 HB2 LEU 114 4.249 12.438 4.647 896 HB3 LEU 114 HB1 LEU 114 4.637 12.605 6.345 897 HG LEU 114 HG LEU 114 3.806 14.712 5.671 898 HD11 LEU 114 HD11 LEU 114 6.816 14.785 5.645 899 HD12 LEU 114 HD12 LEU 114 5.760 14.905 7.056 900 HD13 LEU 114 HD13 LEU 114 5.775 16.194 5.850 901 HD21 LEU 114 HD21 LEU 114 4.815 15.932 3.718 902 HD22 LEU 114 HD22 LEU 114 3.833 14.529 3.304 903 HD23 LEU 114 HD23 LEU 114 5.591 14.412 3.262 904 H GLN 115 HN GLN 115 8.364 11.247 5.266 905 HA GLN 115 HA GLN 115 7.720 8.589 5.778 906 HB2 GLN 115 HB2 GLN 115 10.226 10.143 6.439 907 HB3 GLN 115 HB1 GLN 115 10.098 8.395 6.425 908 HG2 GLN 115 HG2 GLN 115 9.665 8.374 4.071 909 HG3 GLN 115 HG1 GLN 115 9.569 10.133 4.032 910 HE21 GLN 115 HE21 GLN 115 11.827 10.484 5.825 911 HE22 GLN 115 HE22 GLN 115 13.238 10.124 4.897 912 H LYS 116 HN LYS 116 9.107 7.656 7.885 913 HA LYS 116 HA LYS 116 7.251 7.932 9.966 914 HB2 LYS 116 HB2 LYS 116 8.828 6.556 11.313 915 HB3 LYS 116 HB1 LYS 116 8.462 5.866 9.740 916 HG2 LYS 116 HG2 LYS 116 10.583 6.351 8.900 917 HG3 LYS 116 HG1 LYS 116 10.917 7.524 10.174 918 HD2 LYS 116 HD2 LYS 116 12.190 5.536 10.609 919 HD3 LYS 116 HD1 LYS 116 10.918 5.668 11.822 920 HE2 LYS 116 HE2 LYS 116 9.572 4.045 10.539 921 HE3 LYS 116 HE1 LYS 116 10.893 3.890 9.382 922 HZ1 LYS 116 HZ1 LYS 116 12.297 3.211 11.349 923 HZ2 LYS 116 HZ2 LYS 116 11.125 2.093 10.862 924 HZ3 LYS 116 HZ3 LYS 116 10.859 3.068 12.231 925 H ALA 117 HN ALA 117 6.988 9.508 11.330 926 HA ALA 117 HA ALA 117 9.169 10.611 12.842 927 HB1 ALA 117 HB1 ALA 117 7.518 12.457 11.106 928 HB2 ALA 117 HB2 ALA 117 9.214 12.063 10.834 929 HB3 ALA 117 HB3 ALA 117 8.737 12.954 12.281 930 H VAL 118 HN VAL 118 6.827 9.045 12.984 931 HA VAL 118 HA VAL 118 4.604 8.954 13.506 932 HB VAL 118 HB VAL 118 5.836 8.139 15.397 933 HG11 VAL 118 HG11 VAL 118 6.243 9.494 17.385 934 HG12 VAL 118 HG12 VAL 118 5.685 10.927 16.521 935 HG13 VAL 118 HG13 VAL 118 7.144 10.091 15.991 936 HG21 VAL 118 HG21 VAL 118 3.429 8.130 15.419 937 HG22 VAL 118 HG22 VAL 118 3.410 9.723 16.176 938 HG23 VAL 118 HG23 VAL 118 4.068 8.338 17.050 939 H GLN 119 HN GLN 119 3.631 10.530 12.274 940 HA GLN 119 HA GLN 119 2.845 12.970 13.709 941 HB2 GLN 119 HB2 GLN 119 2.666 12.240 10.775 942 HB3 GLN 119 HB1 GLN 119 1.984 13.707 11.465 943 HG2 GLN 119 HG2 GLN 119 4.216 14.433 12.139 944 HG3 GLN 119 HG1 GLN 119 4.907 12.959 11.467 945 HE21 GLN 119 HE21 GLN 119 2.272 14.673 9.986 946 HE22 GLN 119 HE22 GLN 119 3.171 15.266 8.625 947 H GLN 120 HN GLN 120 1.017 12.759 14.796 948 HA GLN 120 HA GLN 120 -0.840 10.655 14.146 949 HB2 GLN 120 HB2 GLN 120 -1.050 12.811 16.261 950 HB3 GLN 120 HB1 GLN 120 -2.077 11.391 16.129 951 HG2 GLN 120 HG2 GLN 120 -0.094 9.961 16.468 952 HG3 GLN 120 HG1 GLN 120 0.876 11.414 16.705 953 HE21 GLN 120 HE21 GLN 120 -2.412 11.092 17.814 954 HE22 GLN 120 HE22 GLN 120 -2.053 11.069 19.503 955 H SER 121 HN SER 121 -1.438 11.393 12.034 956 HA SER 121 HA SER 121 -3.392 13.592 12.070 957 HB2 SER 121 HB2 SER 121 -3.114 13.503 9.551 958 HB3 SER 121 HB1 SER 121 -1.689 14.030 10.445 959 HG SER 121 HG SER 121 -2.181 11.440 9.385 960 H MET 122 HN MET 122 -5.401 12.857 12.354 961 HA MET 122 HA MET 122 -6.230 10.423 10.917 962 HB2 MET 122 HB2 MET 122 -5.787 9.768 13.212 963 HB3 MET 122 HB1 MET 122 -6.789 11.081 13.815 964 HG2 MET 122 HG2 MET 122 -8.757 10.029 12.824 965 HG3 MET 122 HG1 MET 122 -7.747 8.717 12.216 966 HE1 MET 122 HE1 MET 122 -10.378 8.299 14.055 967 HE2 MET 122 HE2 MET 122 -9.789 7.011 15.106 968 HE3 MET 122 HE3 MET 122 -9.405 6.990 13.384 969 H LEU 123 HN LEU 123 -7.786 10.972 9.563 970 HA LEU 123 HA LEU 123 -9.897 12.773 10.514 971 HB2 LEU 123 HB2 LEU 123 -8.352 14.008 9.035 972 HB3 LEU 123 HB1 LEU 123 -8.643 12.832 7.771 973 HG LEU 123 HG LEU 123 -11.006 13.510 7.676 974 HD11 LEU 123 HD11 LEU 123 -11.303 14.247 9.967 975 HD12 LEU 123 HD12 LEU 123 -11.741 15.529 8.838 976 HD13 LEU 123 HD13 LEU 123 -10.201 15.596 9.697 977 HD21 LEU 123 HD21 LEU 123 -9.067 15.810 7.416 978 HD22 LEU 123 HD22 LEU 123 -10.647 15.686 6.641 979 HD23 LEU 123 HD23 LEU 123 -9.362 14.562 6.203 980 H SER 124 HN SER 124 -11.795 11.817 10.407 981 HA SER 124 HA SER 124 -12.065 9.362 8.853 982 HB2 SER 124 HB2 SER 124 -14.209 9.181 10.258 983 HB3 SER 124 HB1 SER 124 -12.673 9.061 11.118 984 HG SER 124 HG SER 124 -14.368 11.330 10.915 985 H1 LYS 161 HN LYS 161 -12.307 -6.119 -3.381 986 HA LYS 161 HA LYS 161 -11.214 -3.573 -4.308 987 HB2 LYS 161 HB2 LYS 161 -13.184 -3.838 -5.726 988 HB3 LYS 161 HB1 LYS 161 -14.175 -4.212 -4.324 989 HG2 LYS 161 HG2 LYS 161 -14.738 -2.025 -4.721 990 HG3 LYS 161 HG1 LYS 161 -13.477 -1.857 -3.503 991 HD2 LYS 161 HD2 LYS 161 -13.010 -1.629 -6.474 992 HD3 LYS 161 HD1 LYS 161 -13.287 -0.257 -5.401 993 HE2 LYS 161 HE2 LYS 161 -11.008 -2.225 -5.239 994 HE3 LYS 161 HE1 LYS 161 -10.914 -0.562 -5.824 995 HZ1 LYS 161 HZ1 LYS 161 -11.665 0.151 -3.576 996 HZ2 LYS 161 HZ2 LYS 161 -10.149 -0.606 -3.584 997 HZ3 LYS 161 HZ3 LYS 161 -11.511 -1.457 -3.057 998 H GLU 162 HN GLU 162 -12.977 -5.476 -2.004 999 HA GLU 162 HA GLU 162 -13.726 -3.145 -0.478 1000 HB2 GLU 162 HB2 GLU 162 -14.812 -4.877 1.020 1001 HB3 GLU 162 HB1 GLU 162 -15.412 -4.740 -0.628 1002 HG2 GLU 162 HG2 GLU 162 -13.386 -6.821 0.175 1003 HG3 GLU 162 HG1 GLU 162 -15.114 -7.083 0.373 1004 H ASN 163 HN ASN 163 -13.601 -3.239 1.858 1005 HA ASN 163 HA ASN 163 -11.134 -3.112 2.980 1006 HB2 ASN 163 HB2 ASN 163 -13.174 -2.384 4.103 1007 HB3 ASN 163 HB1 ASN 163 -13.655 -4.056 4.360 1008 HD21 ASN 163 HD21 ASN 163 -11.466 -1.522 5.284 1009 HD22 ASN 163 HD22 ASN 163 -10.912 -2.262 6.758 1010 H LEU 164 HN LEU 164 -9.649 -4.785 2.350 1011 HA LEU 164 HA LEU 164 -9.637 -6.668 4.555 1012 HB2 LEU 164 HB2 LEU 164 -9.270 -8.648 3.403 1013 HB3 LEU 164 HB1 LEU 164 -10.639 -7.903 2.611 1014 HG LEU 164 HG LEU 164 -7.859 -7.647 1.484 1015 HD11 LEU 164 HD11 LEU 164 -9.874 -9.832 0.984 1016 HD12 LEU 164 HD12 LEU 164 -8.330 -10.016 1.815 1017 HD13 LEU 164 HD13 LEU 164 -8.363 -9.602 0.097 1018 HD21 LEU 164 HD21 LEU 164 -9.059 -7.326 -0.605 1019 HD22 LEU 164 HD22 LEU 164 -9.629 -6.173 0.602 1020 HD23 LEU 164 HD23 LEU 164 -10.598 -7.594 0.213 1021 H GLU 165 HN GLU 165 -7.772 -6.529 5.560 1022 HA GLU 165 HA GLU 165 -5.432 -5.587 4.031 1023 HB2 GLU 165 HB2 GLU 165 -4.758 -4.273 5.776 1024 HB3 GLU 165 HB1 GLU 165 -6.489 -4.247 6.104 1025 HG2 GLU 165 HG2 GLU 165 -6.107 -6.193 7.660 1026 HG3 GLU 165 HG1 GLU 165 -4.377 -5.921 7.431 1027 H SER 166 HN SER 166 -3.309 -6.333 5.129 1028 HA SER 166 HA SER 166 -3.390 -8.866 6.487 1029 HB2 SER 166 HB2 SER 166 -2.452 -8.802 3.621 1030 HB3 SER 166 HB1 SER 166 -2.434 -10.203 4.692 1031 HG SER 166 HG SER 166 -4.901 -9.477 4.736 1032 H MET 167 HN MET 167 -1.448 -9.229 7.494 1033 HA MET 167 HA MET 167 0.865 -7.680 6.650 1034 HB2 MET 167 HB2 MET 167 2.052 -8.716 8.553 1035 HB3 MET 167 HB1 MET 167 0.578 -7.879 9.059 1036 HG2 MET 167 HG2 MET 167 -0.586 -10.039 9.156 1037 HG3 MET 167 HG1 MET 167 0.905 -10.854 8.691 1038 HE1 MET 167 HE1 MET 167 0.363 -7.781 11.094 1039 HE2 MET 167 HE2 MET 167 0.314 -8.579 12.666 1040 HE3 MET 167 HE3 MET 167 -0.981 -8.848 11.501 1041 H VAL 168 HN VAL 168 2.774 -8.581 5.960 1042 HA VAL 168 HA VAL 168 2.943 -11.444 5.495 1043 HB VAL 168 HB VAL 168 4.001 -10.821 3.164 1044 HG11 VAL 168 HG11 VAL 168 2.104 -12.317 3.456 1045 HG12 VAL 168 HG12 VAL 168 1.863 -11.261 2.064 1046 HG13 VAL 168 HG13 VAL 168 1.015 -10.932 3.573 1047 HG21 VAL 168 HG21 VAL 168 2.033 -8.569 3.546 1048 HG22 VAL 168 HG22 VAL 168 2.828 -8.996 2.030 1049 HG23 VAL 168 HG23 VAL 168 3.783 -8.408 3.394 Start of MODEL 2 1 H1 MET 1 HT1 MET 1 8.749 27.834 8.643 2 H2 MET 1 HT2 MET 1 9.477 26.704 9.684 3 H3 MET 1 HT3 MET 1 7.973 27.383 10.080 4 HA MET 1 HA MET 1 6.937 26.304 8.212 5 HB2 MET 1 HB2 MET 1 9.700 25.151 7.779 6 HB3 MET 1 HB1 MET 1 8.247 24.554 6.991 7 HG2 MET 1 HG2 MET 1 7.928 26.736 5.938 8 HG3 MET 1 HG1 MET 1 9.403 27.318 6.708 9 HE1 MET 1 HE1 MET 1 12.130 25.056 5.003 10 HE2 MET 1 HE2 MET 1 11.261 24.699 6.497 11 HE3 MET 1 HE3 MET 1 11.825 26.338 6.174 12 H SER 2 HN SER 2 5.690 25.341 9.714 13 HA SER 2 HA SER 2 6.778 22.896 10.957 14 HB2 SER 2 HB2 SER 2 6.345 24.644 12.662 15 HB3 SER 2 HB1 SER 2 4.676 24.760 12.111 16 HG SER 2 HG SER 2 4.315 23.250 13.514 17 H TYR 3 HN TYR 3 3.834 24.544 9.861 18 HA TYR 3 HA TYR 3 2.774 21.916 9.059 19 HB2 TYR 3 HB2 TYR 3 1.497 23.373 10.781 20 HB3 TYR 3 HB1 TYR 3 1.107 24.404 9.409 21 HD1 TYR 3 HD2 TYR 3 0.628 21.087 10.913 22 HD2 TYR 3 HD1 TYR 3 -0.500 23.690 7.746 23 HE1 TYR 3 HE2 TYR 3 -1.253 19.600 10.372 24 HE2 TYR 3 HE1 TYR 3 -2.385 22.208 7.195 25 HH TYR 3 HH TYR 3 -3.097 19.944 7.486 26 H ILE 4 HN ILE 4 2.344 21.616 6.932 27 HA ILE 4 HA ILE 4 2.778 23.922 5.156 28 HB ILE 4 HB ILE 4 3.495 21.038 4.585 29 HG12 ILE 4 HG12 ILE 4 5.282 23.417 5.148 30 HG13 ILE 4 HG11 ILE 4 4.989 22.075 6.245 31 HG21 ILE 4 HG21 ILE 4 3.908 23.549 2.962 32 HG22 ILE 4 HG22 ILE 4 2.853 22.191 2.566 33 HG23 ILE 4 HG23 ILE 4 4.603 21.974 2.579 34 HD11 ILE 4 HD11 ILE 4 6.039 20.545 4.687 35 HD12 ILE 4 HD12 ILE 4 7.130 21.863 5.111 36 HD13 ILE 4 HD13 ILE 4 6.306 21.865 3.551 37 HA PRO 5 HA PRO 5 -1.398 22.536 4.049 38 HB2 PRO 5 HB2 PRO 5 -1.972 25.297 3.440 39 HB3 PRO 5 HB1 PRO 5 -2.586 24.327 4.779 40 HG2 PRO 5 HG2 PRO 5 -0.879 26.443 5.108 41 HG3 PRO 5 HG1 PRO 5 -0.989 25.077 6.234 42 HD2 PRO 5 HD2 PRO 5 1.001 25.565 4.043 43 HD3 PRO 5 HD1 PRO 5 1.271 24.985 5.703 44 H GLY 6 HN GLY 6 1.174 23.516 2.459 45 HA2 GLY 6 HA2 GLY 6 -0.194 23.547 -0.150 46 HA3 GLY 6 HA1 GLY 6 1.238 24.530 0.181 47 H GLN 7 HN GLN 7 0.614 21.207 1.174 48 HA GLN 7 HA GLN 7 3.123 20.270 0.315 49 HB2 GLN 7 HB2 GLN 7 2.172 18.015 0.751 50 HB3 GLN 7 HB1 GLN 7 1.945 19.133 2.085 51 HG2 GLN 7 HG2 GLN 7 -0.373 19.535 1.191 52 HG3 GLN 7 HG1 GLN 7 -0.093 18.179 0.101 53 HE21 GLN 7 HE21 GLN 7 -2.049 18.482 2.233 54 HE22 GLN 7 HE22 GLN 7 -1.773 17.163 3.325 55 HA PRO 8 HA PRO 8 2.084 19.910 -3.961 56 HB2 PRO 8 HB2 PRO 8 4.530 19.571 -4.876 57 HB3 PRO 8 HB1 PRO 8 4.108 21.056 -4.013 58 HG2 PRO 8 HG2 PRO 8 5.631 18.669 -3.054 59 HG3 PRO 8 HG1 PRO 8 5.911 20.387 -2.719 60 HD2 PRO 8 HD2 PRO 8 4.532 18.571 -1.067 61 HD3 PRO 8 HD1 PRO 8 4.535 20.339 -0.907 62 H VAL 9 HN VAL 9 3.296 18.488 -5.779 63 HA VAL 9 HA VAL 9 3.038 16.641 -7.008 64 HB VAL 9 HB VAL 9 5.218 16.314 -5.909 65 HG11 VAL 9 HG11 VAL 9 3.763 14.456 -4.058 66 HG12 VAL 9 HG12 VAL 9 4.434 16.033 -3.636 67 HG13 VAL 9 HG13 VAL 9 5.509 14.720 -4.130 68 HG21 VAL 9 HG21 VAL 9 5.483 13.940 -6.458 69 HG22 VAL 9 HG22 VAL 9 4.587 14.831 -7.689 70 HG23 VAL 9 HG23 VAL 9 3.728 13.786 -6.557 71 H THR 10 HN THR 10 2.260 14.538 -7.331 72 HA THR 10 HA THR 10 -0.255 14.200 -5.898 73 HB THR 10 HB THR 10 -1.004 13.166 -8.068 74 HG1 THR 10 HG1 THR 10 0.657 12.671 -9.336 75 HG21 THR 10 HG21 THR 10 -1.107 15.351 -9.262 76 HG22 THR 10 HG22 THR 10 0.074 15.997 -8.111 77 HG23 THR 10 HG23 THR 10 -1.527 15.490 -7.555 78 H ALA 11 HN ALA 11 2.345 12.585 -7.388 79 HA ALA 11 HA ALA 11 2.457 10.481 -5.457 80 HB1 ALA 11 HB1 ALA 11 1.673 9.750 -8.281 81 HB2 ALA 11 HB2 ALA 11 0.677 9.540 -6.839 82 HB3 ALA 11 HB3 ALA 11 2.168 8.613 -7.029 83 H VAL 12 HN VAL 12 4.487 10.487 -5.101 84 HA VAL 12 HA VAL 12 6.400 10.723 -7.261 85 HB VAL 12 HB VAL 12 6.990 9.869 -4.491 86 HG11 VAL 12 HG11 VAL 12 8.828 9.675 -5.988 87 HG12 VAL 12 HG12 VAL 12 9.141 11.032 -4.905 88 HG13 VAL 12 HG13 VAL 12 8.597 11.331 -6.556 89 HG21 VAL 12 HG21 VAL 12 6.544 12.695 -5.388 90 HG22 VAL 12 HG22 VAL 12 7.407 12.271 -3.909 91 HG23 VAL 12 HG23 VAL 12 5.709 11.827 -4.095 92 H VAL 13 HN VAL 13 7.401 9.061 -8.122 93 HA VAL 13 HA VAL 13 6.453 6.384 -7.463 94 HB VAL 13 HB VAL 13 7.961 7.269 -9.918 95 HG11 VAL 13 HG11 VAL 13 7.148 5.121 -10.849 96 HG12 VAL 13 HG12 VAL 13 6.516 4.709 -9.254 97 HG13 VAL 13 HG13 VAL 13 8.251 4.919 -9.488 98 HG21 VAL 13 HG21 VAL 13 5.784 8.364 -9.798 99 HG22 VAL 13 HG22 VAL 13 5.005 6.800 -9.559 100 HG23 VAL 13 HG23 VAL 13 5.814 7.158 -11.085 101 H GLN 14 HN GLN 14 7.709 5.045 -6.423 102 HA GLN 14 HA GLN 14 10.593 5.207 -6.663 103 HB2 GLN 14 HB2 GLN 14 9.041 5.364 -4.086 104 HB3 GLN 14 HB1 GLN 14 10.664 4.700 -4.125 105 HG2 GLN 14 HG2 GLN 14 11.404 6.761 -3.827 106 HG3 GLN 14 HG1 GLN 14 10.884 7.103 -5.475 107 HE21 GLN 14 HE21 GLN 14 8.057 6.755 -4.772 108 HE22 GLN 14 HE22 GLN 14 7.614 8.192 -3.902 109 H ARG 15 HN ARG 15 11.568 3.247 -5.779 110 HA ARG 15 HA ARG 15 9.817 0.952 -5.890 111 HB2 ARG 15 HB2 ARG 15 12.498 1.439 -7.140 112 HB3 ARG 15 HB1 ARG 15 11.841 -0.158 -6.896 113 HG2 ARG 15 HG2 ARG 15 9.825 0.601 -8.192 114 HG3 ARG 15 HG1 ARG 15 10.776 2.026 -8.638 115 HD2 ARG 15 HD2 ARG 15 12.552 0.420 -9.420 116 HD3 ARG 15 HD1 ARG 15 11.384 -0.868 -9.151 117 HE ARG 15 HE ARG 15 10.368 1.171 -10.869 118 HH11 ARG 15 HH11 ARG 15 12.510 -1.593 -10.763 119 HH12 ARG 15 HH12 ARG 15 12.214 -2.045 -12.422 120 HH21 ARG 15 HH21 ARG 15 10.028 0.630 -13.069 121 HH22 ARG 15 HH22 ARG 15 10.808 -0.778 -13.727 122 H VAL 16 HN VAL 16 10.169 -0.528 -4.395 123 HA VAL 16 HA VAL 16 12.518 -0.306 -2.715 124 HB VAL 16 HB VAL 16 11.023 1.021 -1.450 125 HG11 VAL 16 HG11 VAL 16 8.763 0.305 -0.824 126 HG12 VAL 16 HG12 VAL 16 8.958 -1.125 -1.838 127 HG13 VAL 16 HG13 VAL 16 8.961 0.484 -2.570 128 HG21 VAL 16 HG21 VAL 16 10.686 -0.220 0.604 129 HG22 VAL 16 HG22 VAL 16 12.233 -0.650 -0.133 130 HG23 VAL 16 HG23 VAL 16 10.857 -1.743 -0.276 131 H GLU 17 HN GLU 17 13.300 -2.278 -2.293 132 HA GLU 17 HA GLU 17 11.620 -4.545 -3.083 133 HB2 GLU 17 HB2 GLU 17 14.644 -4.493 -2.832 134 HB3 GLU 17 HB1 GLU 17 13.658 -5.768 -3.541 135 HG2 GLU 17 HG2 GLU 17 12.904 -4.106 -5.255 136 HG3 GLU 17 HG1 GLU 17 14.100 -2.989 -4.605 137 H ILE 18 HN ILE 18 10.738 -5.430 -1.314 138 HA ILE 18 HA ILE 18 12.070 -5.252 1.260 139 HB ILE 18 HB ILE 18 9.160 -5.604 0.546 140 HG12 ILE 18 HG12 ILE 18 10.561 -3.244 1.807 141 HG13 ILE 18 HG11 ILE 18 10.030 -3.331 0.127 142 HG21 ILE 18 HG21 ILE 18 8.720 -5.349 2.938 143 HG22 ILE 18 HG22 ILE 18 10.458 -5.345 3.249 144 HG23 ILE 18 HG23 ILE 18 9.683 -6.778 2.575 145 HD11 ILE 18 HD11 ILE 18 8.442 -2.094 1.435 146 HD12 ILE 18 HD12 ILE 18 8.280 -3.443 2.562 147 HD13 ILE 18 HD13 ILE 18 7.727 -3.614 0.893 148 H HIS 19 HN HIS 19 12.630 -7.050 2.189 149 HA HIS 19 HA HIS 19 11.678 -9.493 0.943 150 HB2 HIS 19 HB2 HIS 19 13.769 -10.494 1.814 151 HB3 HIS 19 HB1 HIS 19 13.950 -9.224 0.615 152 HD1 HIS 19 HD1 HIS 19 14.640 -9.972 4.250 153 HD2 HIS 19 HD2 HIS 19 15.381 -7.040 1.391 154 HE1 HIS 19 HE1 HIS 19 16.348 -8.436 5.271 155 HE2 HIS 19 HE2 HIS 19 16.968 -6.830 3.425 156 H LYS 20 HN LYS 20 9.775 -9.424 2.139 157 HA LYS 20 HA LYS 20 10.049 -10.769 4.732 158 HB2 LYS 20 HB2 LYS 20 8.040 -8.588 4.129 159 HB3 LYS 20 HB1 LYS 20 8.147 -9.507 5.624 160 HG2 LYS 20 HG2 LYS 20 10.346 -8.549 6.064 161 HG3 LYS 20 HG1 LYS 20 10.256 -7.649 4.550 162 HD2 LYS 20 HD2 LYS 20 9.588 -6.047 6.041 163 HD3 LYS 20 HD1 LYS 20 8.032 -6.735 5.588 164 HE2 LYS 20 HE2 LYS 20 9.623 -7.492 8.032 165 HE3 LYS 20 HE1 LYS 20 8.263 -6.376 8.020 166 HZ1 LYS 20 HZ1 LYS 20 6.927 -8.274 7.086 167 HZ2 LYS 20 HZ2 LYS 20 7.420 -8.433 8.703 168 HZ3 LYS 20 HZ3 LYS 20 8.228 -9.283 7.488 169 H LEU 21 HN LEU 21 9.588 -12.722 3.749 170 HA LEU 21 HA LEU 21 6.976 -13.230 2.763 171 HB2 LEU 21 HB2 LEU 21 7.833 -14.117 0.654 172 HB3 LEU 21 HB1 LEU 21 8.022 -12.379 0.777 173 HG LEU 21 HG LEU 21 10.431 -13.123 1.656 174 HD11 LEU 21 HD11 LEU 21 9.760 -15.509 1.427 175 HD12 LEU 21 HD12 LEU 21 11.246 -15.067 0.579 176 HD13 LEU 21 HD13 LEU 21 9.742 -15.274 -0.322 177 HD21 LEU 21 HD21 LEU 21 11.265 -12.776 -0.602 178 HD22 LEU 21 HD22 LEU 21 9.996 -11.617 -0.212 179 HD23 LEU 21 HD23 LEU 21 9.641 -12.998 -1.251 180 H ARG 22 HN ARG 22 6.638 -15.529 2.526 181 HA ARG 22 HA ARG 22 7.990 -17.205 4.304 182 HB2 ARG 22 HB2 ARG 22 5.636 -17.429 3.160 183 HB3 ARG 22 HB1 ARG 22 6.545 -18.238 1.893 184 HG2 ARG 22 HG2 ARG 22 6.763 -19.118 4.726 185 HG3 ARG 22 HG1 ARG 22 5.438 -19.665 3.694 186 HD2 ARG 22 HD2 ARG 22 7.105 -20.500 2.077 187 HD3 ARG 22 HD1 ARG 22 8.379 -20.003 3.192 188 HE ARG 22 HE ARG 22 6.663 -21.643 4.629 189 HH11 ARG 22 HH11 ARG 22 8.724 -21.989 1.794 190 HH12 ARG 22 HH12 ARG 22 9.072 -23.656 2.111 191 HH21 ARG 22 HH21 ARG 22 7.092 -23.836 5.000 192 HH22 ARG 22 HH22 ARG 22 8.149 -24.713 3.931 193 H GLN 23 HN GLN 23 10.067 -17.715 4.084 194 HA GLN 23 HA GLN 23 11.026 -18.625 1.489 195 HB2 GLN 23 HB2 GLN 23 13.301 -17.626 2.582 196 HB3 GLN 23 HB1 GLN 23 12.304 -16.798 1.394 197 HG2 GLN 23 HG2 GLN 23 11.061 -15.759 3.275 198 HG3 GLN 23 HG1 GLN 23 12.252 -16.459 4.367 199 HE21 GLN 23 HE21 GLN 23 11.524 -13.685 3.679 200 HE22 GLN 23 HE22 GLN 23 13.034 -12.923 3.253 201 H GLY 24 HN GLY 24 10.130 -20.448 2.784 202 HA2 GLY 24 HA2 GLY 24 10.800 -22.613 3.203 203 HA3 GLY 24 HA1 GLY 24 12.461 -22.038 3.202 204 H GLU 25 HN GLU 25 13.457 -21.574 5.021 205 HA GLU 25 HA GLU 25 12.231 -22.531 7.455 206 HB2 GLU 25 HB2 GLU 25 14.790 -22.542 6.473 207 HB3 GLU 25 HB1 GLU 25 14.845 -21.211 7.623 208 HG2 GLU 25 HG2 GLU 25 15.519 -23.344 8.630 209 HG3 GLU 25 HG1 GLU 25 14.091 -22.652 9.401 210 H ASN 26 HN ASN 26 12.085 -19.777 5.731 211 HA ASN 26 HA ASN 26 11.959 -18.111 8.120 212 HB2 ASN 26 HB2 ASN 26 12.399 -17.317 5.267 213 HB3 ASN 26 HB1 ASN 26 12.203 -16.226 6.606 214 HD21 ASN 26 HD21 ASN 26 14.116 -18.611 5.198 215 HD22 ASN 26 HD22 ASN 26 15.639 -18.157 5.919 216 H LEU 27 HN LEU 27 10.201 -17.497 8.565 217 HA LEU 27 HA LEU 27 8.128 -17.065 6.545 218 HB2 LEU 27 HB2 LEU 27 8.005 -18.275 9.241 219 HB3 LEU 27 HB1 LEU 27 6.760 -17.107 8.871 220 HG LEU 27 HG LEU 27 6.039 -19.419 8.419 221 HD11 LEU 27 HD11 LEU 27 5.092 -17.529 7.164 222 HD12 LEU 27 HD12 LEU 27 5.129 -19.014 6.213 223 HD13 LEU 27 HD13 LEU 27 6.327 -17.753 5.922 224 HD21 LEU 27 HD21 LEU 27 7.011 -20.547 6.398 225 HD22 LEU 27 HD22 LEU 27 8.092 -20.475 7.790 226 HD23 LEU 27 HD23 LEU 27 8.322 -19.364 6.439 227 H ILE 28 HN ILE 28 8.382 -15.005 6.140 228 HA ILE 28 HA ILE 28 8.274 -13.151 8.396 229 HB ILE 28 HB ILE 28 8.778 -11.881 5.843 230 HG12 ILE 28 HG12 ILE 28 9.962 -14.084 5.412 231 HG13 ILE 28 HG11 ILE 28 10.991 -12.668 5.357 232 HG21 ILE 28 HG21 ILE 28 10.358 -12.012 8.391 233 HG22 ILE 28 HG22 ILE 28 9.040 -10.892 8.053 234 HG23 ILE 28 HG23 ILE 28 10.531 -10.807 7.116 235 HD11 ILE 28 HD11 ILE 28 11.922 -13.210 7.516 236 HD12 ILE 28 HD12 ILE 28 12.037 -14.629 6.460 237 HD13 ILE 28 HD13 ILE 28 10.787 -14.546 7.707 238 H LEU 29 HN LEU 29 6.554 -11.800 8.478 239 HA LEU 29 HA LEU 29 4.374 -11.850 6.737 240 HB2 LEU 29 HB2 LEU 29 4.681 -14.329 7.593 241 HB3 LEU 29 HB1 LEU 29 3.940 -13.706 9.055 242 HG LEU 29 HG LEU 29 1.968 -13.014 7.758 243 HD11 LEU 29 HD11 LEU 29 1.752 -13.685 5.426 244 HD12 LEU 29 HD12 LEU 29 3.380 -14.366 5.457 245 HD13 LEU 29 HD13 LEU 29 3.149 -12.623 5.645 246 HD21 LEU 29 HD21 LEU 29 2.746 -15.908 7.370 247 HD22 LEU 29 HD22 LEU 29 1.104 -15.265 7.335 248 HD23 LEU 29 HD23 LEU 29 2.040 -15.219 8.831 249 H GLY 30 HN GLY 30 5.235 -9.781 7.794 250 HA2 GLY 30 HA2 GLY 30 3.972 -9.396 10.450 251 HA3 GLY 30 HA1 GLY 30 5.585 -8.816 10.100 252 H PHE 31 HN PHE 31 5.220 -7.411 7.646 253 HA PHE 31 HA PHE 31 4.023 -5.118 8.952 254 HB2 PHE 31 HB2 PHE 31 5.122 -3.719 7.508 255 HB3 PHE 31 HB1 PHE 31 6.216 -5.073 7.592 256 HD1 PHE 31 HD1 PHE 31 3.671 -3.424 5.486 257 HD2 PHE 31 HD2 PHE 31 6.876 -6.198 5.645 258 HE1 PHE 31 HE1 PHE 31 3.764 -3.443 3.041 259 HE2 PHE 31 HE2 PHE 31 6.972 -6.237 3.197 260 HZ PHE 31 HZ PHE 31 5.413 -4.853 1.879 261 H SER 32 HN SER 32 2.460 -3.724 7.902 262 HA SER 32 HA SER 32 0.447 -5.590 6.819 263 HB2 SER 32 HB2 SER 32 -0.016 -5.134 9.156 264 HB3 SER 32 HB1 SER 32 0.056 -3.396 8.863 265 HG SER 32 HG SER 32 -2.033 -5.070 8.590 266 H ILE 33 HN ILE 33 -0.931 -4.897 5.271 267 HA ILE 33 HA ILE 33 -0.487 -2.187 4.237 268 HB ILE 33 HB ILE 33 -0.495 -2.997 1.964 269 HG12 ILE 33 HG12 ILE 33 -0.551 -5.815 3.073 270 HG13 ILE 33 HG11 ILE 33 -1.975 -4.988 2.448 271 HG21 ILE 33 HG21 ILE 33 1.628 -4.334 1.989 272 HG22 ILE 33 HG22 ILE 33 1.478 -4.402 3.751 273 HG23 ILE 33 HG23 ILE 33 1.665 -2.847 2.939 274 HD11 ILE 33 HD11 ILE 33 0.500 -5.739 0.903 275 HD12 ILE 33 HD12 ILE 33 -0.850 -4.807 0.253 276 HD13 ILE 33 HD13 ILE 33 -1.102 -6.473 0.777 277 H GLY 34 HN GLY 34 -2.288 -1.278 3.200 278 HA2 GLY 34 HA2 GLY 34 -4.781 -2.518 4.101 279 HA3 GLY 34 HA1 GLY 34 -4.594 -0.838 3.597 280 H GLY 35 HN GLY 35 -6.443 -3.087 2.802 281 HA2 GLY 35 HA2 GLY 35 -6.125 -2.711 -0.105 282 HA3 GLY 35 HA1 GLY 35 -6.454 -4.312 0.552 283 H GLY 36 HN GLY 36 -7.849 -1.857 -0.974 284 HA2 GLY 36 HA2 GLY 36 -10.506 -2.460 0.079 285 HA3 GLY 36 HA1 GLY 36 -9.986 -0.773 0.069 286 H ILE 37 HN ILE 37 -9.784 -3.491 -2.234 287 HA ILE 37 HA ILE 37 -11.265 -1.864 -4.157 288 HB ILE 37 HB ILE 37 -9.874 -2.844 -5.971 289 HG12 ILE 37 HG12 ILE 37 -8.947 -4.682 -4.433 290 HG13 ILE 37 HG11 ILE 37 -7.839 -3.946 -5.572 291 HG21 ILE 37 HG21 ILE 37 -9.570 -0.569 -5.265 292 HG22 ILE 37 HG22 ILE 37 -8.007 -1.282 -5.670 293 HG23 ILE 37 HG23 ILE 37 -8.480 -1.086 -3.980 294 HD11 ILE 37 HD11 ILE 37 -6.904 -2.576 -3.796 295 HD12 ILE 37 HD12 ILE 37 -6.815 -4.294 -3.400 296 HD13 ILE 37 HD13 ILE 37 -8.051 -3.284 -2.654 297 H ASP 38 HN ASP 38 -10.271 -5.045 -3.063 298 HA ASP 38 HA ASP 38 -11.998 -6.434 -4.906 299 HB2 ASP 38 HB2 ASP 38 -10.947 -7.783 -2.460 300 HB3 ASP 38 HB1 ASP 38 -11.045 -8.383 -4.108 301 H GLN 39 HN GLN 39 -12.680 -4.612 -2.302 302 HA GLN 39 HA GLN 39 -14.066 -6.625 -0.732 303 HB2 GLN 39 HB2 GLN 39 -13.968 -3.785 0.127 304 HB3 GLN 39 HB1 GLN 39 -13.841 -5.252 1.088 305 HG2 GLN 39 HG2 GLN 39 -11.697 -4.035 -0.660 306 HG3 GLN 39 HG1 GLN 39 -11.738 -4.084 1.094 307 HE21 GLN 39 HE21 GLN 39 -9.776 -5.084 -0.792 308 HE22 GLN 39 HE22 GLN 39 -9.607 -6.768 -0.481 309 H ASP 40 HN ASP 40 -14.960 -3.287 -1.364 310 HA ASP 40 HA ASP 40 -17.682 -4.065 -1.976 311 HB2 ASP 40 HB2 ASP 40 -17.486 -4.099 0.525 312 HB3 ASP 40 HB1 ASP 40 -17.052 -2.394 0.472 313 HA PRO 41 HA PRO 41 -17.374 -0.484 -4.538 314 HB2 PRO 41 HB2 PRO 41 -20.022 0.191 -4.640 315 HB3 PRO 41 HB1 PRO 41 -19.321 -1.162 -5.540 316 HG2 PRO 41 HG2 PRO 41 -20.701 -1.191 -2.865 317 HG3 PRO 41 HG1 PRO 41 -20.994 -2.222 -4.264 318 HD2 PRO 41 HD2 PRO 41 -19.521 -3.130 -2.287 319 HD3 PRO 41 HD1 PRO 41 -18.984 -3.420 -3.954 320 H SER 42 HN SER 42 -18.797 -0.333 -1.370 321 HA SER 42 HA SER 42 -19.449 2.401 -1.253 322 HB2 SER 42 HB2 SER 42 -18.554 0.550 0.967 323 HB3 SER 42 HB1 SER 42 -19.388 2.093 1.188 324 HG SER 42 HG SER 42 -20.354 -0.367 0.287 325 H GLN 43 HN GLN 43 -16.387 0.761 -1.009 326 HA GLN 43 HA GLN 43 -15.062 3.001 0.253 327 HB2 GLN 43 HB2 GLN 43 -13.170 1.543 0.308 328 HB3 GLN 43 HB1 GLN 43 -14.583 0.637 0.823 329 HG2 GLN 43 HG2 GLN 43 -14.653 0.086 -1.781 330 HG3 GLN 43 HG1 GLN 43 -12.930 0.361 -1.600 331 HE21 GLN 43 HE21 GLN 43 -15.055 -0.949 0.822 332 HE22 GLN 43 HE22 GLN 43 -14.299 -2.511 0.903 333 H ASN 44 HN ASN 44 -15.827 1.969 -2.859 334 HA ASN 44 HA ASN 44 -13.513 3.437 -3.944 335 HB2 ASN 44 HB2 ASN 44 -13.200 1.014 -4.188 336 HB3 ASN 44 HB1 ASN 44 -14.722 0.917 -5.057 337 HD21 ASN 44 HD21 ASN 44 -11.922 0.263 -5.753 338 HD22 ASN 44 HD22 ASN 44 -11.643 1.070 -7.254 339 HA PRO 45 HA PRO 45 -16.665 5.372 -6.498 340 HB2 PRO 45 HB2 PRO 45 -16.290 7.899 -5.741 341 HB3 PRO 45 HB1 PRO 45 -17.287 6.811 -4.760 342 HG2 PRO 45 HG2 PRO 45 -14.511 7.777 -4.293 343 HG3 PRO 45 HG1 PRO 45 -15.778 7.398 -3.116 344 HD2 PRO 45 HD2 PRO 45 -13.632 5.726 -3.904 345 HD3 PRO 45 HD1 PRO 45 -15.025 5.270 -2.906 346 H PHE 46 HN PHE 46 -13.651 4.666 -6.477 347 HA PHE 46 HA PHE 46 -12.756 5.850 -8.828 348 HB2 PHE 46 HB2 PHE 46 -12.723 7.945 -7.468 349 HB3 PHE 46 HB1 PHE 46 -11.592 7.173 -6.356 350 HD1 PHE 46 HD1 PHE 46 -9.304 6.611 -7.128 351 HD2 PHE 46 HD2 PHE 46 -11.989 8.886 -9.526 352 HE1 PHE 46 HE1 PHE 46 -7.420 7.388 -8.509 353 HE2 PHE 46 HE2 PHE 46 -10.110 9.661 -10.910 354 HZ PHE 46 HZ PHE 46 -7.826 8.940 -10.394 355 H SER 47 HN SER 47 -11.886 4.627 -5.628 356 HA SER 47 HA SER 47 -10.083 2.683 -6.478 357 HB2 SER 47 HB2 SER 47 -9.072 5.396 -6.222 358 HB3 SER 47 HB1 SER 47 -8.257 4.283 -5.133 359 HG SER 47 HG SER 47 -8.586 3.929 -7.929 360 H GLU 48 HN GLU 48 -10.640 5.153 -4.100 361 HA GLU 48 HA GLU 48 -11.533 3.451 -2.065 362 HB2 GLU 48 HB2 GLU 48 -9.239 2.746 -1.940 363 HB3 GLU 48 HB1 GLU 48 -8.702 4.414 -1.947 364 HG2 GLU 48 HG2 GLU 48 -8.539 3.342 0.265 365 HG3 GLU 48 HG1 GLU 48 -9.599 4.751 0.274 366 H ASP 49 HN ASP 49 -9.339 6.131 -1.435 367 HA ASP 49 HA ASP 49 -11.736 7.752 -0.897 368 HB2 ASP 49 HB2 ASP 49 -10.221 7.026 1.081 369 HB3 ASP 49 HB1 ASP 49 -9.144 8.298 0.507 370 H LYS 50 HN LYS 50 -11.259 7.980 -3.292 371 HA LYS 50 HA LYS 50 -10.898 9.398 -5.018 372 HB2 LYS 50 HB2 LYS 50 -10.163 11.345 -2.834 373 HB3 LYS 50 HB1 LYS 50 -10.320 11.782 -4.527 374 HG2 LYS 50 HG2 LYS 50 -12.378 12.401 -3.724 375 HG3 LYS 50 HG1 LYS 50 -12.719 10.755 -4.258 376 HD2 LYS 50 HD2 LYS 50 -13.697 11.007 -2.107 377 HD3 LYS 50 HD1 LYS 50 -12.255 10.006 -1.907 378 HE2 LYS 50 HE2 LYS 50 -11.003 12.008 -1.192 379 HE3 LYS 50 HE1 LYS 50 -12.480 12.960 -1.337 380 HZ1 LYS 50 HZ1 LYS 50 -12.589 12.459 0.844 381 HZ2 LYS 50 HZ2 LYS 50 -11.710 11.018 0.702 382 HZ3 LYS 50 HZ3 LYS 50 -13.351 11.057 0.262 383 H THR 51 HN THR 51 -8.337 10.364 -2.766 384 HA THR 51 HA THR 51 -6.501 10.543 -5.006 385 HB THR 51 HB THR 51 -5.811 11.193 -2.160 386 HG1 THR 51 HG1 THR 51 -7.427 12.713 -3.967 387 HG21 THR 51 HG21 THR 51 -4.084 11.361 -3.884 388 HG22 THR 51 HG22 THR 51 -4.505 12.955 -3.251 389 HG23 THR 51 HG23 THR 51 -5.121 12.434 -4.820 390 H ASP 52 HN ASP 52 -7.409 7.960 -3.547 391 HA ASP 52 HA ASP 52 -4.726 6.888 -3.045 392 HB2 ASP 52 HB2 ASP 52 -6.722 6.742 -1.279 393 HB3 ASP 52 HB1 ASP 52 -7.176 5.338 -2.266 394 H LYS 53 HN LYS 53 -5.167 4.297 -3.366 395 HA LYS 53 HA LYS 53 -6.329 3.876 -6.000 396 HB2 LYS 53 HB2 LYS 53 -3.815 4.249 -6.160 397 HB3 LYS 53 HB1 LYS 53 -3.619 2.763 -5.238 398 HG2 LYS 53 HG2 LYS 53 -3.407 2.488 -7.704 399 HG3 LYS 53 HG1 LYS 53 -4.649 1.473 -6.960 400 HD2 LYS 53 HD2 LYS 53 -6.292 3.285 -7.519 401 HD3 LYS 53 HD1 LYS 53 -5.030 4.016 -8.516 402 HE2 LYS 53 HE2 LYS 53 -6.091 1.205 -8.842 403 HE3 LYS 53 HE1 LYS 53 -6.585 2.588 -9.813 404 HZ1 LYS 53 HZ1 LYS 53 -3.808 1.568 -9.647 405 HZ2 LYS 53 HZ2 LYS 53 -4.381 2.780 -10.682 406 HZ3 LYS 53 HZ3 LYS 53 -4.894 1.177 -10.881 407 H GLY 54 HN GLY 54 -5.832 2.991 -2.799 408 HA2 GLY 54 HA2 GLY 54 -7.382 1.514 -1.756 409 HA3 GLY 54 HA1 GLY 54 -7.460 0.589 -3.245 410 H ILE 55 HN ILE 55 -4.312 1.160 -2.946 411 HA ILE 55 HA ILE 55 -3.789 -1.002 -1.024 412 HB ILE 55 HB ILE 55 -2.414 -0.708 -3.709 413 HG12 ILE 55 HG12 ILE 55 -4.720 -1.733 -3.743 414 HG13 ILE 55 HG11 ILE 55 -3.442 -2.801 -4.309 415 HG21 ILE 55 HG21 ILE 55 -1.963 -2.671 -1.454 416 HG22 ILE 55 HG22 ILE 55 -0.845 -1.421 -1.997 417 HG23 ILE 55 HG23 ILE 55 -1.228 -2.782 -3.053 418 HD11 ILE 55 HD11 ILE 55 -3.433 -3.978 -2.208 419 HD12 ILE 55 HD12 ILE 55 -5.071 -3.938 -2.866 420 HD13 ILE 55 HD13 ILE 55 -4.624 -2.857 -1.546 421 H TYR 56 HN TYR 56 -2.454 -0.334 0.530 422 HA TYR 56 HA TYR 56 -0.106 1.235 -0.040 423 HB2 TYR 56 HB2 TYR 56 -0.649 3.194 1.249 424 HB3 TYR 56 HB1 TYR 56 -1.953 2.957 0.091 425 HD1 TYR 56 HD1 TYR 56 -4.034 1.729 0.913 426 HD2 TYR 56 HD2 TYR 56 -1.130 3.417 3.519 427 HE1 TYR 56 HE1 TYR 56 -5.696 1.764 2.726 428 HE2 TYR 56 HE2 TYR 56 -2.784 3.460 5.345 429 HH TYR 56 HH TYR 56 -5.142 3.427 5.703 430 H VAL 57 HN VAL 57 1.128 1.650 2.170 431 HA VAL 57 HA VAL 57 0.721 -0.706 3.770 432 HB VAL 57 HB VAL 57 2.924 0.216 2.752 433 HG11 VAL 57 HG11 VAL 57 4.222 1.433 4.543 434 HG12 VAL 57 HG12 VAL 57 2.642 1.898 5.180 435 HG13 VAL 57 HG13 VAL 57 3.113 2.361 3.544 436 HG21 VAL 57 HG21 VAL 57 4.169 -0.890 4.473 437 HG22 VAL 57 HG22 VAL 57 2.674 -1.757 4.120 438 HG23 VAL 57 HG23 VAL 57 2.793 -0.748 5.562 439 H THR 58 HN THR 58 0.038 -0.659 5.774 440 HA THR 58 HA THR 58 -0.631 1.962 6.928 441 HB THR 58 HB THR 58 -2.609 0.566 6.372 442 HG1 THR 58 HG1 THR 58 -3.466 1.504 8.050 443 HG21 THR 58 HG21 THR 58 -3.084 -1.437 7.706 444 HG22 THR 58 HG22 THR 58 -1.481 -1.329 8.434 445 HG23 THR 58 HG23 THR 58 -1.647 -1.650 6.705 446 H ARG 59 HN ARG 59 1.440 -0.654 7.218 447 HA ARG 59 HA ARG 59 2.650 0.413 9.511 448 HB2 ARG 59 HB2 ARG 59 1.916 -0.745 11.275 449 HB3 ARG 59 HB1 ARG 59 0.543 -1.113 10.278 450 HG2 ARG 59 HG2 ARG 59 1.451 -3.249 9.687 451 HG3 ARG 59 HG1 ARG 59 2.954 -2.864 10.535 452 HD2 ARG 59 HD2 ARG 59 1.632 -2.626 12.628 453 HD3 ARG 59 HD1 ARG 59 0.220 -3.198 11.747 454 HE ARG 59 HE ARG 59 2.403 -5.004 11.512 455 HH11 ARG 59 HH11 ARG 59 -0.148 -3.966 13.651 456 HH12 ARG 59 HH12 ARG 59 -0.195 -5.449 14.547 457 HH21 ARG 59 HH21 ARG 59 2.365 -6.975 12.682 458 HH22 ARG 59 HH22 ARG 59 1.238 -7.175 13.989 459 H VAL 60 HN VAL 60 4.261 -1.223 10.436 460 HA VAL 60 HA VAL 60 5.416 -2.890 8.371 461 HB VAL 60 HB VAL 60 6.805 -0.459 9.523 462 HG11 VAL 60 HG11 VAL 60 8.332 -2.300 9.495 463 HG12 VAL 60 HG12 VAL 60 8.752 -1.191 8.186 464 HG13 VAL 60 HG13 VAL 60 7.895 -2.696 7.836 465 HG21 VAL 60 HG21 VAL 60 5.385 0.085 7.662 466 HG22 VAL 60 HG22 VAL 60 6.090 -1.218 6.704 467 HG23 VAL 60 HG23 VAL 60 7.074 0.175 7.164 468 H SER 61 HN SER 61 6.439 -4.634 9.314 469 HA SER 61 HA SER 61 6.992 -4.755 12.102 470 HB2 SER 61 HB2 SER 61 8.622 -6.186 10.033 471 HB3 SER 61 HB1 SER 61 8.246 -6.702 11.674 472 HG SER 61 HG SER 61 6.213 -7.225 11.069 473 H GLU 62 HN GLU 62 8.177 -3.145 12.903 474 HA GLU 62 HA GLU 62 9.909 -1.662 11.288 475 HB2 GLU 62 HB2 GLU 62 10.014 -0.202 13.188 476 HB3 GLU 62 HB1 GLU 62 8.362 -0.605 12.830 477 HG2 GLU 62 HG2 GLU 62 8.652 -2.400 14.625 478 HG3 GLU 62 HG1 GLU 62 10.075 -1.485 15.105 479 H GLY 63 HN GLY 63 11.905 -1.060 11.865 480 HA2 GLY 63 HA2 GLY 63 14.128 -1.426 12.357 481 HA3 GLY 63 HA1 GLY 63 13.603 -2.550 13.616 482 H GLY 64 HN GLY 64 12.430 -2.987 10.363 483 HA2 GLY 64 HA2 GLY 64 14.104 -5.403 10.266 484 HA3 GLY 64 HA1 GLY 64 12.377 -5.412 9.924 485 HA PRO 65 HA PRO 65 14.469 -5.335 5.936 486 HB2 PRO 65 HB2 PRO 65 12.112 -6.661 4.971 487 HB3 PRO 65 HB1 PRO 65 13.735 -7.299 5.163 488 HG2 PRO 65 HG2 PRO 65 11.653 -8.142 6.677 489 HG3 PRO 65 HG1 PRO 65 13.322 -8.099 7.285 490 HD2 PRO 65 HD2 PRO 65 11.118 -6.083 7.687 491 HD3 PRO 65 HD1 PRO 65 12.253 -6.781 8.875 492 H ALA 66 HN ALA 66 11.112 -4.382 6.525 493 HA ALA 66 HA ALA 66 10.604 -3.698 3.764 494 HB1 ALA 66 HB1 ALA 66 9.146 -3.019 6.318 495 HB2 ALA 66 HB2 ALA 66 8.632 -4.101 5.020 496 HB3 ALA 66 HB3 ALA 66 8.671 -2.348 4.755 497 H GLU 67 HN GLU 67 11.505 -2.054 6.681 498 HA GLU 67 HA GLU 67 11.006 0.510 5.544 499 HB2 GLU 67 HB2 GLU 67 12.166 1.102 7.811 500 HB3 GLU 67 HB1 GLU 67 10.521 0.467 7.780 501 HG2 GLU 67 HG2 GLU 67 11.122 -1.528 8.635 502 HG3 GLU 67 HG1 GLU 67 12.685 -1.496 7.840 503 H ILE 68 HN ILE 68 13.684 -1.657 6.055 504 HA ILE 68 HA ILE 68 15.652 0.360 5.738 505 HB ILE 68 HB ILE 68 17.185 -1.503 5.534 506 HG12 ILE 68 HG12 ILE 68 15.868 -3.659 6.550 507 HG13 ILE 68 HG11 ILE 68 14.730 -3.015 5.378 508 HG21 ILE 68 HG21 ILE 68 16.986 -2.226 7.896 509 HG22 ILE 68 HG22 ILE 68 15.388 -1.477 7.918 510 HG23 ILE 68 HG23 ILE 68 16.824 -0.484 7.669 511 HD11 ILE 68 HD11 ILE 68 16.438 -3.161 3.640 512 HD12 ILE 68 HD12 ILE 68 16.131 -4.727 4.388 513 HD13 ILE 68 HD13 ILE 68 17.581 -3.817 4.815 514 H ALA 69 HN ALA 69 13.919 -1.957 3.933 515 HA ALA 69 HA ALA 69 15.262 -1.668 1.480 516 HB1 ALA 69 HB1 ALA 69 12.362 -2.264 2.048 517 HB2 ALA 69 HB2 ALA 69 13.646 -3.444 1.771 518 HB3 ALA 69 HB3 ALA 69 13.112 -2.390 0.457 519 H GLY 70 HN GLY 70 13.154 0.262 3.349 520 HA2 GLY 70 HA2 GLY 70 13.097 2.670 2.918 521 HA3 GLY 70 HA1 GLY 70 13.095 2.308 1.189 522 H LEU 71 HN LEU 71 11.221 1.249 4.012 523 HA LEU 71 HA LEU 71 8.765 1.962 2.643 524 HB2 LEU 71 HB2 LEU 71 9.390 -0.471 2.304 525 HB3 LEU 71 HB1 LEU 71 9.223 -0.655 4.037 526 HG LEU 71 HG LEU 71 7.328 -1.413 2.549 527 HD11 LEU 71 HD11 LEU 71 6.782 0.439 4.830 528 HD12 LEU 71 HD12 LEU 71 7.231 -1.258 4.950 529 HD13 LEU 71 HD13 LEU 71 5.684 -0.807 4.228 530 HD21 LEU 71 HD21 LEU 71 7.096 0.476 1.094 531 HD22 LEU 71 HD22 LEU 71 6.854 1.554 2.467 532 HD23 LEU 71 HD23 LEU 71 5.633 0.344 2.074 533 H GLN 72 HN GLN 72 7.103 2.287 4.103 534 HA GLN 72 HA GLN 72 7.442 2.474 6.821 535 HB2 GLN 72 HB2 GLN 72 7.917 4.844 7.139 536 HB3 GLN 72 HB1 GLN 72 9.228 4.003 6.347 537 HG2 GLN 72 HG2 GLN 72 7.448 6.125 5.288 538 HG3 GLN 72 HG1 GLN 72 9.202 5.975 5.246 539 HE21 GLN 72 HE21 GLN 72 6.262 5.326 3.640 540 HE22 GLN 72 HE22 GLN 72 6.941 4.543 2.250 541 H ILE 73 HN ILE 73 5.809 3.970 7.770 542 HA ILE 73 HA ILE 73 3.438 2.797 6.824 543 HB ILE 73 HB ILE 73 3.353 5.011 8.825 544 HG12 ILE 73 HG12 ILE 73 5.439 4.032 9.509 545 HG13 ILE 73 HG11 ILE 73 4.198 3.438 10.603 546 HG21 ILE 73 HG21 ILE 73 1.377 3.748 8.356 547 HG22 ILE 73 HG22 ILE 73 1.928 3.395 9.994 548 HG23 ILE 73 HG23 ILE 73 2.227 2.243 8.693 549 HD11 ILE 73 HD11 ILE 73 5.748 1.677 10.002 550 HD12 ILE 73 HD12 ILE 73 5.399 1.922 8.285 551 HD13 ILE 73 HD13 ILE 73 4.141 1.324 9.373 552 H GLY 74 HN GLY 74 2.351 3.431 5.205 553 HA2 GLY 74 HA2 GLY 74 0.479 4.920 4.685 554 HA3 GLY 74 HA1 GLY 74 1.496 6.274 5.182 555 H ASP 75 HN ASP 75 1.880 3.480 3.017 556 HA ASP 75 HA ASP 75 2.780 5.366 0.921 557 HB2 ASP 75 HB2 ASP 75 4.608 4.147 2.495 558 HB3 ASP 75 HB1 ASP 75 4.409 2.919 1.241 559 H LYS 76 HN LYS 76 2.089 4.773 -1.108 560 HA LYS 76 HA LYS 76 0.195 2.567 -1.012 561 HB2 LYS 76 HB2 LYS 76 0.628 4.511 -3.267 562 HB3 LYS 76 HB1 LYS 76 -0.786 3.512 -2.966 563 HG2 LYS 76 HG2 LYS 76 -1.497 4.848 -1.201 564 HG3 LYS 76 HG1 LYS 76 0.081 5.630 -1.036 565 HD2 LYS 76 HD2 LYS 76 -0.233 6.557 -3.326 566 HD3 LYS 76 HD1 LYS 76 -1.882 5.924 -3.295 567 HE2 LYS 76 HE2 LYS 76 -2.390 7.299 -1.347 568 HE3 LYS 76 HE1 LYS 76 -0.736 7.905 -1.330 569 HZ1 LYS 76 HZ1 LYS 76 -1.303 8.605 -3.745 570 HZ2 LYS 76 HZ2 LYS 76 -1.822 9.555 -2.443 571 HZ3 LYS 76 HZ3 LYS 76 -2.912 8.508 -3.210 572 H ILE 77 HN ILE 77 1.075 0.705 -1.423 573 HA ILE 77 HA ILE 77 3.190 0.330 -3.323 574 HB ILE 77 HB ILE 77 1.504 -1.796 -1.999 575 HG12 ILE 77 HG12 ILE 77 4.152 -0.704 -1.021 576 HG13 ILE 77 HG11 ILE 77 2.605 -0.124 -0.412 577 HG21 ILE 77 HG21 ILE 77 3.511 -3.187 -2.355 578 HG22 ILE 77 HG22 ILE 77 4.275 -1.839 -3.201 579 HG23 ILE 77 HG23 ILE 77 2.826 -2.594 -3.867 580 HD11 ILE 77 HD11 ILE 77 3.613 -1.779 1.063 581 HD12 ILE 77 HD12 ILE 77 3.590 -2.959 -0.248 582 HD13 ILE 77 HD13 ILE 77 2.075 -2.336 0.405 583 H MET 78 HN MET 78 2.601 0.747 -5.370 584 HA MET 78 HA MET 78 -0.084 0.194 -6.251 585 HB2 MET 78 HB2 MET 78 2.249 1.224 -7.857 586 HB3 MET 78 HB1 MET 78 0.550 1.303 -8.299 587 HG2 MET 78 HG2 MET 78 1.608 2.614 -5.834 588 HG3 MET 78 HG1 MET 78 1.656 3.410 -7.400 589 HE1 MET 78 HE1 MET 78 -0.396 2.193 -4.420 590 HE2 MET 78 HE2 MET 78 -1.306 1.206 -5.567 591 HE3 MET 78 HE3 MET 78 -2.062 2.604 -4.812 592 H GLN 79 HN GLN 79 3.097 -1.175 -6.650 593 HA GLN 79 HA GLN 79 1.911 -3.508 -7.834 594 HB2 GLN 79 HB2 GLN 79 4.226 -3.071 -9.350 595 HB3 GLN 79 HB1 GLN 79 2.560 -3.183 -9.899 596 HG2 GLN 79 HG2 GLN 79 2.596 -0.640 -9.119 597 HG3 GLN 79 HG1 GLN 79 4.292 -0.875 -9.518 598 HE21 GLN 79 HE21 GLN 79 4.843 -1.587 -11.569 599 HE22 GLN 79 HE22 GLN 79 3.852 -1.177 -12.951 600 H VAL 80 HN VAL 80 3.154 -5.247 -7.968 601 HA VAL 80 HA VAL 80 5.533 -5.294 -6.211 602 HB VAL 80 HB VAL 80 3.994 -6.680 -5.156 603 HG11 VAL 80 HG11 VAL 80 2.424 -8.149 -6.269 604 HG12 VAL 80 HG12 VAL 80 3.169 -7.802 -7.830 605 HG13 VAL 80 HG13 VAL 80 2.309 -6.530 -6.965 606 HG21 VAL 80 HG21 VAL 80 4.722 -9.004 -5.551 607 HG22 VAL 80 HG22 VAL 80 6.104 -7.905 -5.603 608 HG23 VAL 80 HG23 VAL 80 5.411 -8.525 -7.110 609 H ASN 81 HN ASN 81 7.416 -5.727 -7.224 610 HA ASN 81 HA ASN 81 8.929 -6.290 -8.821 611 HB2 ASN 81 HB2 ASN 81 6.970 -8.553 -8.950 612 HB3 ASN 81 HB1 ASN 81 8.285 -8.478 -10.120 613 HD21 ASN 81 HD21 ASN 81 7.408 -9.068 -6.824 614 HD22 ASN 81 HD22 ASN 81 8.974 -9.608 -6.295 615 H GLY 82 HN GLY 82 6.274 -4.831 -9.558 616 HA2 GLY 82 HA2 GLY 82 6.244 -3.410 -11.543 617 HA3 GLY 82 HA1 GLY 82 6.773 -4.821 -12.468 618 H TRP 83 HN TRP 83 4.519 -5.906 -10.272 619 HA TRP 83 HA TRP 83 2.495 -5.993 -12.352 620 HB2 TRP 83 HB2 TRP 83 2.498 -7.477 -9.749 621 HB3 TRP 83 HB1 TRP 83 1.525 -7.796 -11.154 622 HD1 TRP 83 HD1 TRP 83 5.247 -7.370 -10.819 623 HE1 TRP 83 HE1 TRP 83 6.381 -9.467 -11.580 624 HE3 TRP 83 HE3 TRP 83 1.154 -10.145 -12.026 625 HZ2 TRP 83 HZ2 TRP 83 5.752 -11.973 -12.643 626 HZ3 TRP 83 HZ3 TRP 83 1.521 -12.404 -12.943 627 HH2 TRP 83 HH2 TRP 83 3.792 -13.275 -13.237 628 H ASP 84 HN ASP 84 1.845 -3.790 -11.899 629 HA ASP 84 HA ASP 84 0.646 -2.547 -9.959 630 HB2 ASP 84 HB2 ASP 84 0.151 -1.985 -12.313 631 HB3 ASP 84 HB1 ASP 84 -0.937 -3.363 -12.419 632 H MET 85 HN MET 85 -0.046 -3.331 -8.130 633 HA MET 85 HA MET 85 -1.295 -5.860 -7.808 634 HB2 MET 85 HB2 MET 85 -1.213 -3.615 -5.791 635 HB3 MET 85 HB1 MET 85 -1.354 -5.337 -5.466 636 HG2 MET 85 HG2 MET 85 0.909 -5.637 -6.407 637 HG3 MET 85 HG1 MET 85 1.037 -3.893 -6.571 638 HE1 MET 85 HE1 MET 85 -0.542 -6.098 -3.687 639 HE2 MET 85 HE2 MET 85 0.808 -6.156 -2.556 640 HE3 MET 85 HE3 MET 85 0.946 -6.946 -4.128 641 H THR 86 HN THR 86 -2.618 -2.902 -8.758 642 HA THR 86 HA THR 86 -5.074 -3.278 -7.223 643 HB THR 86 HB THR 86 -5.672 -1.020 -7.894 644 HG1 THR 86 HG1 THR 86 -3.574 -1.401 -9.719 645 HG21 THR 86 HG21 THR 86 -2.797 -1.256 -6.998 646 HG22 THR 86 HG22 THR 86 -4.222 -1.266 -5.957 647 HG23 THR 86 HG23 THR 86 -3.789 0.196 -6.848 648 H MET 87 HN MET 87 -3.889 -4.137 -10.222 649 HA MET 87 HA MET 87 -6.577 -4.166 -11.398 650 HB2 MET 87 HB2 MET 87 -5.512 -4.754 -13.517 651 HB3 MET 87 HB1 MET 87 -4.837 -3.273 -12.856 652 HG2 MET 87 HG2 MET 87 -2.900 -4.538 -12.042 653 HG3 MET 87 HG1 MET 87 -3.580 -6.005 -12.743 654 HE1 MET 87 HE1 MET 87 -1.285 -6.400 -14.095 655 HE2 MET 87 HE2 MET 87 -0.644 -4.930 -13.363 656 HE3 MET 87 HE3 MET 87 -0.546 -5.158 -15.108 657 H VAL 88 HN VAL 88 -4.418 -6.158 -9.751 658 HA VAL 88 HA VAL 88 -5.664 -8.625 -10.700 659 HB VAL 88 HB VAL 88 -3.715 -8.722 -8.476 660 HG11 VAL 88 HG11 VAL 88 -2.806 -10.554 -9.816 661 HG12 VAL 88 HG12 VAL 88 -3.952 -10.169 -11.102 662 HG13 VAL 88 HG13 VAL 88 -4.536 -10.734 -9.533 663 HG21 VAL 88 HG21 VAL 88 -2.823 -7.883 -11.232 664 HG22 VAL 88 HG22 VAL 88 -1.764 -8.376 -9.911 665 HG23 VAL 88 HG23 VAL 88 -2.727 -6.906 -9.765 666 H THR 89 HN THR 89 -5.674 -10.140 -8.276 667 HA THR 89 HA THR 89 -7.551 -8.568 -6.663 668 HB THR 89 HB THR 89 -7.180 -11.460 -7.234 669 HG1 THR 89 HG1 THR 89 -9.220 -9.586 -7.301 670 HG21 THR 89 HG21 THR 89 -8.328 -10.492 -4.646 671 HG22 THR 89 HG22 THR 89 -6.926 -11.542 -4.893 672 HG23 THR 89 HG23 THR 89 -8.544 -12.116 -5.300 673 H HIS 90 HN HIS 90 -7.256 -8.784 -4.316 674 HA HIS 90 HA HIS 90 -4.685 -7.904 -3.639 675 HB2 HIS 90 HB2 HIS 90 -6.869 -7.390 -2.458 676 HB3 HIS 90 HB1 HIS 90 -6.742 -8.972 -1.694 677 HD1 HIS 90 HD1 HIS 90 -5.254 -5.546 -1.647 678 HD2 HIS 90 HD2 HIS 90 -4.863 -9.163 0.348 679 HE1 HIS 90 HE1 HIS 90 -3.879 -5.039 0.393 680 HE2 HIS 90 HE2 HIS 90 -3.495 -7.290 1.479 681 H ASP 91 HN ASP 91 -6.152 -11.052 -3.292 682 HA ASP 91 HA ASP 91 -3.977 -12.241 -1.893 683 HB2 ASP 91 HB2 ASP 91 -6.189 -13.264 -1.814 684 HB3 ASP 91 HB1 ASP 91 -6.165 -13.481 -3.571 685 H GLN 92 HN GLN 92 -4.864 -11.858 -5.259 686 HA GLN 92 HA GLN 92 -2.930 -13.526 -6.415 687 HB2 GLN 92 HB2 GLN 92 -3.649 -10.977 -7.743 688 HB3 GLN 92 HB1 GLN 92 -3.425 -12.572 -8.435 689 HG2 GLN 92 HG2 GLN 92 -5.746 -11.723 -6.764 690 HG3 GLN 92 HG1 GLN 92 -5.740 -11.790 -8.514 691 HE21 GLN 92 HE21 GLN 92 -4.186 -14.147 -8.594 692 HE22 GLN 92 HE22 GLN 92 -5.238 -15.424 -8.141 693 H ALA 93 HN ALA 93 -2.938 -10.106 -5.610 694 HA ALA 93 HA ALA 93 -0.280 -9.635 -6.531 695 HB1 ALA 93 HB1 ALA 93 -0.517 -7.475 -5.412 696 HB2 ALA 93 HB2 ALA 93 -1.999 -8.038 -4.637 697 HB3 ALA 93 HB3 ALA 93 -1.934 -7.852 -6.390 698 H ARG 94 HN ARG 94 -1.745 -10.687 -3.549 699 HA ARG 94 HA ARG 94 0.578 -10.112 -2.004 700 HB2 ARG 94 HB2 ARG 94 -0.710 -10.504 -0.187 701 HB3 ARG 94 HB1 ARG 94 -2.027 -10.425 -1.346 702 HG2 ARG 94 HG2 ARG 94 -2.015 -12.870 -1.511 703 HG3 ARG 94 HG1 ARG 94 -0.718 -12.923 -0.300 704 HD2 ARG 94 HD2 ARG 94 -2.103 -12.200 1.405 705 HD3 ARG 94 HD1 ARG 94 -3.252 -11.451 0.292 706 HE ARG 94 HE ARG 94 -3.498 -14.074 -0.295 707 HH11 ARG 94 HH11 ARG 94 -3.512 -12.380 2.775 708 HH12 ARG 94 HH12 ARG 94 -4.691 -13.431 3.486 709 HH21 ARG 94 HH21 ARG 94 -5.051 -15.433 0.628 710 HH22 ARG 94 HH22 ARG 94 -5.574 -15.166 2.270 711 H LYS 95 HN LYS 95 -0.587 -12.842 -3.822 712 HA LYS 95 HA LYS 95 1.478 -14.566 -2.800 713 HB2 LYS 95 HB2 LYS 95 0.703 -16.232 -4.323 714 HB3 LYS 95 HB1 LYS 95 -0.693 -15.462 -3.593 715 HG2 LYS 95 HG2 LYS 95 -0.746 -14.027 -5.722 716 HG3 LYS 95 HG1 LYS 95 0.306 -15.273 -6.403 717 HD2 LYS 95 HD2 LYS 95 -1.445 -16.942 -5.563 718 HD3 LYS 95 HD1 LYS 95 -2.499 -15.545 -5.356 719 HE2 LYS 95 HE2 LYS 95 -3.102 -16.143 -7.468 720 HE3 LYS 95 HE1 LYS 95 -1.752 -15.074 -7.853 721 HZ1 LYS 95 HZ1 LYS 95 -1.768 -18.041 -7.785 722 HZ2 LYS 95 HZ2 LYS 95 -0.336 -17.141 -7.839 723 HZ3 LYS 95 HZ3 LYS 95 -1.451 -17.034 -9.114 724 H ARG 96 HN ARG 96 1.264 -12.150 -5.288 725 HA ARG 96 HA ARG 96 3.630 -12.878 -6.671 726 HB2 ARG 96 HB2 ARG 96 2.254 -10.230 -6.233 727 HB3 ARG 96 HB1 ARG 96 3.686 -10.415 -7.236 728 HG2 ARG 96 HG2 ARG 96 1.032 -11.750 -7.673 729 HG3 ARG 96 HG1 ARG 96 1.693 -10.389 -8.584 730 HD2 ARG 96 HD2 ARG 96 2.251 -12.139 -9.937 731 HD3 ARG 96 HD1 ARG 96 3.702 -11.986 -8.958 732 HE ARG 96 HE ARG 96 2.691 -13.839 -7.574 733 HH11 ARG 96 HH11 ARG 96 1.964 -13.490 -10.986 734 HH12 ARG 96 HH12 ARG 96 1.715 -15.194 -11.238 735 HH21 ARG 96 HH21 ARG 96 2.380 -16.090 -7.914 736 HH22 ARG 96 HH22 ARG 96 1.982 -16.662 -9.505 737 H LEU 97 HN LEU 97 2.958 -11.321 -3.684 738 HA LEU 97 HA LEU 97 5.559 -10.231 -3.196 739 HB2 LEU 97 HB2 LEU 97 3.538 -11.009 -1.109 740 HB3 LEU 97 HB1 LEU 97 4.722 -9.716 -1.043 741 HG LEU 97 HG LEU 97 2.343 -9.753 -2.890 742 HD11 LEU 97 HD11 LEU 97 1.566 -9.573 -0.642 743 HD12 LEU 97 HD12 LEU 97 1.462 -7.995 -1.420 744 HD13 LEU 97 HD13 LEU 97 2.765 -8.329 -0.275 745 HD21 LEU 97 HD21 LEU 97 4.314 -8.542 -3.671 746 HD22 LEU 97 HD22 LEU 97 4.271 -7.559 -2.205 747 HD23 LEU 97 HD23 LEU 97 2.934 -7.488 -3.356 748 H THR 98 HN THR 98 3.815 -13.108 -2.473 749 HA THR 98 HA THR 98 6.248 -14.313 -1.335 750 HB THR 98 HB THR 98 4.744 -15.698 0.099 751 HG1 THR 98 HG1 THR 98 2.729 -13.833 -0.679 752 HG21 THR 98 HG21 THR 98 5.841 -13.664 0.964 753 HG22 THR 98 HG22 THR 98 4.280 -13.958 1.728 754 HG23 THR 98 HG23 THR 98 4.431 -12.719 0.480 755 H LYS 99 HN LYS 99 6.134 -14.682 -3.963 756 HA LYS 99 HA LYS 99 4.500 -16.926 -4.674 757 HB2 LYS 99 HB2 LYS 99 5.589 -16.899 -6.799 758 HB3 LYS 99 HB1 LYS 99 5.256 -15.235 -6.339 759 HG2 LYS 99 HG2 LYS 99 7.631 -15.146 -5.505 760 HG3 LYS 99 HG1 LYS 99 7.865 -16.701 -6.294 761 HD2 LYS 99 HD2 LYS 99 7.153 -15.682 -8.428 762 HD3 LYS 99 HD1 LYS 99 7.062 -14.121 -7.605 763 HE2 LYS 99 HE2 LYS 99 9.415 -14.190 -7.105 764 HE3 LYS 99 HE1 LYS 99 9.544 -15.826 -7.751 765 HZ1 LYS 99 HZ1 LYS 99 10.347 -14.216 -9.344 766 HZ2 LYS 99 HZ2 LYS 99 8.868 -13.386 -9.305 767 HZ3 LYS 99 HZ3 LYS 99 8.939 -14.958 -9.938 768 H ARG 100 HN ARG 100 7.218 -16.642 -2.946 769 HA ARG 100 HA ARG 100 8.441 -18.217 -1.810 770 HB2 ARG 100 HB2 ARG 100 6.315 -19.756 -2.937 771 HB3 ARG 100 HB1 ARG 100 7.811 -20.663 -3.099 772 HG2 ARG 100 HG2 ARG 100 6.652 -21.240 -1.046 773 HG3 ARG 100 HG1 ARG 100 8.202 -20.472 -0.704 774 HD2 ARG 100 HD2 ARG 100 6.315 -19.707 0.754 775 HD3 ARG 100 HD1 ARG 100 7.140 -18.418 -0.119 776 HE ARG 100 HE ARG 100 5.253 -18.149 -1.490 777 HH11 ARG 100 HH11 ARG 100 4.747 -20.683 0.884 778 HH12 ARG 100 HH12 ARG 100 3.019 -20.610 0.753 779 HH21 ARG 100 HH21 ARG 100 2.990 -18.056 -1.631 780 HH22 ARG 100 HH22 ARG 100 2.025 -19.128 -0.654 781 H SER 101 HN SER 101 8.671 -17.394 -4.935 782 HA SER 101 HA SER 101 11.046 -19.065 -5.394 783 HB2 SER 101 HB2 SER 101 9.370 -17.575 -7.419 784 HB3 SER 101 HB1 SER 101 10.690 -18.686 -7.756 785 HG SER 101 HG SER 101 8.904 -19.877 -6.155 786 H GLU 102 HN GLU 102 10.538 -16.352 -3.980 787 HA GLU 102 HA GLU 102 12.850 -15.043 -5.132 788 HB2 GLU 102 HB2 GLU 102 11.872 -12.883 -5.036 789 HB3 GLU 102 HB1 GLU 102 10.692 -13.892 -5.854 790 HG2 GLU 102 HG2 GLU 102 10.561 -13.244 -2.925 791 HG3 GLU 102 HG1 GLU 102 9.805 -12.254 -4.173 792 H GLU 103 HN GLU 103 13.955 -13.808 -3.591 793 HA GLU 103 HA GLU 103 13.423 -14.580 -0.813 794 HB2 GLU 103 HB2 GLU 103 15.797 -14.225 -0.376 795 HB3 GLU 103 HB1 GLU 103 15.554 -15.431 -1.625 796 HG2 GLU 103 HG2 GLU 103 16.033 -13.698 -3.327 797 HG3 GLU 103 HG1 GLU 103 16.389 -12.570 -2.017 798 H VAL 104 HN VAL 104 12.782 -12.306 -2.780 799 HA VAL 104 HA VAL 104 12.518 -10.288 -0.791 800 HB VAL 104 HB VAL 104 14.885 -10.016 -1.348 801 HG11 VAL 104 HG11 VAL 104 14.822 -10.845 -3.638 802 HG12 VAL 104 HG12 VAL 104 15.565 -9.246 -3.562 803 HG13 VAL 104 HG13 VAL 104 13.905 -9.426 -4.135 804 HG21 VAL 104 HG21 VAL 104 13.612 -8.042 -0.692 805 HG22 VAL 104 HG22 VAL 104 13.140 -7.770 -2.371 806 HG23 VAL 104 HG23 VAL 104 14.830 -7.614 -1.891 807 H VAL 105 HN VAL 105 10.994 -8.801 -1.354 808 HA VAL 105 HA VAL 105 9.578 -9.363 -3.859 809 HB VAL 105 HB VAL 105 8.465 -7.587 -1.742 810 HG11 VAL 105 HG11 VAL 105 6.355 -8.581 -2.467 811 HG12 VAL 105 HG12 VAL 105 7.238 -9.615 -3.589 812 HG13 VAL 105 HG13 VAL 105 7.251 -7.865 -3.807 813 HG21 VAL 105 HG21 VAL 105 7.486 -9.552 -0.588 814 HG22 VAL 105 HG22 VAL 105 9.230 -9.387 -0.388 815 HG23 VAL 105 HG23 VAL 105 8.577 -10.585 -1.513 816 H ARG 106 HN ARG 106 9.816 -7.912 -5.468 817 HA ARG 106 HA ARG 106 10.876 -5.320 -4.910 818 HB2 ARG 106 HB2 ARG 106 11.093 -6.907 -7.049 819 HB3 ARG 106 HB1 ARG 106 9.675 -5.977 -7.516 820 HG2 ARG 106 HG2 ARG 106 10.874 -3.927 -7.142 821 HG3 ARG 106 HG1 ARG 106 12.308 -4.867 -6.718 822 HD2 ARG 106 HD2 ARG 106 11.342 -5.836 -9.194 823 HD3 ARG 106 HD1 ARG 106 11.423 -4.076 -9.303 824 HE ARG 106 HE ARG 106 13.786 -5.189 -8.145 825 HH11 ARG 106 HH11 ARG 106 12.160 -4.657 -11.210 826 HH12 ARG 106 HH12 ARG 106 13.636 -4.563 -12.125 827 HH21 ARG 106 HH21 ARG 106 15.721 -5.078 -9.343 828 HH22 ARG 106 HH22 ARG 106 15.664 -4.789 -11.058 829 H LEU 107 HN LEU 107 9.760 -3.426 -5.128 830 HA LEU 107 HA LEU 107 6.856 -3.614 -5.451 831 HB2 LEU 107 HB2 LEU 107 8.426 -2.502 -3.193 832 HB3 LEU 107 HB1 LEU 107 6.950 -1.687 -3.655 833 HG LEU 107 HG LEU 107 5.676 -3.739 -3.205 834 HD11 LEU 107 HD11 LEU 107 8.307 -4.835 -2.204 835 HD12 LEU 107 HD12 LEU 107 7.437 -5.409 -3.625 836 HD13 LEU 107 HD13 LEU 107 6.726 -5.595 -2.022 837 HD21 LEU 107 HD21 LEU 107 6.137 -1.972 -1.567 838 HD22 LEU 107 HD22 LEU 107 7.493 -2.946 -0.968 839 HD23 LEU 107 HD23 LEU 107 5.837 -3.556 -0.847 840 H LEU 108 HN LEU 108 5.823 -1.755 -6.065 841 HA LEU 108 HA LEU 108 7.489 0.553 -6.778 842 HB2 LEU 108 HB2 LEU 108 5.484 -0.922 -8.410 843 HB3 LEU 108 HB1 LEU 108 5.506 0.830 -8.533 844 HG LEU 108 HG LEU 108 8.027 -0.756 -8.888 845 HD11 LEU 108 HD11 LEU 108 7.632 -0.710 -11.302 846 HD12 LEU 108 HD12 LEU 108 6.015 -0.060 -11.025 847 HD13 LEU 108 HD13 LEU 108 6.421 -1.684 -10.468 848 HD21 LEU 108 HD21 LEU 108 8.197 1.629 -8.514 849 HD22 LEU 108 HD22 LEU 108 7.054 1.925 -9.832 850 HD23 LEU 108 HD23 LEU 108 8.637 1.230 -10.178 851 H VAL 109 HN VAL 109 6.844 2.248 -5.573 852 HA VAL 109 HA VAL 109 4.178 2.154 -4.394 853 HB VAL 109 HB VAL 109 5.935 1.336 -2.871 854 HG11 VAL 109 HG11 VAL 109 7.044 4.121 -3.068 855 HG12 VAL 109 HG12 VAL 109 7.819 2.644 -3.641 856 HG13 VAL 109 HG13 VAL 109 7.565 2.893 -1.914 857 HG21 VAL 109 HG21 VAL 109 5.345 2.732 -0.957 858 HG22 VAL 109 HG22 VAL 109 3.959 2.267 -1.942 859 HG23 VAL 109 HG23 VAL 109 4.628 3.893 -2.073 860 H THR 110 HN THR 110 3.616 4.246 -3.427 861 HA THR 110 HA THR 110 4.692 6.454 -5.051 862 HB THR 110 HB THR 110 2.337 7.389 -5.149 863 HG1 THR 110 HG1 THR 110 1.820 4.746 -4.280 864 HG21 THR 110 HG21 THR 110 3.494 6.477 -7.084 865 HG22 THR 110 HG22 THR 110 1.777 6.051 -7.124 866 HG23 THR 110 HG23 THR 110 2.972 4.851 -6.632 867 H ARG 111 HN ARG 111 5.526 7.887 -3.838 868 HA ARG 111 HA ARG 111 4.621 8.241 -1.093 869 HB2 ARG 111 HB2 ARG 111 7.109 9.023 -2.590 870 HB3 ARG 111 HB1 ARG 111 6.717 9.740 -1.036 871 HG2 ARG 111 HG2 ARG 111 6.887 6.780 -1.394 872 HG3 ARG 111 HG1 ARG 111 8.305 7.773 -1.074 873 HD2 ARG 111 HD2 ARG 111 6.771 8.687 0.855 874 HD3 ARG 111 HD1 ARG 111 6.008 7.114 0.666 875 HE ARG 111 HE ARG 111 7.923 6.081 1.423 876 HH11 ARG 111 HH11 ARG 111 8.466 9.511 1.035 877 HH12 ARG 111 HH12 ARG 111 9.960 9.527 1.915 878 HH21 ARG 111 HH21 ARG 111 9.899 6.068 2.568 879 HH22 ARG 111 HH22 ARG 111 10.769 7.559 2.823 880 H GLN 112 HN GLN 112 4.147 10.309 -0.307 881 HA GLN 112 HA GLN 112 3.533 12.344 -2.268 882 HB2 GLN 112 HB2 GLN 112 2.971 12.505 0.645 883 HB3 GLN 112 HB1 GLN 112 2.098 13.192 -0.682 884 HG2 GLN 112 HG2 GLN 112 2.140 10.290 0.013 885 HG3 GLN 112 HG1 GLN 112 0.864 11.408 0.436 886 HE21 GLN 112 HE21 GLN 112 2.594 11.156 -2.642 887 HE22 GLN 112 HE22 GLN 112 1.232 10.634 -3.572 888 H SER 113 HN SER 113 5.331 11.475 0.347 889 HA SER 113 HA SER 113 7.369 12.062 1.163 890 HB2 SER 113 HB2 SER 113 7.075 14.406 -0.658 891 HB3 SER 113 HB1 SER 113 8.514 14.073 0.302 892 HG SER 113 HG SER 113 8.328 13.301 -2.035 893 H LEU 114 HN LEU 114 4.587 13.342 1.609 894 HA LEU 114 HA LEU 114 5.442 15.189 3.735 895 HB2 LEU 114 HB2 LEU 114 3.189 15.359 1.792 896 HB3 LEU 114 HB1 LEU 114 3.121 16.207 3.325 897 HG LEU 114 HG LEU 114 3.916 17.836 1.874 898 HD11 LEU 114 HD11 LEU 114 5.341 17.843 3.749 899 HD12 LEU 114 HD12 LEU 114 6.403 18.000 2.347 900 HD13 LEU 114 HD13 LEU 114 6.240 16.438 3.167 901 HD21 LEU 114 HD21 LEU 114 5.662 17.430 0.178 902 HD22 LEU 114 HD22 LEU 114 4.216 16.456 -0.088 903 HD23 LEU 114 HD23 LEU 114 5.656 15.717 0.613 904 H GLN 115 HN GLN 115 5.278 12.637 4.042 905 HA GLN 115 HA GLN 115 3.016 11.260 4.590 906 HB2 GLN 115 HB2 GLN 115 4.470 10.139 6.444 907 HB3 GLN 115 HB1 GLN 115 4.856 9.934 4.751 908 HG2 GLN 115 HG2 GLN 115 6.884 10.298 5.917 909 HG3 GLN 115 HG1 GLN 115 6.540 11.760 4.999 910 HE21 GLN 115 HE21 GLN 115 6.545 10.315 8.189 911 HE22 GLN 115 HE22 GLN 115 6.601 11.806 9.067 912 H LYS 116 HN LYS 116 1.569 10.988 6.190 913 HA LYS 116 HA LYS 116 1.749 12.591 8.596 914 HB2 LYS 116 HB2 LYS 116 0.750 13.937 6.609 915 HB3 LYS 116 HB1 LYS 116 -0.661 12.911 6.823 916 HG2 LYS 116 HG2 LYS 116 -1.008 14.959 7.986 917 HG3 LYS 116 HG1 LYS 116 -0.801 13.667 9.168 918 HD2 LYS 116 HD2 LYS 116 0.460 15.516 9.968 919 HD3 LYS 116 HD1 LYS 116 1.622 14.355 9.332 920 HE2 LYS 116 HE2 LYS 116 0.594 16.686 7.727 921 HE3 LYS 116 HE1 LYS 116 2.014 16.797 8.759 922 HZ1 LYS 116 HZ1 LYS 116 2.750 16.352 6.571 923 HZ2 LYS 116 HZ2 LYS 116 1.660 15.078 6.367 924 HZ3 LYS 116 HZ3 LYS 116 2.959 14.914 7.438 925 H ALA 117 HN ALA 117 0.121 11.980 10.158 926 HA ALA 117 HA ALA 117 -1.393 9.563 9.522 927 HB1 ALA 117 HB1 ALA 117 0.471 9.794 11.882 928 HB2 ALA 117 HB2 ALA 117 0.719 8.764 10.473 929 HB3 ALA 117 HB3 ALA 117 -0.630 8.455 11.568 930 H VAL 118 HN VAL 118 -1.973 12.294 9.875 931 HA VAL 118 HA VAL 118 -3.562 12.274 12.341 932 HB VAL 118 HB VAL 118 -2.366 14.764 11.122 933 HG11 VAL 118 HG11 VAL 118 -2.983 15.810 13.180 934 HG12 VAL 118 HG12 VAL 118 -3.465 14.265 13.873 935 HG13 VAL 118 HG13 VAL 118 -4.392 14.959 12.544 936 HG21 VAL 118 HG21 VAL 118 -1.288 13.086 13.384 937 HG22 VAL 118 HG22 VAL 118 -0.727 14.706 12.977 938 HG23 VAL 118 HG23 VAL 118 -0.513 13.386 11.828 939 H GLN 119 HN GLN 119 -5.307 11.509 11.125 940 HA GLN 119 HA GLN 119 -6.592 13.531 9.432 941 HB2 GLN 119 HB2 GLN 119 -6.283 10.589 8.819 942 HB3 GLN 119 HB1 GLN 119 -7.460 11.616 8.012 943 HG2 GLN 119 HG2 GLN 119 -5.716 12.985 7.095 944 HG3 GLN 119 HG1 GLN 119 -4.492 12.113 8.012 945 HE21 GLN 119 HE21 GLN 119 -7.188 10.519 6.526 946 HE22 GLN 119 HE22 GLN 119 -6.280 9.727 5.280 947 H GLN 120 HN GLN 120 -8.248 14.144 10.667 948 HA GLN 120 HA GLN 120 -9.911 12.043 11.883 949 HB2 GLN 120 HB2 GLN 120 -10.808 13.827 13.342 950 HB3 GLN 120 HB1 GLN 120 -9.078 13.601 13.542 951 HG2 GLN 120 HG2 GLN 120 -8.596 15.576 12.310 952 HG3 GLN 120 HG1 GLN 120 -10.275 15.738 11.799 953 HE21 GLN 120 HE21 GLN 120 -11.298 15.025 14.437 954 HE22 GLN 120 HE22 GLN 120 -11.058 16.420 15.433 955 H SER 121 HN SER 121 -9.764 14.390 9.446 956 HA SER 121 HA SER 121 -12.432 13.784 8.569 957 HB2 SER 121 HB2 SER 121 -13.037 16.265 8.421 958 HB3 SER 121 HB1 SER 121 -13.091 15.541 10.028 959 HG SER 121 HG SER 121 -11.915 17.254 10.444 960 H MET 122 HN MET 122 -12.800 14.405 6.399 961 HA MET 122 HA MET 122 -10.740 15.807 4.947 962 HB2 MET 122 HB2 MET 122 -10.241 14.002 3.387 963 HB3 MET 122 HB1 MET 122 -9.824 13.516 5.020 964 HG2 MET 122 HG2 MET 122 -12.364 12.722 3.617 965 HG3 MET 122 HG1 MET 122 -10.900 11.748 3.641 966 HE1 MET 122 HE1 MET 122 -13.207 9.714 6.020 967 HE2 MET 122 HE2 MET 122 -12.193 9.686 4.578 968 HE3 MET 122 HE3 MET 122 -13.707 10.588 4.572 969 H LEU 123 HN LEU 123 -11.358 16.018 2.611 970 HA LEU 123 HA LEU 123 -14.009 16.907 2.397 971 HB2 LEU 123 HB2 LEU 123 -11.956 16.316 0.273 972 HB3 LEU 123 HB1 LEU 123 -13.525 17.011 -0.083 973 HG LEU 123 HG LEU 123 -12.025 18.821 -0.049 974 HD11 LEU 123 HD11 LEU 123 -13.408 18.697 2.623 975 HD12 LEU 123 HD12 LEU 123 -14.063 19.334 1.113 976 HD13 LEU 123 HD13 LEU 123 -12.721 20.154 1.911 977 HD21 LEU 123 HD21 LEU 123 -10.478 19.279 1.811 978 HD22 LEU 123 HD22 LEU 123 -10.122 17.762 0.986 979 HD23 LEU 123 HD23 LEU 123 -10.941 17.742 2.547 980 H SER 124 HN SER 124 -15.796 15.754 2.261 981 HA SER 124 HA SER 124 -15.728 12.982 1.492 982 HB2 SER 124 HB2 SER 124 -17.227 13.774 3.279 983 HB3 SER 124 HB1 SER 124 -18.094 14.770 2.110 984 HG SER 124 HG SER 124 -17.970 12.281 1.166 985 H1 LYS 161 HN LYS 161 -15.986 -0.195 5.463 986 HA LYS 161 HA LYS 161 -16.449 -0.362 2.564 987 HB2 LYS 161 HB2 LYS 161 -14.850 1.638 4.103 988 HB3 LYS 161 HB1 LYS 161 -14.329 1.188 2.488 989 HG2 LYS 161 HG2 LYS 161 -16.362 1.988 1.512 990 HG3 LYS 161 HG1 LYS 161 -17.085 2.228 3.120 991 HD2 LYS 161 HD2 LYS 161 -14.675 3.690 2.025 992 HD3 LYS 161 HD1 LYS 161 -16.299 4.357 2.194 993 HE2 LYS 161 HE2 LYS 161 -16.187 4.325 4.540 994 HE3 LYS 161 HE1 LYS 161 -14.794 3.247 4.549 995 HZ1 LYS 161 HZ1 LYS 161 -14.217 5.552 5.092 996 HZ2 LYS 161 HZ2 LYS 161 -14.760 6.053 3.563 997 HZ3 LYS 161 HZ3 LYS 161 -13.429 5.016 3.689 998 H GLU 162 HN GLU 162 -13.261 0.223 3.623 999 HA GLU 162 HA GLU 162 -12.427 -2.235 2.452 1000 HB2 GLU 162 HB2 GLU 162 -10.135 -1.336 3.427 1001 HB3 GLU 162 HB1 GLU 162 -10.870 -0.651 1.986 1002 HG2 GLU 162 HG2 GLU 162 -10.063 1.108 3.418 1003 HG3 GLU 162 HG1 GLU 162 -11.817 1.157 3.337 1004 H ASN 163 HN ASN 163 -11.468 -3.974 3.367 1005 HA ASN 163 HA ASN 163 -11.110 -4.032 6.242 1006 HB2 ASN 163 HB2 ASN 163 -13.523 -4.682 5.688 1007 HB3 ASN 163 HB1 ASN 163 -12.844 -6.160 5.015 1008 HD21 ASN 163 HD21 ASN 163 -13.337 -4.292 7.916 1009 HD22 ASN 163 HD22 ASN 163 -13.051 -5.594 9.036 1010 H LEU 164 HN LEU 164 -9.832 -4.765 3.356 1011 HA LEU 164 HA LEU 164 -8.633 -7.251 4.283 1012 HB2 LEU 164 HB2 LEU 164 -9.142 -6.141 1.676 1013 HB3 LEU 164 HB1 LEU 164 -7.452 -6.588 1.843 1014 HG LEU 164 HG LEU 164 -9.828 -8.377 2.275 1015 HD11 LEU 164 HD11 LEU 164 -7.678 -8.343 0.153 1016 HD12 LEU 164 HD12 LEU 164 -9.395 -8.003 -0.074 1017 HD13 LEU 164 HD13 LEU 164 -8.866 -9.630 0.358 1018 HD21 LEU 164 HD21 LEU 164 -8.205 -10.168 2.637 1019 HD22 LEU 164 HD22 LEU 164 -8.035 -8.899 3.848 1020 HD23 LEU 164 HD23 LEU 164 -6.886 -9.003 2.514 1021 H GLU 165 HN GLU 165 -6.612 -7.480 4.907 1022 HA GLU 165 HA GLU 165 -4.684 -5.393 4.258 1023 HB2 GLU 165 HB2 GLU 165 -3.861 -5.125 6.428 1024 HB3 GLU 165 HB1 GLU 165 -5.599 -5.153 6.678 1025 HG2 GLU 165 HG2 GLU 165 -5.466 -7.491 7.366 1026 HG3 GLU 165 HG1 GLU 165 -3.727 -7.470 7.071 1027 H SER 166 HN SER 166 -2.409 -6.282 4.780 1028 HA SER 166 HA SER 166 -2.283 -9.175 4.916 1029 HB2 SER 166 HB2 SER 166 -1.050 -7.673 2.588 1030 HB3 SER 166 HB1 SER 166 -0.847 -9.393 2.923 1031 HG SER 166 HG SER 166 -3.421 -9.008 2.931 1032 H MET 167 HN MET 167 -0.814 -9.643 6.344 1033 HA MET 167 HA MET 167 1.305 -7.719 6.945 1034 HB2 MET 167 HB2 MET 167 0.141 -10.036 8.476 1035 HB3 MET 167 HB1 MET 167 1.579 -9.177 9.000 1036 HG2 MET 167 HG2 MET 167 0.353 -7.173 9.331 1037 HG3 MET 167 HG1 MET 167 -1.073 -7.840 8.538 1038 HE1 MET 167 HE1 MET 167 0.485 -9.662 12.484 1039 HE2 MET 167 HE2 MET 167 1.368 -8.394 11.633 1040 HE3 MET 167 HE3 MET 167 1.162 -9.977 10.885 1041 H VAL 168 HN VAL 168 3.042 -8.100 5.719 1042 HA VAL 168 HA VAL 168 4.029 -10.871 5.576 1043 HB VAL 168 HB VAL 168 5.182 -10.181 3.428 1044 HG11 VAL 168 HG11 VAL 168 2.164 -10.227 3.493 1045 HG12 VAL 168 HG12 VAL 168 3.237 -11.623 3.404 1046 HG13 VAL 168 HG13 VAL 168 3.148 -10.492 2.053 1047 HG21 VAL 168 HG21 VAL 168 5.021 -7.772 3.657 1048 HG22 VAL 168 HG22 VAL 168 3.259 -7.865 3.622 1049 HG23 VAL 168 HG23 VAL 168 4.194 -8.300 2.191 Start of MODEL 3 1 H1 MET 1 HT1 MET 1 6.787 19.347 -14.168 2 H2 MET 1 HT2 MET 1 5.606 20.554 -14.320 3 H3 MET 1 HT3 MET 1 5.138 18.937 -14.106 4 HA MET 1 HA MET 1 4.880 20.183 -12.061 5 HB2 MET 1 HB2 MET 1 5.601 17.734 -12.146 6 HB3 MET 1 HB1 MET 1 7.235 18.300 -11.839 7 HG2 MET 1 HG2 MET 1 6.599 19.170 -9.705 8 HG3 MET 1 HG1 MET 1 4.899 18.832 -10.024 9 HE1 MET 1 HE1 MET 1 4.902 14.893 -10.107 10 HE2 MET 1 HE2 MET 1 5.187 15.958 -11.484 11 HE3 MET 1 HE3 MET 1 3.931 16.350 -10.310 12 H SER 2 HN SER 2 5.885 21.436 -10.360 13 HA SER 2 HA SER 2 8.461 22.622 -11.139 14 HB2 SER 2 HB2 SER 2 6.000 24.171 -10.306 15 HB3 SER 2 HB1 SER 2 7.590 24.861 -10.634 16 HG SER 2 HG SER 2 7.230 23.626 -12.761 17 H TYR 3 HN TYR 3 9.785 23.252 -9.495 18 HA TYR 3 HA TYR 3 9.217 22.172 -6.895 19 HB2 TYR 3 HB2 TYR 3 11.481 22.072 -7.906 20 HB3 TYR 3 HB1 TYR 3 11.590 23.824 -7.783 21 HD1 TYR 3 HD1 TYR 3 11.327 20.710 -5.812 22 HD2 TYR 3 HD2 TYR 3 12.209 24.870 -5.728 23 HE1 TYR 3 HE1 TYR 3 12.188 20.475 -3.523 24 HE2 TYR 3 HE2 TYR 3 13.081 24.643 -3.439 25 HH TYR 3 HH TYR 3 13.841 21.724 -2.034 26 H ILE 4 HN ILE 4 7.729 23.249 -5.808 27 HA ILE 4 HA ILE 4 8.291 26.034 -5.116 28 HB ILE 4 HB ILE 4 5.514 25.031 -5.812 29 HG12 ILE 4 HG12 ILE 4 7.304 27.004 -7.257 30 HG13 ILE 4 HG11 ILE 4 6.919 25.376 -7.806 31 HG21 ILE 4 HG21 ILE 4 5.462 26.651 -4.013 32 HG22 ILE 4 HG22 ILE 4 4.863 27.399 -5.495 33 HG23 ILE 4 HG23 ILE 4 6.498 27.746 -4.931 34 HD11 ILE 4 HD11 ILE 4 4.564 26.022 -8.004 35 HD12 ILE 4 HD12 ILE 4 5.614 27.019 -9.009 36 HD13 ILE 4 HD13 ILE 4 4.977 27.657 -7.492 37 HA PRO 5 HA PRO 5 7.810 23.702 -1.251 38 HB2 PRO 5 HB2 PRO 5 9.155 26.100 -0.180 39 HB3 PRO 5 HB1 PRO 5 9.629 24.403 -0.060 40 HG2 PRO 5 HG2 PRO 5 10.983 26.107 -1.615 41 HG3 PRO 5 HG1 PRO 5 10.710 24.425 -2.114 42 HD2 PRO 5 HD2 PRO 5 9.245 26.903 -2.951 43 HD3 PRO 5 HD1 PRO 5 9.843 25.563 -3.954 44 H GLY 6 HN GLY 6 5.856 23.789 -0.406 45 HA2 GLY 6 HA2 GLY 6 4.571 25.189 1.275 46 HA3 GLY 6 HA1 GLY 6 4.623 26.442 0.028 47 H GLN 7 HN GLN 7 4.388 24.060 -1.939 48 HA GLN 7 HA GLN 7 1.482 23.795 -1.722 49 HB2 GLN 7 HB2 GLN 7 3.369 23.712 -4.060 50 HB3 GLN 7 HB1 GLN 7 1.754 23.032 -4.170 51 HG2 GLN 7 HG2 GLN 7 0.867 25.255 -3.435 52 HG3 GLN 7 HG1 GLN 7 2.503 25.886 -3.612 53 HE21 GLN 7 HE21 GLN 7 3.357 26.145 -5.664 54 HE22 GLN 7 HE22 GLN 7 2.374 26.090 -7.089 55 HA PRO 8 HA PRO 8 1.714 19.586 -0.626 56 HB2 PRO 8 HB2 PRO 8 -0.547 19.077 -2.461 57 HB3 PRO 8 HB1 PRO 8 -0.444 18.859 -0.710 58 HG2 PRO 8 HG2 PRO 8 -1.864 20.861 -1.769 59 HG3 PRO 8 HG1 PRO 8 -0.941 21.076 -0.266 60 HD2 PRO 8 HD2 PRO 8 -0.266 21.949 -3.052 61 HD3 PRO 8 HD1 PRO 8 -0.047 22.811 -1.513 62 H VAL 9 HN VAL 9 2.236 17.505 -1.348 63 HA VAL 9 HA VAL 9 3.529 17.414 -3.940 64 HB VAL 9 HB VAL 9 4.535 16.465 -1.810 65 HG11 VAL 9 HG11 VAL 9 2.593 15.362 -0.896 66 HG12 VAL 9 HG12 VAL 9 3.872 14.182 -1.175 67 HG13 VAL 9 HG13 VAL 9 2.510 14.281 -2.290 68 HG21 VAL 9 HG21 VAL 9 5.487 15.936 -3.973 69 HG22 VAL 9 HG22 VAL 9 4.319 14.633 -4.196 70 HG23 VAL 9 HG23 VAL 9 5.538 14.516 -2.928 71 H THR 10 HN THR 10 3.277 15.505 -5.262 72 HA THR 10 HA THR 10 0.447 15.024 -5.687 73 HB THR 10 HB THR 10 1.094 14.456 -7.987 74 HG1 THR 10 HG1 THR 10 3.347 14.862 -8.551 75 HG21 THR 10 HG21 THR 10 0.580 16.753 -7.568 76 HG22 THR 10 HG22 THR 10 2.022 16.725 -8.588 77 HG23 THR 10 HG23 THR 10 2.172 17.036 -6.850 78 H ALA 11 HN ALA 11 3.428 13.320 -6.113 79 HA ALA 11 HA ALA 11 2.796 11.158 -4.388 80 HB1 ALA 11 HB1 ALA 11 1.296 10.515 -6.205 81 HB2 ALA 11 HB2 ALA 11 2.635 9.376 -6.065 82 HB3 ALA 11 HB3 ALA 11 2.638 10.585 -7.349 83 H VAL 12 HN VAL 12 4.710 10.708 -3.587 84 HA VAL 12 HA VAL 12 7.166 11.013 -5.000 85 HB VAL 12 HB VAL 12 6.506 9.400 -2.554 86 HG11 VAL 12 HG11 VAL 12 9.272 10.287 -3.231 87 HG12 VAL 12 HG12 VAL 12 8.610 8.830 -3.969 88 HG13 VAL 12 HG13 VAL 12 8.743 8.941 -2.208 89 HG21 VAL 12 HG21 VAL 12 7.669 12.163 -2.841 90 HG22 VAL 12 HG22 VAL 12 7.645 11.250 -1.333 91 HG23 VAL 12 HG23 VAL 12 6.128 11.714 -2.099 92 H VAL 13 HN VAL 13 7.562 9.812 -6.691 93 HA VAL 13 HA VAL 13 6.472 7.134 -6.913 94 HB VAL 13 HB VAL 13 8.164 8.609 -8.915 95 HG11 VAL 13 HG11 VAL 13 8.075 6.203 -9.258 96 HG12 VAL 13 HG12 VAL 13 7.185 7.047 -10.526 97 HG13 VAL 13 HG13 VAL 13 6.315 6.253 -9.212 98 HG21 VAL 13 HG21 VAL 13 6.224 9.948 -8.537 99 HG22 VAL 13 HG22 VAL 13 5.177 8.530 -8.560 100 HG23 VAL 13 HG23 VAL 13 5.966 9.072 -10.045 101 H GLN 14 HN GLN 14 7.561 5.658 -5.888 102 HA GLN 14 HA GLN 14 10.472 5.681 -5.956 103 HB2 GLN 14 HB2 GLN 14 10.099 6.690 -3.911 104 HB3 GLN 14 HB1 GLN 14 8.620 5.792 -3.619 105 HG2 GLN 14 HG2 GLN 14 9.831 3.852 -3.030 106 HG3 GLN 14 HG1 GLN 14 11.362 4.577 -3.536 107 HE21 GLN 14 HE21 GLN 14 8.787 4.689 -1.167 108 HE22 GLN 14 HE22 GLN 14 9.685 5.545 0.049 109 H ARG 15 HN ARG 15 11.382 3.731 -6.114 110 HA ARG 15 HA ARG 15 9.674 1.387 -6.276 111 HB2 ARG 15 HB2 ARG 15 12.355 1.583 -7.576 112 HB3 ARG 15 HB1 ARG 15 10.917 0.741 -8.088 113 HG2 ARG 15 HG2 ARG 15 11.199 3.720 -8.188 114 HG3 ARG 15 HG1 ARG 15 11.569 2.648 -9.543 115 HD2 ARG 15 HD2 ARG 15 9.169 1.790 -9.257 116 HD3 ARG 15 HD1 ARG 15 8.919 3.217 -8.254 117 HE ARG 15 HE ARG 15 10.104 3.963 -10.717 118 HH11 ARG 15 HH11 ARG 15 7.029 2.939 -9.363 119 HH12 ARG 15 HH12 ARG 15 6.091 3.696 -10.607 120 HH21 ARG 15 HH21 ARG 15 8.865 4.962 -12.337 121 HH22 ARG 15 HH22 ARG 15 7.127 4.842 -12.303 122 H VAL 16 HN VAL 16 10.007 0.219 -4.427 123 HA VAL 16 HA VAL 16 12.760 -0.011 -3.468 124 HB VAL 16 HB VAL 16 11.735 1.546 -1.975 125 HG11 VAL 16 HG11 VAL 16 9.526 -0.455 -1.549 126 HG12 VAL 16 HG12 VAL 16 9.394 1.050 -2.470 127 HG13 VAL 16 HG13 VAL 16 9.701 1.100 -0.733 128 HG21 VAL 16 HG21 VAL 16 11.847 -1.180 -0.698 129 HG22 VAL 16 HG22 VAL 16 11.850 0.350 0.189 130 HG23 VAL 16 HG23 VAL 16 13.187 -0.053 -0.897 131 H GLU 17 HN GLU 17 13.387 -2.002 -3.065 132 HA GLU 17 HA GLU 17 11.507 -4.175 -3.453 133 HB2 GLU 17 HB2 GLU 17 13.657 -5.581 -3.325 134 HB3 GLU 17 HB1 GLU 17 13.413 -4.567 -4.736 135 HG2 GLU 17 HG2 GLU 17 14.948 -3.442 -2.458 136 HG3 GLU 17 HG1 GLU 17 15.718 -4.674 -3.462 137 H ILE 18 HN ILE 18 10.469 -4.678 -1.629 138 HA ILE 18 HA ILE 18 11.690 -4.663 0.943 139 HB ILE 18 HB ILE 18 8.936 -5.635 0.116 140 HG12 ILE 18 HG12 ILE 18 8.949 -3.395 -0.540 141 HG13 ILE 18 HG11 ILE 18 8.261 -3.354 1.082 142 HG21 ILE 18 HG21 ILE 18 9.671 -6.417 2.300 143 HG22 ILE 18 HG22 ILE 18 8.358 -5.247 2.452 144 HG23 ILE 18 HG23 ILE 18 10.020 -4.758 2.783 145 HD11 ILE 18 HD11 ILE 18 10.360 -2.660 1.995 146 HD12 ILE 18 HD12 ILE 18 9.906 -1.581 0.671 147 HD13 ILE 18 HD13 ILE 18 11.128 -2.836 0.419 148 H HIS 19 HN HIS 19 11.672 -6.561 2.208 149 HA HIS 19 HA HIS 19 11.401 -9.081 0.855 150 HB2 HIS 19 HB2 HIS 19 13.584 -8.525 0.211 151 HB3 HIS 19 HB1 HIS 19 14.008 -7.992 1.822 152 HD1 HIS 19 HD1 HIS 19 15.661 -9.595 2.778 153 HD2 HIS 19 HD2 HIS 19 12.635 -11.503 0.665 154 HE1 HIS 19 HE1 HIS 19 16.094 -12.059 3.062 155 HE2 HIS 19 HE2 HIS 19 14.093 -13.182 2.005 156 H LYS 20 HN LYS 20 9.771 -9.404 2.359 157 HA LYS 20 HA LYS 20 10.150 -9.744 5.122 158 HB2 LYS 20 HB2 LYS 20 8.305 -11.507 4.770 159 HB3 LYS 20 HB1 LYS 20 7.932 -9.836 4.378 160 HG2 LYS 20 HG2 LYS 20 8.194 -10.250 2.037 161 HG3 LYS 20 HG1 LYS 20 8.795 -11.880 2.346 162 HD2 LYS 20 HD2 LYS 20 6.030 -10.854 2.965 163 HD3 LYS 20 HD1 LYS 20 6.466 -11.944 1.645 164 HE2 LYS 20 HE2 LYS 20 6.669 -12.481 4.605 165 HE3 LYS 20 HE1 LYS 20 5.554 -13.231 3.464 166 HZ1 LYS 20 HZ1 LYS 20 7.410 -14.682 3.964 167 HZ2 LYS 20 HZ2 LYS 20 8.509 -13.512 3.441 168 HZ3 LYS 20 HZ3 LYS 20 7.444 -14.227 2.335 169 H LEU 21 HN LEU 21 10.411 -12.034 6.178 170 HA LEU 21 HA LEU 21 12.750 -13.009 4.671 171 HB2 LEU 21 HB2 LEU 21 13.074 -11.157 6.478 172 HB3 LEU 21 HB1 LEU 21 12.934 -12.494 7.607 173 HG LEU 21 HG LEU 21 14.935 -12.607 5.371 174 HD11 LEU 21 HD11 LEU 21 15.279 -10.473 6.555 175 HD12 LEU 21 HD12 LEU 21 16.596 -11.615 6.834 176 HD13 LEU 21 HD13 LEU 21 15.374 -11.355 8.080 177 HD21 LEU 21 HD21 LEU 21 14.902 -13.768 8.147 178 HD22 LEU 21 HD22 LEU 21 16.104 -14.073 6.893 179 HD23 LEU 21 HD23 LEU 21 14.444 -14.635 6.680 180 H ARG 22 HN ARG 22 12.678 -15.109 4.425 181 HA ARG 22 HA ARG 22 11.613 -16.824 6.476 182 HB2 ARG 22 HB2 ARG 22 11.253 -18.099 4.687 183 HB3 ARG 22 HB1 ARG 22 12.236 -17.064 3.667 184 HG2 ARG 22 HG2 ARG 22 13.267 -19.110 3.459 185 HG3 ARG 22 HG1 ARG 22 14.203 -18.346 4.748 186 HD2 ARG 22 HD2 ARG 22 13.703 -20.610 5.370 187 HD3 ARG 22 HD1 ARG 22 12.834 -19.476 6.408 188 HE ARG 22 HE ARG 22 10.866 -19.964 4.950 189 HH11 ARG 22 HH11 ARG 22 13.471 -22.297 5.224 190 HH12 ARG 22 HH12 ARG 22 12.430 -23.661 4.952 191 HH21 ARG 22 HH21 ARG 22 9.517 -21.768 4.588 192 HH22 ARG 22 HH22 ARG 22 10.198 -23.366 4.584 193 H GLN 23 HN GLN 23 12.701 -17.528 8.079 194 HA GLN 23 HA GLN 23 15.575 -17.930 7.884 195 HB2 GLN 23 HB2 GLN 23 15.047 -17.338 10.568 196 HB3 GLN 23 HB1 GLN 23 15.940 -16.365 9.413 197 HG2 GLN 23 HG2 GLN 23 13.869 -15.258 8.735 198 HG3 GLN 23 HG1 GLN 23 12.991 -16.216 9.929 199 HE21 GLN 23 HE21 GLN 23 13.410 -13.319 9.606 200 HE22 GLN 23 HE22 GLN 23 14.033 -12.773 11.141 201 H GLY 24 HN GLY 24 14.252 -19.942 7.270 202 HA2 GLY 24 HA2 GLY 24 14.585 -22.191 7.732 203 HA3 GLY 24 HA1 GLY 24 15.096 -21.736 9.356 204 H GLU 25 HN GLU 25 13.717 -21.843 10.991 205 HA GLU 25 HA GLU 25 11.161 -23.106 10.605 206 HB2 GLU 25 HB2 GLU 25 12.812 -23.260 12.599 207 HB3 GLU 25 HB1 GLU 25 12.088 -21.753 13.125 208 HG2 GLU 25 HG2 GLU 25 11.026 -23.570 14.268 209 HG3 GLU 25 HG1 GLU 25 9.880 -22.847 13.142 210 H ASN 26 HN ASN 26 12.304 -20.076 10.144 211 HA ASN 26 HA ASN 26 9.878 -18.796 11.090 212 HB2 ASN 26 HB2 ASN 26 12.601 -17.666 10.633 213 HB3 ASN 26 HB1 ASN 26 11.189 -16.706 10.946 214 HD21 ASN 26 HD21 ASN 26 13.322 -19.040 12.128 215 HD22 ASN 26 HD22 ASN 26 13.045 -18.787 13.833 216 H LEU 27 HN LEU 27 8.720 -18.110 9.805 217 HA LEU 27 HA LEU 27 9.574 -16.991 7.238 218 HB2 LEU 27 HB2 LEU 27 7.130 -18.548 8.028 219 HB3 LEU 27 HB1 LEU 27 6.948 -17.261 6.867 220 HG LEU 27 HG LEU 27 7.189 -19.397 5.745 221 HD11 LEU 27 HD11 LEU 27 9.061 -18.845 4.268 222 HD12 LEU 27 HD12 LEU 27 9.612 -17.638 5.430 223 HD13 LEU 27 HD13 LEU 27 8.055 -17.442 4.622 224 HD21 LEU 27 HD21 LEU 27 9.807 -19.557 7.241 225 HD22 LEU 27 HD22 LEU 27 9.357 -20.608 5.888 226 HD23 LEU 27 HD23 LEU 27 8.419 -20.639 7.383 227 H ILE 28 HN ILE 28 9.628 -14.851 7.527 228 HA ILE 28 HA ILE 28 8.014 -13.798 9.717 229 HB ILE 28 HB ILE 28 10.189 -12.426 8.164 230 HG12 ILE 28 HG12 ILE 28 11.166 -14.388 9.191 231 HG13 ILE 28 HG11 ILE 28 11.659 -12.976 10.099 232 HG21 ILE 28 HG21 ILE 28 10.294 -10.982 10.166 233 HG22 ILE 28 HG22 ILE 28 8.872 -11.819 10.787 234 HG23 ILE 28 HG23 ILE 28 8.766 -10.891 9.292 235 HD11 ILE 28 HD11 ILE 28 11.106 -14.944 11.511 236 HD12 ILE 28 HD12 ILE 28 9.440 -14.842 10.924 237 HD13 ILE 28 HD13 ILE 28 10.121 -13.521 11.870 238 H LEU 29 HN LEU 29 6.313 -13.016 9.385 239 HA LEU 29 HA LEU 29 5.505 -11.653 6.931 240 HB2 LEU 29 HB2 LEU 29 4.414 -13.881 8.042 241 HB3 LEU 29 HB1 LEU 29 3.531 -12.654 8.925 242 HG LEU 29 HG LEU 29 2.680 -11.736 6.825 243 HD11 LEU 29 HD11 LEU 29 4.169 -14.012 5.523 244 HD12 LEU 29 HD12 LEU 29 4.586 -12.302 5.406 245 HD13 LEU 29 HD13 LEU 29 3.071 -12.889 4.717 246 HD21 LEU 29 HD21 LEU 29 1.198 -13.580 6.244 247 HD22 LEU 29 HD22 LEU 29 1.429 -13.503 7.992 248 HD23 LEU 29 HD23 LEU 29 2.280 -14.721 7.041 249 H GLY 30 HN GLY 30 6.495 -9.782 7.744 250 HA2 GLY 30 HA2 GLY 30 6.134 -9.093 10.537 251 HA3 GLY 30 HA1 GLY 30 7.251 -8.345 9.416 252 H PHE 31 HN PHE 31 6.238 -6.808 7.787 253 HA PHE 31 HA PHE 31 4.820 -4.957 9.499 254 HB2 PHE 31 HB2 PHE 31 5.294 -3.268 7.861 255 HB3 PHE 31 HB1 PHE 31 6.748 -4.220 8.127 256 HD1 PHE 31 HD2 PHE 31 7.248 -6.072 6.419 257 HD2 PHE 31 HD1 PHE 31 4.502 -2.901 5.747 258 HE1 PHE 31 HE2 PHE 31 7.442 -6.417 3.999 259 HE2 PHE 31 HE1 PHE 31 4.681 -3.234 3.340 260 HZ PHE 31 HZ PHE 31 6.158 -4.994 2.444 261 H SER 32 HN SER 32 3.150 -3.454 8.050 262 HA SER 32 HA SER 32 1.137 -5.493 7.377 263 HB2 SER 32 HB2 SER 32 0.939 -4.658 9.738 264 HB3 SER 32 HB1 SER 32 0.627 -3.051 9.081 265 HG SER 32 HG SER 32 -1.320 -4.124 9.513 266 H ILE 33 HN ILE 33 -0.431 -4.900 5.892 267 HA ILE 33 HA ILE 33 0.038 -2.345 4.532 268 HB ILE 33 HB ILE 33 -0.005 -3.351 2.338 269 HG12 ILE 33 HG12 ILE 33 0.404 -6.048 2.549 270 HG13 ILE 33 HG11 ILE 33 -0.800 -5.769 3.803 271 HG21 ILE 33 HG21 ILE 33 2.022 -4.655 4.126 272 HG22 ILE 33 HG22 ILE 33 2.166 -3.111 3.283 273 HG23 ILE 33 HG23 ILE 33 2.110 -4.618 2.364 274 HD11 ILE 33 HD11 ILE 33 -1.050 -4.983 0.914 275 HD12 ILE 33 HD12 ILE 33 -2.260 -4.706 2.168 276 HD13 ILE 33 HD13 ILE 33 -1.841 -6.353 1.691 277 H GLY 34 HN GLY 34 -1.767 -1.575 3.394 278 HA2 GLY 34 HA2 GLY 34 -4.231 -2.708 4.486 279 HA3 GLY 34 HA1 GLY 34 -4.039 -1.064 3.873 280 H GLY 35 HN GLY 35 -5.460 -3.914 3.243 281 HA2 GLY 35 HA2 GLY 35 -5.684 -3.199 0.388 282 HA3 GLY 35 HA1 GLY 35 -5.693 -4.878 0.936 283 H GLY 36 HN GLY 36 -7.721 -2.784 -0.282 284 HA2 GLY 36 HA2 GLY 36 -9.895 -3.549 1.590 285 HA3 GLY 36 HA1 GLY 36 -9.796 -1.932 0.900 286 H ILE 37 HN ILE 37 -8.862 -3.162 -1.654 287 HA ILE 37 HA ILE 37 -11.275 -2.974 -3.022 288 HB ILE 37 HB ILE 37 -10.084 -3.583 -4.996 289 HG12 ILE 37 HG12 ILE 37 -8.979 -5.635 -4.064 290 HG13 ILE 37 HG11 ILE 37 -7.908 -4.635 -5.011 291 HG21 ILE 37 HG21 ILE 37 -8.133 -2.102 -4.819 292 HG22 ILE 37 HG22 ILE 37 -8.296 -2.139 -3.062 293 HG23 ILE 37 HG23 ILE 37 -9.570 -1.425 -4.050 294 HD11 ILE 37 HD11 ILE 37 -6.763 -5.476 -3.077 295 HD12 ILE 37 HD12 ILE 37 -7.999 -4.792 -2.021 296 HD13 ILE 37 HD13 ILE 37 -6.948 -3.725 -2.950 297 H ASP 38 HN ASP 38 -9.575 -5.760 -1.827 298 HA ASP 38 HA ASP 38 -11.444 -7.572 -3.181 299 HB2 ASP 38 HB2 ASP 38 -9.057 -7.871 -3.670 300 HB3 ASP 38 HB1 ASP 38 -8.711 -8.055 -1.958 301 H GLN 39 HN GLN 39 -11.644 -6.011 -0.504 302 HA GLN 39 HA GLN 39 -11.897 -8.297 1.314 303 HB2 GLN 39 HB2 GLN 39 -12.259 -5.467 2.185 304 HB3 GLN 39 HB1 GLN 39 -11.692 -6.853 3.107 305 HG2 GLN 39 HG2 GLN 39 -10.207 -5.468 0.913 306 HG3 GLN 39 HG1 GLN 39 -9.902 -5.281 2.631 307 HE21 GLN 39 HE21 GLN 39 -8.160 -6.174 0.502 308 HE22 GLN 39 HE22 GLN 39 -7.608 -7.742 0.947 309 H ASP 40 HN ASP 40 -13.726 -5.313 1.357 310 HA ASP 40 HA ASP 40 -16.176 -6.667 0.678 311 HB2 ASP 40 HB2 ASP 40 -15.737 -7.224 3.105 312 HB3 ASP 40 HB1 ASP 40 -15.905 -5.508 3.455 313 HA PRO 41 HA PRO 41 -16.671 -2.593 -0.964 314 HB2 PRO 41 HB2 PRO 41 -19.223 -2.872 -1.809 315 HB3 PRO 41 HB1 PRO 41 -17.880 -3.711 -2.605 316 HG2 PRO 41 HG2 PRO 41 -19.718 -4.733 -0.454 317 HG3 PRO 41 HG1 PRO 41 -19.341 -5.476 -2.009 318 HD2 PRO 41 HD2 PRO 41 -18.091 -6.282 0.167 319 HD3 PRO 41 HD1 PRO 41 -17.174 -6.065 -1.341 320 H SER 42 HN SER 42 -18.432 -3.916 1.621 321 HA SER 42 HA SER 42 -20.262 -1.887 2.219 322 HB2 SER 42 HB2 SER 42 -18.773 -3.603 4.223 323 HB3 SER 42 HB1 SER 42 -20.369 -2.860 4.416 324 HG SER 42 HG SER 42 -19.708 -5.232 3.328 325 H GLN 43 HN GLN 43 -16.861 -2.362 3.190 326 HA GLN 43 HA GLN 43 -16.953 0.213 4.562 327 HB2 GLN 43 HB2 GLN 43 -15.055 -0.556 5.715 328 HB3 GLN 43 HB1 GLN 43 -16.121 -1.946 5.570 329 HG2 GLN 43 HG2 GLN 43 -14.787 -2.631 3.576 330 HG3 GLN 43 HG1 GLN 43 -13.628 -1.375 4.010 331 HE21 GLN 43 HE21 GLN 43 -15.103 -4.348 4.928 332 HE22 GLN 43 HE22 GLN 43 -13.965 -4.773 6.167 333 H ASN 44 HN ASN 44 -15.308 -1.518 1.975 334 HA ASN 44 HA ASN 44 -13.973 0.933 1.130 335 HB2 ASN 44 HB2 ASN 44 -13.691 -1.891 0.090 336 HB3 ASN 44 HB1 ASN 44 -12.705 -0.512 -0.324 337 HD21 ASN 44 HD21 ASN 44 -11.351 0.421 1.339 338 HD22 ASN 44 HD22 ASN 44 -10.771 -0.584 2.615 339 HA PRO 45 HA PRO 45 -17.626 1.233 -1.539 340 HB2 PRO 45 HB2 PRO 45 -16.914 3.733 -2.465 341 HB3 PRO 45 HB1 PRO 45 -17.862 3.438 -0.997 342 HG2 PRO 45 HG2 PRO 45 -14.944 4.010 -1.295 343 HG3 PRO 45 HG1 PRO 45 -16.084 4.594 -0.067 344 HD2 PRO 45 HD2 PRO 45 -14.343 2.607 0.450 345 HD3 PRO 45 HD1 PRO 45 -15.974 2.627 1.150 346 H PHE 46 HN PHE 46 -14.283 1.242 -2.234 347 HA PHE 46 HA PHE 46 -14.665 0.207 -4.853 348 HB2 PHE 46 HB2 PHE 46 -14.987 2.674 -5.237 349 HB3 PHE 46 HB1 PHE 46 -13.329 2.922 -4.686 350 HD1 PHE 46 HD1 PHE 46 -15.356 1.169 -7.245 351 HD2 PHE 46 HD2 PHE 46 -11.553 2.756 -6.191 352 HE1 PHE 46 HE1 PHE 46 -14.567 0.779 -9.538 353 HE2 PHE 46 HE2 PHE 46 -10.753 2.371 -8.489 354 HZ PHE 46 HZ PHE 46 -12.265 1.380 -10.163 355 H SER 47 HN SER 47 -12.446 1.603 -2.460 356 HA SER 47 HA SER 47 -10.418 -0.301 -3.178 357 HB2 SER 47 HB2 SER 47 -8.806 1.655 -3.301 358 HB3 SER 47 HB1 SER 47 -9.897 1.478 -4.663 359 HG SER 47 HG SER 47 -10.314 3.504 -4.241 360 H GLU 48 HN GLU 48 -10.773 2.720 -1.475 361 HA GLU 48 HA GLU 48 -10.706 1.677 1.139 362 HB2 GLU 48 HB2 GLU 48 -8.292 1.609 -0.042 363 HB3 GLU 48 HB1 GLU 48 -8.253 3.231 0.647 364 HG2 GLU 48 HG2 GLU 48 -8.787 0.691 2.151 365 HG3 GLU 48 HG1 GLU 48 -7.263 1.577 2.148 366 H ASP 49 HN ASP 49 -9.542 4.384 -0.769 367 HA ASP 49 HA ASP 49 -11.481 6.131 0.523 368 HB2 ASP 49 HB2 ASP 49 -9.178 6.196 1.735 369 HB3 ASP 49 HB1 ASP 49 -8.617 7.045 0.296 370 H LYS 50 HN LYS 50 -10.270 8.503 -0.642 371 HA LYS 50 HA LYS 50 -11.599 8.374 -3.123 372 HB2 LYS 50 HB2 LYS 50 -9.609 10.463 -2.244 373 HB3 LYS 50 HB1 LYS 50 -10.898 10.664 -3.424 374 HG2 LYS 50 HG2 LYS 50 -12.569 10.550 -1.746 375 HG3 LYS 50 HG1 LYS 50 -11.402 10.032 -0.528 376 HD2 LYS 50 HD2 LYS 50 -11.574 12.251 -0.002 377 HD3 LYS 50 HD1 LYS 50 -10.241 12.310 -1.154 378 HE2 LYS 50 HE2 LYS 50 -13.142 12.844 -1.791 379 HE3 LYS 50 HE1 LYS 50 -11.908 14.077 -1.544 380 HZ1 LYS 50 HZ1 LYS 50 -12.028 12.077 -3.734 381 HZ2 LYS 50 HZ2 LYS 50 -10.701 13.104 -3.460 382 HZ3 LYS 50 HZ3 LYS 50 -12.207 13.754 -3.864 383 H THR 51 HN THR 51 -8.180 9.085 -2.541 384 HA THR 51 HA THR 51 -7.631 8.053 -5.247 385 HB THR 51 HB THR 51 -5.557 9.504 -5.063 386 HG1 THR 51 HG1 THR 51 -6.480 11.291 -3.349 387 HG21 THR 51 HG21 THR 51 -8.286 10.787 -4.980 388 HG22 THR 51 HG22 THR 51 -7.437 10.193 -6.406 389 HG23 THR 51 HG23 THR 51 -6.818 11.594 -5.534 390 H ASP 52 HN ASP 52 -7.760 6.613 -2.629 391 HA ASP 52 HA ASP 52 -5.079 6.115 -1.782 392 HB2 ASP 52 HB2 ASP 52 -6.986 5.741 -0.273 393 HB3 ASP 52 HB1 ASP 52 -7.482 4.348 -1.246 394 H LYS 53 HN LYS 53 -7.229 4.362 -3.900 395 HA LYS 53 HA LYS 53 -6.755 2.914 -5.623 396 HB2 LYS 53 HB2 LYS 53 -3.989 2.870 -4.450 397 HB3 LYS 53 HB1 LYS 53 -4.500 1.632 -5.584 398 HG2 LYS 53 HG2 LYS 53 -3.442 3.141 -6.950 399 HG3 LYS 53 HG1 LYS 53 -5.126 3.631 -7.105 400 HD2 LYS 53 HD2 LYS 53 -4.823 5.541 -5.833 401 HD3 LYS 53 HD1 LYS 53 -3.379 4.906 -5.038 402 HE2 LYS 53 HE2 LYS 53 -2.774 6.644 -6.612 403 HE3 LYS 53 HE1 LYS 53 -2.151 5.090 -7.160 404 HZ1 LYS 53 HZ1 LYS 53 -4.213 4.973 -8.590 405 HZ2 LYS 53 HZ2 LYS 53 -3.051 6.120 -9.043 406 HZ3 LYS 53 HZ3 LYS 53 -4.454 6.615 -8.225 407 H GLY 54 HN GLY 54 -5.803 2.158 -2.303 408 HA2 GLY 54 HA2 GLY 54 -7.023 0.577 -1.028 409 HA3 GLY 54 HA1 GLY 54 -7.498 -0.236 -2.517 410 H ILE 55 HN ILE 55 -4.326 0.390 -2.880 411 HA ILE 55 HA ILE 55 -3.389 -1.999 -1.420 412 HB ILE 55 HB ILE 55 -2.362 -1.035 -4.103 413 HG12 ILE 55 HG12 ILE 55 -4.586 -2.083 -4.290 414 HG13 ILE 55 HG11 ILE 55 -3.331 -3.033 -5.077 415 HG21 ILE 55 HG21 ILE 55 -1.152 -3.279 -4.048 416 HG22 ILE 55 HG22 ILE 55 -1.544 -3.323 -2.327 417 HG23 ILE 55 HG23 ILE 55 -0.555 -2.013 -2.972 418 HD11 ILE 55 HD11 ILE 55 -3.264 -4.520 -3.116 419 HD12 ILE 55 HD12 ILE 55 -4.851 -4.482 -3.886 420 HD13 ILE 55 HD13 ILE 55 -4.573 -3.588 -2.390 421 H TYR 56 HN TYR 56 -2.211 -1.149 0.236 422 HA TYR 56 HA TYR 56 0.018 0.575 -0.346 423 HB2 TYR 56 HB2 TYR 56 -0.681 2.470 1.034 424 HB3 TYR 56 HB1 TYR 56 -1.813 2.229 -0.288 425 HD1 TYR 56 HD1 TYR 56 -3.803 0.489 0.442 426 HD2 TYR 56 HD2 TYR 56 -1.635 3.067 3.036 427 HE1 TYR 56 HE1 TYR 56 -5.670 0.442 2.041 428 HE2 TYR 56 HE2 TYR 56 -3.492 3.018 4.644 429 HH TYR 56 HH TYR 56 -6.230 2.522 4.297 430 H VAL 57 HN VAL 57 1.294 1.067 1.654 431 HA VAL 57 HA VAL 57 1.041 -0.990 3.637 432 HB VAL 57 HB VAL 57 3.181 0.184 2.532 433 HG11 VAL 57 HG11 VAL 57 2.631 1.784 4.987 434 HG12 VAL 57 HG12 VAL 57 3.012 2.346 3.360 435 HG13 VAL 57 HG13 VAL 57 4.252 1.567 4.333 436 HG21 VAL 57 HG21 VAL 57 3.130 -0.732 5.369 437 HG22 VAL 57 HG22 VAL 57 4.485 -0.806 4.242 438 HG23 VAL 57 HG23 VAL 57 3.055 -1.803 3.970 439 H THR 58 HN THR 58 0.453 -0.646 5.755 440 HA THR 58 HA THR 58 -0.641 2.037 6.314 441 HB THR 58 HB THR 58 -2.401 0.285 5.971 442 HG1 THR 58 HG1 THR 58 -3.553 1.299 7.436 443 HG21 THR 58 HG21 THR 58 -1.220 -0.938 8.470 444 HG22 THR 58 HG22 THR 58 -1.195 -1.650 6.856 445 HG23 THR 58 HG23 THR 58 -2.728 -1.428 7.698 446 H ARG 59 HN ARG 59 1.657 -0.231 7.040 447 HA ARG 59 HA ARG 59 2.621 1.044 9.346 448 HB2 ARG 59 HB2 ARG 59 1.258 0.168 10.906 449 HB3 ARG 59 HB1 ARG 59 0.582 -0.940 9.749 450 HG2 ARG 59 HG2 ARG 59 2.364 -2.502 10.124 451 HG3 ARG 59 HG1 ARG 59 3.079 -1.405 11.320 452 HD2 ARG 59 HD2 ARG 59 0.339 -2.642 11.472 453 HD3 ARG 59 HD1 ARG 59 1.744 -3.177 12.388 454 HE ARG 59 HE ARG 59 1.677 -0.839 13.364 455 HH11 ARG 59 HH11 ARG 59 -1.224 -2.456 12.203 456 HH12 ARG 59 HH12 ARG 59 -2.270 -1.630 13.326 457 HH21 ARG 59 HH21 ARG 59 0.275 0.226 14.833 458 HH22 ARG 59 HH22 ARG 59 -1.421 -0.133 14.818 459 H VAL 60 HN VAL 60 4.292 -0.330 10.396 460 HA VAL 60 HA VAL 60 5.553 -2.242 8.632 461 HB VAL 60 HB VAL 60 6.802 0.420 9.362 462 HG11 VAL 60 HG11 VAL 60 8.113 -2.019 8.188 463 HG12 VAL 60 HG12 VAL 60 8.401 -1.324 9.780 464 HG13 VAL 60 HG13 VAL 60 8.866 -0.430 8.330 465 HG21 VAL 60 HG21 VAL 60 7.125 0.697 6.978 466 HG22 VAL 60 HG22 VAL 60 5.420 0.413 7.326 467 HG23 VAL 60 HG23 VAL 60 6.414 -0.890 6.673 468 H SER 61 HN SER 61 6.515 -3.783 9.871 469 HA SER 61 HA SER 61 6.917 -3.328 12.687 470 HB2 SER 61 HB2 SER 61 8.005 -5.546 10.973 471 HB3 SER 61 HB1 SER 61 7.927 -5.535 12.728 472 HG SER 61 HG SER 61 5.965 -6.120 10.901 473 H GLU 62 HN GLU 62 8.397 -1.944 13.208 474 HA GLU 62 HA GLU 62 10.254 -0.980 11.399 475 HB2 GLU 62 HB2 GLU 62 9.637 -0.408 14.269 476 HB3 GLU 62 HB1 GLU 62 10.860 0.444 13.375 477 HG2 GLU 62 HG2 GLU 62 9.365 1.509 12.015 478 HG3 GLU 62 HG1 GLU 62 8.139 0.263 12.229 479 H GLY 63 HN GLY 63 12.328 -0.782 11.611 480 HA2 GLY 63 HA2 GLY 63 14.487 -1.608 11.770 481 HA3 GLY 63 HA1 GLY 63 14.007 -2.366 13.290 482 H GLY 64 HN GLY 64 12.267 -2.995 10.304 483 HA2 GLY 64 HA2 GLY 64 13.173 -5.777 10.585 484 HA3 GLY 64 HA1 GLY 64 11.584 -5.283 10.014 485 HA PRO 65 HA PRO 65 13.646 -5.892 6.113 486 HB2 PRO 65 HB2 PRO 65 11.446 -6.691 4.834 487 HB3 PRO 65 HB1 PRO 65 12.337 -7.735 5.937 488 HG2 PRO 65 HG2 PRO 65 9.695 -6.520 6.257 489 HG3 PRO 65 HG1 PRO 65 10.422 -7.857 7.160 490 HD2 PRO 65 HD2 PRO 65 10.216 -5.059 7.908 491 HD3 PRO 65 HD1 PRO 65 10.811 -6.431 8.871 492 H ALA 66 HN ALA 66 10.639 -4.078 6.496 493 HA ALA 66 HA ALA 66 10.506 -3.552 3.631 494 HB1 ALA 66 HB1 ALA 66 8.571 -2.079 4.280 495 HB2 ALA 66 HB2 ALA 66 8.847 -2.561 5.957 496 HB3 ALA 66 HB3 ALA 66 8.401 -3.774 4.756 497 H GLU 67 HN GLU 67 11.437 -1.958 6.556 498 HA GLU 67 HA GLU 67 11.115 0.625 5.339 499 HB2 GLU 67 HB2 GLU 67 11.857 1.340 7.638 500 HB3 GLU 67 HB1 GLU 67 10.343 0.439 7.562 501 HG2 GLU 67 HG2 GLU 67 11.173 -1.288 8.700 502 HG3 GLU 67 HG1 GLU 67 12.693 -1.214 7.816 503 H ILE 68 HN ILE 68 13.437 -1.790 6.005 504 HA ILE 68 HA ILE 68 15.617 0.002 6.091 505 HB ILE 68 HB ILE 68 16.947 -2.021 6.042 506 HG12 ILE 68 HG12 ILE 68 15.274 -4.023 6.810 507 HG13 ILE 68 HG11 ILE 68 14.368 -3.239 5.527 508 HG21 ILE 68 HG21 ILE 68 16.359 -2.713 8.341 509 HG22 ILE 68 HG22 ILE 68 14.845 -1.823 8.150 510 HG23 ILE 68 HG23 ILE 68 16.380 -0.962 8.122 511 HD11 ILE 68 HD11 ILE 68 17.161 -4.342 5.293 512 HD12 ILE 68 HD12 ILE 68 16.248 -3.558 4.005 513 HD13 ILE 68 HD13 ILE 68 15.687 -5.091 4.673 514 H ALA 69 HN ALA 69 13.884 -1.990 3.992 515 HA ALA 69 HA ALA 69 15.619 -1.851 1.758 516 HB1 ALA 69 HB1 ALA 69 12.609 -2.112 1.804 517 HB2 ALA 69 HB2 ALA 69 13.752 -3.453 1.870 518 HB3 ALA 69 HB3 ALA 69 13.656 -2.444 0.424 519 H GLY 70 HN GLY 70 13.410 0.217 3.346 520 HA2 GLY 70 HA2 GLY 70 13.617 2.643 2.908 521 HA3 GLY 70 HA1 GLY 70 13.736 2.250 1.191 522 H LEU 71 HN LEU 71 11.543 1.311 3.811 523 HA LEU 71 HA LEU 71 9.270 2.201 2.222 524 HB2 LEU 71 HB2 LEU 71 9.666 -0.290 2.064 525 HB3 LEU 71 HB1 LEU 71 9.461 -0.363 3.803 526 HG LEU 71 HG LEU 71 7.532 -1.097 2.342 527 HD11 LEU 71 HD11 LEU 71 7.040 0.955 4.476 528 HD12 LEU 71 HD12 LEU 71 7.379 -0.751 4.741 529 HD13 LEU 71 HD13 LEU 71 5.889 -0.268 3.929 530 HD21 LEU 71 HD21 LEU 71 5.996 0.681 1.619 531 HD22 LEU 71 HD22 LEU 71 7.534 0.734 0.758 532 HD23 LEU 71 HD23 LEU 71 7.209 1.885 2.052 533 H GLN 72 HN GLN 72 7.448 2.562 3.694 534 HA GLN 72 HA GLN 72 7.870 2.921 6.391 535 HB2 GLN 72 HB2 GLN 72 7.596 5.579 5.985 536 HB3 GLN 72 HB1 GLN 72 9.063 4.713 6.338 537 HG2 GLN 72 HG2 GLN 72 9.178 6.456 4.577 538 HG3 GLN 72 HG1 GLN 72 9.907 4.900 4.245 539 HE21 GLN 72 HE21 GLN 72 6.487 5.775 3.994 540 HE22 GLN 72 HE22 GLN 72 6.386 5.460 2.300 541 H ILE 73 HN ILE 73 6.153 4.580 7.192 542 HA ILE 73 HA ILE 73 3.833 3.049 6.642 543 HB ILE 73 HB ILE 73 3.700 5.515 8.312 544 HG12 ILE 73 HG12 ILE 73 5.894 4.757 8.942 545 HG13 ILE 73 HG11 ILE 73 4.779 4.264 10.208 546 HG21 ILE 73 HG21 ILE 73 2.461 4.001 9.779 547 HG22 ILE 73 HG22 ILE 73 2.790 2.683 8.657 548 HG23 ILE 73 HG23 ILE 73 1.802 4.047 8.144 549 HD11 ILE 73 HD11 ILE 73 6.360 2.509 9.755 550 HD12 ILE 73 HD12 ILE 73 5.923 2.512 8.038 551 HD13 ILE 73 HD13 ILE 73 4.744 1.997 9.257 552 H GLY 74 HN GLY 74 2.688 3.427 4.871 553 HA2 GLY 74 HA2 GLY 74 0.641 4.633 4.311 554 HA3 GLY 74 HA1 GLY 74 1.493 6.135 4.697 555 H ASP 75 HN ASP 75 1.740 3.292 2.582 556 HA ASP 75 HA ASP 75 2.675 5.039 0.407 557 HB2 ASP 75 HB2 ASP 75 4.442 3.654 2.014 558 HB3 ASP 75 HB1 ASP 75 4.204 2.561 0.656 559 H LYS 76 HN LYS 76 1.653 4.427 -1.493 560 HA LYS 76 HA LYS 76 0.187 1.913 -1.233 561 HB2 LYS 76 HB2 LYS 76 -1.276 2.772 -3.115 562 HB3 LYS 76 HB1 LYS 76 -1.438 3.550 -1.556 563 HG2 LYS 76 HG2 LYS 76 0.320 4.749 -3.641 564 HG3 LYS 76 HG1 LYS 76 -1.428 4.940 -3.731 565 HD2 LYS 76 HD2 LYS 76 0.181 5.640 -1.288 566 HD3 LYS 76 HD1 LYS 76 -0.144 6.788 -2.589 567 HE2 LYS 76 HE2 LYS 76 -1.745 7.105 -0.796 568 HE3 LYS 76 HE1 LYS 76 -2.570 6.482 -2.217 569 HZ1 LYS 76 HZ1 LYS 76 -2.619 4.301 -1.213 570 HZ2 LYS 76 HZ2 LYS 76 -3.315 5.420 -0.147 571 HZ3 LYS 76 HZ3 LYS 76 -1.748 4.850 0.127 572 H ILE 77 HN ILE 77 1.044 0.303 -2.078 573 HA ILE 77 HA ILE 77 3.030 0.297 -4.100 574 HB ILE 77 HB ILE 77 1.385 -2.050 -3.134 575 HG12 ILE 77 HG12 ILE 77 4.029 -1.087 -2.023 576 HG13 ILE 77 HG11 ILE 77 2.477 -0.692 -1.290 577 HG21 ILE 77 HG21 ILE 77 4.143 -1.883 -4.342 578 HG22 ILE 77 HG22 ILE 77 2.690 -2.476 -5.146 579 HG23 ILE 77 HG23 ILE 77 3.359 -3.353 -3.770 580 HD11 ILE 77 HD11 ILE 77 3.623 -3.446 -1.658 581 HD12 ILE 77 HD12 ILE 77 2.044 -3.080 -0.961 582 HD13 ILE 77 HD13 ILE 77 3.516 -2.544 -0.148 583 H MET 78 HN MET 78 2.624 0.683 -6.187 584 HA MET 78 HA MET 78 -0.040 0.183 -7.241 585 HB2 MET 78 HB2 MET 78 2.362 1.384 -8.618 586 HB3 MET 78 HB1 MET 78 0.705 1.415 -9.188 587 HG2 MET 78 HG2 MET 78 1.598 2.702 -6.631 588 HG3 MET 78 HG1 MET 78 1.530 3.541 -8.178 589 HE1 MET 78 HE1 MET 78 -0.285 2.363 -5.077 590 HE2 MET 78 HE2 MET 78 -0.979 1.091 -6.088 591 HE3 MET 78 HE3 MET 78 -2.002 2.389 -5.483 592 H GLN 79 HN GLN 79 3.246 -0.924 -7.674 593 HA GLN 79 HA GLN 79 2.256 -3.284 -9.058 594 HB2 GLN 79 HB2 GLN 79 4.737 -2.622 -10.237 595 HB3 GLN 79 HB1 GLN 79 3.166 -2.749 -10.998 596 HG2 GLN 79 HG2 GLN 79 2.827 -0.344 -10.145 597 HG3 GLN 79 HG1 GLN 79 4.580 -0.401 -9.986 598 HE21 GLN 79 HE21 GLN 79 5.435 -1.736 -12.093 599 HE22 GLN 79 HE22 GLN 79 5.012 -0.905 -13.565 600 H VAL 80 HN VAL 80 3.630 -4.967 -9.161 601 HA VAL 80 HA VAL 80 5.423 -5.006 -6.827 602 HB VAL 80 HB VAL 80 3.431 -6.232 -6.370 603 HG11 VAL 80 HG11 VAL 80 2.614 -8.066 -7.753 604 HG12 VAL 80 HG12 VAL 80 3.901 -7.763 -8.923 605 HG13 VAL 80 HG13 VAL 80 2.649 -6.549 -8.657 606 HG21 VAL 80 HG21 VAL 80 5.430 -7.280 -5.519 607 HG22 VAL 80 HG22 VAL 80 5.746 -8.053 -7.077 608 HG23 VAL 80 HG23 VAL 80 4.359 -8.557 -6.101 609 H ASN 81 HN ASN 81 7.476 -5.495 -7.282 610 HA ASN 81 HA ASN 81 9.339 -6.106 -8.424 611 HB2 ASN 81 HB2 ASN 81 7.364 -8.198 -9.187 612 HB3 ASN 81 HB1 ASN 81 8.857 -8.114 -10.108 613 HD21 ASN 81 HD21 ASN 81 7.392 -9.074 -7.179 614 HD22 ASN 81 HD22 ASN 81 8.821 -9.721 -6.422 615 H GLY 82 HN GLY 82 6.909 -4.482 -9.850 616 HA2 GLY 82 HA2 GLY 82 7.802 -2.869 -11.526 617 HA3 GLY 82 HA1 GLY 82 8.441 -4.276 -12.373 618 H TRP 83 HN TRP 83 5.480 -5.326 -11.359 619 HA TRP 83 HA TRP 83 4.124 -4.167 -13.655 620 HB2 TRP 83 HB2 TRP 83 2.957 -6.558 -13.468 621 HB3 TRP 83 HB1 TRP 83 4.342 -6.239 -14.505 622 HD1 TRP 83 HD1 TRP 83 3.548 -7.447 -10.991 623 HE1 TRP 83 HE1 TRP 83 5.303 -9.191 -10.332 624 HE3 TRP 83 HE3 TRP 83 6.453 -7.362 -15.177 625 HZ2 TRP 83 HZ2 TRP 83 7.545 -10.441 -11.408 626 HZ3 TRP 83 HZ3 TRP 83 8.388 -8.893 -15.293 627 HH2 TRP 83 HH2 TRP 83 8.901 -10.391 -13.431 628 H ASP 84 HN ASP 84 2.567 -3.029 -13.017 629 HA ASP 84 HA ASP 84 1.211 -2.445 -10.913 630 HB2 ASP 84 HB2 ASP 84 0.619 -1.760 -13.249 631 HB3 ASP 84 HB1 ASP 84 -0.326 -3.239 -13.385 632 H MET 85 HN MET 85 0.370 -3.381 -9.247 633 HA MET 85 HA MET 85 -0.940 -6.005 -9.570 634 HB2 MET 85 HB2 MET 85 -0.612 -6.225 -7.094 635 HB3 MET 85 HB1 MET 85 0.860 -6.233 -8.054 636 HG2 MET 85 HG2 MET 85 1.645 -4.393 -7.072 637 HG3 MET 85 HG1 MET 85 0.081 -3.582 -7.114 638 HE1 MET 85 HE1 MET 85 0.910 -6.788 -3.908 639 HE2 MET 85 HE2 MET 85 2.047 -6.510 -5.227 640 HE3 MET 85 HE3 MET 85 0.430 -7.127 -5.570 641 H THR 86 HN THR 86 -1.960 -3.007 -9.678 642 HA THR 86 HA THR 86 -3.923 -3.059 -7.539 643 HB THR 86 HB THR 86 -4.680 -0.882 -8.382 644 HG1 THR 86 HG1 THR 86 -2.848 -1.451 -10.492 645 HG21 THR 86 HG21 THR 86 -2.616 0.382 -7.996 646 HG22 THR 86 HG22 THR 86 -1.678 -1.098 -8.199 647 HG23 THR 86 HG23 THR 86 -2.793 -0.938 -6.840 648 H MET 87 HN MET 87 -3.710 -3.969 -10.843 649 HA MET 87 HA MET 87 -6.545 -3.984 -11.379 650 HB2 MET 87 HB2 MET 87 -4.404 -5.567 -12.806 651 HB3 MET 87 HB1 MET 87 -5.982 -5.103 -13.423 652 HG2 MET 87 HG2 MET 87 -5.330 -2.798 -13.514 653 HG3 MET 87 HG1 MET 87 -3.788 -3.166 -12.741 654 HE1 MET 87 HE1 MET 87 -2.438 -2.342 -16.240 655 HE2 MET 87 HE2 MET 87 -2.219 -2.164 -14.500 656 HE3 MET 87 HE3 MET 87 -3.647 -1.487 -15.284 657 H VAL 88 HN VAL 88 -4.262 -6.055 -9.893 658 HA VAL 88 HA VAL 88 -5.698 -8.516 -10.329 659 HB VAL 88 HB VAL 88 -3.559 -8.477 -8.304 660 HG11 VAL 88 HG11 VAL 88 -4.078 -10.038 -10.817 661 HG12 VAL 88 HG12 VAL 88 -4.402 -10.540 -9.156 662 HG13 VAL 88 HG13 VAL 88 -2.740 -10.339 -9.707 663 HG21 VAL 88 HG21 VAL 88 -3.021 -7.582 -11.126 664 HG22 VAL 88 HG22 VAL 88 -1.786 -8.292 -10.090 665 HG23 VAL 88 HG23 VAL 88 -2.561 -6.778 -9.624 666 H THR 89 HN THR 89 -5.750 -9.943 -8.062 667 HA THR 89 HA THR 89 -7.443 -8.303 -6.300 668 HB THR 89 HB THR 89 -7.585 -11.034 -7.308 669 HG1 THR 89 HG1 THR 89 -9.821 -10.083 -6.121 670 HG21 THR 89 HG21 THR 89 -8.204 -10.603 -4.407 671 HG22 THR 89 HG22 THR 89 -7.026 -11.719 -5.101 672 HG23 THR 89 HG23 THR 89 -8.748 -11.985 -5.361 673 H HIS 90 HN HIS 90 -7.315 -8.930 -3.954 674 HA HIS 90 HA HIS 90 -4.672 -8.441 -3.095 675 HB2 HIS 90 HB2 HIS 90 -6.741 -7.751 -1.870 676 HB3 HIS 90 HB1 HIS 90 -6.998 -9.434 -1.429 677 HD1 HIS 90 HD1 HIS 90 -4.273 -6.795 -0.975 678 HD2 HIS 90 HD2 HIS 90 -5.929 -10.079 0.963 679 HE1 HIS 90 HE1 HIS 90 -3.182 -6.858 1.287 680 HE2 HIS 90 HE2 HIS 90 -4.353 -8.723 2.520 681 H ASP 91 HN ASP 91 -6.615 -11.341 -3.242 682 HA ASP 91 HA ASP 91 -4.810 -13.098 -1.957 683 HB2 ASP 91 HB2 ASP 91 -7.133 -13.740 -2.387 684 HB3 ASP 91 HB1 ASP 91 -6.841 -13.636 -4.128 685 H GLN 92 HN GLN 92 -5.323 -12.195 -5.309 686 HA GLN 92 HA GLN 92 -3.454 -13.796 -6.578 687 HB2 GLN 92 HB2 GLN 92 -3.853 -10.969 -7.438 688 HB3 GLN 92 HB1 GLN 92 -3.632 -12.405 -8.421 689 HG2 GLN 92 HG2 GLN 92 -6.075 -11.739 -6.836 690 HG3 GLN 92 HG1 GLN 92 -5.883 -11.472 -8.559 691 HE21 GLN 92 HE21 GLN 92 -4.408 -13.920 -8.888 692 HE22 GLN 92 HE22 GLN 92 -5.582 -15.175 -8.804 693 H ALA 93 HN ALA 93 -3.185 -10.532 -5.305 694 HA ALA 93 HA ALA 93 -0.469 -10.133 -5.957 695 HB1 ALA 93 HB1 ALA 93 -1.981 -8.274 -5.521 696 HB2 ALA 93 HB2 ALA 93 -0.626 -8.231 -4.394 697 HB3 ALA 93 HB3 ALA 93 -2.197 -8.812 -3.853 698 H ARG 94 HN ARG 94 -2.182 -11.372 -3.140 699 HA ARG 94 HA ARG 94 0.022 -11.333 -1.418 700 HB2 ARG 94 HB2 ARG 94 -2.626 -12.687 -1.386 701 HB3 ARG 94 HB1 ARG 94 -1.391 -13.260 -0.266 702 HG2 ARG 94 HG2 ARG 94 -1.186 -10.729 0.342 703 HG3 ARG 94 HG1 ARG 94 -2.798 -10.636 -0.373 704 HD2 ARG 94 HD2 ARG 94 -3.231 -11.024 1.879 705 HD3 ARG 94 HD1 ARG 94 -3.356 -12.631 1.160 706 HE ARG 94 HE ARG 94 -0.755 -12.476 1.952 707 HH11 ARG 94 HH11 ARG 94 -3.852 -12.190 3.558 708 HH12 ARG 94 HH12 ARG 94 -3.211 -12.529 5.137 709 HH21 ARG 94 HH21 ARG 94 0.097 -12.911 4.041 710 HH22 ARG 94 HH22 ARG 94 -0.974 -12.942 5.414 711 H LYS 95 HN LYS 95 -1.400 -13.985 -3.297 712 HA LYS 95 HA LYS 95 0.547 -15.839 -2.424 713 HB2 LYS 95 HB2 LYS 95 -0.401 -17.388 -4.038 714 HB3 LYS 95 HB1 LYS 95 -1.637 -16.600 -3.077 715 HG2 LYS 95 HG2 LYS 95 -2.592 -16.517 -5.124 716 HG3 LYS 95 HG1 LYS 95 -1.744 -14.975 -5.135 717 HD2 LYS 95 HD2 LYS 95 0.040 -15.896 -6.438 718 HD3 LYS 95 HD1 LYS 95 -0.619 -17.526 -6.282 719 HE2 LYS 95 HE2 LYS 95 -2.616 -16.810 -7.525 720 HE3 LYS 95 HE1 LYS 95 -1.900 -15.213 -7.734 721 HZ1 LYS 95 HZ1 LYS 95 -0.114 -16.176 -8.995 722 HZ2 LYS 95 HZ2 LYS 95 -1.585 -16.667 -9.676 723 HZ3 LYS 95 HZ3 LYS 95 -0.696 -17.747 -8.716 724 H ARG 96 HN ARG 96 0.688 -13.421 -4.880 725 HA ARG 96 HA ARG 96 2.687 -14.940 -6.340 726 HB2 ARG 96 HB2 ARG 96 2.718 -13.157 -7.950 727 HB3 ARG 96 HB1 ARG 96 1.058 -13.589 -7.595 728 HG2 ARG 96 HG2 ARG 96 0.920 -11.322 -7.650 729 HG3 ARG 96 HG1 ARG 96 1.207 -11.585 -5.927 730 HD2 ARG 96 HD2 ARG 96 2.587 -9.778 -6.894 731 HD3 ARG 96 HD1 ARG 96 3.547 -11.082 -6.193 732 HE ARG 96 HE ARG 96 3.032 -10.931 -9.098 733 HH11 ARG 96 HH11 ARG 96 5.223 -11.202 -6.374 734 HH12 ARG 96 HH12 ARG 96 6.620 -11.563 -7.347 735 HH21 ARG 96 HH21 ARG 96 4.869 -11.382 -10.396 736 HH22 ARG 96 HH22 ARG 96 6.411 -11.641 -9.640 737 H LEU 97 HN LEU 97 2.580 -12.097 -4.167 738 HA LEU 97 HA LEU 97 5.388 -11.675 -4.330 739 HB2 LEU 97 HB2 LEU 97 5.098 -10.321 -2.290 740 HB3 LEU 97 HB1 LEU 97 4.048 -9.857 -3.612 741 HG LEU 97 HG LEU 97 2.330 -11.409 -2.341 742 HD11 LEU 97 HD11 LEU 97 2.609 -11.330 0.053 743 HD12 LEU 97 HD12 LEU 97 4.148 -10.485 -0.131 744 HD13 LEU 97 HD13 LEU 97 3.984 -12.148 -0.693 745 HD21 LEU 97 HD21 LEU 97 1.535 -9.418 -1.143 746 HD22 LEU 97 HD22 LEU 97 2.005 -9.055 -2.804 747 HD23 LEU 97 HD23 LEU 97 3.074 -8.618 -1.469 748 H THR 98 HN THR 98 3.404 -13.776 -2.412 749 HA THR 98 HA THR 98 5.862 -14.843 -1.202 750 HB THR 98 HB THR 98 4.233 -16.114 0.329 751 HG1 THR 98 HG1 THR 98 2.498 -14.366 -1.013 752 HG21 THR 98 HG21 THR 98 4.053 -14.217 1.875 753 HG22 THR 98 HG22 THR 98 4.450 -13.114 0.558 754 HG23 THR 98 HG23 THR 98 5.644 -14.287 1.114 755 H LYS 99 HN LYS 99 5.563 -15.453 -3.779 756 HA LYS 99 HA LYS 99 4.075 -17.863 -4.188 757 HB2 LYS 99 HB2 LYS 99 4.911 -17.800 -6.447 758 HB3 LYS 99 HB1 LYS 99 4.489 -16.156 -5.978 759 HG2 LYS 99 HG2 LYS 99 6.921 -15.859 -5.356 760 HG3 LYS 99 HG1 LYS 99 7.220 -17.381 -6.191 761 HD2 LYS 99 HD2 LYS 99 6.176 -16.370 -8.226 762 HD3 LYS 99 HD1 LYS 99 6.127 -14.828 -7.360 763 HE2 LYS 99 HE2 LYS 99 8.641 -15.283 -6.936 764 HE3 LYS 99 HE1 LYS 99 8.494 -16.406 -8.287 765 HZ1 LYS 99 HZ1 LYS 99 8.013 -13.479 -8.308 766 HZ2 LYS 99 HZ2 LYS 99 7.595 -14.494 -9.608 767 HZ3 LYS 99 HZ3 LYS 99 9.221 -14.331 -9.141 768 H ARG 100 HN ARG 100 6.815 -17.267 -2.658 769 HA ARG 100 HA ARG 100 8.396 -18.570 -1.674 770 HB2 ARG 100 HB2 ARG 100 6.667 -20.348 -1.600 771 HB3 ARG 100 HB1 ARG 100 7.200 -20.899 -3.178 772 HG2 ARG 100 HG2 ARG 100 8.080 -22.271 -1.331 773 HG3 ARG 100 HG1 ARG 100 9.355 -21.527 -2.297 774 HD2 ARG 100 HD2 ARG 100 8.368 -20.131 0.147 775 HD3 ARG 100 HD1 ARG 100 9.472 -21.494 0.331 776 HE ARG 100 HE ARG 100 10.543 -19.751 -1.582 777 HH11 ARG 100 HH11 ARG 100 9.888 -19.823 1.855 778 HH12 ARG 100 HH12 ARG 100 11.165 -18.714 2.243 779 HH21 ARG 100 HH21 ARG 100 12.216 -18.288 -1.061 780 HH22 ARG 100 HH22 ARG 100 12.474 -17.812 0.598 781 H SER 101 HN SER 101 7.966 -18.581 -5.083 782 HA SER 101 HA SER 101 10.653 -19.368 -5.702 783 HB2 SER 101 HB2 SER 101 8.767 -19.555 -7.335 784 HB3 SER 101 HB1 SER 101 8.681 -17.796 -7.391 785 HG SER 101 HG SER 101 9.971 -18.963 -9.075 786 H GLU 102 HN GLU 102 9.042 -16.623 -4.555 787 HA GLU 102 HA GLU 102 11.555 -15.365 -4.128 788 HB2 GLU 102 HB2 GLU 102 10.917 -13.199 -4.875 789 HB3 GLU 102 HB1 GLU 102 10.501 -14.290 -6.186 790 HG2 GLU 102 HG2 GLU 102 8.161 -14.233 -5.516 791 HG3 GLU 102 HG1 GLU 102 8.569 -13.185 -4.160 792 H GLU 103 HN GLU 103 11.520 -14.232 -2.199 793 HA GLU 103 HA GLU 103 9.016 -14.344 -0.669 794 HB2 GLU 103 HB2 GLU 103 10.348 -14.649 1.379 795 HB3 GLU 103 HB1 GLU 103 10.553 -15.994 0.266 796 HG2 GLU 103 HG2 GLU 103 12.709 -15.181 -0.396 797 HG3 GLU 103 HG1 GLU 103 12.474 -13.701 0.537 798 H VAL 104 HN VAL 104 10.693 -12.588 -2.353 799 HA VAL 104 HA VAL 104 11.183 -10.293 -0.643 800 HB VAL 104 HB VAL 104 12.610 -11.399 -2.653 801 HG11 VAL 104 HG11 VAL 104 11.008 -10.910 -4.386 802 HG12 VAL 104 HG12 VAL 104 12.485 -9.980 -4.642 803 HG13 VAL 104 HG13 VAL 104 11.055 -9.195 -3.974 804 HG21 VAL 104 HG21 VAL 104 12.547 -8.482 -1.987 805 HG22 VAL 104 HG22 VAL 104 13.872 -9.336 -2.784 806 HG23 VAL 104 HG23 VAL 104 13.429 -9.746 -1.127 807 H VAL 105 HN VAL 105 10.266 -8.158 -1.501 808 HA VAL 105 HA VAL 105 8.298 -8.565 -3.591 809 HB VAL 105 HB VAL 105 6.911 -8.981 -1.675 810 HG11 VAL 105 HG11 VAL 105 8.181 -7.913 0.065 811 HG12 VAL 105 HG12 VAL 105 6.527 -7.298 0.072 812 HG13 VAL 105 HG13 VAL 105 7.830 -6.323 -0.609 813 HG21 VAL 105 HG21 VAL 105 5.199 -7.269 -1.990 814 HG22 VAL 105 HG22 VAL 105 5.916 -7.766 -3.523 815 HG23 VAL 105 HG23 VAL 105 6.382 -6.234 -2.789 816 H ARG 106 HN ARG 106 9.059 -7.245 -5.012 817 HA ARG 106 HA ARG 106 10.130 -4.676 -4.320 818 HB2 ARG 106 HB2 ARG 106 10.360 -6.403 -6.492 819 HB3 ARG 106 HB1 ARG 106 9.446 -5.037 -7.106 820 HG2 ARG 106 HG2 ARG 106 12.186 -5.017 -5.912 821 HG3 ARG 106 HG1 ARG 106 11.687 -4.644 -7.548 822 HD2 ARG 106 HD2 ARG 106 10.604 -2.647 -6.876 823 HD3 ARG 106 HD1 ARG 106 10.866 -3.032 -5.178 824 HE ARG 106 HE ARG 106 13.094 -2.406 -5.366 825 HH11 ARG 106 HH11 ARG 106 11.501 -2.194 -8.492 826 HH12 ARG 106 HH12 ARG 106 12.768 -1.250 -9.215 827 HH21 ARG 106 HH21 ARG 106 14.719 -1.153 -6.274 828 HH22 ARG 106 HH22 ARG 106 14.593 -0.625 -7.929 829 H LEU 107 HN LEU 107 9.210 -2.758 -4.661 830 HA LEU 107 HA LEU 107 6.342 -2.773 -5.310 831 HB2 LEU 107 HB2 LEU 107 7.484 -0.808 -3.379 832 HB3 LEU 107 HB1 LEU 107 5.845 -1.407 -3.509 833 HG LEU 107 HG LEU 107 8.176 -2.977 -2.398 834 HD11 LEU 107 HD11 LEU 107 7.223 -2.565 -0.247 835 HD12 LEU 107 HD12 LEU 107 5.864 -1.693 -0.960 836 HD13 LEU 107 HD13 LEU 107 7.493 -1.016 -1.045 837 HD21 LEU 107 HD21 LEU 107 6.372 -4.349 -3.404 838 HD22 LEU 107 HD22 LEU 107 5.226 -3.580 -2.303 839 HD23 LEU 107 HD23 LEU 107 6.541 -4.570 -1.660 840 H LEU 108 HN LEU 108 5.928 -1.467 -6.985 841 HA LEU 108 HA LEU 108 7.491 1.011 -7.131 842 HB2 LEU 108 HB2 LEU 108 5.321 0.093 -9.021 843 HB3 LEU 108 HB1 LEU 108 6.375 1.478 -9.223 844 HG LEU 108 HG LEU 108 6.964 -1.421 -9.618 845 HD11 LEU 108 HD11 LEU 108 7.655 1.064 -11.166 846 HD12 LEU 108 HD12 LEU 108 6.318 -0.037 -11.504 847 HD13 LEU 108 HD13 LEU 108 7.984 -0.597 -11.660 848 HD21 LEU 108 HD21 LEU 108 8.706 -0.834 -8.111 849 HD22 LEU 108 HD22 LEU 108 9.001 0.697 -8.937 850 HD23 LEU 108 HD23 LEU 108 9.380 -0.835 -9.740 851 H VAL 109 HN VAL 109 6.732 2.539 -5.843 852 HA VAL 109 HA VAL 109 4.007 2.200 -4.899 853 HB VAL 109 HB VAL 109 5.985 1.273 -3.539 854 HG11 VAL 109 HG11 VAL 109 7.025 2.846 -1.983 855 HG12 VAL 109 HG12 VAL 109 6.281 4.178 -2.871 856 HG13 VAL 109 HG13 VAL 109 7.474 3.148 -3.661 857 HG21 VAL 109 HG21 VAL 109 3.924 3.041 -2.312 858 HG22 VAL 109 HG22 VAL 109 4.913 1.887 -1.416 859 HG23 VAL 109 HG23 VAL 109 3.796 1.318 -2.659 860 H THR 110 HN THR 110 3.705 4.093 -3.318 861 HA THR 110 HA THR 110 4.452 6.657 -4.504 862 HB THR 110 HB THR 110 1.782 7.092 -4.392 863 HG1 THR 110 HG1 THR 110 2.137 4.377 -4.556 864 HG21 THR 110 HG21 THR 110 1.742 6.961 -6.766 865 HG22 THR 110 HG22 THR 110 3.137 5.883 -6.783 866 HG23 THR 110 HG23 THR 110 3.323 7.567 -6.273 867 H ARG 111 HN ARG 111 5.113 7.703 -2.716 868 HA ARG 111 HA ARG 111 3.236 7.765 -0.444 869 HB2 ARG 111 HB2 ARG 111 5.204 8.269 1.026 870 HB3 ARG 111 HB1 ARG 111 5.171 6.642 0.366 871 HG2 ARG 111 HG2 ARG 111 6.914 7.084 -1.116 872 HG3 ARG 111 HG1 ARG 111 6.744 8.831 -0.933 873 HD2 ARG 111 HD2 ARG 111 7.443 8.571 1.435 874 HD3 ARG 111 HD1 ARG 111 7.756 6.865 1.111 875 HE ARG 111 HE ARG 111 9.197 8.235 -0.786 876 HH11 ARG 111 HH11 ARG 111 9.118 8.114 2.709 877 HH12 ARG 111 HH12 ARG 111 10.775 8.601 2.890 878 HH21 ARG 111 HH21 ARG 111 11.392 8.854 -0.551 879 HH22 ARG 111 HH22 ARG 111 12.060 9.006 1.053 880 H GLN 112 HN GLN 112 3.445 9.746 0.901 881 HA GLN 112 HA GLN 112 3.591 12.133 -0.693 882 HB2 GLN 112 HB2 GLN 112 2.898 11.560 2.173 883 HB3 GLN 112 HB1 GLN 112 2.948 13.188 1.516 884 HG2 GLN 112 HG2 GLN 112 0.713 12.215 1.665 885 HG3 GLN 112 HG1 GLN 112 1.157 12.725 0.050 886 HE21 GLN 112 HE21 GLN 112 1.459 11.192 -1.561 887 HE22 GLN 112 HE22 GLN 112 0.879 9.569 -1.387 888 H SER 113 HN SER 113 5.025 10.734 2.048 889 HA SER 113 HA SER 113 7.188 10.737 2.842 890 HB2 SER 113 HB2 SER 113 7.963 11.679 0.620 891 HB3 SER 113 HB1 SER 113 7.713 13.278 1.322 892 HG SER 113 HG SER 113 9.283 12.795 2.880 893 H LEU 114 HN LEU 114 4.792 12.731 2.999 894 HA LEU 114 HA LEU 114 5.725 14.049 5.444 895 HB2 LEU 114 HB2 LEU 114 3.789 14.959 3.351 896 HB3 LEU 114 HB1 LEU 114 3.876 15.719 4.930 897 HG LEU 114 HG LEU 114 5.204 17.142 3.707 898 HD11 LEU 114 HD11 LEU 114 7.611 16.458 4.087 899 HD12 LEU 114 HD12 LEU 114 6.969 14.933 4.723 900 HD13 LEU 114 HD13 LEU 114 6.561 16.464 5.507 901 HD21 LEU 114 HD21 LEU 114 6.167 14.749 2.137 902 HD22 LEU 114 HD22 LEU 114 6.716 16.410 1.896 903 HD23 LEU 114 HD23 LEU 114 5.031 15.984 1.590 904 H GLN 115 HN GLN 115 4.598 11.562 4.682 905 HA GLN 115 HA GLN 115 1.890 11.427 5.592 906 HB2 GLN 115 HB2 GLN 115 2.533 8.857 5.463 907 HB3 GLN 115 HB1 GLN 115 2.131 9.796 4.047 908 HG2 GLN 115 HG2 GLN 115 4.064 8.320 3.719 909 HG3 GLN 115 HG1 GLN 115 4.443 10.018 3.462 910 HE21 GLN 115 HE21 GLN 115 4.808 7.299 5.645 911 HE22 GLN 115 HE22 GLN 115 6.203 7.916 6.470 912 H LYS 116 HN LYS 116 1.107 10.677 7.455 913 HA LYS 116 HA LYS 116 2.868 9.548 9.476 914 HB2 LYS 116 HB2 LYS 116 1.291 12.105 9.897 915 HB3 LYS 116 HB1 LYS 116 1.950 11.139 11.209 916 HG2 LYS 116 HG2 LYS 116 3.648 12.304 9.018 917 HG3 LYS 116 HG1 LYS 116 3.299 13.148 10.531 918 HD2 LYS 116 HD2 LYS 116 4.385 11.446 11.808 919 HD3 LYS 116 HD1 LYS 116 4.536 10.402 10.391 920 HE2 LYS 116 HE2 LYS 116 5.797 13.128 10.515 921 HE3 LYS 116 HE1 LYS 116 6.614 11.694 11.130 922 HZ1 LYS 116 HZ1 LYS 116 5.558 11.794 8.370 923 HZ2 LYS 116 HZ2 LYS 116 6.740 10.763 9.013 924 HZ3 LYS 116 HZ3 LYS 116 7.092 12.400 8.749 925 H ALA 117 HN ALA 117 1.604 8.694 11.322 926 HA ALA 117 HA ALA 117 -1.221 8.229 10.723 927 HB1 ALA 117 HB1 ALA 117 -0.968 5.816 11.189 928 HB2 ALA 117 HB2 ALA 117 0.780 6.035 11.266 929 HB3 ALA 117 HB3 ALA 117 -0.078 6.315 9.751 930 H VAL 118 HN VAL 118 0.364 9.782 12.510 931 HA VAL 118 HA VAL 118 0.205 8.558 15.109 932 HB VAL 118 HB VAL 118 1.372 10.662 15.747 933 HG11 VAL 118 HG11 VAL 118 3.506 10.077 14.729 934 HG12 VAL 118 HG12 VAL 118 2.652 9.100 13.533 935 HG13 VAL 118 HG13 VAL 118 2.621 8.637 15.234 936 HG21 VAL 118 HG21 VAL 118 2.296 12.075 13.959 937 HG22 VAL 118 HG22 VAL 118 0.537 12.145 14.043 938 HG23 VAL 118 HG23 VAL 118 1.322 11.175 12.796 939 H GLN 119 HN GLN 119 -2.159 9.358 13.571 940 HA GLN 119 HA GLN 119 -3.281 11.456 15.277 941 HB2 GLN 119 HB2 GLN 119 -5.138 11.419 13.500 942 HB3 GLN 119 HB1 GLN 119 -3.587 12.129 13.064 943 HG2 GLN 119 HG2 GLN 119 -2.963 10.002 11.980 944 HG3 GLN 119 HG1 GLN 119 -4.571 9.378 12.344 945 HE21 GLN 119 HE21 GLN 119 -2.741 11.704 10.495 946 HE22 GLN 119 HE22 GLN 119 -3.982 12.022 9.314 947 H GLN 120 HN GLN 120 -5.122 11.077 16.464 948 HA GLN 120 HA GLN 120 -5.556 8.379 17.256 949 HB2 GLN 120 HB2 GLN 120 -7.201 9.278 18.799 950 HB3 GLN 120 HB1 GLN 120 -5.743 10.263 18.834 951 HG2 GLN 120 HG2 GLN 120 -6.784 11.980 17.561 952 HG3 GLN 120 HG1 GLN 120 -8.185 10.966 17.224 953 HE21 GLN 120 HE21 GLN 120 -8.293 9.915 19.933 954 HE22 GLN 120 HE22 GLN 120 -8.925 11.188 20.914 955 H SER 121 HN SER 121 -7.876 7.583 17.517 956 HA SER 121 HA SER 121 -9.054 7.544 14.869 957 HB2 SER 121 HB2 SER 121 -9.791 5.969 17.347 958 HB3 SER 121 HB1 SER 121 -10.352 5.655 15.701 959 HG SER 121 HG SER 121 -8.053 5.411 15.166 960 H MET 122 HN MET 122 -10.686 8.810 14.313 961 HA MET 122 HA MET 122 -12.261 10.204 16.305 962 HB2 MET 122 HB2 MET 122 -12.449 10.128 13.285 963 HB3 MET 122 HB1 MET 122 -13.478 11.114 14.315 964 HG2 MET 122 HG2 MET 122 -11.523 12.319 15.123 965 HG3 MET 122 HG1 MET 122 -10.485 11.323 14.106 966 HE1 MET 122 HE1 MET 122 -10.394 14.856 12.370 967 HE2 MET 122 HE2 MET 122 -9.444 13.595 13.155 968 HE3 MET 122 HE3 MET 122 -10.562 14.576 14.104 969 H LEU 123 HN LEU 123 -12.339 7.234 14.753 970 HA LEU 123 HA LEU 123 -15.219 6.946 14.725 971 HB2 LEU 123 HB2 LEU 123 -13.011 4.975 14.109 972 HB3 LEU 123 HB1 LEU 123 -14.718 4.616 13.976 973 HG LEU 123 HG LEU 123 -14.830 6.519 12.276 974 HD11 LEU 123 HD11 LEU 123 -12.742 7.033 11.114 975 HD12 LEU 123 HD12 LEU 123 -11.845 6.104 12.314 976 HD13 LEU 123 HD13 LEU 123 -12.697 7.573 12.793 977 HD21 LEU 123 HD21 LEU 123 -15.028 4.222 11.618 978 HD22 LEU 123 HD22 LEU 123 -13.281 4.002 11.717 979 HD23 LEU 123 HD23 LEU 123 -13.968 5.049 10.476 980 H SER 124 HN SER 124 -16.384 6.135 16.333 981 HA SER 124 HA SER 124 -15.026 4.469 18.340 982 HB2 SER 124 HB2 SER 124 -17.279 6.433 18.848 983 HB3 SER 124 HB1 SER 124 -16.544 5.377 20.053 984 HG SER 124 HG SER 124 -14.783 6.967 18.623 985 H1 LYS 161 HN LYS 161 -17.611 -4.721 9.447 986 HA LYS 161 HA LYS 161 -15.814 -6.611 8.144 987 HB2 LYS 161 HB2 LYS 161 -16.054 -5.609 5.944 988 HB3 LYS 161 HB1 LYS 161 -17.596 -6.231 6.504 989 HG2 LYS 161 HG2 LYS 161 -16.836 -3.324 6.708 990 HG3 LYS 161 HG1 LYS 161 -17.626 -4.009 5.286 991 HD2 LYS 161 HD2 LYS 161 -18.694 -3.908 8.118 992 HD3 LYS 161 HD1 LYS 161 -19.308 -3.033 6.714 993 HE2 LYS 161 HE2 LYS 161 -19.930 -5.153 5.663 994 HE3 LYS 161 HE1 LYS 161 -19.308 -6.029 7.058 995 HZ1 LYS 161 HZ1 LYS 161 -20.966 -4.807 8.423 996 HZ2 LYS 161 HZ2 LYS 161 -21.654 -5.846 7.271 997 HZ3 LYS 161 HZ3 LYS 161 -21.627 -4.175 6.993 998 H GLU 162 HN GLU 162 -13.844 -6.066 8.480 999 HA GLU 162 HA GLU 162 -12.837 -3.583 7.644 1000 HB2 GLU 162 HB2 GLU 162 -11.779 -2.957 9.860 1001 HB3 GLU 162 HB1 GLU 162 -13.488 -2.627 9.648 1002 HG2 GLU 162 HG2 GLU 162 -13.984 -4.708 10.920 1003 HG3 GLU 162 HG1 GLU 162 -12.255 -4.867 11.234 1004 H ASN 163 HN ASN 163 -11.260 -4.294 6.545 1005 HA ASN 163 HA ASN 163 -9.656 -6.525 7.578 1006 HB2 ASN 163 HB2 ASN 163 -10.326 -5.806 4.730 1007 HB3 ASN 163 HB1 ASN 163 -9.135 -7.021 5.178 1008 HD21 ASN 163 HD21 ASN 163 -10.283 -8.644 4.132 1009 HD22 ASN 163 HD22 ASN 163 -11.760 -9.292 4.789 1010 H LEU 164 HN LEU 164 -8.708 -4.938 4.756 1011 HA LEU 164 HA LEU 164 -6.984 -3.625 4.172 1012 HB2 LEU 164 HB2 LEU 164 -7.202 -2.641 7.006 1013 HB3 LEU 164 HB1 LEU 164 -6.090 -1.969 5.827 1014 HG LEU 164 HG LEU 164 -9.097 -1.964 5.632 1015 HD11 LEU 164 HD11 LEU 164 -8.230 -0.393 7.277 1016 HD12 LEU 164 HD12 LEU 164 -8.864 0.459 5.868 1017 HD13 LEU 164 HD13 LEU 164 -7.122 0.270 6.078 1018 HD21 LEU 164 HD21 LEU 164 -8.044 -2.221 3.439 1019 HD22 LEU 164 HD22 LEU 164 -7.026 -0.817 3.762 1020 HD23 LEU 164 HD23 LEU 164 -8.773 -0.625 3.612 1021 H GLU 165 HN GLU 165 -6.006 -4.167 7.502 1022 HA GLU 165 HA GLU 165 -3.318 -4.416 6.837 1023 HB2 GLU 165 HB2 GLU 165 -4.784 -5.273 9.317 1024 HB3 GLU 165 HB1 GLU 165 -3.039 -5.427 9.124 1025 HG2 GLU 165 HG2 GLU 165 -2.987 -2.967 8.647 1026 HG3 GLU 165 HG1 GLU 165 -4.673 -2.908 9.180 1027 H SER 166 HN SER 166 -2.382 -5.869 5.721 1028 HA SER 166 HA SER 166 -2.668 -8.659 6.591 1029 HB2 SER 166 HB2 SER 166 -2.067 -7.729 3.764 1030 HB3 SER 166 HB1 SER 166 -2.204 -9.404 4.306 1031 HG SER 166 HG SER 166 -4.382 -7.874 4.952 1032 H MET 167 HN MET 167 -0.848 -9.127 7.654 1033 HA MET 167 HA MET 167 1.516 -7.550 7.286 1034 HB2 MET 167 HB2 MET 167 0.882 -9.907 9.049 1035 HB3 MET 167 HB1 MET 167 2.510 -9.239 8.938 1036 HG2 MET 167 HG2 MET 167 1.712 -7.089 9.717 1037 HG3 MET 167 HG1 MET 167 0.054 -7.690 9.764 1038 HE1 MET 167 HE1 MET 167 0.161 -6.579 12.257 1039 HE2 MET 167 HE2 MET 167 1.895 -6.278 12.150 1040 HE3 MET 167 HE3 MET 167 1.238 -7.162 13.528 1041 H VAL 168 HN VAL 168 3.422 -8.131 6.393 1042 HA VAL 168 HA VAL 168 3.671 -10.762 5.159 1043 HB VAL 168 HB VAL 168 4.554 -9.763 3.054 1044 HG11 VAL 168 HG11 VAL 168 2.249 -10.573 3.170 1045 HG12 VAL 168 HG12 VAL 168 2.393 -9.190 2.085 1046 HG13 VAL 168 HG13 VAL 168 1.716 -8.977 3.700 1047 HG21 VAL 168 HG21 VAL 168 3.420 -7.196 4.156 1048 HG22 VAL 168 HG22 VAL 168 4.096 -7.431 2.544 1049 HG23 VAL 168 HG23 VAL 168 5.135 -7.562 3.966 Start of MODEL 4 1 H1 MET 1 HT1 MET 1 8.464 24.286 -8.674 2 H2 MET 1 HT2 MET 1 9.531 24.652 -9.937 3 H3 MET 1 HT3 MET 1 8.721 25.896 -9.134 4 HA MET 1 HA MET 1 10.730 24.079 -7.942 5 HB2 MET 1 HB2 MET 1 12.225 25.977 -7.875 6 HB3 MET 1 HB1 MET 1 11.686 25.728 -9.527 7 HG2 MET 1 HG2 MET 1 10.698 27.842 -7.620 8 HG3 MET 1 HG1 MET 1 11.769 28.081 -9.000 9 HE1 MET 1 HE1 MET 1 10.202 30.015 -10.009 10 HE2 MET 1 HE2 MET 1 9.225 29.842 -8.552 11 HE3 MET 1 HE3 MET 1 8.453 29.846 -10.137 12 H SER 2 HN SER 2 8.423 26.730 -7.470 13 HA SER 2 HA SER 2 8.991 26.707 -4.595 14 HB2 SER 2 HB2 SER 2 7.441 28.745 -4.657 15 HB3 SER 2 HB1 SER 2 8.999 28.907 -5.470 16 HG SER 2 HG SER 2 7.050 29.630 -6.647 17 H TYR 3 HN TYR 3 7.412 24.665 -6.201 18 HA TYR 3 HA TYR 3 5.751 23.218 -5.756 19 HB2 TYR 3 HB2 TYR 3 5.271 24.929 -3.329 20 HB3 TYR 3 HB1 TYR 3 4.383 23.447 -3.665 21 HD1 TYR 3 HD1 TYR 3 5.539 21.263 -3.568 22 HD2 TYR 3 HD2 TYR 3 7.530 24.871 -2.510 23 HE1 TYR 3 HE1 TYR 3 7.303 19.957 -2.459 24 HE2 TYR 3 HE2 TYR 3 9.302 23.578 -1.404 25 HH TYR 3 HH TYR 3 9.633 21.376 -0.407 26 H ILE 4 HN ILE 4 5.025 26.533 -5.777 27 HA ILE 4 HA ILE 4 3.348 27.820 -6.547 28 HB ILE 4 HB ILE 4 2.770 25.442 -8.305 29 HG12 ILE 4 HG12 ILE 4 5.072 26.203 -8.515 30 HG13 ILE 4 HG11 ILE 4 4.166 26.643 -9.949 31 HG21 ILE 4 HG21 ILE 4 1.742 27.073 -9.819 32 HG22 ILE 4 HG22 ILE 4 2.003 28.340 -8.620 33 HG23 ILE 4 HG23 ILE 4 0.905 27.004 -8.270 34 HD11 ILE 4 HD11 ILE 4 4.869 28.482 -7.677 35 HD12 ILE 4 HD12 ILE 4 3.962 28.929 -9.122 36 HD13 ILE 4 HD13 ILE 4 5.650 28.436 -9.257 37 HA PRO 5 HA PRO 5 0.220 26.376 -3.577 38 HB2 PRO 5 HB2 PRO 5 -0.404 29.271 -3.868 39 HB3 PRO 5 HB1 PRO 5 -0.224 28.302 -2.402 40 HG2 PRO 5 HG2 PRO 5 1.682 30.002 -3.140 41 HG3 PRO 5 HG1 PRO 5 2.095 28.421 -2.448 42 HD2 PRO 5 HD2 PRO 5 2.165 29.324 -5.299 43 HD3 PRO 5 HD1 PRO 5 3.290 28.267 -4.424 44 H GLY 6 HN GLY 6 -1.813 25.735 -4.025 45 HA2 GLY 6 HA2 GLY 6 -3.966 26.323 -5.130 46 HA3 GLY 6 HA1 GLY 6 -2.992 26.724 -6.547 47 H GLN 7 HN GLN 7 -1.189 24.569 -6.409 48 HA GLN 7 HA GLN 7 -2.901 22.422 -7.374 49 HB2 GLN 7 HB2 GLN 7 0.096 22.833 -7.508 50 HB3 GLN 7 HB1 GLN 7 -0.746 21.449 -8.180 51 HG2 GLN 7 HG2 GLN 7 -1.988 22.914 -9.677 52 HG3 GLN 7 HG1 GLN 7 -1.162 24.314 -8.998 53 HE21 GLN 7 HE21 GLN 7 0.404 21.237 -9.609 54 HE22 GLN 7 HE22 GLN 7 1.402 21.791 -10.919 55 HA PRO 8 HA PRO 8 -2.439 19.989 -3.733 56 HB2 PRO 8 HB2 PRO 8 -2.617 17.570 -5.364 57 HB3 PRO 8 HB1 PRO 8 -3.784 18.227 -4.217 58 HG2 PRO 8 HG2 PRO 8 -4.218 18.212 -6.886 59 HG3 PRO 8 HG1 PRO 8 -4.853 19.480 -5.820 60 HD2 PRO 8 HD2 PRO 8 -2.451 19.535 -7.615 61 HD3 PRO 8 HD1 PRO 8 -3.674 20.796 -7.329 62 H VAL 9 HN VAL 9 -1.346 17.762 -3.108 63 HA VAL 9 HA VAL 9 1.471 18.118 -3.490 64 HB VAL 9 HB VAL 9 0.310 17.309 -1.375 65 HG11 VAL 9 HG11 VAL 9 -1.131 15.637 -2.384 66 HG12 VAL 9 HG12 VAL 9 -0.098 14.923 -1.147 67 HG13 VAL 9 HG13 VAL 9 0.279 14.685 -2.854 68 HG21 VAL 9 HG21 VAL 9 2.652 15.729 -2.425 69 HG22 VAL 9 HG22 VAL 9 2.156 15.805 -0.734 70 HG23 VAL 9 HG23 VAL 9 2.708 17.263 -1.557 71 H THR 10 HN THR 10 2.641 15.728 -3.782 72 HA THR 10 HA THR 10 1.754 14.812 -6.375 73 HB THR 10 HB THR 10 4.057 15.090 -7.257 74 HG1 THR 10 HG1 THR 10 4.946 15.376 -5.024 75 HG21 THR 10 HG21 THR 10 2.649 17.611 -6.373 76 HG22 THR 10 HG22 THR 10 2.305 16.673 -7.833 77 HG23 THR 10 HG23 THR 10 3.851 17.514 -7.667 78 H ALA 11 HN ALA 11 1.609 12.842 -6.147 79 HA ALA 11 HA ALA 11 2.684 11.031 -4.404 80 HB1 ALA 11 HB1 ALA 11 0.867 10.473 -5.972 81 HB2 ALA 11 HB2 ALA 11 2.179 9.287 -6.001 82 HB3 ALA 11 HB3 ALA 11 2.038 10.477 -7.295 83 H VAL 12 HN VAL 12 4.561 10.708 -3.931 84 HA VAL 12 HA VAL 12 6.764 10.852 -5.788 85 HB VAL 12 HB VAL 12 6.854 9.656 -3.084 86 HG11 VAL 12 HG11 VAL 12 9.148 10.603 -3.077 87 HG12 VAL 12 HG12 VAL 12 8.876 11.096 -4.752 88 HG13 VAL 12 HG13 VAL 12 8.839 9.384 -4.313 89 HG21 VAL 12 HG21 VAL 12 6.763 12.596 -3.690 90 HG22 VAL 12 HG22 VAL 12 7.462 11.955 -2.201 91 HG23 VAL 12 HG23 VAL 12 5.756 11.675 -2.565 92 H VAL 13 HN VAL 13 7.600 9.201 -6.750 93 HA VAL 13 HA VAL 13 6.417 6.544 -6.381 94 HB VAL 13 HB VAL 13 8.064 7.511 -8.715 95 HG11 VAL 13 HG11 VAL 13 7.184 5.553 -9.863 96 HG12 VAL 13 HG12 VAL 13 6.306 5.085 -8.409 97 HG13 VAL 13 HG13 VAL 13 8.068 5.090 -8.409 98 HG21 VAL 13 HG21 VAL 13 5.986 7.747 -9.947 99 HG22 VAL 13 HG22 VAL 13 5.971 8.788 -8.523 100 HG23 VAL 13 HG23 VAL 13 5.063 7.276 -8.519 101 H GLN 14 HN GLN 14 7.568 5.079 -5.349 102 HA GLN 14 HA GLN 14 10.490 5.288 -5.427 103 HB2 GLN 14 HB2 GLN 14 8.750 4.800 -3.022 104 HB3 GLN 14 HB1 GLN 14 10.408 4.213 -3.080 105 HG2 GLN 14 HG2 GLN 14 10.912 6.193 -2.190 106 HG3 GLN 14 HG1 GLN 14 10.753 6.782 -3.843 107 HE21 GLN 14 HE21 GLN 14 7.812 6.282 -3.707 108 HE22 GLN 14 HE22 GLN 14 7.184 7.626 -2.810 109 H ARG 15 HN ARG 15 11.506 3.531 -5.926 110 HA ARG 15 HA ARG 15 9.975 1.114 -6.331 111 HB2 ARG 15 HB2 ARG 15 12.606 2.009 -7.528 112 HB3 ARG 15 HB1 ARG 15 11.711 0.573 -7.953 113 HG2 ARG 15 HG2 ARG 15 11.173 2.069 -9.659 114 HG3 ARG 15 HG1 ARG 15 9.790 2.160 -8.553 115 HD2 ARG 15 HD2 ARG 15 10.385 4.372 -9.175 116 HD3 ARG 15 HD1 ARG 15 10.815 4.095 -7.480 117 HE ARG 15 HE ARG 15 12.992 3.622 -9.310 118 HH11 ARG 15 HH11 ARG 15 11.294 6.139 -7.537 119 HH12 ARG 15 HH12 ARG 15 12.691 7.167 -7.412 120 HH21 ARG 15 HH21 ARG 15 14.812 4.977 -9.171 121 HH22 ARG 15 HH22 ARG 15 14.698 6.518 -8.370 122 H VAL 16 HN VAL 16 10.181 -0.121 -4.676 123 HA VAL 16 HA VAL 16 12.745 -0.196 -3.270 124 HB VAL 16 HB VAL 16 11.332 1.261 -1.999 125 HG11 VAL 16 HG11 VAL 16 9.301 -0.958 -1.988 126 HG12 VAL 16 HG12 VAL 16 9.148 0.605 -2.797 127 HG13 VAL 16 HG13 VAL 16 9.185 0.519 -1.033 128 HG21 VAL 16 HG21 VAL 16 11.422 -1.420 -0.646 129 HG22 VAL 16 HG22 VAL 16 11.257 0.144 0.166 130 HG23 VAL 16 HG23 VAL 16 12.741 -0.251 -0.710 131 H GLU 17 HN GLU 17 13.469 -2.128 -2.975 132 HA GLU 17 HA GLU 17 11.725 -4.430 -3.356 133 HB2 GLU 17 HB2 GLU 17 14.742 -4.192 -3.441 134 HB3 GLU 17 HB1 GLU 17 13.851 -5.692 -3.670 135 HG2 GLU 17 HG2 GLU 17 12.740 -4.739 -5.623 136 HG3 GLU 17 HG1 GLU 17 13.640 -3.240 -5.406 137 H ILE 18 HN ILE 18 10.922 -5.114 -1.563 138 HA ILE 18 HA ILE 18 12.322 -4.812 0.967 139 HB ILE 18 HB ILE 18 9.401 -5.185 0.293 140 HG12 ILE 18 HG12 ILE 18 10.684 -2.842 1.676 141 HG13 ILE 18 HG11 ILE 18 10.490 -2.926 -0.080 142 HG21 ILE 18 HG21 ILE 18 8.966 -4.958 2.676 143 HG22 ILE 18 HG22 ILE 18 10.700 -4.905 2.999 144 HG23 ILE 18 HG23 ILE 18 9.971 -6.367 2.334 145 HD11 ILE 18 HD11 ILE 18 8.084 -3.358 0.302 146 HD12 ILE 18 HD12 ILE 18 8.637 -1.746 0.775 147 HD13 ILE 18 HD13 ILE 18 8.347 -2.983 2.004 148 H HIS 19 HN HIS 19 13.171 -6.565 1.749 149 HA HIS 19 HA HIS 19 12.172 -9.050 0.673 150 HB2 HIS 19 HB2 HIS 19 14.459 -9.883 1.196 151 HB3 HIS 19 HB1 HIS 19 14.298 -8.702 -0.074 152 HD1 HIS 19 HD1 HIS 19 15.637 -9.010 3.464 153 HD2 HIS 19 HD2 HIS 19 15.744 -6.456 0.182 154 HE1 HIS 19 HE1 HIS 19 17.396 -7.289 4.003 155 HE2 HIS 19 HE2 HIS 19 17.601 -5.904 1.900 156 H LYS 20 HN LYS 20 10.518 -9.297 2.177 157 HA LYS 20 HA LYS 20 11.343 -10.490 4.700 158 HB2 LYS 20 HB2 LYS 20 8.790 -9.772 3.416 159 HB3 LYS 20 HB1 LYS 20 8.762 -11.268 4.345 160 HG2 LYS 20 HG2 LYS 20 9.758 -8.635 5.413 161 HG3 LYS 20 HG1 LYS 20 8.123 -9.260 5.656 162 HD2 LYS 20 HD2 LYS 20 8.829 -10.462 7.381 163 HD3 LYS 20 HD1 LYS 20 9.939 -11.326 6.318 164 HE2 LYS 20 HE2 LYS 20 10.540 -8.721 7.713 165 HE3 LYS 20 HE1 LYS 20 11.054 -10.310 8.271 166 HZ1 LYS 20 HZ1 LYS 20 12.750 -9.009 7.000 167 HZ2 LYS 20 HZ2 LYS 20 11.803 -9.237 5.611 168 HZ3 LYS 20 HZ3 LYS 20 12.464 -10.570 6.413 169 H LEU 21 HN LEU 21 10.340 -13.030 4.859 170 HA LEU 21 HA LEU 21 11.593 -14.204 2.536 171 HB2 LEU 21 HB2 LEU 21 13.471 -13.110 3.566 172 HB3 LEU 21 HB1 LEU 21 13.145 -13.921 5.093 173 HG LEU 21 HG LEU 21 13.712 -16.073 4.106 174 HD11 LEU 21 HD11 LEU 21 14.299 -14.535 1.576 175 HD12 LEU 21 HD12 LEU 21 12.936 -15.630 1.821 176 HD13 LEU 21 HD13 LEU 21 14.584 -16.254 1.846 177 HD21 LEU 21 HD21 LEU 21 16.099 -15.678 3.714 178 HD22 LEU 21 HD22 LEU 21 15.501 -14.768 5.101 179 HD23 LEU 21 HD23 LEU 21 15.782 -13.948 3.564 180 H ARG 22 HN ARG 22 11.154 -16.220 2.279 181 HA ARG 22 HA ARG 22 10.289 -17.951 4.385 182 HB2 ARG 22 HB2 ARG 22 9.626 -18.104 1.911 183 HB3 ARG 22 HB1 ARG 22 11.253 -18.696 1.607 184 HG2 ARG 22 HG2 ARG 22 9.346 -20.046 3.498 185 HG3 ARG 22 HG1 ARG 22 9.448 -20.438 1.778 186 HD2 ARG 22 HD2 ARG 22 11.741 -20.553 3.715 187 HD3 ARG 22 HD1 ARG 22 10.758 -21.944 3.251 188 HE ARG 22 HE ARG 22 12.185 -20.415 1.178 189 HH11 ARG 22 HH11 ARG 22 11.791 -23.372 3.039 190 HH12 ARG 22 HH12 ARG 22 12.766 -24.332 1.965 191 HH21 ARG 22 HH21 ARG 22 13.476 -21.672 -0.226 192 HH22 ARG 22 HH22 ARG 22 13.718 -23.366 0.106 193 H GLN 23 HN GLN 23 11.707 -18.726 5.831 194 HA GLN 23 HA GLN 23 14.515 -18.916 5.057 195 HB2 GLN 23 HB2 GLN 23 13.734 -18.675 7.909 196 HB3 GLN 23 HB1 GLN 23 15.137 -18.032 7.070 197 HG2 GLN 23 HG2 GLN 23 13.430 -16.545 5.854 198 HG3 GLN 23 HG1 GLN 23 12.373 -16.955 7.200 199 HE21 GLN 23 HE21 GLN 23 13.379 -14.439 6.401 200 HE22 GLN 23 HE22 GLN 23 14.284 -13.789 7.747 201 H GLY 24 HN GLY 24 13.586 -20.952 4.262 202 HA2 GLY 24 HA2 GLY 24 13.857 -23.239 4.408 203 HA3 GLY 24 HA1 GLY 24 14.361 -23.025 6.081 204 H GLU 25 HN GLU 25 13.034 -23.507 7.623 205 HA GLU 25 HA GLU 25 10.341 -24.373 7.028 206 HB2 GLU 25 HB2 GLU 25 12.285 -24.627 9.190 207 HB3 GLU 25 HB1 GLU 25 10.639 -24.390 9.750 208 HG2 GLU 25 HG2 GLU 25 9.875 -26.351 8.747 209 HG3 GLU 25 HG1 GLU 25 11.270 -26.448 7.673 210 H ASN 26 HN ASN 26 11.655 -21.459 7.301 211 HA ASN 26 HA ASN 26 9.588 -20.363 8.997 212 HB2 ASN 26 HB2 ASN 26 12.235 -19.258 8.117 213 HB3 ASN 26 HB1 ASN 26 10.990 -18.286 8.856 214 HD21 ASN 26 HD21 ASN 26 13.237 -20.762 9.238 215 HD22 ASN 26 HD22 ASN 26 13.296 -20.781 10.982 216 H LEU 27 HN LEU 27 8.381 -19.038 8.309 217 HA LEU 27 HA LEU 27 8.608 -17.803 5.678 218 HB2 LEU 27 HB2 LEU 27 6.284 -19.188 6.965 219 HB3 LEU 27 HB1 LEU 27 5.979 -17.782 5.984 220 HG LEU 27 HG LEU 27 5.648 -19.771 4.665 221 HD11 LEU 27 HD11 LEU 27 7.066 -19.286 2.802 222 HD12 LEU 27 HD12 LEU 27 8.256 -18.505 3.845 223 HD13 LEU 27 HD13 LEU 27 6.666 -17.767 3.606 224 HD21 LEU 27 HD21 LEU 27 7.553 -21.291 4.201 225 HD22 LEU 27 HD22 LEU 27 7.010 -21.337 5.875 226 HD23 LEU 27 HD23 LEU 27 8.481 -20.456 5.453 227 H ILE 28 HN ILE 28 9.029 -15.739 6.135 228 HA ILE 28 HA ILE 28 7.914 -14.599 8.601 229 HB ILE 28 HB ILE 28 10.051 -13.311 6.963 230 HG12 ILE 28 HG12 ILE 28 10.855 -15.606 7.344 231 HG13 ILE 28 HG11 ILE 28 11.780 -14.456 8.300 232 HG21 ILE 28 HG21 ILE 28 10.688 -12.379 9.110 233 HG22 ILE 28 HG22 ILE 28 9.408 -13.311 9.889 234 HG23 ILE 28 HG23 ILE 28 9.002 -12.053 8.721 235 HD11 ILE 28 HD11 ILE 28 11.309 -16.517 9.534 236 HD12 ILE 28 HD12 ILE 28 9.574 -16.232 9.343 237 HD13 ILE 28 HD13 ILE 28 10.549 -15.114 10.296 238 H LEU 29 HN LEU 29 6.396 -13.417 8.505 239 HA LEU 29 HA LEU 29 5.617 -11.929 6.117 240 HB2 LEU 29 HB2 LEU 29 4.324 -14.133 7.303 241 HB3 LEU 29 HB1 LEU 29 3.410 -12.729 7.821 242 HG LEU 29 HG LEU 29 3.026 -12.088 5.507 243 HD11 LEU 29 HD11 LEU 29 3.731 -13.515 3.670 244 HD12 LEU 29 HD12 LEU 29 4.585 -14.571 4.797 245 HD13 LEU 29 HD13 LEU 29 5.124 -12.906 4.567 246 HD21 LEU 29 HD21 LEU 29 1.551 -13.904 4.877 247 HD22 LEU 29 HD22 LEU 29 1.467 -13.637 6.618 248 HD23 LEU 29 HD23 LEU 29 2.384 -15.003 5.976 249 H GLY 30 HN GLY 30 6.615 -10.200 6.990 250 HA2 GLY 30 HA2 GLY 30 6.269 -9.473 9.772 251 HA3 GLY 30 HA1 GLY 30 7.352 -8.712 8.626 252 H PHE 31 HN PHE 31 6.280 -7.178 7.016 253 HA PHE 31 HA PHE 31 4.848 -5.379 8.795 254 HB2 PHE 31 HB2 PHE 31 5.444 -3.609 7.366 255 HB3 PHE 31 HB1 PHE 31 6.848 -4.659 7.431 256 HD1 PHE 31 HD2 PHE 31 7.255 -6.220 5.503 257 HD2 PHE 31 HD1 PHE 31 4.464 -3.020 5.330 258 HE1 PHE 31 HE2 PHE 31 7.300 -6.335 3.060 259 HE2 PHE 31 HE1 PHE 31 4.491 -3.133 2.876 260 HZ PHE 31 HZ PHE 31 5.961 -4.632 1.727 261 H SER 32 HN SER 32 3.093 -3.898 7.603 262 HA SER 32 HA SER 32 1.223 -5.900 6.522 263 HB2 SER 32 HB2 SER 32 0.533 -3.814 8.600 264 HB3 SER 32 HB1 SER 32 -0.528 -5.075 7.969 265 HG SER 32 HG SER 32 0.463 -6.541 9.155 266 H ILE 33 HN ILE 33 -0.256 -5.208 5.051 267 HA ILE 33 HA ILE 33 0.016 -2.416 4.185 268 HB ILE 33 HB ILE 33 -0.070 -3.091 1.856 269 HG12 ILE 33 HG12 ILE 33 0.196 -5.957 2.788 270 HG13 ILE 33 HG11 ILE 33 -1.335 -5.245 2.297 271 HG21 ILE 33 HG21 ILE 33 2.172 -4.163 1.708 272 HG22 ILE 33 HG22 ILE 33 2.110 -4.436 3.452 273 HG23 ILE 33 HG23 ILE 33 2.110 -2.791 2.816 274 HD11 ILE 33 HD11 ILE 33 -0.451 -4.845 0.072 275 HD12 ILE 33 HD12 ILE 33 -0.333 -6.551 0.512 276 HD13 ILE 33 HD13 ILE 33 1.103 -5.526 0.561 277 H GLY 34 HN GLY 34 -1.829 -1.442 3.497 278 HA2 GLY 34 HA2 GLY 34 -4.225 -2.976 4.244 279 HA3 GLY 34 HA1 GLY 34 -4.111 -1.214 4.214 280 H GLY 35 HN GLY 35 -5.849 -3.398 2.875 281 HA2 GLY 35 HA2 GLY 35 -5.828 -2.032 0.254 282 HA3 GLY 35 HA1 GLY 35 -6.060 -3.779 0.367 283 H GLY 36 HN GLY 36 -7.541 -0.669 0.717 284 HA2 GLY 36 HA2 GLY 36 -10.120 -1.149 0.617 285 HA3 GLY 36 HA1 GLY 36 -9.780 -1.802 2.213 286 H ILE 37 HN ILE 37 -8.102 1.005 0.904 287 HA ILE 37 HA ILE 37 -8.489 2.588 3.130 288 HB ILE 37 HB ILE 37 -7.943 4.537 1.716 289 HG12 ILE 37 HG12 ILE 37 -8.204 2.510 -0.502 290 HG13 ILE 37 HG11 ILE 37 -9.178 3.955 -0.273 291 HG21 ILE 37 HG21 ILE 37 -6.286 2.076 1.201 292 HG22 ILE 37 HG22 ILE 37 -6.159 3.154 2.590 293 HG23 ILE 37 HG23 ILE 37 -5.747 3.740 0.978 294 HD11 ILE 37 HD11 ILE 37 -7.606 4.289 -2.026 295 HD12 ILE 37 HD12 ILE 37 -6.276 3.828 -0.965 296 HD13 ILE 37 HD13 ILE 37 -7.175 5.315 -0.658 297 H ASP 38 HN ASP 38 -10.445 2.685 0.144 298 HA ASP 38 HA ASP 38 -12.610 3.915 1.744 299 HB2 ASP 38 HB2 ASP 38 -11.508 4.640 -0.918 300 HB3 ASP 38 HB1 ASP 38 -13.260 4.665 -0.767 301 H GLN 39 HN GLN 39 -11.494 1.304 0.125 302 HA GLN 39 HA GLN 39 -14.118 0.354 -0.646 303 HB2 GLN 39 HB2 GLN 39 -13.255 -0.344 -2.842 304 HB3 GLN 39 HB1 GLN 39 -13.178 1.394 -2.629 305 HG2 GLN 39 HG2 GLN 39 -10.861 -0.514 -2.349 306 HG3 GLN 39 HG1 GLN 39 -11.172 0.553 -3.718 307 HE21 GLN 39 HE21 GLN 39 -9.910 0.142 -0.657 308 HE22 GLN 39 HE22 GLN 39 -9.333 1.741 -0.413 309 H ASP 40 HN ASP 40 -12.825 -1.852 -2.086 310 HA ASP 40 HA ASP 40 -11.153 -3.291 -0.267 311 HB2 ASP 40 HB2 ASP 40 -13.367 -3.638 0.776 312 HB3 ASP 40 HB1 ASP 40 -13.985 -4.248 -0.750 313 HA PRO 41 HA PRO 41 -9.940 -4.687 -4.242 314 HB2 PRO 41 HB2 PRO 41 -8.420 -6.800 -3.571 315 HB3 PRO 41 HB1 PRO 41 -7.940 -5.141 -3.180 316 HG2 PRO 41 HG2 PRO 41 -9.373 -7.137 -1.444 317 HG3 PRO 41 HG1 PRO 41 -7.921 -6.204 -1.071 318 HD2 PRO 41 HD2 PRO 41 -10.296 -5.395 -0.213 319 HD3 PRO 41 HD1 PRO 41 -9.109 -4.214 -0.814 320 H SER 42 HN SER 42 -11.712 -6.819 -2.141 321 HA SER 42 HA SER 42 -12.000 -8.963 -4.014 322 HB2 SER 42 HB2 SER 42 -14.046 -8.300 -1.904 323 HB3 SER 42 HB1 SER 42 -13.551 -9.885 -2.508 324 HG SER 42 HG SER 42 -12.196 -8.129 -0.755 325 H GLN 43 HN GLN 43 -13.913 -6.092 -3.223 326 HA GLN 43 HA GLN 43 -15.852 -6.631 -5.293 327 HB2 GLN 43 HB2 GLN 43 -15.443 -4.271 -3.441 328 HB3 GLN 43 HB1 GLN 43 -16.877 -4.596 -4.409 329 HG2 GLN 43 HG2 GLN 43 -17.523 -6.374 -3.098 330 HG3 GLN 43 HG1 GLN 43 -15.904 -6.646 -2.485 331 HE21 GLN 43 HE21 GLN 43 -15.172 -5.538 -0.758 332 HE22 GLN 43 HE22 GLN 43 -16.192 -4.551 0.254 333 H ASN 44 HN ASN 44 -13.024 -4.698 -4.739 334 HA ASN 44 HA ASN 44 -13.197 -3.604 -7.487 335 HB2 ASN 44 HB2 ASN 44 -13.427 -1.789 -5.928 336 HB3 ASN 44 HB1 ASN 44 -12.019 -2.329 -5.013 337 HD21 ASN 44 HD21 ASN 44 -10.822 -0.515 -5.283 338 HD22 ASN 44 HD22 ASN 44 -10.216 0.008 -6.808 339 HA PRO 45 HA PRO 45 -9.332 -6.023 -7.486 340 HB2 PRO 45 HB2 PRO 45 -9.769 -7.347 -9.738 341 HB3 PRO 45 HB1 PRO 45 -10.632 -7.804 -8.256 342 HG2 PRO 45 HG2 PRO 45 -11.592 -6.149 -10.567 343 HG3 PRO 45 HG1 PRO 45 -12.421 -7.451 -9.708 344 HD2 PRO 45 HD2 PRO 45 -12.810 -4.773 -9.208 345 HD3 PRO 45 HD1 PRO 45 -13.125 -6.065 -8.033 346 H PHE 46 HN PHE 46 -9.908 -3.262 -8.370 347 HA PHE 46 HA PHE 46 -7.762 -3.056 -10.298 348 HB2 PHE 46 HB2 PHE 46 -9.927 -3.347 -11.599 349 HB3 PHE 46 HB1 PHE 46 -10.412 -1.770 -10.966 350 HD1 PHE 46 HD1 PHE 46 -9.155 0.260 -11.636 351 HD2 PHE 46 HD2 PHE 46 -8.368 -3.550 -13.360 352 HE1 PHE 46 HE1 PHE 46 -7.978 1.354 -13.504 353 HE2 PHE 46 HE2 PHE 46 -7.186 -2.465 -15.224 354 HZ PHE 46 HZ PHE 46 -6.991 -0.015 -15.298 355 H SER 47 HN SER 47 -10.405 -1.007 -9.002 356 HA SER 47 HA SER 47 -9.428 0.983 -7.645 357 HB2 SER 47 HB2 SER 47 -8.252 1.168 -10.389 358 HB3 SER 47 HB1 SER 47 -8.652 2.619 -9.499 359 HG SER 47 HG SER 47 -6.916 0.558 -8.605 360 H GLU 48 HN GLU 48 -11.566 1.589 -7.375 361 HA GLU 48 HA GLU 48 -13.226 1.673 -9.759 362 HB2 GLU 48 HB2 GLU 48 -13.922 0.515 -7.625 363 HB3 GLU 48 HB1 GLU 48 -14.105 2.111 -6.912 364 HG2 GLU 48 HG2 GLU 48 -15.825 2.689 -8.443 365 HG3 GLU 48 HG1 GLU 48 -15.543 1.234 -9.396 366 H ASP 49 HN ASP 49 -11.509 3.745 -7.754 367 HA ASP 49 HA ASP 49 -13.094 6.077 -8.595 368 HB2 ASP 49 HB2 ASP 49 -12.522 5.819 -6.163 369 HB3 ASP 49 HB1 ASP 49 -10.823 5.986 -6.591 370 H LYS 50 HN LYS 50 -10.840 4.283 -9.872 371 HA LYS 50 HA LYS 50 -9.279 4.517 -11.495 372 HB2 LYS 50 HB2 LYS 50 -10.594 7.136 -11.547 373 HB3 LYS 50 HB1 LYS 50 -8.927 7.163 -12.116 374 HG2 LYS 50 HG2 LYS 50 -11.137 5.402 -13.149 375 HG3 LYS 50 HG1 LYS 50 -10.427 6.801 -13.964 376 HD2 LYS 50 HD2 LYS 50 -8.282 5.714 -14.053 377 HD3 LYS 50 HD1 LYS 50 -8.905 4.353 -13.126 378 HE2 LYS 50 HE2 LYS 50 -10.446 3.805 -14.934 379 HE3 LYS 50 HE1 LYS 50 -9.874 5.195 -15.857 380 HZ1 LYS 50 HZ1 LYS 50 -7.706 4.210 -15.995 381 HZ2 LYS 50 HZ2 LYS 50 -8.858 3.100 -16.570 382 HZ3 LYS 50 HZ3 LYS 50 -8.187 2.902 -15.030 383 H THR 51 HN THR 51 -8.916 7.513 -9.694 384 HA THR 51 HA THR 51 -6.119 7.010 -9.154 385 HB THR 51 HB THR 51 -6.391 9.160 -7.771 386 HG1 THR 51 HG1 THR 51 -8.491 9.549 -7.468 387 HG21 THR 51 HG21 THR 51 -5.393 9.151 -9.976 388 HG22 THR 51 HG22 THR 51 -6.449 10.554 -9.818 389 HG23 THR 51 HG23 THR 51 -6.987 9.142 -10.724 390 H ASP 52 HN ASP 52 -8.424 5.402 -8.180 391 HA ASP 52 HA ASP 52 -9.039 5.275 -5.568 392 HB2 ASP 52 HB2 ASP 52 -9.337 3.591 -7.555 393 HB3 ASP 52 HB1 ASP 52 -7.901 2.840 -6.883 394 H LYS 53 HN LYS 53 -6.245 3.447 -6.736 395 HA LYS 53 HA LYS 53 -4.306 2.807 -5.744 396 HB2 LYS 53 HB2 LYS 53 -4.606 5.644 -4.806 397 HB3 LYS 53 HB1 LYS 53 -3.298 4.653 -4.174 398 HG2 LYS 53 HG2 LYS 53 -2.527 5.984 -6.043 399 HG3 LYS 53 HG1 LYS 53 -2.487 4.268 -6.448 400 HD2 LYS 53 HD2 LYS 53 -4.628 4.529 -7.645 401 HD3 LYS 53 HD1 LYS 53 -4.600 6.253 -7.283 402 HE2 LYS 53 HE2 LYS 53 -3.807 5.920 -9.527 403 HE3 LYS 53 HE1 LYS 53 -2.458 6.435 -8.514 404 HZ1 LYS 53 HZ1 LYS 53 -3.033 3.655 -9.399 405 HZ2 LYS 53 HZ2 LYS 53 -1.776 4.091 -8.352 406 HZ3 LYS 53 HZ3 LYS 53 -1.774 4.646 -9.955 407 H GLY 54 HN GLY 54 -6.682 1.984 -4.710 408 HA2 GLY 54 HA2 GLY 54 -7.153 2.213 -2.023 409 HA3 GLY 54 HA1 GLY 54 -7.574 0.814 -3.003 410 H ILE 55 HN ILE 55 -4.320 0.991 -3.225 411 HA ILE 55 HA ILE 55 -3.942 -0.908 -1.006 412 HB ILE 55 HB ILE 55 -2.567 -0.784 -3.698 413 HG12 ILE 55 HG12 ILE 55 -4.779 -1.695 -3.876 414 HG13 ILE 55 HG11 ILE 55 -3.626 -3.020 -3.997 415 HG21 ILE 55 HG21 ILE 55 -2.102 -2.664 -1.395 416 HG22 ILE 55 HG22 ILE 55 -0.968 -1.478 -2.044 417 HG23 ILE 55 HG23 ILE 55 -1.443 -2.870 -3.019 418 HD11 ILE 55 HD11 ILE 55 -5.216 -2.266 -1.538 419 HD12 ILE 55 HD12 ILE 55 -4.043 -3.595 -1.659 420 HD13 ILE 55 HD13 ILE 55 -5.524 -3.636 -2.619 421 H TYR 56 HN TYR 56 -2.491 -0.381 0.519 422 HA TYR 56 HA TYR 56 -0.166 1.215 -0.073 423 HB2 TYR 56 HB2 TYR 56 -0.645 3.087 1.329 424 HB3 TYR 56 HB1 TYR 56 -2.027 2.908 0.255 425 HD1 TYR 56 HD1 TYR 56 -3.579 0.809 1.545 426 HD2 TYR 56 HD2 TYR 56 -1.433 4.044 3.268 427 HE1 TYR 56 HE1 TYR 56 -5.089 0.762 3.492 428 HE2 TYR 56 HE2 TYR 56 -2.926 4.006 5.224 429 HH TYR 56 HH TYR 56 -5.182 3.251 5.807 430 H VAL 57 HN VAL 57 1.127 1.586 2.038 431 HA VAL 57 HA VAL 57 1.081 -0.798 3.642 432 HB VAL 57 HB VAL 57 2.807 1.621 3.398 433 HG11 VAL 57 HG11 VAL 57 2.644 1.214 5.758 434 HG12 VAL 57 HG12 VAL 57 4.237 0.723 5.178 435 HG13 VAL 57 HG13 VAL 57 3.006 -0.495 5.514 436 HG21 VAL 57 HG21 VAL 57 3.138 -0.156 1.814 437 HG22 VAL 57 HG22 VAL 57 3.344 -1.304 3.142 438 HG23 VAL 57 HG23 VAL 57 4.521 -0.009 2.898 439 H THR 58 HN THR 58 0.385 -0.897 5.691 440 HA THR 58 HA THR 58 -0.739 1.580 6.854 441 HB THR 58 HB THR 58 -2.525 0.002 6.226 442 HG1 THR 58 HG1 THR 58 -1.989 0.647 8.898 443 HG21 THR 58 HG21 THR 58 -1.184 -1.903 8.149 444 HG22 THR 58 HG22 THR 58 -1.254 -2.090 6.396 445 HG23 THR 58 HG23 THR 58 -2.736 -2.162 7.352 446 H ARG 59 HN ARG 59 1.582 -0.798 7.099 447 HA ARG 59 HA ARG 59 2.610 0.232 9.507 448 HB2 ARG 59 HB2 ARG 59 1.841 -1.091 11.128 449 HB3 ARG 59 HB1 ARG 59 0.713 -1.746 9.974 450 HG2 ARG 59 HG2 ARG 59 1.941 -3.635 9.594 451 HG3 ARG 59 HG1 ARG 59 3.444 -2.880 10.106 452 HD2 ARG 59 HD2 ARG 59 2.893 -4.412 11.806 453 HD3 ARG 59 HD1 ARG 59 2.495 -2.818 12.439 454 HE ARG 59 HE ARG 59 0.121 -3.464 11.681 455 HH11 ARG 59 HH11 ARG 59 2.538 -5.685 12.876 456 HH12 ARG 59 HH12 ARG 59 1.393 -6.781 13.581 457 HH21 ARG 59 HH21 ARG 59 -1.410 -4.882 12.623 458 HH22 ARG 59 HH22 ARG 59 -0.854 -6.320 13.424 459 H VAL 60 HN VAL 60 4.437 -1.112 10.281 460 HA VAL 60 HA VAL 60 5.756 -2.631 8.191 461 HB VAL 60 HB VAL 60 6.834 -0.086 9.427 462 HG11 VAL 60 HG11 VAL 60 8.535 -1.742 9.630 463 HG12 VAL 60 HG12 VAL 60 8.971 -0.649 8.311 464 HG13 VAL 60 HG13 VAL 60 8.310 -2.252 7.960 465 HG21 VAL 60 HG21 VAL 60 5.496 0.011 7.286 466 HG22 VAL 60 HG22 VAL 60 6.809 -0.896 6.529 467 HG23 VAL 60 HG23 VAL 60 7.119 0.702 7.219 468 H SER 61 HN SER 61 6.957 -4.288 9.104 469 HA SER 61 HA SER 61 7.234 -4.469 11.945 470 HB2 SER 61 HB2 SER 61 9.068 -6.222 11.100 471 HB3 SER 61 HB1 SER 61 7.342 -6.580 11.117 472 HG SER 61 HG SER 61 7.298 -6.541 8.992 473 H GLU 62 HN GLU 62 8.384 -2.986 12.899 474 HA GLU 62 HA GLU 62 10.125 -1.339 11.504 475 HB2 GLU 62 HB2 GLU 62 9.344 -1.541 14.368 476 HB3 GLU 62 HB1 GLU 62 10.452 -0.348 13.777 477 HG2 GLU 62 HG2 GLU 62 8.851 0.705 12.466 478 HG3 GLU 62 HG1 GLU 62 7.762 -0.672 12.567 479 H GLY 63 HN GLY 63 12.084 -1.031 11.626 480 HA2 GLY 63 HA2 GLY 63 14.330 -1.611 11.593 481 HA3 GLY 63 HA1 GLY 63 14.040 -2.497 13.094 482 H GLY 64 HN GLY 64 12.352 -3.039 10.033 483 HA2 GLY 64 HA2 GLY 64 13.384 -5.791 10.159 484 HA3 GLY 64 HA1 GLY 64 11.771 -5.345 9.630 485 HA PRO 65 HA PRO 65 13.767 -5.557 5.672 486 HB2 PRO 65 HB2 PRO 65 11.629 -6.381 4.374 487 HB3 PRO 65 HB1 PRO 65 12.479 -7.451 5.491 488 HG2 PRO 65 HG2 PRO 65 9.855 -6.125 5.777 489 HG3 PRO 65 HG1 PRO 65 10.461 -7.589 6.567 490 HD2 PRO 65 HD2 PRO 65 10.364 -4.915 7.623 491 HD3 PRO 65 HD1 PRO 65 10.983 -6.389 8.406 492 H ALA 66 HN ALA 66 10.682 -3.942 6.211 493 HA ALA 66 HA ALA 66 10.450 -3.221 3.426 494 HB1 ALA 66 HB1 ALA 66 8.827 -2.423 5.851 495 HB2 ALA 66 HB2 ALA 66 8.425 -3.670 4.668 496 HB3 ALA 66 HB3 ALA 66 8.439 -1.967 4.192 497 H GLU 67 HN GLU 67 11.416 -1.750 6.424 498 HA GLU 67 HA GLU 67 10.937 0.892 5.363 499 HB2 GLU 67 HB2 GLU 67 11.836 1.483 7.687 500 HB3 GLU 67 HB1 GLU 67 10.282 0.652 7.606 501 HG2 GLU 67 HG2 GLU 67 11.116 -1.283 8.448 502 HG3 GLU 67 HG1 GLU 67 12.712 -0.986 7.762 503 H ILE 68 HN ILE 68 13.388 -1.453 5.815 504 HA ILE 68 HA ILE 68 15.495 0.428 5.938 505 HB ILE 68 HB ILE 68 16.907 -1.539 5.806 506 HG12 ILE 68 HG12 ILE 68 15.279 -3.607 6.567 507 HG13 ILE 68 HG11 ILE 68 14.399 -2.845 5.250 508 HG21 ILE 68 HG21 ILE 68 14.848 -1.431 7.961 509 HG22 ILE 68 HG22 ILE 68 16.392 -0.582 7.926 510 HG23 ILE 68 HG23 ILE 68 16.355 -2.338 8.098 511 HD11 ILE 68 HD11 ILE 68 16.367 -3.085 3.812 512 HD12 ILE 68 HD12 ILE 68 15.803 -4.640 4.426 513 HD13 ILE 68 HD13 ILE 68 17.227 -3.874 5.133 514 H ALA 69 HN ALA 69 13.838 -1.607 3.823 515 HA ALA 69 HA ALA 69 15.500 -1.245 1.544 516 HB1 ALA 69 HB1 ALA 69 13.869 -3.072 1.674 517 HB2 ALA 69 HB2 ALA 69 13.572 -2.054 0.263 518 HB3 ALA 69 HB3 ALA 69 12.557 -1.891 1.695 519 H GLY 70 HN GLY 70 13.204 0.592 3.275 520 HA2 GLY 70 HA2 GLY 70 13.290 3.031 2.967 521 HA3 GLY 70 HA1 GLY 70 13.394 2.748 1.225 522 H LEU 71 HN LEU 71 11.255 1.460 3.736 523 HA LEU 71 HA LEU 71 8.920 2.463 2.257 524 HB2 LEU 71 HB2 LEU 71 9.426 0.023 1.952 525 HB3 LEU 71 HB1 LEU 71 9.292 -0.173 3.683 526 HG LEU 71 HG LEU 71 7.384 -0.951 2.255 527 HD11 LEU 71 HD11 LEU 71 5.837 -0.591 3.961 528 HD12 LEU 71 HD12 LEU 71 6.552 0.968 4.383 529 HD13 LEU 71 HD13 LEU 71 7.417 -0.528 4.739 530 HD21 LEU 71 HD21 LEU 71 5.672 0.792 1.744 531 HD22 LEU 71 HD22 LEU 71 7.124 0.875 0.742 532 HD23 LEU 71 HD23 LEU 71 6.904 2.009 2.066 533 H GLN 72 HN GLN 72 7.055 2.618 3.735 534 HA GLN 72 HA GLN 72 7.408 2.769 6.481 535 HB2 GLN 72 HB2 GLN 72 7.259 5.271 6.721 536 HB3 GLN 72 HB1 GLN 72 8.774 4.614 6.172 537 HG2 GLN 72 HG2 GLN 72 8.258 6.670 5.051 538 HG3 GLN 72 HG1 GLN 72 8.367 5.316 3.934 539 HE21 GLN 72 HE21 GLN 72 6.632 4.705 2.805 540 HE22 GLN 72 HE22 GLN 72 5.143 5.558 2.837 541 H ILE 73 HN ILE 73 5.523 4.401 7.322 542 HA ILE 73 HA ILE 73 3.275 2.873 6.471 543 HB ILE 73 HB ILE 73 3.342 5.042 8.559 544 HG12 ILE 73 HG12 ILE 73 5.079 3.627 9.251 545 HG13 ILE 73 HG11 ILE 73 3.671 2.989 10.098 546 HG21 ILE 73 HG21 ILE 73 1.148 4.303 7.914 547 HG22 ILE 73 HG22 ILE 73 1.528 3.728 9.535 548 HG23 ILE 73 HG23 ILE 73 1.616 2.627 8.164 549 HD11 ILE 73 HD11 ILE 73 4.952 1.175 9.203 550 HD12 ILE 73 HD12 ILE 73 4.930 1.900 7.587 551 HD13 ILE 73 HD13 ILE 73 3.434 1.294 8.306 552 H GLY 74 HN GLY 74 2.160 3.367 4.879 553 HA2 GLY 74 HA2 GLY 74 0.124 4.693 4.405 554 HA3 GLY 74 HA1 GLY 74 1.108 6.133 4.672 555 H ASP 75 HN ASP 75 1.959 3.169 2.946 556 HA ASP 75 HA ASP 75 2.693 4.985 0.714 557 HB2 ASP 75 HB2 ASP 75 4.429 3.576 2.277 558 HB3 ASP 75 HB1 ASP 75 4.180 2.465 0.922 559 H LYS 76 HN LYS 76 1.856 4.541 -1.255 560 HA LYS 76 HA LYS 76 -0.048 2.344 -1.291 561 HB2 LYS 76 HB2 LYS 76 0.342 4.477 -3.383 562 HB3 LYS 76 HB1 LYS 76 -1.059 3.438 -3.162 563 HG2 LYS 76 HG2 LYS 76 -1.910 4.704 -1.520 564 HG3 LYS 76 HG1 LYS 76 -0.323 5.112 -0.861 565 HD2 LYS 76 HD2 LYS 76 -0.041 6.509 -3.012 566 HD3 LYS 76 HD1 LYS 76 -1.800 6.367 -3.146 567 HE2 LYS 76 HE2 LYS 76 -1.056 8.423 -1.958 568 HE3 LYS 76 HE1 LYS 76 -2.105 7.383 -0.991 569 HZ1 LYS 76 HZ1 LYS 76 0.861 7.355 -0.827 570 HZ2 LYS 76 HZ2 LYS 76 -0.221 6.548 0.190 571 HZ3 LYS 76 HZ3 LYS 76 -0.135 8.238 0.224 572 H ILE 77 HN ILE 77 0.730 0.495 -1.894 573 HA ILE 77 HA ILE 77 2.911 0.195 -3.741 574 HB ILE 77 HB ILE 77 1.035 -1.901 -2.639 575 HG12 ILE 77 HG12 ILE 77 3.789 -1.181 -1.637 576 HG13 ILE 77 HG11 ILE 77 2.313 -0.518 -0.939 577 HG21 ILE 77 HG21 ILE 77 3.761 -2.151 -3.915 578 HG22 ILE 77 HG22 ILE 77 2.225 -2.678 -4.602 579 HG23 ILE 77 HG23 ILE 77 2.863 -3.467 -3.161 580 HD11 ILE 77 HD11 ILE 77 2.993 -3.441 -1.093 581 HD12 ILE 77 HD12 ILE 77 1.585 -2.722 -0.311 582 HD13 ILE 77 HD13 ILE 77 3.200 -2.414 0.327 583 H MET 78 HN MET 78 2.659 0.403 -5.903 584 HA MET 78 HA MET 78 0.002 -0.097 -7.030 585 HB2 MET 78 HB2 MET 78 2.398 1.232 -8.317 586 HB3 MET 78 HB1 MET 78 0.761 1.182 -8.951 587 HG2 MET 78 HG2 MET 78 1.493 2.526 -6.368 588 HG3 MET 78 HG1 MET 78 1.489 3.349 -7.924 589 HE1 MET 78 HE1 MET 78 -2.151 2.073 -5.440 590 HE2 MET 78 HE2 MET 78 -0.500 2.322 -4.870 591 HE3 MET 78 HE3 MET 78 -0.893 0.906 -5.844 592 H GLN 79 HN GLN 79 3.325 -1.098 -7.063 593 HA GLN 79 HA GLN 79 2.609 -3.353 -8.780 594 HB2 GLN 79 HB2 GLN 79 5.333 -2.120 -8.883 595 HB3 GLN 79 HB1 GLN 79 4.555 -3.170 -10.043 596 HG2 GLN 79 HG2 GLN 79 2.947 -0.952 -10.064 597 HG3 GLN 79 HG1 GLN 79 4.556 -0.306 -9.845 598 HE21 GLN 79 HE21 GLN 79 5.919 -2.405 -11.155 599 HE22 GLN 79 HE22 GLN 79 5.652 -2.216 -12.863 600 H VAL 80 HN VAL 80 3.597 -5.167 -8.480 601 HA VAL 80 HA VAL 80 5.434 -5.375 -6.192 602 HB VAL 80 HB VAL 80 3.152 -5.969 -5.516 603 HG11 VAL 80 HG11 VAL 80 3.369 -8.135 -7.605 604 HG12 VAL 80 HG12 VAL 80 2.289 -6.739 -7.643 605 HG13 VAL 80 HG13 VAL 80 2.076 -7.985 -6.412 606 HG21 VAL 80 HG21 VAL 80 3.745 -8.212 -4.579 607 HG22 VAL 80 HG22 VAL 80 5.026 -7.014 -4.393 608 HG23 VAL 80 HG23 VAL 80 5.151 -8.245 -5.657 609 H ASN 81 HN ASN 81 7.165 -6.671 -6.605 610 HA ASN 81 HA ASN 81 8.498 -8.260 -7.544 611 HB2 ASN 81 HB2 ASN 81 5.963 -9.248 -8.862 612 HB3 ASN 81 HB1 ASN 81 7.488 -10.116 -8.770 613 HD21 ASN 81 HD21 ASN 81 8.122 -9.420 -6.099 614 HD22 ASN 81 HD22 ASN 81 7.042 -10.308 -5.066 615 H GLY 82 HN GLY 82 7.009 -5.858 -9.099 616 HA2 GLY 82 HA2 GLY 82 8.479 -4.758 -10.777 617 HA3 GLY 82 HA1 GLY 82 8.495 -6.304 -11.615 618 H TRP 83 HN TRP 83 5.415 -6.181 -10.570 619 HA TRP 83 HA TRP 83 4.517 -4.696 -12.889 620 HB2 TRP 83 HB2 TRP 83 2.750 -6.634 -12.850 621 HB3 TRP 83 HB1 TRP 83 4.265 -6.794 -13.725 622 HD1 TRP 83 HD1 TRP 83 2.769 -7.615 -10.295 623 HE1 TRP 83 HE1 TRP 83 3.824 -9.792 -9.483 624 HE3 TRP 83 HE3 TRP 83 5.961 -8.553 -14.175 625 HZ2 TRP 83 HZ2 TRP 83 5.656 -11.702 -10.326 626 HZ3 TRP 83 HZ3 TRP 83 7.317 -10.611 -14.093 627 HH2 TRP 83 HH2 TRP 83 7.147 -12.140 -12.191 628 H ASP 84 HN ASP 84 2.935 -3.396 -12.531 629 HA ASP 84 HA ASP 84 1.489 -2.634 -10.460 630 HB2 ASP 84 HB2 ASP 84 1.192 -1.894 -12.827 631 HB3 ASP 84 HB1 ASP 84 0.202 -3.322 -13.109 632 H MET 85 HN MET 85 0.334 -3.535 -8.918 633 HA MET 85 HA MET 85 -0.685 -6.263 -9.280 634 HB2 MET 85 HB2 MET 85 -0.728 -6.298 -6.787 635 HB3 MET 85 HB1 MET 85 0.869 -6.140 -7.503 636 HG2 MET 85 HG2 MET 85 1.239 -4.283 -6.373 637 HG3 MET 85 HG1 MET 85 -0.221 -3.543 -7.020 638 HE1 MET 85 HE1 MET 85 1.241 -5.747 -4.003 639 HE2 MET 85 HE2 MET 85 0.144 -6.772 -4.930 640 HE3 MET 85 HE3 MET 85 -0.296 -6.254 -3.292 641 H THR 86 HN THR 86 -2.013 -3.381 -9.731 642 HA THR 86 HA THR 86 -4.139 -3.477 -7.769 643 HB THR 86 HB THR 86 -5.011 -1.453 -8.805 644 HG1 THR 86 HG1 THR 86 -2.904 -1.780 -10.717 645 HG21 THR 86 HG21 THR 86 -2.013 -1.321 -8.520 646 HG22 THR 86 HG22 THR 86 -3.169 -1.248 -7.191 647 HG23 THR 86 HG23 THR 86 -3.134 0.038 -8.399 648 H MET 87 HN MET 87 -3.664 -4.516 -11.024 649 HA MET 87 HA MET 87 -6.448 -4.633 -11.704 650 HB2 MET 87 HB2 MET 87 -4.012 -5.797 -13.045 651 HB3 MET 87 HB1 MET 87 -5.643 -5.955 -13.681 652 HG2 MET 87 HG2 MET 87 -5.805 -3.498 -13.778 653 HG3 MET 87 HG1 MET 87 -4.127 -3.391 -13.252 654 HE1 MET 87 HE1 MET 87 -5.388 -2.084 -15.946 655 HE2 MET 87 HE2 MET 87 -4.057 -2.378 -17.067 656 HE3 MET 87 HE3 MET 87 -3.723 -1.848 -15.417 657 H VAL 88 HN VAL 88 -4.554 -6.491 -9.729 658 HA VAL 88 HA VAL 88 -6.181 -8.897 -10.162 659 HB VAL 88 HB VAL 88 -4.122 -9.191 -8.144 660 HG11 VAL 88 HG11 VAL 88 -4.640 -10.528 -10.789 661 HG12 VAL 88 HG12 VAL 88 -5.225 -11.049 -9.203 662 HG13 VAL 88 HG13 VAL 88 -3.500 -11.096 -9.568 663 HG21 VAL 88 HG21 VAL 88 -2.939 -7.470 -9.408 664 HG22 VAL 88 HG22 VAL 88 -3.171 -8.391 -10.894 665 HG23 VAL 88 HG23 VAL 88 -2.160 -9.039 -9.603 666 H THR 89 HN THR 89 -6.346 -10.084 -7.748 667 HA THR 89 HA THR 89 -7.747 -8.083 -6.143 668 HB THR 89 HB THR 89 -7.871 -11.018 -6.498 669 HG1 THR 89 HG1 THR 89 -9.638 -8.858 -6.392 670 HG21 THR 89 HG21 THR 89 -9.116 -11.373 -4.422 671 HG22 THR 89 HG22 THR 89 -8.648 -9.752 -3.893 672 HG23 THR 89 HG23 THR 89 -7.417 -10.986 -4.169 673 H HIS 90 HN HIS 90 -7.314 -8.216 -3.741 674 HA HIS 90 HA HIS 90 -4.580 -7.671 -3.357 675 HB2 HIS 90 HB2 HIS 90 -6.507 -6.772 -1.976 676 HB3 HIS 90 HB1 HIS 90 -6.558 -8.333 -1.166 677 HD1 HIS 90 HD1 HIS 90 -5.268 -5.069 -0.713 678 HD2 HIS 90 HD2 HIS 90 -3.804 -8.884 0.040 679 HE1 HIS 90 HE1 HIS 90 -3.478 -4.775 1.026 680 HE2 HIS 90 HE2 HIS 90 -2.746 -7.115 1.591 681 H ASP 91 HN ASP 91 -6.493 -10.515 -2.685 682 HA ASP 91 HA ASP 91 -4.476 -12.005 -1.393 683 HB2 ASP 91 HB2 ASP 91 -6.841 -12.655 -1.266 684 HB3 ASP 91 HB1 ASP 91 -6.855 -12.951 -3.009 685 H GLN 92 HN GLN 92 -5.554 -11.779 -4.746 686 HA GLN 92 HA GLN 92 -3.824 -13.609 -5.913 687 HB2 GLN 92 HB2 GLN 92 -4.465 -11.054 -7.282 688 HB3 GLN 92 HB1 GLN 92 -4.374 -12.679 -7.944 689 HG2 GLN 92 HG2 GLN 92 -6.536 -11.553 -6.219 690 HG3 GLN 92 HG1 GLN 92 -6.644 -11.966 -7.928 691 HE21 GLN 92 HE21 GLN 92 -6.500 -14.083 -8.507 692 HE22 GLN 92 HE22 GLN 92 -6.909 -15.336 -7.400 693 H ALA 93 HN ALA 93 -3.484 -10.135 -5.455 694 HA ALA 93 HA ALA 93 -0.902 -9.972 -6.619 695 HB1 ALA 93 HB1 ALA 93 -2.092 -8.004 -4.687 696 HB2 ALA 93 HB2 ALA 93 -2.640 -8.137 -6.358 697 HB3 ALA 93 HB3 ALA 93 -0.968 -7.706 -6.016 698 H ARG 94 HN ARG 94 -2.144 -10.774 -3.504 699 HA ARG 94 HA ARG 94 0.383 -10.411 -2.222 700 HB2 ARG 94 HB2 ARG 94 -0.711 -10.628 -0.263 701 HB3 ARG 94 HB1 ARG 94 -2.147 -10.418 -1.255 702 HG2 ARG 94 HG2 ARG 94 -2.397 -12.857 -1.369 703 HG3 ARG 94 HG1 ARG 94 -0.979 -13.021 -0.313 704 HD2 ARG 94 HD2 ARG 94 -2.073 -12.039 1.506 705 HD3 ARG 94 HD1 ARG 94 -3.348 -11.355 0.491 706 HE ARG 94 HE ARG 94 -3.735 -13.984 0.133 707 HH11 ARG 94 HH11 ARG 94 -3.275 -12.089 3.049 708 HH12 ARG 94 HH12 ARG 94 -4.235 -13.141 4.041 709 HH21 ARG 94 HH21 ARG 94 -5.007 -15.370 1.451 710 HH22 ARG 94 HH22 ARG 94 -5.223 -14.998 3.136 711 H LYS 95 HN LYS 95 -1.476 -13.092 -3.582 712 HA LYS 95 HA LYS 95 0.332 -15.146 -2.999 713 HB2 LYS 95 HB2 LYS 95 -1.416 -14.818 -5.448 714 HB3 LYS 95 HB1 LYS 95 -0.628 -16.308 -4.949 715 HG2 LYS 95 HG2 LYS 95 -1.930 -15.997 -2.744 716 HG3 LYS 95 HG1 LYS 95 -2.925 -14.879 -3.686 717 HD2 LYS 95 HD2 LYS 95 -3.893 -16.524 -4.870 718 HD3 LYS 95 HD1 LYS 95 -2.402 -17.472 -4.963 719 HE2 LYS 95 HE2 LYS 95 -4.135 -18.598 -3.641 720 HE3 LYS 95 HE1 LYS 95 -2.689 -18.229 -2.707 721 HZ1 LYS 95 HZ1 LYS 95 -5.040 -16.432 -2.668 722 HZ2 LYS 95 HZ2 LYS 95 -3.767 -16.535 -1.559 723 HZ3 LYS 95 HZ3 LYS 95 -4.926 -17.767 -1.637 724 H ARG 96 HN ARG 96 0.597 -12.462 -5.154 725 HA ARG 96 HA ARG 96 2.636 -13.612 -6.824 726 HB2 ARG 96 HB2 ARG 96 2.133 -10.673 -6.301 727 HB3 ARG 96 HB1 ARG 96 2.969 -11.375 -7.680 728 HG2 ARG 96 HG2 ARG 96 0.041 -11.729 -7.057 729 HG3 ARG 96 HG1 ARG 96 0.707 -10.585 -8.224 730 HD2 ARG 96 HD2 ARG 96 1.306 -13.515 -8.416 731 HD3 ARG 96 HD1 ARG 96 -0.193 -12.843 -9.065 732 HE ARG 96 HE ARG 96 1.357 -11.324 -10.384 733 HH11 ARG 96 HH11 ARG 96 2.322 -14.510 -9.326 734 HH12 ARG 96 HH12 ARG 96 3.306 -14.824 -10.727 735 HH21 ARG 96 HH21 ARG 96 2.611 -11.728 -12.251 736 HH22 ARG 96 HH22 ARG 96 3.452 -13.250 -12.408 737 H LEU 97 HN LEU 97 2.544 -11.377 -4.092 738 HA LEU 97 HA LEU 97 5.398 -11.168 -3.983 739 HB2 LEU 97 HB2 LEU 97 4.880 -9.805 -1.912 740 HB3 LEU 97 HB1 LEU 97 4.329 -9.195 -3.460 741 HG LEU 97 HG LEU 97 2.086 -10.388 -2.786 742 HD11 LEU 97 HD11 LEU 97 3.100 -11.469 -0.837 743 HD12 LEU 97 HD12 LEU 97 1.706 -10.461 -0.432 744 HD13 LEU 97 HD13 LEU 97 3.343 -9.879 -0.116 745 HD21 LEU 97 HD21 LEU 97 2.967 -7.844 -1.443 746 HD22 LEU 97 HD22 LEU 97 1.311 -8.347 -1.785 747 HD23 LEU 97 HD23 LEU 97 2.407 -7.977 -3.112 748 H THR 98 HN THR 98 3.065 -13.147 -2.323 749 HA THR 98 HA THR 98 5.222 -14.041 -0.538 750 HB THR 98 HB THR 98 3.433 -15.221 0.771 751 HG1 THR 98 HG1 THR 98 1.745 -13.689 -0.937 752 HG21 THR 98 HG21 THR 98 4.350 -13.127 1.557 753 HG22 THR 98 HG22 THR 98 2.623 -13.198 1.901 754 HG23 THR 98 HG23 THR 98 3.214 -12.228 0.554 755 H LYS 99 HN LYS 99 5.358 -14.868 -3.190 756 HA LYS 99 HA LYS 99 4.278 -17.536 -3.234 757 HB2 LYS 99 HB2 LYS 99 5.436 -17.698 -5.418 758 HB3 LYS 99 HB1 LYS 99 4.329 -16.336 -5.327 759 HG2 LYS 99 HG2 LYS 99 6.304 -14.879 -4.827 760 HG3 LYS 99 HG1 LYS 99 7.332 -16.271 -5.174 761 HD2 LYS 99 HD2 LYS 99 6.423 -16.420 -7.415 762 HD3 LYS 99 HD1 LYS 99 5.313 -15.093 -7.069 763 HE2 LYS 99 HE2 LYS 99 8.301 -14.817 -6.915 764 HE3 LYS 99 HE1 LYS 99 7.384 -14.497 -8.390 765 HZ1 LYS 99 HZ1 LYS 99 6.190 -12.764 -7.282 766 HZ2 LYS 99 HZ2 LYS 99 7.842 -12.495 -7.019 767 HZ3 LYS 99 HZ3 LYS 99 6.883 -13.145 -5.787 768 H ARG 100 HN ARG 100 6.487 -18.811 -4.476 769 HA ARG 100 HA ARG 100 8.202 -19.099 -2.084 770 HB2 ARG 100 HB2 ARG 100 7.334 -21.221 -4.055 771 HB3 ARG 100 HB1 ARG 100 8.343 -21.486 -2.640 772 HG2 ARG 100 HG2 ARG 100 5.497 -20.497 -2.539 773 HG3 ARG 100 HG1 ARG 100 5.979 -22.183 -2.349 774 HD2 ARG 100 HD2 ARG 100 7.203 -21.687 -0.360 775 HD3 ARG 100 HD1 ARG 100 7.008 -19.952 -0.606 776 HE ARG 100 HE ARG 100 4.637 -20.240 -0.130 777 HH11 ARG 100 HH11 ARG 100 6.695 -22.955 0.700 778 HH12 ARG 100 HH12 ARG 100 5.651 -23.522 1.959 779 HH21 ARG 100 HH21 ARG 100 3.275 -20.972 1.523 780 HH22 ARG 100 HH22 ARG 100 3.697 -22.394 2.432 781 H SER 101 HN SER 101 8.507 -17.496 -4.613 782 HA SER 101 HA SER 101 10.783 -18.912 -5.820 783 HB2 SER 101 HB2 SER 101 8.927 -16.900 -7.092 784 HB3 SER 101 HB1 SER 101 10.230 -17.767 -7.894 785 HG SER 101 HG SER 101 8.363 -19.311 -6.535 786 H GLU 102 HN GLU 102 10.082 -16.152 -3.938 787 HA GLU 102 HA GLU 102 12.582 -14.962 -4.828 788 HB2 GLU 102 HB2 GLU 102 11.670 -12.749 -4.560 789 HB3 GLU 102 HB1 GLU 102 10.737 -13.663 -5.736 790 HG2 GLU 102 HG2 GLU 102 9.212 -14.195 -3.704 791 HG3 GLU 102 HG1 GLU 102 9.993 -12.778 -2.994 792 H GLU 103 HN GLU 103 12.955 -13.068 -3.207 793 HA GLU 103 HA GLU 103 12.875 -14.141 -0.486 794 HB2 GLU 103 HB2 GLU 103 15.175 -13.485 -0.154 795 HB3 GLU 103 HB1 GLU 103 15.115 -14.497 -1.589 796 HG2 GLU 103 HG2 GLU 103 15.126 -12.503 -3.002 797 HG3 GLU 103 HG1 GLU 103 15.191 -11.485 -1.567 798 H VAL 104 HN VAL 104 11.727 -12.061 -2.430 799 HA VAL 104 HA VAL 104 11.892 -9.731 -0.766 800 HB VAL 104 HB VAL 104 14.151 -9.971 -1.631 801 HG11 VAL 104 HG11 VAL 104 12.889 -9.626 -4.345 802 HG12 VAL 104 HG12 VAL 104 13.663 -11.089 -3.731 803 HG13 VAL 104 HG13 VAL 104 14.620 -9.633 -4.012 804 HG21 VAL 104 HG21 VAL 104 13.242 -7.735 -1.195 805 HG22 VAL 104 HG22 VAL 104 12.697 -7.645 -2.869 806 HG23 VAL 104 HG23 VAL 104 14.420 -7.724 -2.505 807 H VAL 105 HN VAL 105 10.476 -8.156 -1.355 808 HA VAL 105 HA VAL 105 8.867 -8.800 -3.736 809 HB VAL 105 HB VAL 105 7.047 -7.496 -2.739 810 HG11 VAL 105 HG11 VAL 105 8.171 -9.620 -0.923 811 HG12 VAL 105 HG12 VAL 105 7.128 -9.873 -2.322 812 HG13 VAL 105 HG13 VAL 105 6.507 -9.038 -0.899 813 HG21 VAL 105 HG21 VAL 105 8.811 -7.225 -0.309 814 HG22 VAL 105 HG22 VAL 105 7.131 -6.707 -0.443 815 HG23 VAL 105 HG23 VAL 105 8.377 -5.916 -1.409 816 H ARG 106 HN ARG 106 8.976 -7.521 -5.414 817 HA ARG 106 HA ARG 106 10.484 -5.058 -5.294 818 HB2 ARG 106 HB2 ARG 106 9.257 -6.704 -7.475 819 HB3 ARG 106 HB1 ARG 106 9.722 -5.033 -7.770 820 HG2 ARG 106 HG2 ARG 106 11.460 -6.567 -8.441 821 HG3 ARG 106 HG1 ARG 106 11.959 -5.512 -7.130 822 HD2 ARG 106 HD2 ARG 106 11.504 -7.368 -5.543 823 HD3 ARG 106 HD1 ARG 106 11.164 -8.406 -6.926 824 HE ARG 106 HE ARG 106 13.794 -7.121 -6.513 825 HH11 ARG 106 HH11 ARG 106 11.838 -9.957 -7.225 826 HH12 ARG 106 HH12 ARG 106 13.204 -10.961 -7.573 827 HH21 ARG 106 HH21 ARG 106 15.580 -8.451 -6.952 828 HH22 ARG 106 HH22 ARG 106 15.335 -10.104 -7.416 829 H LEU 107 HN LEU 107 9.528 -3.229 -4.799 830 HA LEU 107 HA LEU 107 6.662 -3.038 -5.366 831 HB2 LEU 107 HB2 LEU 107 8.263 -2.294 -3.028 832 HB3 LEU 107 HB1 LEU 107 7.005 -1.164 -3.497 833 HG LEU 107 HG LEU 107 5.301 -2.807 -3.213 834 HD11 LEU 107 HD11 LEU 107 5.798 -5.108 -2.534 835 HD12 LEU 107 HD12 LEU 107 7.525 -4.777 -2.701 836 HD13 LEU 107 HD13 LEU 107 6.482 -4.746 -4.123 837 HD21 LEU 107 HD21 LEU 107 7.265 -3.105 -0.974 838 HD22 LEU 107 HD22 LEU 107 5.501 -3.237 -0.887 839 HD23 LEU 107 HD23 LEU 107 6.255 -1.679 -1.242 840 H LEU 108 HN LEU 108 5.866 -1.429 -6.355 841 HA LEU 108 HA LEU 108 7.508 0.989 -6.709 842 HB2 LEU 108 HB2 LEU 108 5.972 -0.493 -8.703 843 HB3 LEU 108 HB1 LEU 108 5.506 1.197 -8.584 844 HG LEU 108 HG LEU 108 7.780 1.899 -9.020 845 HD11 LEU 108 HD11 LEU 108 9.473 0.199 -9.661 846 HD12 LEU 108 HD12 LEU 108 8.376 -1.051 -9.071 847 HD13 LEU 108 HD13 LEU 108 9.013 0.165 -7.955 848 HD21 LEU 108 HD21 LEU 108 6.254 1.478 -10.903 849 HD22 LEU 108 HD22 LEU 108 6.876 -0.168 -11.019 850 HD23 LEU 108 HD23 LEU 108 7.945 1.206 -11.326 851 H VAL 109 HN VAL 109 6.789 2.401 -5.378 852 HA VAL 109 HA VAL 109 4.054 2.157 -4.466 853 HB VAL 109 HB VAL 109 5.936 1.185 -3.043 854 HG11 VAL 109 HG11 VAL 109 6.393 4.089 -2.469 855 HG12 VAL 109 HG12 VAL 109 7.537 2.965 -3.201 856 HG13 VAL 109 HG13 VAL 109 7.047 2.756 -1.520 857 HG21 VAL 109 HG21 VAL 109 4.044 3.139 -1.820 858 HG22 VAL 109 HG22 VAL 109 4.859 1.822 -0.977 859 HG23 VAL 109 HG23 VAL 109 3.690 1.466 -2.248 860 H THR 110 HN THR 110 3.522 4.050 -3.160 861 HA THR 110 HA THR 110 4.504 6.524 -4.351 862 HB THR 110 HB THR 110 2.013 7.192 -4.662 863 HG1 THR 110 HG1 THR 110 1.900 4.369 -4.511 864 HG21 THR 110 HG21 THR 110 2.057 6.422 -6.951 865 HG22 THR 110 HG22 THR 110 3.300 5.241 -6.549 866 HG23 THR 110 HG23 THR 110 3.663 6.967 -6.460 867 H ARG 111 HN ARG 111 5.087 7.634 -2.632 868 HA ARG 111 HA ARG 111 3.030 7.939 -0.546 869 HB2 ARG 111 HB2 ARG 111 4.758 8.466 1.069 870 HB3 ARG 111 HB1 ARG 111 5.105 6.915 0.323 871 HG2 ARG 111 HG2 ARG 111 6.785 7.947 -1.087 872 HG3 ARG 111 HG1 ARG 111 6.418 9.529 -0.389 873 HD2 ARG 111 HD2 ARG 111 6.934 8.400 1.861 874 HD3 ARG 111 HD1 ARG 111 7.697 7.142 0.897 875 HE ARG 111 HE ARG 111 8.603 9.761 0.207 876 HH11 ARG 111 HH11 ARG 111 9.087 7.054 2.370 877 HH12 ARG 111 HH12 ARG 111 10.708 7.517 2.797 878 HH21 ARG 111 HH21 ARG 111 10.717 10.386 0.775 879 HH22 ARG 111 HH22 ARG 111 11.634 9.422 1.883 880 H GLN 112 HN GLN 112 2.903 10.122 0.415 881 HA GLN 112 HA GLN 112 3.172 12.086 -1.684 882 HB2 GLN 112 HB2 GLN 112 1.833 12.291 0.978 883 HB3 GLN 112 HB1 GLN 112 1.688 13.416 -0.341 884 HG2 GLN 112 HG2 GLN 112 0.709 10.572 -0.264 885 HG3 GLN 112 HG1 GLN 112 -0.278 12.024 -0.192 886 HE21 GLN 112 HE21 GLN 112 1.745 10.044 -2.201 887 HE22 GLN 112 HE22 GLN 112 1.175 10.654 -3.712 888 H SER 113 HN SER 113 4.520 11.127 1.038 889 HA SER 113 HA SER 113 6.496 11.650 2.091 890 HB2 SER 113 HB2 SER 113 6.808 13.237 -0.010 891 HB3 SER 113 HB1 SER 113 6.446 14.468 1.196 892 HG SER 113 HG SER 113 8.176 13.334 2.473 893 H LEU 114 HN LEU 114 3.607 12.879 2.235 894 HA LEU 114 HA LEU 114 4.026 14.499 4.628 895 HB2 LEU 114 HB2 LEU 114 1.838 14.244 2.649 896 HB3 LEU 114 HB1 LEU 114 1.489 14.855 4.253 897 HG LEU 114 HG LEU 114 1.837 16.772 2.905 898 HD11 LEU 114 HD11 LEU 114 4.340 16.098 4.438 899 HD12 LEU 114 HD12 LEU 114 2.932 16.996 5.014 900 HD13 LEU 114 HD13 LEU 114 3.984 17.702 3.786 901 HD21 LEU 114 HD21 LEU 114 3.883 17.056 1.523 902 HD22 LEU 114 HD22 LEU 114 2.832 15.752 0.964 903 HD23 LEU 114 HD23 LEU 114 4.300 15.373 1.864 904 H GLN 115 HN GLN 115 4.613 12.227 5.167 905 HA GLN 115 HA GLN 115 2.641 10.306 5.801 906 HB2 GLN 115 HB2 GLN 115 4.500 9.290 7.163 907 HB3 GLN 115 HB1 GLN 115 4.867 9.540 5.468 908 HG2 GLN 115 HG2 GLN 115 6.150 11.504 5.993 909 HG3 GLN 115 HG1 GLN 115 5.691 11.389 7.690 910 HE21 GLN 115 HE21 GLN 115 6.490 8.578 5.772 911 HE22 GLN 115 HE22 GLN 115 7.997 8.238 6.560 912 H LYS 116 HN LYS 116 1.641 9.832 7.690 913 HA LYS 116 HA LYS 116 1.952 11.756 9.896 914 HB2 LYS 116 HB2 LYS 116 -0.511 10.282 8.940 915 HB3 LYS 116 HB1 LYS 116 -0.436 11.193 10.442 916 HG2 LYS 116 HG2 LYS 116 0.393 12.651 8.026 917 HG3 LYS 116 HG1 LYS 116 -1.312 12.201 8.112 918 HD2 LYS 116 HD2 LYS 116 0.164 13.646 10.314 919 HD3 LYS 116 HD1 LYS 116 -0.779 14.456 9.063 920 HE2 LYS 116 HE2 LYS 116 -1.841 12.426 11.027 921 HE3 LYS 116 HE1 LYS 116 -2.070 14.170 11.127 922 HZ1 LYS 116 HZ1 LYS 116 -3.018 12.468 8.878 923 HZ2 LYS 116 HZ2 LYS 116 -3.311 14.123 9.079 924 HZ3 LYS 116 HZ3 LYS 116 -3.989 13.002 10.159 925 H ALA 117 HN ALA 117 3.085 10.804 11.472 926 HA ALA 117 HA ALA 117 2.474 7.987 12.085 927 HB1 ALA 117 HB1 ALA 117 5.103 9.436 12.432 928 HB2 ALA 117 HB2 ALA 117 4.756 8.195 11.228 929 HB3 ALA 117 HB3 ALA 117 4.783 7.777 12.942 930 H VAL 118 HN VAL 118 1.476 10.614 12.830 931 HA VAL 118 HA VAL 118 1.790 10.489 15.739 932 HB VAL 118 HB VAL 118 1.433 13.042 14.166 933 HG11 VAL 118 HG11 VAL 118 0.632 13.045 16.464 934 HG12 VAL 118 HG12 VAL 118 2.010 14.125 16.240 935 HG13 VAL 118 HG13 VAL 118 2.232 12.556 17.018 936 HG21 VAL 118 HG21 VAL 118 3.801 13.534 14.649 937 HG22 VAL 118 HG22 VAL 118 3.609 12.140 13.585 938 HG23 VAL 118 HG23 VAL 118 3.992 11.902 15.290 939 H GLN 119 HN GLN 119 -0.106 9.264 15.794 940 HA GLN 119 HA GLN 119 -2.547 10.640 14.892 941 HB2 GLN 119 HB2 GLN 119 -1.938 7.680 14.885 942 HB3 GLN 119 HB1 GLN 119 -3.513 8.371 14.528 943 HG2 GLN 119 HG2 GLN 119 -1.020 8.983 12.960 944 HG3 GLN 119 HG1 GLN 119 -2.173 7.720 12.536 945 HE21 GLN 119 HE21 GLN 119 -4.216 8.282 11.829 946 HE22 GLN 119 HE22 GLN 119 -4.570 9.870 11.218 947 H GLN 120 HN GLN 120 -4.515 9.975 16.040 948 HA GLN 120 HA GLN 120 -4.319 8.543 18.504 949 HB2 GLN 120 HB2 GLN 120 -5.082 10.361 19.968 950 HB3 GLN 120 HB1 GLN 120 -3.506 10.721 19.280 951 HG2 GLN 120 HG2 GLN 120 -4.433 12.285 17.756 952 HG3 GLN 120 HG1 GLN 120 -6.078 11.797 18.157 953 HE21 GLN 120 HE21 GLN 120 -3.599 12.164 20.580 954 HE22 GLN 120 HE22 GLN 120 -4.258 13.582 21.320 955 H SER 121 HN SER 121 -6.565 8.758 19.647 956 HA SER 121 HA SER 121 -8.814 8.479 19.598 957 HB2 SER 121 HB2 SER 121 -8.935 10.656 18.447 958 HB3 SER 121 HB1 SER 121 -8.704 9.848 16.897 959 HG SER 121 HG SER 121 -10.970 10.302 18.139 960 H MET 122 HN MET 122 -10.313 6.964 18.881 961 HA MET 122 HA MET 122 -9.595 5.287 16.591 962 HB2 MET 122 HB2 MET 122 -10.109 4.182 19.366 963 HB3 MET 122 HB1 MET 122 -9.922 3.221 17.905 964 HG2 MET 122 HG2 MET 122 -7.638 3.972 17.665 965 HG3 MET 122 HG1 MET 122 -7.810 5.013 19.075 966 HE1 MET 122 HE1 MET 122 -5.416 2.346 20.531 967 HE2 MET 122 HE2 MET 122 -5.719 4.059 20.241 968 HE3 MET 122 HE3 MET 122 -5.379 2.979 18.889 969 H LEU 123 HN LEU 123 -11.355 5.340 15.365 970 HA LEU 123 HA LEU 123 -13.987 5.347 16.713 971 HB2 LEU 123 HB2 LEU 123 -13.240 6.668 14.098 972 HB3 LEU 123 HB1 LEU 123 -14.841 6.645 14.809 973 HG LEU 123 HG LEU 123 -12.420 7.981 16.018 974 HD11 LEU 123 HD11 LEU 123 -13.162 9.113 13.999 975 HD12 LEU 123 HD12 LEU 123 -13.533 10.075 15.430 976 HD13 LEU 123 HD13 LEU 123 -14.812 9.170 14.618 977 HD21 LEU 123 HD21 LEU 123 -13.999 8.937 17.611 978 HD22 LEU 123 HD22 LEU 123 -14.018 7.177 17.693 979 HD23 LEU 123 HD23 LEU 123 -15.317 8.032 16.866 980 H SER 124 HN SER 124 -15.533 3.965 15.997 981 HA SER 124 HA SER 124 -15.060 2.502 13.499 982 HB2 SER 124 HB2 SER 124 -15.900 1.195 16.104 983 HB3 SER 124 HB1 SER 124 -15.671 0.383 14.554 984 HG SER 124 HG SER 124 -13.449 1.619 14.908 985 H1 LYS 161 HN LYS 161 -18.651 -7.605 1.443 986 HA LYS 161 HA LYS 161 -16.332 -8.178 3.143 987 HB2 LYS 161 HB2 LYS 161 -16.446 -9.088 0.777 988 HB3 LYS 161 HB1 LYS 161 -16.306 -7.425 0.206 989 HG2 LYS 161 HG2 LYS 161 -14.149 -8.473 0.155 990 HG3 LYS 161 HG1 LYS 161 -14.168 -7.217 1.394 991 HD2 LYS 161 HD2 LYS 161 -14.726 -9.084 3.042 992 HD3 LYS 161 HD1 LYS 161 -14.268 -10.201 1.757 993 HE2 LYS 161 HE2 LYS 161 -12.385 -9.838 3.229 994 HE3 LYS 161 HE1 LYS 161 -12.051 -9.127 1.650 995 HZ1 LYS 161 HZ1 LYS 161 -13.057 -7.596 3.986 996 HZ2 LYS 161 HZ2 LYS 161 -12.530 -6.958 2.499 997 HZ3 LYS 161 HZ3 LYS 161 -11.426 -7.697 3.549 998 H GLU 162 HN GLU 162 -15.097 -6.554 3.978 999 HA GLU 162 HA GLU 162 -15.034 -3.988 2.681 1000 HB2 GLU 162 HB2 GLU 162 -15.661 -2.792 4.836 1001 HB3 GLU 162 HB1 GLU 162 -16.957 -3.505 3.889 1002 HG2 GLU 162 HG2 GLU 162 -16.789 -5.509 5.424 1003 HG3 GLU 162 HG1 GLU 162 -15.756 -4.516 6.451 1004 H ASN 163 HN ASN 163 -12.988 -3.908 2.481 1005 HA ASN 163 HA ASN 163 -10.823 -3.419 2.942 1006 HB2 ASN 163 HB2 ASN 163 -11.751 -1.834 4.583 1007 HB3 ASN 163 HB1 ASN 163 -11.740 -3.103 5.800 1008 HD21 ASN 163 HD21 ASN 163 -10.367 -2.048 7.155 1009 HD22 ASN 163 HD22 ASN 163 -8.685 -1.784 6.795 1010 H LEU 164 HN LEU 164 -8.983 -4.595 3.245 1011 HA LEU 164 HA LEU 164 -8.813 -6.541 5.362 1012 HB2 LEU 164 HB2 LEU 164 -8.457 -8.484 4.054 1013 HB3 LEU 164 HB1 LEU 164 -9.936 -7.759 3.463 1014 HG LEU 164 HG LEU 164 -8.143 -6.661 1.758 1015 HD11 LEU 164 HD11 LEU 164 -6.268 -7.899 2.685 1016 HD12 LEU 164 HD12 LEU 164 -6.602 -8.415 1.032 1017 HD13 LEU 164 HD13 LEU 164 -7.110 -9.421 2.388 1018 HD21 LEU 164 HD21 LEU 164 -10.230 -7.755 1.135 1019 HD22 LEU 164 HD22 LEU 164 -9.520 -9.332 1.471 1020 HD23 LEU 164 HD23 LEU 164 -8.901 -8.354 0.141 1021 H GLU 165 HN GLU 165 -6.644 -7.216 5.735 1022 HA GLU 165 HA GLU 165 -4.674 -5.515 4.364 1023 HB2 GLU 165 HB2 GLU 165 -3.568 -5.092 6.366 1024 HB3 GLU 165 HB1 GLU 165 -5.251 -5.070 6.863 1025 HG2 GLU 165 HG2 GLU 165 -3.437 -7.449 7.138 1026 HG3 GLU 165 HG1 GLU 165 -3.724 -6.270 8.412 1027 H SER 166 HN SER 166 -2.363 -6.465 4.907 1028 HA SER 166 HA SER 166 -2.243 -9.325 5.215 1029 HB2 SER 166 HB2 SER 166 -1.316 -8.067 2.612 1030 HB3 SER 166 HB1 SER 166 -1.043 -9.740 3.093 1031 HG SER 166 HG SER 166 -3.650 -9.203 3.316 1032 H MET 167 HN MET 167 -0.525 -9.634 6.518 1033 HA MET 167 HA MET 167 1.720 -7.793 6.393 1034 HB2 MET 167 HB2 MET 167 2.384 -10.078 7.975 1035 HB3 MET 167 HB1 MET 167 2.135 -8.418 8.493 1036 HG2 MET 167 HG2 MET 167 -0.095 -10.411 8.184 1037 HG3 MET 167 HG1 MET 167 0.733 -10.071 9.703 1038 HE1 MET 167 HE1 MET 167 -2.754 -8.332 10.202 1039 HE2 MET 167 HE2 MET 167 -1.590 -9.467 10.883 1040 HE3 MET 167 HE3 MET 167 -2.422 -9.853 9.376 1041 H VAL 168 HN VAL 168 3.726 -8.350 5.659 1042 HA VAL 168 HA VAL 168 4.059 -10.966 4.416 1043 HB VAL 168 HB VAL 168 4.958 -9.922 2.340 1044 HG11 VAL 168 HG11 VAL 168 2.086 -9.271 3.005 1045 HG12 VAL 168 HG12 VAL 168 2.692 -10.788 2.336 1046 HG13 VAL 168 HG13 VAL 168 2.764 -9.310 1.379 1047 HG21 VAL 168 HG21 VAL 168 4.481 -7.599 1.836 1048 HG22 VAL 168 HG22 VAL 168 5.457 -7.712 3.305 1049 HG23 VAL 168 HG23 VAL 168 3.726 -7.392 3.419 Start of MODEL 5 1 H1 MET 1 HT1 MET 1 16.447 21.813 6.645 2 H2 MET 1 HT2 MET 1 14.977 21.087 7.077 3 H3 MET 1 HT3 MET 1 14.985 22.617 6.351 4 HA MET 1 HA MET 1 15.868 21.694 4.321 5 HB2 MET 1 HB2 MET 1 15.642 19.112 5.870 6 HB3 MET 1 HB1 MET 1 15.804 19.170 4.120 7 HG2 MET 1 HG2 MET 1 17.958 20.302 4.362 8 HG3 MET 1 HG1 MET 1 17.791 20.238 6.117 9 HE1 MET 1 HE1 MET 1 18.122 16.451 3.488 10 HE2 MET 1 HE2 MET 1 18.204 18.080 2.819 11 HE3 MET 1 HE3 MET 1 16.704 17.500 3.543 12 H SER 2 HN SER 2 13.386 22.573 5.567 13 HA SER 2 HA SER 2 11.361 20.671 4.738 14 HB2 SER 2 HB2 SER 2 11.137 22.024 6.822 15 HB3 SER 2 HB1 SER 2 11.026 23.476 5.831 16 HG SER 2 HG SER 2 9.229 22.082 4.786 17 H TYR 3 HN TYR 3 12.829 23.622 3.609 18 HA TYR 3 HA TYR 3 12.590 24.881 1.744 19 HB2 TYR 3 HB2 TYR 3 11.949 22.142 0.704 20 HB3 TYR 3 HB1 TYR 3 12.064 23.541 -0.357 21 HD1 TYR 3 HD1 TYR 3 14.274 24.894 -0.254 22 HD2 TYR 3 HD2 TYR 3 13.852 20.938 1.241 23 HE1 TYR 3 HE1 TYR 3 16.715 24.596 -0.370 24 HE2 TYR 3 HE2 TYR 3 16.288 20.628 1.130 25 HH TYR 3 HH TYR 3 18.211 21.523 0.031 26 H ILE 4 HN ILE 4 10.789 25.867 2.899 27 HA ILE 4 HA ILE 4 8.816 26.963 2.859 28 HB ILE 4 HB ILE 4 8.500 25.762 0.111 29 HG12 ILE 4 HG12 ILE 4 9.475 28.492 0.974 30 HG13 ILE 4 HG11 ILE 4 10.483 27.191 0.351 31 HG21 ILE 4 HG21 ILE 4 6.351 26.457 1.041 32 HG22 ILE 4 HG22 ILE 4 6.844 27.528 -0.273 33 HG23 ILE 4 HG23 ILE 4 7.018 28.051 1.403 34 HD11 ILE 4 HD11 ILE 4 10.033 28.858 -1.354 35 HD12 ILE 4 HD12 ILE 4 8.300 28.606 -1.156 36 HD13 ILE 4 HD13 ILE 4 9.312 27.307 -1.786 37 HA PRO 5 HA PRO 5 6.411 23.326 4.190 38 HB2 PRO 5 HB2 PRO 5 5.707 24.932 6.489 39 HB3 PRO 5 HB1 PRO 5 6.637 23.434 6.444 40 HG2 PRO 5 HG2 PRO 5 7.709 25.870 7.089 41 HG3 PRO 5 HG1 PRO 5 8.639 24.527 6.397 42 HD2 PRO 5 HD2 PRO 5 7.541 26.969 5.057 43 HD3 PRO 5 HD1 PRO 5 9.087 26.132 4.789 44 H GLY 6 HN GLY 6 4.857 23.634 2.610 45 HA2 GLY 6 HA2 GLY 6 2.363 24.613 3.303 46 HA3 GLY 6 HA1 GLY 6 3.188 25.931 2.468 47 H GLN 7 HN GLN 7 4.684 24.212 0.704 48 HA GLN 7 HA GLN 7 2.581 23.692 -1.229 49 HB2 GLN 7 HB2 GLN 7 4.609 23.276 -2.743 50 HB3 GLN 7 HB1 GLN 7 4.327 24.917 -2.184 51 HG2 GLN 7 HG2 GLN 7 6.054 24.703 -0.521 52 HG3 GLN 7 HG1 GLN 7 6.272 22.998 -0.919 53 HE21 GLN 7 HE21 GLN 7 7.365 22.423 -2.776 54 HE22 GLN 7 HE22 GLN 7 8.310 23.559 -3.689 55 HA PRO 8 HA PRO 8 2.915 19.329 -0.082 56 HB2 PRO 8 HB2 PRO 8 0.483 19.023 -1.658 57 HB3 PRO 8 HB1 PRO 8 0.717 18.780 0.075 58 HG2 PRO 8 HG2 PRO 8 -0.749 20.829 -0.939 59 HG3 PRO 8 HG1 PRO 8 0.144 20.942 0.588 60 HD2 PRO 8 HD2 PRO 8 0.890 21.977 -2.124 61 HD3 PRO 8 HD1 PRO 8 1.070 22.751 -0.528 62 H VAL 9 HN VAL 9 3.751 17.647 -1.233 63 HA VAL 9 HA VAL 9 4.508 18.106 -3.962 64 HB VAL 9 HB VAL 9 5.871 16.805 -2.241 65 HG11 VAL 9 HG11 VAL 9 5.436 14.400 -2.065 66 HG12 VAL 9 HG12 VAL 9 3.936 14.617 -2.967 67 HG13 VAL 9 HG13 VAL 9 4.126 15.365 -1.381 68 HG21 VAL 9 HG21 VAL 9 6.806 15.274 -3.912 69 HG22 VAL 9 HG22 VAL 9 6.490 16.874 -4.584 70 HG23 VAL 9 HG23 VAL 9 5.393 15.539 -4.933 71 H THR 10 HN THR 10 4.143 16.423 -5.584 72 HA THR 10 HA THR 10 1.312 16.278 -5.970 73 HB THR 10 HB THR 10 1.947 15.650 -8.275 74 HG1 THR 10 HG1 THR 10 4.354 15.812 -8.624 75 HG21 THR 10 HG21 THR 10 3.393 17.979 -6.995 76 HG22 THR 10 HG22 THR 10 1.811 17.997 -7.791 77 HG23 THR 10 HG23 THR 10 3.276 17.752 -8.746 78 H ALA 11 HN ALA 11 3.931 14.018 -6.288 79 HA ALA 11 HA ALA 11 2.748 11.974 -4.714 80 HB1 ALA 11 HB1 ALA 11 2.800 11.483 -7.699 81 HB2 ALA 11 HB2 ALA 11 1.349 11.685 -6.716 82 HB3 ALA 11 HB3 ALA 11 2.404 10.293 -6.457 83 H VAL 12 HN VAL 12 4.303 10.796 -3.928 84 HA VAL 12 HA VAL 12 6.974 11.047 -5.021 85 HB VAL 12 HB VAL 12 5.957 9.517 -2.645 86 HG11 VAL 12 HG11 VAL 12 8.071 8.680 -3.776 87 HG12 VAL 12 HG12 VAL 12 8.190 9.035 -2.052 88 HG13 VAL 12 HG13 VAL 12 8.829 10.180 -3.238 89 HG21 VAL 12 HG21 VAL 12 5.719 11.882 -2.275 90 HG22 VAL 12 HG22 VAL 12 7.382 12.166 -2.797 91 HG23 VAL 12 HG23 VAL 12 7.066 11.280 -1.305 92 H VAL 13 HN VAL 13 7.389 9.823 -6.674 93 HA VAL 13 HA VAL 13 6.230 7.163 -6.908 94 HB VAL 13 HB VAL 13 8.034 8.581 -8.862 95 HG11 VAL 13 HG11 VAL 13 8.057 6.163 -9.112 96 HG12 VAL 13 HG12 VAL 13 7.221 6.916 -10.469 97 HG13 VAL 13 HG13 VAL 13 6.296 6.141 -9.184 98 HG21 VAL 13 HG21 VAL 13 5.959 8.987 -10.164 99 HG22 VAL 13 HG22 VAL 13 6.001 9.851 -8.626 100 HG23 VAL 13 HG23 VAL 13 5.030 8.389 -8.788 101 H GLN 14 HN GLN 14 7.236 5.736 -5.787 102 HA GLN 14 HA GLN 14 10.138 5.714 -5.627 103 HB2 GLN 14 HB2 GLN 14 9.323 6.780 -3.608 104 HB3 GLN 14 HB1 GLN 14 8.103 5.531 -3.391 105 HG2 GLN 14 HG2 GLN 14 10.012 3.915 -3.220 106 HG3 GLN 14 HG1 GLN 14 11.066 5.319 -3.053 107 HE21 GLN 14 HE21 GLN 14 7.786 4.954 -1.818 108 HE22 GLN 14 HE22 GLN 14 8.214 5.012 -0.133 109 H ARG 15 HN ARG 15 10.866 3.660 -6.004 110 HA ARG 15 HA ARG 15 9.041 1.493 -5.511 111 HB2 ARG 15 HB2 ARG 15 10.433 0.464 -7.459 112 HB3 ARG 15 HB1 ARG 15 9.076 1.520 -7.778 113 HG2 ARG 15 HG2 ARG 15 10.590 2.415 -9.203 114 HG3 ARG 15 HG1 ARG 15 10.961 3.356 -7.748 115 HD2 ARG 15 HD2 ARG 15 12.642 1.560 -7.195 116 HD3 ARG 15 HD1 ARG 15 12.362 0.923 -8.815 117 HE ARG 15 HE ARG 15 12.998 3.597 -9.139 118 HH11 ARG 15 HH11 ARG 15 14.553 0.765 -7.796 119 HH12 ARG 15 HH12 ARG 15 16.162 1.306 -8.161 120 HH21 ARG 15 HH21 ARG 15 15.104 4.308 -9.650 121 HH22 ARG 15 HH22 ARG 15 16.471 3.309 -9.265 122 H VAL 16 HN VAL 16 9.734 0.226 -3.982 123 HA VAL 16 HA VAL 16 12.582 0.235 -3.319 124 HB VAL 16 HB VAL 16 11.443 1.601 -1.693 125 HG11 VAL 16 HG11 VAL 16 9.502 -0.667 -1.361 126 HG12 VAL 16 HG12 VAL 16 9.184 0.888 -2.139 127 HG13 VAL 16 HG13 VAL 16 9.528 0.817 -0.406 128 HG21 VAL 16 HG21 VAL 16 13.106 0.152 -0.714 129 HG22 VAL 16 HG22 VAL 16 11.919 -1.139 -0.532 130 HG23 VAL 16 HG23 VAL 16 11.758 0.346 0.413 131 H GLU 17 HN GLU 17 13.301 -1.777 -2.449 132 HA GLU 17 HA GLU 17 11.629 -4.008 -3.341 133 HB2 GLU 17 HB2 GLU 17 14.645 -3.909 -3.118 134 HB3 GLU 17 HB1 GLU 17 13.684 -5.182 -3.858 135 HG2 GLU 17 HG2 GLU 17 12.986 -3.731 -5.624 136 HG3 GLU 17 HG1 GLU 17 13.750 -2.345 -4.852 137 H ILE 18 HN ILE 18 10.700 -4.901 -1.611 138 HA ILE 18 HA ILE 18 12.097 -5.058 0.926 139 HB ILE 18 HB ILE 18 9.202 -5.745 0.347 140 HG12 ILE 18 HG12 ILE 18 9.134 -3.475 -0.083 141 HG13 ILE 18 HG11 ILE 18 8.858 -3.503 1.654 142 HG21 ILE 18 HG21 ILE 18 10.127 -6.747 2.342 143 HG22 ILE 18 HG22 ILE 18 8.955 -5.499 2.772 144 HG23 ILE 18 HG23 ILE 18 10.686 -5.170 2.901 145 HD11 ILE 18 HD11 ILE 18 11.521 -3.087 0.364 146 HD12 ILE 18 HD12 ILE 18 11.125 -2.912 2.077 147 HD13 ILE 18 HD13 ILE 18 10.455 -1.782 0.898 148 H HIS 19 HN HIS 19 12.851 -6.956 1.562 149 HA HIS 19 HA HIS 19 11.694 -9.271 0.220 150 HB2 HIS 19 HB2 HIS 19 14.026 -8.738 -0.459 151 HB3 HIS 19 HB1 HIS 19 14.531 -9.185 1.173 152 HD1 HIS 19 HD1 HIS 19 15.797 -11.358 0.282 153 HD2 HIS 19 HD2 HIS 19 11.733 -11.147 -0.537 154 HE1 HIS 19 HE1 HIS 19 15.123 -13.689 -0.405 155 HE2 HIS 19 HE2 HIS 19 12.624 -13.569 -0.794 156 H LYS 20 HN LYS 20 10.245 -9.827 1.640 157 HA LYS 20 HA LYS 20 11.140 -10.727 4.280 158 HB2 LYS 20 HB2 LYS 20 8.451 -10.912 4.432 159 HB3 LYS 20 HB1 LYS 20 9.360 -9.483 4.898 160 HG2 LYS 20 HG2 LYS 20 7.469 -8.838 3.566 161 HG3 LYS 20 HG1 LYS 20 8.953 -8.522 2.671 162 HD2 LYS 20 HD2 LYS 20 8.596 -10.366 1.235 163 HD3 LYS 20 HD1 LYS 20 7.349 -11.037 2.293 164 HE2 LYS 20 HE2 LYS 20 7.159 -8.479 0.703 165 HE3 LYS 20 HE1 LYS 20 6.347 -10.003 0.333 166 HZ1 LYS 20 HZ1 LYS 20 5.888 -8.250 2.677 167 HZ2 LYS 20 HZ2 LYS 20 5.279 -9.822 2.563 168 HZ3 LYS 20 HZ3 LYS 20 4.792 -8.644 1.450 169 H LEU 21 HN LEU 21 11.312 -12.845 4.599 170 HA LEU 21 HA LEU 21 10.115 -14.765 2.861 171 HB2 LEU 21 HB2 LEU 21 11.765 -14.130 1.323 172 HB3 LEU 21 HB1 LEU 21 12.968 -13.871 2.572 173 HG LEU 21 HG LEU 21 13.154 -16.311 2.886 174 HD11 LEU 21 HD11 LEU 21 12.066 -17.394 0.590 175 HD12 LEU 21 HD12 LEU 21 10.809 -16.310 1.198 176 HD13 LEU 21 HD13 LEU 21 11.465 -17.583 2.240 177 HD21 LEU 21 HD21 LEU 21 13.538 -15.437 0.032 178 HD22 LEU 21 HD22 LEU 21 14.355 -16.775 0.840 179 HD23 LEU 21 HD23 LEU 21 14.651 -15.114 1.363 180 H ARG 22 HN ARG 22 10.484 -16.878 3.592 181 HA ARG 22 HA ARG 22 11.451 -17.431 6.160 182 HB2 ARG 22 HB2 ARG 22 10.275 -19.219 5.391 183 HB3 ARG 22 HB1 ARG 22 10.812 -19.035 3.729 184 HG2 ARG 22 HG2 ARG 22 11.761 -21.033 4.409 185 HG3 ARG 22 HG1 ARG 22 13.070 -19.868 4.661 186 HD2 ARG 22 HD2 ARG 22 12.990 -21.192 6.614 187 HD3 ARG 22 HD1 ARG 22 12.263 -19.628 6.995 188 HE ARG 22 HE ARG 22 10.097 -21.071 6.356 189 HH11 ARG 22 HH11 ARG 22 12.797 -21.775 8.497 190 HH12 ARG 22 HH12 ARG 22 11.861 -22.806 9.530 191 HH21 ARG 22 HH21 ARG 22 8.881 -22.433 7.754 192 HH22 ARG 22 HH22 ARG 22 9.673 -23.185 9.112 193 H GLN 23 HN GLN 23 13.398 -16.827 6.736 194 HA GLN 23 HA GLN 23 15.633 -17.787 5.140 195 HB2 GLN 23 HB2 GLN 23 16.517 -15.690 6.830 196 HB3 GLN 23 HB1 GLN 23 16.474 -15.730 5.074 197 HG2 GLN 23 HG2 GLN 23 13.998 -15.101 5.333 198 HG3 GLN 23 HG1 GLN 23 14.451 -14.636 6.969 199 HE21 GLN 23 HE21 GLN 23 13.490 -13.097 4.693 200 HE22 GLN 23 HE22 GLN 23 14.663 -11.830 4.454 201 H GLY 24 HN GLY 24 14.604 -19.531 6.597 202 HA2 GLY 24 HA2 GLY 24 15.528 -21.195 7.924 203 HA3 GLY 24 HA1 GLY 24 16.834 -20.089 8.336 204 H GLU 25 HN GLU 25 16.817 -19.071 10.207 205 HA GLU 25 HA GLU 25 14.866 -19.669 12.196 206 HB2 GLU 25 HB2 GLU 25 17.006 -17.535 12.119 207 HB3 GLU 25 HB1 GLU 25 16.065 -17.982 13.524 208 HG2 GLU 25 HG2 GLU 25 17.886 -19.227 13.964 209 HG3 GLU 25 HG1 GLU 25 17.069 -20.379 12.908 210 H ASN 26 HN ASN 26 14.843 -17.661 9.592 211 HA ASN 26 HA ASN 26 13.333 -15.579 10.925 212 HB2 ASN 26 HB2 ASN 26 14.897 -15.549 8.384 213 HB3 ASN 26 HB1 ASN 26 13.866 -14.250 8.917 214 HD21 ASN 26 HD21 ASN 26 16.624 -16.094 9.558 215 HD22 ASN 26 HD22 ASN 26 17.460 -14.929 10.552 216 H LEU 27 HN LEU 27 11.487 -15.522 10.534 217 HA LEU 27 HA LEU 27 10.412 -16.168 7.906 218 HB2 LEU 27 HB2 LEU 27 9.393 -16.806 10.606 219 HB3 LEU 27 HB1 LEU 27 8.220 -16.169 9.474 220 HG LEU 27 HG LEU 27 8.183 -18.601 9.447 221 HD11 LEU 27 HD11 LEU 27 9.453 -17.504 6.943 222 HD12 LEU 27 HD12 LEU 27 7.741 -17.399 7.351 223 HD13 LEU 27 HD13 LEU 27 8.486 -18.973 7.064 224 HD21 LEU 27 HD21 LEU 27 10.187 -19.816 8.572 225 HD22 LEU 27 HD22 LEU 27 10.390 -19.131 10.185 226 HD23 LEU 27 HD23 LEU 27 11.114 -18.327 8.788 227 H ILE 28 HN ILE 28 10.267 -14.245 6.967 228 HA ILE 28 HA ILE 28 9.245 -12.061 8.618 229 HB ILE 28 HB ILE 28 10.128 -11.209 5.997 230 HG12 ILE 28 HG12 ILE 28 11.761 -13.128 6.395 231 HG13 ILE 28 HG11 ILE 28 12.505 -11.536 6.215 232 HG21 ILE 28 HG21 ILE 28 9.645 -9.740 7.829 233 HG22 ILE 28 HG22 ILE 28 11.344 -9.587 7.378 234 HG23 ILE 28 HG23 ILE 28 10.891 -10.507 8.813 235 HD11 ILE 28 HD11 ILE 28 12.820 -11.388 8.623 236 HD12 ILE 28 HD12 ILE 28 13.557 -12.869 8.003 237 HD13 ILE 28 HD13 ILE 28 12.005 -12.935 8.844 238 H LEU 29 HN LEU 29 7.434 -11.262 8.253 239 HA LEU 29 HA LEU 29 5.700 -11.383 6.109 240 HB2 LEU 29 HB2 LEU 29 5.970 -13.887 7.596 241 HB3 LEU 29 HB1 LEU 29 4.341 -13.240 7.711 242 HG LEU 29 HG LEU 29 5.733 -13.562 5.079 243 HD11 LEU 29 HD11 LEU 29 4.553 -15.698 4.828 244 HD12 LEU 29 HD12 LEU 29 3.949 -15.562 6.479 245 HD13 LEU 29 HD13 LEU 29 5.677 -15.756 6.187 246 HD21 LEU 29 HD21 LEU 29 2.821 -13.426 5.833 247 HD22 LEU 29 HD22 LEU 29 3.494 -13.450 4.200 248 HD23 LEU 29 HD23 LEU 29 3.786 -12.066 5.260 249 H GLY 30 HN GLY 30 5.973 -9.349 7.280 250 HA2 GLY 30 HA2 GLY 30 4.591 -9.341 9.906 251 HA3 GLY 30 HA1 GLY 30 6.206 -8.679 9.761 252 H PHE 31 HN PHE 31 6.001 -7.144 7.435 253 HA PHE 31 HA PHE 31 4.617 -4.916 8.560 254 HB2 PHE 31 HB2 PHE 31 5.463 -3.592 6.847 255 HB3 PHE 31 HB1 PHE 31 6.699 -4.802 7.075 256 HD1 PHE 31 HD1 PHE 31 4.102 -3.535 4.849 257 HD2 PHE 31 HD2 PHE 31 7.181 -6.415 5.383 258 HE1 PHE 31 HE1 PHE 31 4.004 -4.087 2.451 259 HE2 PHE 31 HE2 PHE 31 7.103 -6.967 3.002 260 HZ PHE 31 HZ PHE 31 5.551 -5.644 1.488 261 H SER 32 HN SER 32 2.844 -3.746 7.395 262 HA SER 32 HA SER 32 1.081 -5.854 6.341 263 HB2 SER 32 HB2 SER 32 0.635 -5.389 8.783 264 HB3 SER 32 HB1 SER 32 0.130 -3.768 8.309 265 HG SER 32 HG SER 32 -1.676 -5.047 8.402 266 H ILE 33 HN ILE 33 -0.671 -5.163 5.054 267 HA ILE 33 HA ILE 33 -0.231 -2.517 3.867 268 HB ILE 33 HB ILE 33 -0.400 -3.481 1.603 269 HG12 ILE 33 HG12 ILE 33 0.081 -6.166 2.901 270 HG13 ILE 33 HG11 ILE 33 -1.520 -5.616 2.411 271 HG21 ILE 33 HG21 ILE 33 1.871 -4.395 3.344 272 HG22 ILE 33 HG22 ILE 33 1.767 -2.921 2.377 273 HG23 ILE 33 HG23 ILE 33 1.896 -4.493 1.582 274 HD11 ILE 33 HD11 ILE 33 -0.554 -7.085 0.757 275 HD12 ILE 33 HD12 ILE 33 0.846 -6.021 0.600 276 HD13 ILE 33 HD13 ILE 33 -0.750 -5.457 0.102 277 H GLY 34 HN GLY 34 -2.004 -1.516 3.177 278 HA2 GLY 34 HA2 GLY 34 -4.518 -2.831 3.893 279 HA3 GLY 34 HA1 GLY 34 -4.302 -1.112 3.563 280 H GLY 35 HN GLY 35 -6.032 -3.482 2.476 281 HA2 GLY 35 HA2 GLY 35 -5.760 -2.645 -0.327 282 HA3 GLY 35 HA1 GLY 35 -5.812 -4.365 0.062 283 H GLY 36 HN GLY 36 -7.646 -2.469 -1.441 284 HA2 GLY 36 HA2 GLY 36 -10.120 -3.548 -0.420 285 HA3 GLY 36 HA1 GLY 36 -9.959 -1.813 -0.164 286 H ILE 37 HN ILE 37 -9.487 -4.183 -2.759 287 HA ILE 37 HA ILE 37 -10.656 -2.225 -4.607 288 HB ILE 37 HB ILE 37 -9.516 -3.663 -6.407 289 HG12 ILE 37 HG12 ILE 37 -8.849 -5.458 -4.677 290 HG13 ILE 37 HG11 ILE 37 -7.657 -4.981 -5.874 291 HG21 ILE 37 HG21 ILE 37 -7.432 -2.361 -6.170 292 HG22 ILE 37 HG22 ILE 37 -7.961 -1.884 -4.557 293 HG23 ILE 37 HG23 ILE 37 -8.900 -1.406 -5.971 294 HD11 ILE 37 HD11 ILE 37 -6.502 -3.631 -4.249 295 HD12 ILE 37 HD12 ILE 37 -6.710 -5.271 -3.631 296 HD13 ILE 37 HD13 ILE 37 -7.741 -3.968 -3.044 297 H ASP 38 HN ASP 38 -10.234 -5.742 -4.466 298 HA ASP 38 HA ASP 38 -12.796 -6.100 -5.819 299 HB2 ASP 38 HB2 ASP 38 -10.798 -7.326 -6.613 300 HB3 ASP 38 HB1 ASP 38 -10.646 -8.094 -5.037 301 H GLN 39 HN GLN 39 -12.073 -5.408 -2.873 302 HA GLN 39 HA GLN 39 -13.028 -7.691 -1.398 303 HB2 GLN 39 HB2 GLN 39 -12.492 -5.016 -0.178 304 HB3 GLN 39 HB1 GLN 39 -12.253 -6.620 0.512 305 HG2 GLN 39 HG2 GLN 39 -10.625 -5.348 -1.672 306 HG3 GLN 39 HG1 GLN 39 -10.127 -5.571 -0.000 307 HE21 GLN 39 HE21 GLN 39 -8.919 -6.563 -2.502 308 HE22 GLN 39 HE22 GLN 39 -8.853 -8.283 -2.344 309 H ASP 40 HN ASP 40 -13.923 -4.331 -0.974 310 HA ASP 40 HA ASP 40 -16.752 -5.064 -1.174 311 HB2 ASP 40 HB2 ASP 40 -16.271 -5.158 1.203 312 HB3 ASP 40 HB1 ASP 40 -15.501 -3.575 1.145 313 HA PRO 41 HA PRO 41 -16.538 -1.089 -3.306 314 HB2 PRO 41 HB2 PRO 41 -18.586 -1.480 -4.913 315 HB3 PRO 41 HB1 PRO 41 -17.175 -2.544 -5.073 316 HG2 PRO 41 HG2 PRO 41 -19.752 -3.037 -3.596 317 HG3 PRO 41 HG1 PRO 41 -18.934 -4.087 -4.746 318 HD2 PRO 41 HD2 PRO 41 -18.680 -4.321 -2.041 319 HD3 PRO 41 HD1 PRO 41 -17.442 -4.854 -3.195 320 H SER 42 HN SER 42 -18.693 -2.266 -1.068 321 HA SER 42 HA SER 42 -21.083 -0.886 -1.596 322 HB2 SER 42 HB2 SER 42 -20.235 -1.839 1.130 323 HB3 SER 42 HB1 SER 42 -21.861 -1.800 0.437 324 HG SER 42 HG SER 42 -19.880 -3.688 0.213 325 H GLN 43 HN GLN 43 -18.214 0.085 0.117 326 HA GLN 43 HA GLN 43 -19.657 2.254 1.419 327 HB2 GLN 43 HB2 GLN 43 -17.668 2.464 2.759 328 HB3 GLN 43 HB1 GLN 43 -18.249 0.803 2.756 329 HG2 GLN 43 HG2 GLN 43 -16.528 0.532 0.824 330 HG3 GLN 43 HG1 GLN 43 -15.803 1.966 1.554 331 HE21 GLN 43 HE21 GLN 43 -16.653 -1.348 1.969 332 HE22 GLN 43 HE22 GLN 43 -15.645 -1.655 3.372 333 H ASN 44 HN ASN 44 -18.210 1.725 -1.408 334 HA ASN 44 HA ASN 44 -17.799 4.609 -1.788 335 HB2 ASN 44 HB2 ASN 44 -15.585 3.383 -1.601 336 HB3 ASN 44 HB1 ASN 44 -16.018 2.563 -3.097 337 HD21 ASN 44 HD21 ASN 44 -14.061 3.551 -3.924 338 HD22 ASN 44 HD22 ASN 44 -14.113 5.180 -4.495 339 HA PRO 45 HA PRO 45 -20.598 3.127 -5.061 340 HB2 PRO 45 HB2 PRO 45 -22.452 5.042 -4.789 341 HB3 PRO 45 HB1 PRO 45 -22.403 3.648 -3.695 342 HG2 PRO 45 HG2 PRO 45 -21.464 6.445 -3.247 343 HG3 PRO 45 HG1 PRO 45 -22.276 5.341 -2.123 344 HD2 PRO 45 HD2 PRO 45 -19.540 5.829 -2.200 345 HD3 PRO 45 HD1 PRO 45 -20.302 4.402 -1.469 346 H PHE 46 HN PHE 46 -18.535 5.622 -4.522 347 HA PHE 46 HA PHE 46 -19.221 7.166 -6.895 348 HB2 PHE 46 HB2 PHE 46 -18.613 8.350 -4.798 349 HB3 PHE 46 HB1 PHE 46 -17.015 7.607 -4.868 350 HD1 PHE 46 HD1 PHE 46 -19.310 9.854 -6.736 351 HD2 PHE 46 HD2 PHE 46 -15.293 8.611 -6.066 352 HE1 PHE 46 HE1 PHE 46 -18.505 11.711 -8.136 353 HE2 PHE 46 HE2 PHE 46 -14.483 10.466 -7.464 354 HZ PHE 46 HZ PHE 46 -16.092 12.017 -8.502 355 H SER 47 HN SER 47 -16.726 4.972 -5.657 356 HA SER 47 HA SER 47 -15.731 4.765 -8.375 357 HB2 SER 47 HB2 SER 47 -14.078 5.367 -5.923 358 HB3 SER 47 HB1 SER 47 -13.402 4.768 -7.432 359 HG SER 47 HG SER 47 -15.070 6.903 -7.772 360 H GLU 48 HN GLU 48 -13.661 3.056 -7.805 361 HA GLU 48 HA GLU 48 -14.209 0.863 -6.246 362 HB2 GLU 48 HB2 GLU 48 -15.266 -0.689 -7.827 363 HB3 GLU 48 HB1 GLU 48 -16.309 0.694 -7.496 364 HG2 GLU 48 HG2 GLU 48 -15.538 1.711 -9.626 365 HG3 GLU 48 HG1 GLU 48 -14.647 0.229 -9.965 366 H ASP 49 HN ASP 49 -13.117 2.103 -9.308 367 HA ASP 49 HA ASP 49 -10.590 0.660 -8.982 368 HB2 ASP 49 HB2 ASP 49 -10.501 0.196 -11.362 369 HB3 ASP 49 HB1 ASP 49 -11.998 -0.462 -10.713 370 H LYS 50 HN LYS 50 -12.350 3.362 -10.294 371 HA LYS 50 HA LYS 50 -10.556 4.686 -11.820 372 HB2 LYS 50 HB2 LYS 50 -12.466 6.063 -9.931 373 HB3 LYS 50 HB1 LYS 50 -11.790 6.734 -11.408 374 HG2 LYS 50 HG2 LYS 50 -13.747 6.101 -12.299 375 HG3 LYS 50 HG1 LYS 50 -12.992 4.509 -12.373 376 HD2 LYS 50 HD2 LYS 50 -13.983 3.950 -10.195 377 HD3 LYS 50 HD1 LYS 50 -14.744 5.536 -10.141 378 HE2 LYS 50 HE2 LYS 50 -15.251 3.419 -12.231 379 HE3 LYS 50 HE1 LYS 50 -16.299 3.776 -10.860 380 HZ1 LYS 50 HZ1 LYS 50 -16.527 6.058 -11.756 381 HZ2 LYS 50 HZ2 LYS 50 -17.159 4.864 -12.781 382 HZ3 LYS 50 HZ3 LYS 50 -15.662 5.576 -13.135 383 H THR 51 HN THR 51 -11.167 6.075 -8.620 384 HA THR 51 HA THR 51 -8.336 6.835 -8.550 385 HB THR 51 HB THR 51 -9.961 8.690 -8.410 386 HG1 THR 51 HG1 THR 51 -8.441 8.163 -6.057 387 HG21 THR 51 HG21 THR 51 -11.791 7.503 -7.298 388 HG22 THR 51 HG22 THR 51 -11.355 8.968 -6.414 389 HG23 THR 51 HG23 THR 51 -10.830 7.389 -5.826 390 H ASP 52 HN ASP 52 -9.719 4.242 -7.787 391 HA ASP 52 HA ASP 52 -9.554 4.098 -4.923 392 HB2 ASP 52 HB2 ASP 52 -10.505 2.405 -7.090 393 HB3 ASP 52 HB1 ASP 52 -9.641 1.495 -5.860 394 H LYS 53 HN LYS 53 -8.012 1.986 -7.308 395 HA LYS 53 HA LYS 53 -5.995 0.979 -7.424 396 HB2 LYS 53 HB2 LYS 53 -5.162 3.267 -5.641 397 HB3 LYS 53 HB1 LYS 53 -4.042 1.999 -6.114 398 HG2 LYS 53 HG2 LYS 53 -3.657 3.728 -7.637 399 HG3 LYS 53 HG1 LYS 53 -4.657 2.576 -8.518 400 HD2 LYS 53 HD2 LYS 53 -6.646 3.985 -7.829 401 HD3 LYS 53 HD1 LYS 53 -5.479 5.194 -7.295 402 HE2 LYS 53 HE2 LYS 53 -5.770 4.100 -10.090 403 HE3 LYS 53 HE1 LYS 53 -6.260 5.703 -9.538 404 HZ1 LYS 53 HZ1 LYS 53 -3.467 4.676 -9.572 405 HZ2 LYS 53 HZ2 LYS 53 -3.949 6.235 -9.102 406 HZ3 LYS 53 HZ3 LYS 53 -4.138 5.735 -10.711 407 H GLY 54 HN GLY 54 -6.670 1.950 -4.067 408 HA2 GLY 54 HA2 GLY 54 -7.117 0.689 -2.218 409 HA3 GLY 54 HA1 GLY 54 -7.604 -0.563 -3.349 410 H ILE 55 HN ILE 55 -4.301 0.456 -3.490 411 HA ILE 55 HA ILE 55 -3.501 -1.777 -1.741 412 HB ILE 55 HB ILE 55 -2.201 -1.026 -4.375 413 HG12 ILE 55 HG12 ILE 55 -4.323 -2.280 -4.638 414 HG13 ILE 55 HG11 ILE 55 -2.924 -3.190 -5.195 415 HG21 ILE 55 HG21 ILE 55 -0.846 -3.114 -3.946 416 HG22 ILE 55 HG22 ILE 55 -1.453 -3.055 -2.286 417 HG23 ILE 55 HG23 ILE 55 -0.484 -1.721 -2.920 418 HD11 ILE 55 HD11 ILE 55 -2.941 -4.479 -3.123 419 HD12 ILE 55 HD12 ILE 55 -4.479 -4.606 -3.977 420 HD13 ILE 55 HD13 ILE 55 -4.338 -3.560 -2.563 421 H TYR 56 HN TYR 56 -2.300 -1.015 -0.087 422 HA TYR 56 HA TYR 56 -0.150 0.827 -0.536 423 HB2 TYR 56 HB2 TYR 56 -0.999 2.508 1.167 424 HB3 TYR 56 HB1 TYR 56 -1.775 2.546 -0.409 425 HD1 TYR 56 HD1 TYR 56 -2.204 1.498 3.106 426 HD2 TYR 56 HD2 TYR 56 -4.092 2.133 -0.646 427 HE1 TYR 56 HE1 TYR 56 -4.408 1.276 4.190 428 HE2 TYR 56 HE2 TYR 56 -6.300 1.918 0.420 429 HH TYR 56 HH TYR 56 -6.709 1.847 3.848 430 H VAL 57 HN VAL 57 0.973 1.391 1.625 431 HA VAL 57 HA VAL 57 1.084 -0.975 3.271 432 HB VAL 57 HB VAL 57 2.683 1.521 2.951 433 HG11 VAL 57 HG11 VAL 57 3.040 -0.499 5.140 434 HG12 VAL 57 HG12 VAL 57 2.471 1.157 5.334 435 HG13 VAL 57 HG13 VAL 57 4.119 0.851 4.789 436 HG21 VAL 57 HG21 VAL 57 3.266 -0.176 1.436 437 HG22 VAL 57 HG22 VAL 57 3.283 -1.390 2.722 438 HG23 VAL 57 HG23 VAL 57 4.523 -0.128 2.679 439 H THR 58 HN THR 58 0.314 -1.051 5.277 440 HA THR 58 HA THR 58 -0.618 1.456 6.505 441 HB THR 58 HB THR 58 -2.499 -0.093 5.942 442 HG1 THR 58 HG1 THR 58 -2.202 0.021 8.765 443 HG21 THR 58 HG21 THR 58 -1.191 -1.917 7.965 444 HG22 THR 58 HG22 THR 58 -1.333 -2.224 6.233 445 HG23 THR 58 HG23 THR 58 -2.779 -2.152 7.239 446 H ARG 59 HN ARG 59 1.615 -1.028 6.586 447 HA ARG 59 HA ARG 59 2.556 -0.257 9.201 448 HB2 ARG 59 HB2 ARG 59 1.549 -3.047 8.779 449 HB3 ARG 59 HB1 ARG 59 2.765 -2.668 9.976 450 HG2 ARG 59 HG2 ARG 59 0.705 -0.836 10.273 451 HG3 ARG 59 HG1 ARG 59 -0.046 -2.426 10.167 452 HD2 ARG 59 HD2 ARG 59 2.238 -1.705 12.006 453 HD3 ARG 59 HD1 ARG 59 0.548 -1.755 12.489 454 HE ARG 59 HE ARG 59 1.003 -4.219 11.428 455 HH11 ARG 59 HH11 ARG 59 2.416 -2.325 14.019 456 HH12 ARG 59 HH12 ARG 59 2.984 -3.722 14.891 457 HH21 ARG 59 HH21 ARG 59 1.732 -6.050 12.596 458 HH22 ARG 59 HH22 ARG 59 2.595 -5.831 14.089 459 H VAL 60 HN VAL 60 4.438 -1.395 9.856 460 HA VAL 60 HA VAL 60 5.969 -2.736 7.789 461 HB VAL 60 HB VAL 60 6.817 -0.145 9.095 462 HG11 VAL 60 HG11 VAL 60 8.544 -2.198 7.735 463 HG12 VAL 60 HG12 VAL 60 8.561 -1.768 9.443 464 HG13 VAL 60 HG13 VAL 60 9.070 -0.588 8.233 465 HG21 VAL 60 HG21 VAL 60 7.371 0.538 6.819 466 HG22 VAL 60 HG22 VAL 60 5.682 0.040 6.913 467 HG23 VAL 60 HG23 VAL 60 6.887 -1.043 6.208 468 H SER 61 HN SER 61 6.848 -4.481 8.729 469 HA SER 61 HA SER 61 7.108 -4.755 11.536 470 HB2 SER 61 HB2 SER 61 8.619 -6.713 10.856 471 HB3 SER 61 HB1 SER 61 6.924 -6.773 10.390 472 HG SER 61 HG SER 61 9.108 -5.973 8.765 473 H GLU 62 HN GLU 62 8.423 -3.589 12.645 474 HA GLU 62 HA GLU 62 10.411 -2.000 11.580 475 HB2 GLU 62 HB2 GLU 62 10.753 -1.305 13.831 476 HB3 GLU 62 HB1 GLU 62 9.046 -1.471 13.563 477 HG2 GLU 62 HG2 GLU 62 9.296 -3.787 14.553 478 HG3 GLU 62 HG1 GLU 62 10.880 -3.256 15.090 479 H GLY 63 HN GLY 63 12.439 -1.981 11.902 480 HA2 GLY 63 HA2 GLY 63 14.603 -2.765 11.878 481 HA3 GLY 63 HA1 GLY 63 14.117 -3.787 13.228 482 H GLY 64 HN GLY 64 12.593 -3.969 10.074 483 HA2 GLY 64 HA2 GLY 64 13.642 -6.716 9.929 484 HA3 GLY 64 HA1 GLY 64 12.009 -6.246 9.459 485 HA PRO 65 HA PRO 65 13.997 -6.076 5.478 486 HB2 PRO 65 HB2 PRO 65 11.804 -6.767 4.130 487 HB3 PRO 65 HB1 PRO 65 12.771 -7.940 5.020 488 HG2 PRO 65 HG2 PRO 65 10.098 -6.898 5.602 489 HG3 PRO 65 HG1 PRO 65 10.886 -8.359 6.216 490 HD2 PRO 65 HD2 PRO 65 10.600 -5.787 7.513 491 HD3 PRO 65 HD1 PRO 65 11.324 -7.280 8.159 492 H ALA 66 HN ALA 66 10.922 -4.565 6.286 493 HA ALA 66 HA ALA 66 10.514 -3.569 3.621 494 HB1 ALA 66 HB1 ALA 66 9.108 -3.053 6.235 495 HB2 ALA 66 HB2 ALA 66 8.543 -4.006 4.864 496 HB3 ALA 66 HB3 ALA 66 8.654 -2.244 4.730 497 H GLU 67 HN GLU 67 11.718 -2.344 6.641 498 HA GLU 67 HA GLU 67 11.350 0.397 5.764 499 HB2 GLU 67 HB2 GLU 67 12.361 0.736 8.090 500 HB3 GLU 67 HB1 GLU 67 10.729 0.076 7.981 501 HG2 GLU 67 HG2 GLU 67 11.365 -1.965 8.703 502 HG3 GLU 67 HG1 GLU 67 12.926 -1.836 7.907 503 H ILE 68 HN ILE 68 13.680 -2.093 5.980 504 HA ILE 68 HA ILE 68 15.859 -0.325 6.260 505 HB ILE 68 HB ILE 68 17.208 -2.289 5.888 506 HG12 ILE 68 HG12 ILE 68 15.568 -4.418 6.378 507 HG13 ILE 68 HG11 ILE 68 14.663 -3.469 5.213 508 HG21 ILE 68 HG21 ILE 68 15.155 -2.454 8.038 509 HG22 ILE 68 HG22 ILE 68 16.682 -1.576 8.108 510 HG23 ILE 68 HG23 ILE 68 16.681 -3.340 8.059 511 HD11 ILE 68 HD11 ILE 68 17.480 -4.455 4.836 512 HD12 ILE 68 HD12 ILE 68 16.523 -3.546 3.666 513 HD13 ILE 68 HD13 ILE 68 16.030 -5.174 4.135 514 H ALA 69 HN ALA 69 14.174 -2.152 3.922 515 HA ALA 69 HA ALA 69 15.827 -1.499 1.721 516 HB1 ALA 69 HB1 ALA 69 13.825 -2.059 0.357 517 HB2 ALA 69 HB2 ALA 69 12.908 -2.226 1.856 518 HB3 ALA 69 HB3 ALA 69 14.258 -3.311 1.522 519 H GLY 70 HN GLY 70 13.386 0.009 3.572 520 HA2 GLY 70 HA2 GLY 70 13.429 2.454 3.687 521 HA3 GLY 70 HA1 GLY 70 13.675 2.478 1.940 522 H LEU 71 HN LEU 71 11.327 0.812 4.065 523 HA LEU 71 HA LEU 71 9.183 2.028 2.498 524 HB2 LEU 71 HB2 LEU 71 9.494 -0.440 2.218 525 HB3 LEU 71 HB1 LEU 71 9.207 -0.615 3.944 526 HG LEU 71 HG LEU 71 6.973 0.518 3.538 527 HD11 LEU 71 HD11 LEU 71 7.641 -0.249 0.700 528 HD12 LEU 71 HD12 LEU 71 7.376 1.383 1.317 529 HD13 LEU 71 HD13 LEU 71 6.045 0.226 1.280 530 HD21 LEU 71 HD21 LEU 71 6.904 -1.678 4.163 531 HD22 LEU 71 HD22 LEU 71 7.795 -2.215 2.742 532 HD23 LEU 71 HD23 LEU 71 6.097 -1.740 2.595 533 H GLN 72 HN GLN 72 7.233 2.253 3.732 534 HA GLN 72 HA GLN 72 7.293 2.486 6.488 535 HB2 GLN 72 HB2 GLN 72 7.251 5.040 6.529 536 HB3 GLN 72 HB1 GLN 72 8.767 4.199 6.375 537 HG2 GLN 72 HG2 GLN 72 8.129 6.344 4.957 538 HG3 GLN 72 HG1 GLN 72 9.288 5.121 4.452 539 HE21 GLN 72 HE21 GLN 72 6.069 6.329 4.074 540 HE22 GLN 72 HE22 GLN 72 5.764 5.530 2.566 541 H ILE 73 HN ILE 73 5.435 4.181 7.104 542 HA ILE 73 HA ILE 73 3.245 2.660 6.085 543 HB ILE 73 HB ILE 73 3.151 4.828 8.169 544 HG12 ILE 73 HG12 ILE 73 4.931 3.468 8.921 545 HG13 ILE 73 HG11 ILE 73 3.514 2.861 9.774 546 HG21 ILE 73 HG21 ILE 73 1.026 4.020 7.456 547 HG22 ILE 73 HG22 ILE 73 1.365 3.402 9.072 548 HG23 ILE 73 HG23 ILE 73 1.545 2.351 7.669 549 HD11 ILE 73 HD11 ILE 73 4.929 1.061 8.945 550 HD12 ILE 73 HD12 ILE 73 4.723 1.655 7.291 551 HD13 ILE 73 HD13 ILE 73 3.335 1.032 8.189 552 H GLY 74 HN GLY 74 2.281 3.207 4.359 553 HA2 GLY 74 HA2 GLY 74 0.144 4.510 4.046 554 HA3 GLY 74 HA1 GLY 74 1.137 5.952 4.286 555 H ASP 75 HN ASP 75 1.640 2.977 2.422 556 HA ASP 75 HA ASP 75 2.503 4.788 0.247 557 HB2 ASP 75 HB2 ASP 75 3.959 2.912 1.832 558 HB3 ASP 75 HB1 ASP 75 3.983 2.390 0.153 559 H LYS 76 HN LYS 76 1.426 4.482 -1.635 560 HA LYS 76 HA LYS 76 -0.395 2.235 -1.824 561 HB2 LYS 76 HB2 LYS 76 0.045 4.455 -3.824 562 HB3 LYS 76 HB1 LYS 76 -1.366 3.423 -3.663 563 HG2 LYS 76 HG2 LYS 76 -2.187 4.589 -1.875 564 HG3 LYS 76 HG1 LYS 76 -0.594 5.175 -1.382 565 HD2 LYS 76 HD2 LYS 76 -0.536 6.665 -3.318 566 HD3 LYS 76 HD1 LYS 76 -2.109 6.058 -3.841 567 HE2 LYS 76 HE2 LYS 76 -1.684 7.351 -1.158 568 HE3 LYS 76 HE1 LYS 76 -2.090 8.280 -2.601 569 HZ1 LYS 76 HZ1 LYS 76 -3.965 7.452 -1.035 570 HZ2 LYS 76 HZ2 LYS 76 -3.758 5.981 -1.844 571 HZ3 LYS 76 HZ3 LYS 76 -4.181 7.370 -2.714 572 H ILE 77 HN ILE 77 0.514 0.412 -2.520 573 HA ILE 77 HA ILE 77 2.762 0.359 -4.307 574 HB ILE 77 HB ILE 77 1.082 -1.943 -3.300 575 HG12 ILE 77 HG12 ILE 77 3.710 -0.942 -2.193 576 HG13 ILE 77 HG11 ILE 77 2.151 -0.476 -1.522 577 HG21 ILE 77 HG21 ILE 77 2.464 -2.458 -5.273 578 HG22 ILE 77 HG22 ILE 77 3.009 -3.320 -3.835 579 HG23 ILE 77 HG23 ILE 77 3.892 -1.903 -4.398 580 HD11 ILE 77 HD11 ILE 77 1.667 -2.808 -1.025 581 HD12 ILE 77 HD12 ILE 77 3.158 -2.270 -0.249 582 HD13 ILE 77 HD13 ILE 77 3.229 -3.275 -1.696 583 H MET 78 HN MET 78 2.566 0.550 -6.440 584 HA MET 78 HA MET 78 -0.039 0.016 -7.658 585 HB2 MET 78 HB2 MET 78 2.405 1.290 -8.889 586 HB3 MET 78 HB1 MET 78 0.798 1.217 -9.594 587 HG2 MET 78 HG2 MET 78 1.439 2.623 -7.023 588 HG3 MET 78 HG1 MET 78 1.426 3.415 -8.596 589 HE1 MET 78 HE1 MET 78 -2.225 2.046 -6.144 590 HE2 MET 78 HE2 MET 78 -0.633 2.462 -5.504 591 HE3 MET 78 HE3 MET 78 -0.850 0.979 -6.433 592 H GLN 79 HN GLN 79 3.296 -1.020 -7.781 593 HA GLN 79 HA GLN 79 2.427 -3.474 -9.093 594 HB2 GLN 79 HB2 GLN 79 4.953 -3.039 -10.130 595 HB3 GLN 79 HB1 GLN 79 3.430 -2.951 -11.006 596 HG2 GLN 79 HG2 GLN 79 3.384 -0.529 -10.156 597 HG3 GLN 79 HG1 GLN 79 5.101 -0.832 -9.877 598 HE21 GLN 79 HE21 GLN 79 5.798 -2.327 -12.001 599 HE22 GLN 79 HE22 GLN 79 5.617 -1.429 -13.474 600 H VAL 80 HN VAL 80 3.777 -5.141 -8.965 601 HA VAL 80 HA VAL 80 5.489 -5.018 -6.566 602 HB VAL 80 HB VAL 80 3.388 -6.030 -5.977 603 HG11 VAL 80 HG11 VAL 80 3.855 -7.974 -8.226 604 HG12 VAL 80 HG12 VAL 80 2.661 -6.674 -8.201 605 HG13 VAL 80 HG13 VAL 80 2.523 -8.018 -7.066 606 HG21 VAL 80 HG21 VAL 80 4.217 -8.315 -5.305 607 HG22 VAL 80 HG22 VAL 80 5.306 -6.989 -4.889 608 HG23 VAL 80 HG23 VAL 80 5.657 -8.013 -6.292 609 H ASN 81 HN ASN 81 7.425 -6.003 -6.775 610 HA ASN 81 HA ASN 81 9.208 -6.993 -7.761 611 HB2 ASN 81 HB2 ASN 81 7.132 -8.598 -9.269 612 HB3 ASN 81 HB1 ASN 81 8.847 -8.976 -9.151 613 HD21 ASN 81 HD21 ASN 81 9.684 -9.248 -6.950 614 HD22 ASN 81 HD22 ASN 81 8.687 -10.107 -5.811 615 H GLY 82 HN GLY 82 7.097 -5.071 -9.349 616 HA2 GLY 82 HA2 GLY 82 8.146 -3.522 -10.947 617 HA3 GLY 82 HA1 GLY 82 8.853 -4.934 -11.726 618 H TRP 83 HN TRP 83 5.741 -5.865 -10.937 619 HA TRP 83 HA TRP 83 4.747 -4.873 -13.486 620 HB2 TRP 83 HB2 TRP 83 3.336 -7.072 -13.235 621 HB3 TRP 83 HB1 TRP 83 4.903 -7.059 -14.026 622 HD1 TRP 83 HD1 TRP 83 3.416 -7.648 -10.561 623 HE1 TRP 83 HE1 TRP 83 4.743 -9.531 -9.451 624 HE3 TRP 83 HE3 TRP 83 6.841 -8.610 -14.233 625 HZ2 TRP 83 HZ2 TRP 83 6.846 -11.245 -10.007 626 HZ3 TRP 83 HZ3 TRP 83 8.476 -10.418 -13.849 627 HH2 TRP 83 HH2 TRP 83 8.456 -11.697 -11.762 628 H ASP 84 HN ASP 84 3.382 -3.428 -13.107 629 HA ASP 84 HA ASP 84 1.702 -2.589 -11.347 630 HB2 ASP 84 HB2 ASP 84 1.522 -1.692 -13.518 631 HB3 ASP 84 HB1 ASP 84 1.039 -3.233 -14.210 632 H MET 85 HN MET 85 0.624 -3.460 -9.807 633 HA MET 85 HA MET 85 -1.152 -5.742 -10.335 634 HB2 MET 85 HB2 MET 85 -1.658 -5.271 -7.763 635 HB3 MET 85 HB1 MET 85 -0.292 -6.239 -8.289 636 HG2 MET 85 HG2 MET 85 1.237 -4.530 -7.870 637 HG3 MET 85 HG1 MET 85 -0.019 -3.298 -7.809 638 HE1 MET 85 HE1 MET 85 0.453 -6.497 -4.516 639 HE2 MET 85 HE2 MET 85 1.509 -6.442 -5.927 640 HE3 MET 85 HE3 MET 85 -0.203 -6.825 -6.124 641 H THR 86 HN THR 86 -1.814 -3.118 -8.142 642 HA THR 86 HA THR 86 -3.304 -1.503 -7.883 643 HB THR 86 HB THR 86 -4.219 -0.338 -9.914 644 HG1 THR 86 HG1 THR 86 -2.333 -1.472 -11.577 645 HG21 THR 86 HG21 THR 86 -2.238 0.437 -8.743 646 HG22 THR 86 HG22 THR 86 -2.057 0.676 -10.481 647 HG23 THR 86 HG23 THR 86 -1.229 -0.661 -9.680 648 H MET 87 HN MET 87 -4.477 -3.695 -10.330 649 HA MET 87 HA MET 87 -7.199 -3.382 -9.216 650 HB2 MET 87 HB2 MET 87 -6.452 -4.223 -12.026 651 HB3 MET 87 HB1 MET 87 -8.075 -3.928 -11.418 652 HG2 MET 87 HG2 MET 87 -5.883 -1.897 -11.750 653 HG3 MET 87 HG1 MET 87 -7.336 -2.049 -12.734 654 HE1 MET 87 HE1 MET 87 -7.732 1.319 -10.661 655 HE2 MET 87 HE2 MET 87 -7.607 0.632 -12.281 656 HE3 MET 87 HE3 MET 87 -6.210 0.613 -11.204 657 H VAL 88 HN VAL 88 -4.604 -5.352 -9.526 658 HA VAL 88 HA VAL 88 -5.670 -7.945 -9.558 659 HB VAL 88 HB VAL 88 -3.162 -6.661 -8.525 660 HG11 VAL 88 HG11 VAL 88 -3.843 -9.575 -8.223 661 HG12 VAL 88 HG12 VAL 88 -3.722 -8.406 -6.912 662 HG13 VAL 88 HG13 VAL 88 -2.285 -8.823 -7.856 663 HG21 VAL 88 HG21 VAL 88 -2.125 -8.084 -10.230 664 HG22 VAL 88 HG22 VAL 88 -3.372 -7.031 -10.908 665 HG23 VAL 88 HG23 VAL 88 -3.712 -8.741 -10.629 666 H THR 89 HN THR 89 -5.937 -9.385 -7.621 667 HA THR 89 HA THR 89 -7.263 -7.768 -5.594 668 HB THR 89 HB THR 89 -8.453 -9.696 -6.539 669 HG1 THR 89 HG1 THR 89 -9.383 -10.235 -4.591 670 HG21 THR 89 HG21 THR 89 -6.808 -11.476 -4.824 671 HG22 THR 89 HG22 THR 89 -6.382 -11.194 -6.509 672 HG23 THR 89 HG23 THR 89 -7.941 -11.912 -6.107 673 H HIS 90 HN HIS 90 -6.898 -7.934 -3.450 674 HA HIS 90 HA HIS 90 -4.202 -7.830 -2.719 675 HB2 HIS 90 HB2 HIS 90 -6.196 -6.776 -1.538 676 HB3 HIS 90 HB1 HIS 90 -6.520 -8.368 -0.871 677 HD1 HIS 90 HD1 HIS 90 -3.537 -9.100 -0.131 678 HD2 HIS 90 HD2 HIS 90 -5.444 -5.522 0.778 679 HE1 HIS 90 HE1 HIS 90 -2.330 -8.178 1.870 680 HE2 HIS 90 HE2 HIS 90 -3.622 -6.118 2.506 681 H ASP 91 HN ASP 91 -6.490 -10.417 -2.744 682 HA ASP 91 HA ASP 91 -5.127 -12.168 -0.984 683 HB2 ASP 91 HB2 ASP 91 -7.437 -12.610 -1.452 684 HB3 ASP 91 HB1 ASP 91 -7.111 -12.692 -3.187 685 H GLN 92 HN GLN 92 -5.161 -11.829 -4.517 686 HA GLN 92 HA GLN 92 -3.328 -13.979 -4.808 687 HB2 GLN 92 HB2 GLN 92 -3.807 -13.832 -7.033 688 HB3 GLN 92 HB1 GLN 92 -5.305 -13.308 -6.281 689 HG2 GLN 92 HG2 GLN 92 -5.235 -11.422 -7.395 690 HG3 GLN 92 HG1 GLN 92 -3.645 -11.038 -6.726 691 HE21 GLN 92 HE21 GLN 92 -4.500 -13.816 -8.491 692 HE22 GLN 92 HE22 GLN 92 -3.437 -13.515 -9.778 693 H ALA 93 HN ALA 93 -3.285 -10.530 -4.563 694 HA ALA 93 HA ALA 93 -0.653 -10.147 -5.581 695 HB1 ALA 93 HB1 ALA 93 -2.206 -8.287 -5.459 696 HB2 ALA 93 HB2 ALA 93 -0.829 -7.968 -4.405 697 HB3 ALA 93 HB3 ALA 93 -2.363 -8.493 -3.715 698 H ARG 94 HN ARG 94 -2.182 -10.880 -2.522 699 HA ARG 94 HA ARG 94 0.161 -10.474 -0.975 700 HB2 ARG 94 HB2 ARG 94 -1.152 -10.917 0.871 701 HB3 ARG 94 HB1 ARG 94 -2.399 -10.485 -0.301 702 HG2 ARG 94 HG2 ARG 94 -2.771 -12.882 -0.739 703 HG3 ARG 94 HG1 ARG 94 -1.612 -13.259 0.548 704 HD2 ARG 94 HD2 ARG 94 -3.012 -12.562 2.209 705 HD3 ARG 94 HD1 ARG 94 -3.848 -11.407 1.167 706 HE ARG 94 HE ARG 94 -4.552 -13.838 0.151 707 HH11 ARG 94 HH11 ARG 94 -4.647 -12.477 3.367 708 HH12 ARG 94 HH12 ARG 94 -6.130 -13.266 3.806 709 HH21 ARG 94 HH21 ARG 94 -6.511 -14.841 0.676 710 HH22 ARG 94 HH22 ARG 94 -7.212 -14.601 2.258 711 H LYS 95 HN LYS 95 -1.245 -13.157 -2.690 712 HA LYS 95 HA LYS 95 0.480 -15.079 -1.430 713 HB2 LYS 95 HB2 LYS 95 -0.543 -16.738 -2.770 714 HB3 LYS 95 HB1 LYS 95 -1.814 -15.635 -2.290 715 HG2 LYS 95 HG2 LYS 95 -1.642 -14.570 -4.575 716 HG3 LYS 95 HG1 LYS 95 -0.523 -15.876 -4.998 717 HD2 LYS 95 HD2 LYS 95 -2.861 -16.347 -5.677 718 HD3 LYS 95 HD1 LYS 95 -2.228 -17.537 -4.538 719 HE2 LYS 95 HE2 LYS 95 -3.358 -16.381 -2.700 720 HE3 LYS 95 HE1 LYS 95 -3.984 -15.189 -3.836 721 HZ1 LYS 95 HZ1 LYS 95 -5.208 -16.969 -4.942 722 HZ2 LYS 95 HZ2 LYS 95 -5.651 -16.822 -3.321 723 HZ3 LYS 95 HZ3 LYS 95 -4.628 -18.087 -3.811 724 H ARG 96 HN ARG 96 0.720 -12.966 -4.189 725 HA ARG 96 HA ARG 96 2.954 -14.506 -5.227 726 HB2 ARG 96 HB2 ARG 96 3.023 -12.853 -7.028 727 HB3 ARG 96 HB1 ARG 96 1.453 -13.629 -6.861 728 HG2 ARG 96 HG2 ARG 96 0.448 -11.695 -6.552 729 HG3 ARG 96 HG1 ARG 96 1.601 -11.225 -5.296 730 HD2 ARG 96 HD2 ARG 96 1.748 -9.657 -7.085 731 HD3 ARG 96 HD1 ARG 96 3.205 -10.663 -7.045 732 HE ARG 96 HE ARG 96 2.306 -11.896 -8.938 733 HH11 ARG 96 HH11 ARG 96 0.853 -8.781 -8.262 734 HH12 ARG 96 HH12 ARG 96 0.223 -8.577 -9.862 735 HH21 ARG 96 HH21 ARG 96 1.488 -11.621 -11.061 736 HH22 ARG 96 HH22 ARG 96 0.578 -10.204 -11.460 737 H LEU 97 HN LEU 97 2.395 -11.464 -3.495 738 HA LEU 97 HA LEU 97 5.108 -10.656 -3.614 739 HB2 LEU 97 HB2 LEU 97 4.528 -9.070 -1.837 740 HB3 LEU 97 HB1 LEU 97 3.439 -8.999 -3.205 741 HG LEU 97 HG LEU 97 1.941 -10.556 -1.744 742 HD11 LEU 97 HD11 LEU 97 3.667 -10.907 -0.035 743 HD12 LEU 97 HD12 LEU 97 2.181 -10.221 0.624 744 HD13 LEU 97 HD13 LEU 97 3.590 -9.191 0.370 745 HD21 LEU 97 HD21 LEU 97 2.331 -7.619 -1.200 746 HD22 LEU 97 HD22 LEU 97 0.919 -8.555 -0.712 747 HD23 LEU 97 HD23 LEU 97 1.291 -8.345 -2.424 748 H THR 98 HN THR 98 3.335 -12.710 -1.402 749 HA THR 98 HA THR 98 5.960 -13.378 -0.254 750 HB THR 98 HB THR 98 4.554 -14.489 1.626 751 HG1 THR 98 HG1 THR 98 2.562 -13.590 0.238 752 HG21 THR 98 HG21 THR 98 4.819 -11.498 1.391 753 HG22 THR 98 HG22 THR 98 6.027 -12.619 2.020 754 HG23 THR 98 HG23 THR 98 4.515 -12.373 2.892 755 H LYS 99 HN LYS 99 5.775 -14.433 -2.489 756 HA LYS 99 HA LYS 99 4.303 -16.865 -2.640 757 HB2 LYS 99 HB2 LYS 99 5.607 -17.192 -4.745 758 HB3 LYS 99 HB1 LYS 99 4.731 -15.668 -4.665 759 HG2 LYS 99 HG2 LYS 99 6.872 -14.600 -3.884 760 HG3 LYS 99 HG1 LYS 99 7.681 -16.118 -4.278 761 HD2 LYS 99 HD2 LYS 99 6.109 -14.389 -6.182 762 HD3 LYS 99 HD1 LYS 99 7.868 -14.523 -6.112 763 HE2 LYS 99 HE2 LYS 99 7.797 -16.803 -6.773 764 HE3 LYS 99 HE1 LYS 99 6.044 -16.858 -6.589 765 HZ1 LYS 99 HZ1 LYS 99 5.838 -15.276 -8.410 766 HZ2 LYS 99 HZ2 LYS 99 6.659 -16.666 -8.915 767 HZ3 LYS 99 HZ3 LYS 99 7.525 -15.238 -8.598 768 H ARG 100 HN ARG 100 7.182 -15.946 -1.344 769 HA ARG 100 HA ARG 100 8.670 -17.031 0.027 770 HB2 ARG 100 HB2 ARG 100 6.511 -18.535 0.390 771 HB3 ARG 100 HB1 ARG 100 7.455 -19.710 -0.511 772 HG2 ARG 100 HG2 ARG 100 8.035 -20.257 1.629 773 HG3 ARG 100 HG1 ARG 100 9.306 -19.091 1.248 774 HD2 ARG 100 HD2 ARG 100 8.417 -18.572 3.428 775 HD3 ARG 100 HD1 ARG 100 7.917 -17.318 2.285 776 HE ARG 100 HE ARG 100 6.145 -19.528 3.123 777 HH11 ARG 100 HH11 ARG 100 6.679 -16.138 2.399 778 HH12 ARG 100 HH12 ARG 100 5.032 -15.688 2.691 779 HH21 ARG 100 HH21 ARG 100 3.974 -18.949 3.484 780 HH22 ARG 100 HH22 ARG 100 3.486 -17.291 3.298 781 H SER 101 HN SER 101 8.578 -17.027 -3.022 782 HA SER 101 HA SER 101 10.802 -18.873 -3.479 783 HB2 SER 101 HB2 SER 101 8.447 -18.402 -5.328 784 HB3 SER 101 HB1 SER 101 9.812 -19.464 -5.622 785 HG SER 101 HG SER 101 7.870 -19.727 -3.569 786 H GLU 102 HN GLU 102 10.404 -15.879 -3.054 787 HA GLU 102 HA GLU 102 11.426 -14.899 -5.594 788 HB2 GLU 102 HB2 GLU 102 10.572 -12.777 -5.078 789 HB3 GLU 102 HB1 GLU 102 9.304 -13.889 -4.587 790 HG2 GLU 102 HG2 GLU 102 11.277 -12.497 -2.787 791 HG3 GLU 102 HG1 GLU 102 9.557 -12.144 -2.947 792 H GLU 103 HN GLU 103 12.860 -13.086 -5.287 793 HA GLU 103 HA GLU 103 14.885 -13.627 -3.242 794 HB2 GLU 103 HB2 GLU 103 16.370 -12.359 -4.924 795 HB3 GLU 103 HB1 GLU 103 15.926 -14.020 -5.296 796 HG2 GLU 103 HG2 GLU 103 14.044 -13.091 -6.679 797 HG3 GLU 103 HG1 GLU 103 14.770 -11.499 -6.450 798 H VAL 104 HN VAL 104 12.474 -11.653 -4.116 799 HA VAL 104 HA VAL 104 12.808 -9.786 -2.104 800 HB VAL 104 HB VAL 104 14.823 -9.256 -3.539 801 HG11 VAL 104 HG11 VAL 104 14.439 -7.906 -5.531 802 HG12 VAL 104 HG12 VAL 104 12.698 -8.116 -5.331 803 HG13 VAL 104 HG13 VAL 104 13.715 -9.511 -5.678 804 HG21 VAL 104 HG21 VAL 104 14.052 -7.691 -1.874 805 HG22 VAL 104 HG22 VAL 104 12.805 -7.084 -2.963 806 HG23 VAL 104 HG23 VAL 104 14.509 -6.801 -3.324 807 H VAL 105 HN VAL 105 11.133 -7.989 -2.288 808 HA VAL 105 HA VAL 105 9.448 -8.422 -4.670 809 HB VAL 105 HB VAL 105 7.435 -8.071 -3.493 810 HG11 VAL 105 HG11 VAL 105 9.142 -9.980 -1.930 811 HG12 VAL 105 HG12 VAL 105 8.300 -10.323 -3.440 812 HG13 VAL 105 HG13 VAL 105 7.380 -9.975 -1.977 813 HG21 VAL 105 HG21 VAL 105 8.132 -6.369 -1.884 814 HG22 VAL 105 HG22 VAL 105 9.006 -7.595 -0.965 815 HG23 VAL 105 HG23 VAL 105 7.248 -7.676 -1.093 816 H ARG 106 HN ARG 106 9.292 -6.749 -5.895 817 HA ARG 106 HA ARG 106 10.299 -4.209 -4.939 818 HB2 ARG 106 HB2 ARG 106 9.436 -5.139 -7.675 819 HB3 ARG 106 HB1 ARG 106 9.988 -3.501 -7.322 820 HG2 ARG 106 HG2 ARG 106 12.042 -4.595 -6.369 821 HG3 ARG 106 HG1 ARG 106 11.527 -6.064 -7.187 822 HD2 ARG 106 HD2 ARG 106 11.606 -4.950 -9.317 823 HD3 ARG 106 HD1 ARG 106 11.945 -3.403 -8.531 824 HE ARG 106 HE ARG 106 14.033 -4.716 -7.675 825 HH11 ARG 106 HH11 ARG 106 12.601 -4.973 -10.864 826 HH12 ARG 106 HH12 ARG 106 14.101 -5.358 -11.641 827 HH21 ARG 106 HH21 ARG 106 15.985 -5.222 -8.680 828 HH22 ARG 106 HH22 ARG 106 16.037 -5.514 -10.394 829 H LEU 107 HN LEU 107 9.103 -2.535 -4.409 830 HA LEU 107 HA LEU 107 6.259 -2.661 -5.187 831 HB2 LEU 107 HB2 LEU 107 7.214 -0.976 -2.889 832 HB3 LEU 107 HB1 LEU 107 5.587 -1.504 -3.250 833 HG LEU 107 HG LEU 107 6.231 -2.706 -1.342 834 HD11 LEU 107 HD11 LEU 107 5.155 -4.262 -2.688 835 HD12 LEU 107 HD12 LEU 107 6.671 -5.072 -2.245 836 HD13 LEU 107 HD13 LEU 107 6.495 -4.319 -3.838 837 HD21 LEU 107 HD21 LEU 107 8.359 -3.965 -1.267 838 HD22 LEU 107 HD22 LEU 107 8.552 -2.212 -1.360 839 HD23 LEU 107 HD23 LEU 107 8.786 -3.202 -2.803 840 H LEU 108 HN LEU 108 6.168 -1.511 -6.887 841 HA LEU 108 HA LEU 108 7.436 1.111 -6.978 842 HB2 LEU 108 HB2 LEU 108 5.892 -0.577 -8.898 843 HB3 LEU 108 HB1 LEU 108 5.951 1.160 -9.151 844 HG LEU 108 HG LEU 108 8.583 0.068 -8.624 845 HD11 LEU 108 HD11 LEU 108 7.091 -0.970 -11.025 846 HD12 LEU 108 HD12 LEU 108 7.738 -1.928 -9.692 847 HD13 LEU 108 HD13 LEU 108 8.838 -1.075 -10.777 848 HD21 LEU 108 HD21 LEU 108 9.089 1.353 -10.619 849 HD22 LEU 108 HD22 LEU 108 8.104 2.280 -9.482 850 HD23 LEU 108 HD23 LEU 108 7.364 1.565 -10.923 851 H VAL 109 HN VAL 109 6.422 2.712 -5.937 852 HA VAL 109 HA VAL 109 3.659 2.335 -5.177 853 HB VAL 109 HB VAL 109 5.053 1.092 -3.620 854 HG11 VAL 109 HG11 VAL 109 6.446 3.693 -3.066 855 HG12 VAL 109 HG12 VAL 109 7.148 2.264 -3.826 856 HG13 VAL 109 HG13 VAL 109 6.648 2.208 -2.136 857 HG21 VAL 109 HG21 VAL 109 4.013 3.579 -2.357 858 HG22 VAL 109 HG22 VAL 109 4.310 2.032 -1.562 859 HG23 VAL 109 HG23 VAL 109 3.059 2.164 -2.796 860 H THR 110 HN THR 110 3.025 4.129 -3.797 861 HA THR 110 HA THR 110 4.150 6.689 -4.663 862 HB THR 110 HB THR 110 1.693 7.453 -4.936 863 HG1 THR 110 HG1 THR 110 1.467 4.639 -4.985 864 HG21 THR 110 HG21 THR 110 3.298 7.320 -6.768 865 HG22 THR 110 HG22 THR 110 1.681 6.817 -7.276 866 HG23 THR 110 HG23 THR 110 2.921 5.605 -6.959 867 H ARG 111 HN ARG 111 4.492 7.904 -2.970 868 HA ARG 111 HA ARG 111 2.455 7.922 -0.871 869 HB2 ARG 111 HB2 ARG 111 4.211 8.255 0.835 870 HB3 ARG 111 HB1 ARG 111 4.279 6.673 0.071 871 HG2 ARG 111 HG2 ARG 111 6.179 7.271 -1.194 872 HG3 ARG 111 HG1 ARG 111 6.000 8.979 -0.772 873 HD2 ARG 111 HD2 ARG 111 6.747 8.667 1.363 874 HD3 ARG 111 HD1 ARG 111 6.336 6.956 1.381 875 HE ARG 111 HE ARG 111 8.261 6.663 -0.175 876 HH11 ARG 111 HH11 ARG 111 8.140 9.468 1.909 877 HH12 ARG 111 HH12 ARG 111 9.872 9.582 2.063 878 HH21 ARG 111 HH21 ARG 111 10.540 6.793 0.051 879 HH22 ARG 111 HH22 ARG 111 11.225 8.082 0.998 880 H GLN 112 HN GLN 112 2.797 9.905 0.559 881 HA GLN 112 HA GLN 112 3.446 12.189 -1.159 882 HB2 GLN 112 HB2 GLN 112 1.751 12.093 1.323 883 HB3 GLN 112 HB1 GLN 112 2.052 13.511 0.327 884 HG2 GLN 112 HG2 GLN 112 0.615 11.005 -0.517 885 HG3 GLN 112 HG1 GLN 112 -0.134 12.544 -0.118 886 HE21 GLN 112 HE21 GLN 112 1.779 10.797 -2.431 887 HE22 GLN 112 HE22 GLN 112 1.596 11.914 -3.743 888 H SER 113 HN SER 113 3.395 11.259 2.161 889 HA SER 113 HA SER 113 4.829 11.454 3.901 890 HB2 SER 113 HB2 SER 113 6.606 12.287 1.672 891 HB3 SER 113 HB1 SER 113 7.173 12.262 3.345 892 HG SER 113 HG SER 113 6.356 9.977 3.286 893 H LEU 114 HN LEU 114 3.217 13.643 2.637 894 HA LEU 114 HA LEU 114 4.386 15.891 4.127 895 HB2 LEU 114 HB2 LEU 114 3.261 15.727 1.407 896 HB3 LEU 114 HB1 LEU 114 2.951 17.191 2.325 897 HG LEU 114 HG LEU 114 4.891 17.729 1.144 898 HD11 LEU 114 HD11 LEU 114 5.298 18.309 3.386 899 HD12 LEU 114 HD12 LEU 114 6.773 17.492 2.858 900 HD13 LEU 114 HD13 LEU 114 5.586 16.631 3.850 901 HD21 LEU 114 HD21 LEU 114 6.845 16.118 1.040 902 HD22 LEU 114 HD22 LEU 114 5.415 15.655 0.117 903 HD23 LEU 114 HD23 LEU 114 5.744 14.884 1.669 904 H GLN 115 HN GLN 115 2.782 13.990 5.039 905 HA GLN 115 HA GLN 115 0.036 14.683 5.135 906 HB2 GLN 115 HB2 GLN 115 -0.129 13.001 6.850 907 HB3 GLN 115 HB1 GLN 115 0.909 12.398 5.572 908 HG2 GLN 115 HG2 GLN 115 2.869 12.811 6.890 909 HG3 GLN 115 HG1 GLN 115 1.920 13.634 8.128 910 HE21 GLN 115 HE21 GLN 115 3.669 11.348 8.414 911 HE22 GLN 115 HE22 GLN 115 2.698 10.065 9.054 912 H LYS 116 HN LYS 116 -1.103 15.410 7.084 913 HA LYS 116 HA LYS 116 0.309 17.575 8.377 914 HB2 LYS 116 HB2 LYS 116 -2.525 16.564 8.669 915 HB3 LYS 116 HB1 LYS 116 -1.882 17.937 9.557 916 HG2 LYS 116 HG2 LYS 116 -1.435 19.077 7.413 917 HG3 LYS 116 HG1 LYS 116 -2.177 17.713 6.570 918 HD2 LYS 116 HD2 LYS 116 -4.280 18.125 7.759 919 HD3 LYS 116 HD1 LYS 116 -3.539 19.484 8.602 920 HE2 LYS 116 HE2 LYS 116 -3.858 19.280 5.611 921 HE3 LYS 116 HE1 LYS 116 -4.957 20.151 6.678 922 HZ1 LYS 116 HZ1 LYS 116 -3.415 21.682 5.713 923 HZ2 LYS 116 HZ2 LYS 116 -2.085 20.755 6.207 924 HZ3 LYS 116 HZ3 LYS 116 -3.049 21.538 7.365 925 H ALA 117 HN ALA 117 1.759 16.943 9.854 926 HA ALA 117 HA ALA 117 0.911 15.016 11.900 927 HB1 ALA 117 HB1 ALA 117 3.709 15.910 11.180 928 HB2 ALA 117 HB2 ALA 117 2.986 14.355 10.767 929 HB3 ALA 117 HB3 ALA 117 3.306 14.759 12.453 930 H VAL 118 HN VAL 118 0.753 17.899 11.163 931 HA VAL 118 HA VAL 118 1.274 19.113 13.755 932 HB VAL 118 HB VAL 118 0.989 20.253 10.983 933 HG11 VAL 118 HG11 VAL 118 1.203 22.474 11.919 934 HG12 VAL 118 HG12 VAL 118 1.142 21.799 13.547 935 HG13 VAL 118 HG13 VAL 118 -0.261 21.667 12.486 936 HG21 VAL 118 HG21 VAL 118 3.213 20.471 12.999 937 HG22 VAL 118 HG22 VAL 118 3.214 21.135 11.365 938 HG23 VAL 118 HG23 VAL 118 3.191 19.388 11.605 939 H GLN 119 HN GLN 119 -0.924 17.891 11.739 940 HA GLN 119 HA GLN 119 -3.156 17.763 11.484 941 HB2 GLN 119 HB2 GLN 119 -2.835 18.391 14.386 942 HB3 GLN 119 HB1 GLN 119 -4.433 18.140 13.691 943 HG2 GLN 119 HG2 GLN 119 -2.161 16.164 13.572 944 HG3 GLN 119 HG1 GLN 119 -3.469 16.123 14.756 945 HE21 GLN 119 HE21 GLN 119 -2.525 15.493 11.492 946 HE22 GLN 119 HE22 GLN 119 -4.001 14.717 10.993 947 H GLN 120 HN GLN 120 -5.286 19.143 12.525 948 HA GLN 120 HA GLN 120 -4.947 21.972 12.217 949 HB2 GLN 120 HB2 GLN 120 -4.917 20.914 9.886 950 HB3 GLN 120 HB1 GLN 120 -6.612 20.536 10.168 951 HG2 GLN 120 HG2 GLN 120 -7.044 22.927 10.543 952 HG3 GLN 120 HG1 GLN 120 -5.360 23.259 10.139 953 HE21 GLN 120 HE21 GLN 120 -8.417 22.157 8.949 954 HE22 GLN 120 HE22 GLN 120 -8.077 22.366 7.263 955 H SER 121 HN SER 121 -6.584 22.995 13.300 956 HA SER 121 HA SER 121 -8.716 21.245 14.308 957 HB2 SER 121 HB2 SER 121 -8.840 22.995 16.167 958 HB3 SER 121 HB1 SER 121 -7.407 21.967 16.135 959 HG SER 121 HG SER 121 -7.280 24.460 16.310 960 H MET 122 HN MET 122 -8.115 24.106 12.477 961 HA MET 122 HA MET 122 -11.002 24.690 12.520 962 HB2 MET 122 HB2 MET 122 -10.548 27.028 12.196 963 HB3 MET 122 HB1 MET 122 -9.631 26.481 13.593 964 HG2 MET 122 HG2 MET 122 -8.473 26.763 10.832 965 HG3 MET 122 HG1 MET 122 -8.427 28.035 12.052 966 HE1 MET 122 HE1 MET 122 -6.148 26.527 14.808 967 HE2 MET 122 HE2 MET 122 -7.909 26.510 14.741 968 HE3 MET 122 HE3 MET 122 -7.024 27.951 14.240 969 H LEU 123 HN LEU 123 -11.999 25.166 10.564 970 HA LEU 123 HA LEU 123 -10.407 24.557 8.171 971 HB2 LEU 123 HB2 LEU 123 -13.375 24.414 8.690 972 HB3 LEU 123 HB1 LEU 123 -12.696 24.310 7.079 973 HG LEU 123 HG LEU 123 -13.159 22.092 7.789 974 HD11 LEU 123 HD11 LEU 123 -10.955 21.040 7.776 975 HD12 LEU 123 HD12 LEU 123 -10.210 22.603 8.116 976 HD13 LEU 123 HD13 LEU 123 -11.065 22.345 6.595 977 HD21 LEU 123 HD21 LEU 123 -11.643 22.722 10.316 978 HD22 LEU 123 HD22 LEU 123 -12.206 21.117 9.852 979 HD23 LEU 123 HD23 LEU 123 -13.371 22.404 10.169 980 H SER 124 HN SER 124 -9.493 26.578 7.922 981 HA SER 124 HA SER 124 -9.299 28.725 7.219 982 HB2 SER 124 HB2 SER 124 -12.109 28.318 6.146 983 HB3 SER 124 HB1 SER 124 -10.981 29.586 5.659 984 HG SER 124 HG SER 124 -10.136 26.929 5.509 985 H1 LYS 161 HN LYS 161 -11.631 1.543 -1.968 986 HA LYS 161 HA LYS 161 -12.646 2.124 0.659 987 HB2 LYS 161 HB2 LYS 161 -14.770 1.318 -0.166 988 HB3 LYS 161 HB1 LYS 161 -14.029 2.340 -1.391 989 HG2 LYS 161 HG2 LYS 161 -13.199 -0.314 -1.888 990 HG3 LYS 161 HG1 LYS 161 -14.943 -0.345 -1.605 991 HD2 LYS 161 HD2 LYS 161 -15.365 1.113 -3.380 992 HD3 LYS 161 HD1 LYS 161 -13.684 1.646 -3.469 993 HE2 LYS 161 HE2 LYS 161 -14.603 -1.160 -4.062 994 HE3 LYS 161 HE1 LYS 161 -14.373 0.083 -5.293 995 HZ1 LYS 161 HZ1 LYS 161 -12.039 0.273 -4.534 996 HZ2 LYS 161 HZ2 LYS 161 -12.412 -1.262 -5.162 997 HZ3 LYS 161 HZ3 LYS 161 -12.293 -1.042 -3.490 998 H GLU 162 HN GLU 162 -13.234 0.719 2.256 999 HA GLU 162 HA GLU 162 -13.373 -1.147 3.523 1000 HB2 GLU 162 HB2 GLU 162 -14.338 -2.287 1.528 1001 HB3 GLU 162 HB1 GLU 162 -12.712 -2.760 1.056 1002 HG2 GLU 162 HG2 GLU 162 -13.996 -4.532 2.224 1003 HG3 GLU 162 HG1 GLU 162 -12.464 -4.123 2.993 1004 H ASN 163 HN ASN 163 -11.992 -2.405 4.756 1005 HA ASN 163 HA ASN 163 -9.153 -1.930 4.116 1006 HB2 ASN 163 HB2 ASN 163 -10.594 -1.642 6.741 1007 HB3 ASN 163 HB1 ASN 163 -8.848 -1.870 6.670 1008 HD21 ASN 163 HD21 ASN 163 -11.483 0.285 6.091 1009 HD22 ASN 163 HD22 ASN 163 -10.526 1.684 5.703 1010 H LEU 164 HN LEU 164 -8.637 -3.902 3.318 1011 HA LEU 164 HA LEU 164 -8.580 -6.048 5.310 1012 HB2 LEU 164 HB2 LEU 164 -9.567 -7.113 3.556 1013 HB3 LEU 164 HB1 LEU 164 -8.880 -6.018 2.368 1014 HG LEU 164 HG LEU 164 -6.697 -7.146 2.695 1015 HD11 LEU 164 HD11 LEU 164 -6.640 -9.364 3.708 1016 HD12 LEU 164 HD12 LEU 164 -8.327 -9.192 4.197 1017 HD13 LEU 164 HD13 LEU 164 -7.095 -8.139 4.893 1018 HD21 LEU 164 HD21 LEU 164 -8.090 -7.650 0.801 1019 HD22 LEU 164 HD22 LEU 164 -8.988 -8.839 1.743 1020 HD23 LEU 164 HD23 LEU 164 -7.285 -9.114 1.362 1021 H GLU 165 HN GLU 165 -6.696 -5.706 6.396 1022 HA GLU 165 HA GLU 165 -4.330 -5.130 4.769 1023 HB2 GLU 165 HB2 GLU 165 -3.319 -4.128 6.588 1024 HB3 GLU 165 HB1 GLU 165 -5.002 -3.734 6.889 1025 HG2 GLU 165 HG2 GLU 165 -5.172 -5.520 8.507 1026 HG3 GLU 165 HG1 GLU 165 -3.521 -6.030 8.138 1027 H SER 166 HN SER 166 -2.376 -6.316 5.243 1028 HA SER 166 HA SER 166 -2.738 -8.912 6.524 1029 HB2 SER 166 HB2 SER 166 -1.752 -8.671 3.669 1030 HB3 SER 166 HB1 SER 166 -2.027 -10.166 4.564 1031 HG SER 166 HG SER 166 -4.299 -9.077 4.732 1032 H MET 167 HN MET 167 -0.997 -9.291 7.742 1033 HA MET 167 HA MET 167 1.440 -7.831 7.405 1034 HB2 MET 167 HB2 MET 167 2.338 -9.305 9.188 1035 HB3 MET 167 HB1 MET 167 0.832 -8.515 9.639 1036 HG2 MET 167 HG2 MET 167 -0.389 -10.574 9.177 1037 HG3 MET 167 HG1 MET 167 1.116 -11.365 8.713 1038 HE1 MET 167 HE1 MET 167 -0.754 -9.518 11.634 1039 HE2 MET 167 HE2 MET 167 0.837 -8.758 11.635 1040 HE3 MET 167 HE3 MET 167 0.347 -9.784 12.985 1041 H VAL 168 HN VAL 168 3.082 -8.292 6.159 1042 HA VAL 168 HA VAL 168 3.347 -10.962 5.005 1043 HB VAL 168 HB VAL 168 3.638 -9.851 2.730 1044 HG11 VAL 168 HG11 VAL 168 0.903 -9.792 4.004 1045 HG12 VAL 168 HG12 VAL 168 1.681 -11.196 3.273 1046 HG13 VAL 168 HG13 VAL 168 1.227 -9.817 2.272 1047 HG21 VAL 168 HG21 VAL 168 2.162 -7.607 4.098 1048 HG22 VAL 168 HG22 VAL 168 2.562 -7.703 2.382 1049 HG23 VAL 168 HG23 VAL 168 3.847 -7.554 3.586 Start of MODEL 6 1 H1 MET 1 HT1 MET 1 -10.678 27.147 -24.709 2 H2 MET 1 HT2 MET 1 -11.400 26.961 -23.186 3 H3 MET 1 HT3 MET 1 -10.740 25.617 -23.974 4 HA MET 1 HA MET 1 -8.531 26.646 -23.841 5 HB2 MET 1 HB2 MET 1 -9.990 28.612 -22.056 6 HB3 MET 1 HB1 MET 1 -8.247 28.499 -22.236 7 HG2 MET 1 HG2 MET 1 -8.436 29.112 -24.586 8 HG3 MET 1 HG1 MET 1 -10.187 29.216 -24.419 9 HE1 MET 1 HE1 MET 1 -8.361 31.593 -25.577 10 HE2 MET 1 HE2 MET 1 -9.107 32.979 -24.780 11 HE3 MET 1 HE3 MET 1 -10.116 31.687 -25.432 12 H SER 2 HN SER 2 -8.050 24.714 -22.910 13 HA SER 2 HA SER 2 -9.013 24.237 -20.186 14 HB2 SER 2 HB2 SER 2 -8.021 21.885 -20.697 15 HB3 SER 2 HB1 SER 2 -9.539 22.357 -21.457 16 HG SER 2 HG SER 2 -8.332 21.585 -23.097 17 H TYR 3 HN TYR 3 -7.747 24.659 -18.567 18 HA TYR 3 HA TYR 3 -4.994 23.829 -18.592 19 HB2 TYR 3 HB2 TYR 3 -4.019 25.950 -17.984 20 HB3 TYR 3 HB1 TYR 3 -4.871 26.144 -19.507 21 HD1 TYR 3 HD1 TYR 3 -7.011 27.424 -19.572 22 HD2 TYR 3 HD2 TYR 3 -4.668 27.164 -16.029 23 HE1 TYR 3 HE1 TYR 3 -8.221 29.349 -18.631 24 HE2 TYR 3 HE2 TYR 3 -5.873 29.087 -15.085 25 HH TYR 3 HH TYR 3 -8.737 30.323 -16.473 26 H ILE 4 HN ILE 4 -4.089 23.783 -16.429 27 HA ILE 4 HA ILE 4 -6.162 23.867 -14.334 28 HB ILE 4 HB ILE 4 -4.191 21.600 -14.692 29 HG12 ILE 4 HG12 ILE 4 -7.181 21.613 -15.172 30 HG13 ILE 4 HG11 ILE 4 -5.963 21.604 -16.442 31 HG21 ILE 4 HG21 ILE 4 -6.497 21.956 -12.782 32 HG22 ILE 4 HG22 ILE 4 -4.783 22.025 -12.370 33 HG23 ILE 4 HG23 ILE 4 -5.494 20.509 -12.924 34 HD11 ILE 4 HD11 ILE 4 -6.865 19.394 -16.112 35 HD12 ILE 4 HD12 ILE 4 -6.433 19.440 -14.402 36 HD13 ILE 4 HD13 ILE 4 -5.170 19.430 -15.634 37 HA PRO 5 HA PRO 5 -2.531 25.823 -12.477 38 HB2 PRO 5 HB2 PRO 5 -4.278 27.514 -10.996 39 HB3 PRO 5 HB1 PRO 5 -3.324 27.944 -12.413 40 HG2 PRO 5 HG2 PRO 5 -6.094 27.839 -12.336 41 HG3 PRO 5 HG1 PRO 5 -5.110 27.769 -13.812 42 HD2 PRO 5 HD2 PRO 5 -6.382 25.542 -12.268 43 HD3 PRO 5 HD1 PRO 5 -6.217 25.752 -14.027 44 H GLY 6 HN GLY 6 -4.627 23.702 -11.483 45 HA2 GLY 6 HA2 GLY 6 -3.538 23.596 -8.766 46 HA3 GLY 6 HA1 GLY 6 -5.293 23.549 -8.967 47 H GLN 7 HN GLN 7 -2.547 22.029 -10.634 48 HA GLN 7 HA GLN 7 -3.927 19.608 -11.082 49 HB2 GLN 7 HB2 GLN 7 -1.745 18.745 -11.824 50 HB3 GLN 7 HB1 GLN 7 -2.104 20.308 -12.538 51 HG2 GLN 7 HG2 GLN 7 -0.644 21.367 -10.856 52 HG3 GLN 7 HG1 GLN 7 -0.238 19.766 -10.241 53 HE21 GLN 7 HE21 GLN 7 1.476 21.815 -11.414 54 HE22 GLN 7 HE22 GLN 7 2.257 21.067 -12.768 55 HA PRO 8 HA PRO 8 -3.589 17.347 -7.363 56 HB2 PRO 8 HB2 PRO 8 -2.566 15.064 -8.961 57 HB3 PRO 8 HB1 PRO 8 -3.971 15.154 -7.893 58 HG2 PRO 8 HG2 PRO 8 -4.284 15.128 -10.533 59 HG3 PRO 8 HG1 PRO 8 -5.295 16.167 -9.513 60 HD2 PRO 8 HD2 PRO 8 -2.929 16.897 -11.196 61 HD3 PRO 8 HD1 PRO 8 -4.455 17.777 -10.963 62 H VAL 9 HN VAL 9 -2.152 16.274 -5.909 63 HA VAL 9 HA VAL 9 0.375 17.385 -5.743 64 HB VAL 9 HB VAL 9 0.659 15.739 -3.912 65 HG11 VAL 9 HG11 VAL 9 -1.950 17.220 -3.928 66 HG12 VAL 9 HG12 VAL 9 -0.380 17.891 -3.485 67 HG13 VAL 9 HG13 VAL 9 -1.115 16.635 -2.489 68 HG21 VAL 9 HG21 VAL 9 -2.057 14.790 -4.765 69 HG22 VAL 9 HG22 VAL 9 -1.220 14.300 -3.293 70 HG23 VAL 9 HG23 VAL 9 -0.556 13.868 -4.871 71 H THR 10 HN THR 10 2.255 15.700 -5.126 72 HA THR 10 HA THR 10 2.685 14.353 -7.659 73 HB THR 10 HB THR 10 5.045 14.947 -7.470 74 HG1 THR 10 HG1 THR 10 4.811 15.349 -5.075 75 HG21 THR 10 HG21 THR 10 3.566 16.286 -8.827 76 HG22 THR 10 HG22 THR 10 4.720 17.354 -8.021 77 HG23 THR 10 HG23 THR 10 3.061 17.224 -7.416 78 H ALA 11 HN ALA 11 2.397 12.473 -7.218 79 HA ALA 11 HA ALA 11 3.056 11.039 -4.864 80 HB1 ALA 11 HB1 ALA 11 2.265 9.082 -6.048 81 HB2 ALA 11 HB2 ALA 11 2.328 9.947 -7.583 82 HB3 ALA 11 HB3 ALA 11 1.166 10.430 -6.347 83 H VAL 12 HN VAL 12 5.015 10.741 -4.337 84 HA VAL 12 HA VAL 12 7.257 10.478 -6.018 85 HB VAL 12 HB VAL 12 6.851 9.396 -3.239 86 HG11 VAL 12 HG11 VAL 12 9.542 10.079 -4.309 87 HG12 VAL 12 HG12 VAL 12 8.786 8.562 -4.795 88 HG13 VAL 12 HG13 VAL 12 9.076 8.888 -3.080 89 HG21 VAL 12 HG21 VAL 12 8.125 11.411 -2.507 90 HG22 VAL 12 HG22 VAL 12 6.532 11.762 -3.170 91 HG23 VAL 12 HG23 VAL 12 7.977 12.041 -4.151 92 H VAL 13 HN VAL 13 7.380 8.905 -7.474 93 HA VAL 13 HA VAL 13 6.290 6.272 -6.894 94 HB VAL 13 HB VAL 13 7.786 7.125 -9.367 95 HG11 VAL 13 HG11 VAL 13 7.767 4.743 -9.105 96 HG12 VAL 13 HG12 VAL 13 6.621 5.170 -10.376 97 HG13 VAL 13 HG13 VAL 13 6.038 4.749 -8.766 98 HG21 VAL 13 HG21 VAL 13 4.816 7.087 -8.856 99 HG22 VAL 13 HG22 VAL 13 5.565 7.336 -10.433 100 HG23 VAL 13 HG23 VAL 13 5.813 8.513 -9.142 101 H GLN 14 HN GLN 14 7.485 5.070 -5.659 102 HA GLN 14 HA GLN 14 10.380 5.301 -5.810 103 HB2 GLN 14 HB2 GLN 14 9.564 6.247 -3.766 104 HB3 GLN 14 HB1 GLN 14 8.534 4.854 -3.470 105 HG2 GLN 14 HG2 GLN 14 10.416 3.471 -3.112 106 HG3 GLN 14 HG1 GLN 14 11.528 4.766 -3.549 107 HE21 GLN 14 HE21 GLN 14 8.615 5.132 -1.630 108 HE22 GLN 14 HE22 GLN 14 9.426 5.562 -0.153 109 H ARG 15 HN ARG 15 11.519 3.481 -5.935 110 HA ARG 15 HA ARG 15 10.064 1.017 -6.403 111 HB2 ARG 15 HB2 ARG 15 12.793 1.964 -7.296 112 HB3 ARG 15 HB1 ARG 15 12.048 0.443 -7.720 113 HG2 ARG 15 HG2 ARG 15 10.157 2.335 -8.431 114 HG3 ARG 15 HG1 ARG 15 11.704 3.031 -8.918 115 HD2 ARG 15 HD2 ARG 15 12.256 0.969 -10.119 116 HD3 ARG 15 HD1 ARG 15 10.706 0.284 -9.622 117 HE ARG 15 HE ARG 15 9.864 2.454 -10.896 118 HH11 ARG 15 HH11 ARG 15 12.434 0.264 -11.848 119 HH12 ARG 15 HH12 ARG 15 12.109 0.428 -13.548 120 HH21 ARG 15 HH21 ARG 15 9.472 2.705 -13.114 121 HH22 ARG 15 HH22 ARG 15 10.421 1.809 -14.261 122 H VAL 16 HN VAL 16 10.304 -0.522 -4.890 123 HA VAL 16 HA VAL 16 12.639 -0.306 -3.144 124 HB VAL 16 HB VAL 16 9.977 -1.180 -2.065 125 HG11 VAL 16 HG11 VAL 16 12.476 -0.076 -0.805 126 HG12 VAL 16 HG12 VAL 16 11.830 -1.712 -0.669 127 HG13 VAL 16 HG13 VAL 16 10.972 -0.359 0.071 128 HG21 VAL 16 HG21 VAL 16 9.604 1.069 -1.213 129 HG22 VAL 16 HG22 VAL 16 9.576 1.003 -2.979 130 HG23 VAL 16 HG23 VAL 16 10.993 1.641 -2.135 131 H GLU 17 HN GLU 17 13.470 -2.219 -2.498 132 HA GLU 17 HA GLU 17 12.117 -4.684 -3.315 133 HB2 GLU 17 HB2 GLU 17 15.108 -4.242 -3.014 134 HB3 GLU 17 HB1 GLU 17 14.316 -5.700 -3.610 135 HG2 GLU 17 HG2 GLU 17 13.703 -4.704 -5.615 136 HG3 GLU 17 HG1 GLU 17 13.896 -3.076 -4.977 137 H ILE 18 HN ILE 18 11.269 -5.498 -1.487 138 HA ILE 18 HA ILE 18 12.518 -4.924 1.083 139 HB ILE 18 HB ILE 18 9.670 -5.566 0.326 140 HG12 ILE 18 HG12 ILE 18 10.723 -3.088 1.668 141 HG13 ILE 18 HG11 ILE 18 10.568 -3.246 -0.085 142 HG21 ILE 18 HG21 ILE 18 9.126 -5.266 2.699 143 HG22 ILE 18 HG22 ILE 18 10.847 -5.137 3.068 144 HG23 ILE 18 HG23 ILE 18 10.192 -6.642 2.422 145 HD11 ILE 18 HD11 ILE 18 8.381 -3.400 1.960 146 HD12 ILE 18 HD12 ILE 18 8.181 -3.807 0.254 147 HD13 ILE 18 HD13 ILE 18 8.620 -2.159 0.724 148 H HIS 19 HN HIS 19 13.567 -6.518 1.931 149 HA HIS 19 HA HIS 19 12.545 -9.214 1.527 150 HB2 HIS 19 HB2 HIS 19 14.892 -9.928 1.562 151 HB3 HIS 19 HB1 HIS 19 14.496 -8.883 0.231 152 HD1 HIS 19 HD1 HIS 19 16.485 -8.877 3.445 153 HD2 HIS 19 HD2 HIS 19 15.910 -6.539 0.059 154 HE1 HIS 19 HE1 HIS 19 18.311 -7.153 3.495 155 HE2 HIS 19 HE2 HIS 19 18.060 -5.875 1.337 156 H LYS 20 HN LYS 20 11.442 -9.432 3.463 157 HA LYS 20 HA LYS 20 12.746 -8.890 5.951 158 HB2 LYS 20 HB2 LYS 20 10.338 -8.668 5.797 159 HB3 LYS 20 HB1 LYS 20 10.188 -10.350 5.312 160 HG2 LYS 20 HG2 LYS 20 9.579 -9.929 7.662 161 HG3 LYS 20 HG1 LYS 20 10.878 -11.102 7.460 162 HD2 LYS 20 HD2 LYS 20 12.521 -9.336 7.980 163 HD3 LYS 20 HD1 LYS 20 11.193 -8.201 8.238 164 HE2 LYS 20 HE2 LYS 20 10.402 -9.436 10.113 165 HE3 LYS 20 HE1 LYS 20 11.483 -10.782 9.762 166 HZ1 LYS 20 HZ1 LYS 20 12.304 -8.064 10.646 167 HZ2 LYS 20 HZ2 LYS 20 13.367 -9.320 10.252 168 HZ3 LYS 20 HZ3 LYS 20 12.338 -9.474 11.590 169 H LEU 21 HN LEU 21 11.182 -11.987 5.896 170 HA LEU 21 HA LEU 21 13.696 -13.352 5.357 171 HB2 LEU 21 HB2 LEU 21 13.036 -12.675 7.968 172 HB3 LEU 21 HB1 LEU 21 12.551 -14.355 7.830 173 HG LEU 21 HG LEU 21 14.716 -14.494 8.648 174 HD11 LEU 21 HD11 LEU 21 14.466 -15.934 6.715 175 HD12 LEU 21 HD12 LEU 21 16.128 -15.358 6.847 176 HD13 LEU 21 HD13 LEU 21 15.037 -14.644 5.660 177 HD21 LEU 21 HD21 LEU 21 16.608 -13.149 7.825 178 HD22 LEU 21 HD22 LEU 21 15.304 -12.158 8.481 179 HD23 LEU 21 HD23 LEU 21 15.506 -12.306 6.736 180 H ARG 22 HN ARG 22 12.966 -14.798 3.865 181 HA ARG 22 HA ARG 22 10.775 -16.531 4.468 182 HB2 ARG 22 HB2 ARG 22 11.543 -16.100 2.124 183 HB3 ARG 22 HB1 ARG 22 13.075 -16.865 2.516 184 HG2 ARG 22 HG2 ARG 22 10.466 -18.339 2.699 185 HG3 ARG 22 HG1 ARG 22 11.399 -18.233 1.205 186 HD2 ARG 22 HD2 ARG 22 13.351 -19.148 2.466 187 HD3 ARG 22 HD1 ARG 22 12.263 -19.399 3.823 188 HE ARG 22 HE ARG 22 11.030 -20.969 2.391 189 HH11 ARG 22 HH11 ARG 22 14.307 -20.089 1.510 190 HH12 ARG 22 HH12 ARG 22 14.658 -21.612 0.745 191 HH21 ARG 22 HH21 ARG 22 11.479 -22.990 1.389 192 HH22 ARG 22 HH22 ARG 22 13.031 -23.258 0.664 193 H GLN 23 HN GLN 23 10.937 -17.870 6.163 194 HA GLN 23 HA GLN 23 13.588 -18.757 6.983 195 HB2 GLN 23 HB2 GLN 23 11.417 -18.962 8.942 196 HB3 GLN 23 HB1 GLN 23 13.038 -18.307 9.125 197 HG2 GLN 23 HG2 GLN 23 12.247 -16.298 7.844 198 HG3 GLN 23 HG1 GLN 23 10.617 -16.938 8.018 199 HE21 GLN 23 HE21 GLN 23 11.732 -14.460 8.960 200 HE22 GLN 23 HE22 GLN 23 11.502 -14.446 10.690 201 H GLY 24 HN GLY 24 12.949 -20.193 5.133 202 HA2 GLY 24 HA2 GLY 24 12.767 -22.427 4.589 203 HA3 GLY 24 HA1 GLY 24 12.441 -22.737 6.289 204 H GLU 25 HN GLU 25 10.477 -23.037 6.978 205 HA GLU 25 HA GLU 25 8.366 -23.411 5.072 206 HB2 GLU 25 HB2 GLU 25 8.599 -23.711 8.055 207 HB3 GLU 25 HB1 GLU 25 7.052 -23.819 7.241 208 HG2 GLU 25 HG2 GLU 25 7.901 -26.027 7.588 209 HG3 GLU 25 HG1 GLU 25 7.968 -25.669 5.863 210 H ASN 26 HN ASN 26 9.638 -20.754 6.460 211 HA ASN 26 HA ASN 26 7.080 -19.439 6.788 212 HB2 ASN 26 HB2 ASN 26 9.781 -18.782 7.897 213 HB3 ASN 26 HB1 ASN 26 8.403 -17.724 7.996 214 HD21 ASN 26 HD21 ASN 26 9.764 -20.671 8.930 215 HD22 ASN 26 HD22 ASN 26 8.793 -20.949 10.355 216 H LEU 27 HN LEU 27 6.668 -17.905 5.709 217 HA LEU 27 HA LEU 27 8.604 -16.448 4.055 218 HB2 LEU 27 HB2 LEU 27 5.790 -17.368 3.468 219 HB3 LEU 27 HB1 LEU 27 6.416 -15.931 2.716 220 HG LEU 27 HG LEU 27 6.574 -17.832 1.219 221 HD11 LEU 27 HD11 LEU 27 8.832 -17.589 0.543 222 HD12 LEU 27 HD12 LEU 27 9.341 -17.121 2.165 223 HD13 LEU 27 HD13 LEU 27 8.317 -16.038 1.214 224 HD21 LEU 27 HD21 LEU 27 8.292 -19.052 3.379 225 HD22 LEU 27 HD22 LEU 27 8.111 -19.689 1.738 226 HD23 LEU 27 HD23 LEU 27 6.719 -19.632 2.817 227 H ILE 28 HN ILE 28 8.878 -14.641 5.149 228 HA ILE 28 HA ILE 28 6.567 -13.348 6.421 229 HB ILE 28 HB ILE 28 9.352 -12.779 7.280 230 HG12 ILE 28 HG12 ILE 28 9.152 -15.281 7.261 231 HG13 ILE 28 HG11 ILE 28 9.459 -14.583 8.844 232 HG21 ILE 28 HG21 ILE 28 8.217 -12.471 9.441 233 HG22 ILE 28 HG22 ILE 28 6.695 -12.824 8.623 234 HG23 ILE 28 HG23 ILE 28 7.653 -11.425 8.139 235 HD11 ILE 28 HD11 ILE 28 7.858 -16.446 8.894 236 HD12 ILE 28 HD12 ILE 28 6.771 -15.515 7.852 237 HD13 ILE 28 HD13 ILE 28 7.153 -14.931 9.472 238 H LEU 29 HN LEU 29 6.106 -11.377 5.620 239 HA LEU 29 HA LEU 29 8.357 -9.807 4.569 240 HB2 LEU 29 HB2 LEU 29 6.113 -10.311 3.245 241 HB3 LEU 29 HB1 LEU 29 5.521 -8.960 4.197 242 HG LEU 29 HG LEU 29 7.072 -7.465 3.223 243 HD11 LEU 29 HD11 LEU 29 8.395 -9.934 2.132 244 HD12 LEU 29 HD12 LEU 29 9.059 -8.768 3.275 245 HD13 LEU 29 HD13 LEU 29 8.786 -8.301 1.596 246 HD21 LEU 29 HD21 LEU 29 6.059 -9.334 1.080 247 HD22 LEU 29 HD22 LEU 29 6.578 -7.668 0.833 248 HD23 LEU 29 HD23 LEU 29 5.153 -8.011 1.812 249 H GLY 30 HN GLY 30 5.683 -9.944 6.826 250 HA2 GLY 30 HA2 GLY 30 6.094 -9.349 9.088 251 HA3 GLY 30 HA1 GLY 30 7.308 -8.208 8.543 252 H PHE 31 HN PHE 31 6.126 -6.575 6.867 253 HA PHE 31 HA PHE 31 4.524 -5.037 8.664 254 HB2 PHE 31 HB2 PHE 31 4.560 -3.311 6.955 255 HB3 PHE 31 HB1 PHE 31 6.174 -3.937 7.265 256 HD1 PHE 31 HD2 PHE 31 7.108 -5.634 5.580 257 HD2 PHE 31 HD1 PHE 31 3.693 -3.213 4.857 258 HE1 PHE 31 HE2 PHE 31 7.383 -5.964 3.167 259 HE2 PHE 31 HE1 PHE 31 3.958 -3.526 2.453 260 HZ PHE 31 HZ PHE 31 5.812 -4.910 1.585 261 H SER 32 HN SER 32 2.615 -3.746 7.351 262 HA SER 32 HA SER 32 0.822 -5.933 6.504 263 HB2 SER 32 HB2 SER 32 0.044 -3.694 8.390 264 HB3 SER 32 HB1 SER 32 -0.959 -5.059 7.899 265 HG SER 32 HG SER 32 1.254 -6.089 8.863 266 H ILE 33 HN ILE 33 -0.667 -5.429 4.895 267 HA ILE 33 HA ILE 33 -0.406 -2.682 3.847 268 HB ILE 33 HB ILE 33 -0.463 -3.586 1.577 269 HG12 ILE 33 HG12 ILE 33 -0.125 -6.300 2.884 270 HG13 ILE 33 HG11 ILE 33 -1.631 -5.730 2.175 271 HG21 ILE 33 HG21 ILE 33 1.833 -4.537 1.552 272 HG22 ILE 33 HG22 ILE 33 1.757 -4.659 3.311 273 HG23 ILE 33 HG23 ILE 33 1.688 -3.078 2.533 274 HD11 ILE 33 HD11 ILE 33 -0.459 -7.233 0.686 275 HD12 ILE 33 HD12 ILE 33 0.954 -6.177 0.706 276 HD13 ILE 33 HD13 ILE 33 -0.559 -5.614 -0.006 277 H GLY 34 HN GLY 34 -2.234 -1.952 2.635 278 HA2 GLY 34 HA2 GLY 34 -4.630 -3.552 3.243 279 HA3 GLY 34 HA1 GLY 34 -4.587 -1.810 3.509 280 H GLY 35 HN GLY 35 -5.884 -3.980 1.576 281 HA2 GLY 35 HA2 GLY 35 -5.787 -2.179 -0.768 282 HA3 GLY 35 HA1 GLY 35 -6.058 -3.916 -0.887 283 H GLY 36 HN GLY 36 -7.464 -0.834 -0.143 284 HA2 GLY 36 HA2 GLY 36 -10.063 -1.107 -0.309 285 HA3 GLY 36 HA1 GLY 36 -9.811 -2.160 1.082 286 H ILE 37 HN ILE 37 -7.496 0.087 1.332 287 HA ILE 37 HA ILE 37 -8.705 1.092 3.677 288 HB ILE 37 HB ILE 37 -6.688 2.284 4.096 289 HG12 ILE 37 HG12 ILE 37 -6.361 3.276 1.840 290 HG13 ILE 37 HG11 ILE 37 -4.898 2.568 2.496 291 HG21 ILE 37 HG21 ILE 37 -6.172 -0.341 2.728 292 HG22 ILE 37 HG22 ILE 37 -6.602 -0.086 4.421 293 HG23 ILE 37 HG23 ILE 37 -5.043 0.470 3.813 294 HD11 ILE 37 HD11 ILE 37 -5.029 2.057 0.177 295 HD12 ILE 37 HD12 ILE 37 -6.662 1.422 0.355 296 HD13 ILE 37 HD13 ILE 37 -5.300 0.571 1.086 297 H ASP 38 HN ASP 38 -8.007 2.673 0.580 298 HA ASP 38 HA ASP 38 -9.270 5.109 1.638 299 HB2 ASP 38 HB2 ASP 38 -6.807 4.929 0.683 300 HB3 ASP 38 HB1 ASP 38 -7.643 5.070 -0.862 301 H GLN 39 HN GLN 39 -10.038 2.504 -0.123 302 HA GLN 39 HA GLN 39 -12.083 3.770 -1.608 303 HB2 GLN 39 HB2 GLN 39 -11.166 2.619 -3.763 304 HB3 GLN 39 HB1 GLN 39 -10.554 4.199 -3.288 305 HG2 GLN 39 HG2 GLN 39 -8.681 2.910 -3.835 306 HG3 GLN 39 HG1 GLN 39 -8.715 2.992 -2.089 307 HE21 GLN 39 HE21 GLN 39 -9.161 1.240 -0.921 308 HE22 GLN 39 HE22 GLN 39 -9.223 -0.334 -1.565 309 H ASP 40 HN ASP 40 -12.735 1.872 -3.304 310 HA ASP 40 HA ASP 40 -12.953 -0.751 -2.584 311 HB2 ASP 40 HB2 ASP 40 -14.096 0.956 -0.650 312 HB3 ASP 40 HB1 ASP 40 -15.419 0.228 -1.522 313 HA PRO 41 HA PRO 41 -15.107 -0.378 -6.326 314 HB2 PRO 41 HB2 PRO 41 -16.381 -2.708 -6.619 315 HB3 PRO 41 HB1 PRO 41 -14.618 -2.641 -6.499 316 HG2 PRO 41 HG2 PRO 41 -16.630 -3.397 -4.430 317 HG3 PRO 41 HG1 PRO 41 -15.038 -4.099 -4.757 318 HD2 PRO 41 HD2 PRO 41 -15.578 -2.257 -2.748 319 HD3 PRO 41 HD1 PRO 41 -13.971 -2.583 -3.421 320 H SER 42 HN SER 42 -17.040 -1.099 -3.597 321 HA SER 42 HA SER 42 -19.528 -0.581 -5.042 322 HB2 SER 42 HB2 SER 42 -19.235 -1.392 -2.144 323 HB3 SER 42 HB1 SER 42 -20.650 -1.569 -3.182 324 HG SER 42 HG SER 42 -19.844 -3.355 -3.974 325 H GLN 43 HN GLN 43 -17.280 0.954 -2.899 326 HA GLN 43 HA GLN 43 -19.307 2.967 -2.348 327 HB2 GLN 43 HB2 GLN 43 -18.144 3.221 -0.145 328 HB3 GLN 43 HB1 GLN 43 -19.048 1.743 -0.351 329 HG2 GLN 43 HG2 GLN 43 -16.342 1.403 -1.171 330 HG3 GLN 43 HG1 GLN 43 -16.405 2.071 0.440 331 HE21 GLN 43 HE21 GLN 43 -16.895 -0.628 -1.498 332 HE22 GLN 43 HE22 GLN 43 -17.117 -1.737 -0.207 333 H ASN 44 HN ASN 44 -16.269 2.313 -3.756 334 HA ASN 44 HA ASN 44 -16.177 5.192 -4.293 335 HB2 ASN 44 HB2 ASN 44 -14.383 4.442 -2.578 336 HB3 ASN 44 HB1 ASN 44 -13.575 3.744 -3.966 337 HD21 ASN 44 HD21 ASN 44 -12.678 5.882 -2.275 338 HD22 ASN 44 HD22 ASN 44 -12.495 7.280 -3.275 339 HA PRO 45 HA PRO 45 -15.707 2.925 -8.245 340 HB2 PRO 45 HB2 PRO 45 -17.949 3.793 -9.446 341 HB3 PRO 45 HB1 PRO 45 -17.954 2.371 -8.388 342 HG2 PRO 45 HG2 PRO 45 -18.891 5.146 -7.837 343 HG3 PRO 45 HG1 PRO 45 -19.556 3.600 -7.284 344 HD2 PRO 45 HD2 PRO 45 -17.921 5.282 -5.786 345 HD3 PRO 45 HD1 PRO 45 -18.230 3.570 -5.448 346 H PHE 46 HN PHE 46 -15.546 5.810 -6.865 347 HA PHE 46 HA PHE 46 -15.362 7.480 -9.231 348 HB2 PHE 46 HB2 PHE 46 -16.326 8.299 -7.048 349 HB3 PHE 46 HB1 PHE 46 -14.707 8.175 -6.358 350 HD1 PHE 46 HD1 PHE 46 -16.566 9.796 -9.151 351 HD2 PHE 46 HD2 PHE 46 -13.287 9.976 -6.448 352 HE1 PHE 46 HE1 PHE 46 -16.065 12.084 -9.914 353 HE2 PHE 46 HE2 PHE 46 -12.776 12.259 -7.206 354 HZ PHE 46 HZ PHE 46 -14.168 13.317 -8.943 355 H SER 47 HN SER 47 -13.310 5.737 -6.957 356 HA SER 47 HA SER 47 -10.927 6.902 -8.135 357 HB2 SER 47 HB2 SER 47 -9.780 5.294 -6.552 358 HB3 SER 47 HB1 SER 47 -10.819 6.489 -5.787 359 HG SER 47 HG SER 47 -11.718 3.886 -6.451 360 H GLU 48 HN GLU 48 -9.397 4.460 -8.042 361 HA GLU 48 HA GLU 48 -8.699 2.820 -9.427 362 HB2 GLU 48 HB2 GLU 48 -10.739 1.725 -8.634 363 HB3 GLU 48 HB1 GLU 48 -11.670 2.479 -9.924 364 HG2 GLU 48 HG2 GLU 48 -10.273 1.242 -11.566 365 HG3 GLU 48 HG1 GLU 48 -9.449 0.461 -10.218 366 H ASP 49 HN ASP 49 -9.897 5.635 -10.474 367 HA ASP 49 HA ASP 49 -10.275 5.105 -13.261 368 HB2 ASP 49 HB2 ASP 49 -11.443 6.966 -12.197 369 HB3 ASP 49 HB1 ASP 49 -9.901 7.738 -11.838 370 H LYS 50 HN LYS 50 -7.772 6.871 -11.494 371 HA LYS 50 HA LYS 50 -6.139 6.965 -13.869 372 HB2 LYS 50 HB2 LYS 50 -5.715 8.120 -11.129 373 HB3 LYS 50 HB1 LYS 50 -4.507 8.213 -12.397 374 HG2 LYS 50 HG2 LYS 50 -5.574 10.265 -12.502 375 HG3 LYS 50 HG1 LYS 50 -6.339 9.337 -13.793 376 HD2 LYS 50 HD2 LYS 50 -8.232 8.848 -12.326 377 HD3 LYS 50 HD1 LYS 50 -7.462 9.751 -11.019 378 HE2 LYS 50 HE2 LYS 50 -9.173 11.089 -12.138 379 HE3 LYS 50 HE1 LYS 50 -7.570 11.789 -12.351 380 HZ1 LYS 50 HZ1 LYS 50 -7.472 10.955 -14.561 381 HZ2 LYS 50 HZ2 LYS 50 -8.949 11.766 -14.394 382 HZ3 LYS 50 HZ3 LYS 50 -8.903 10.065 -14.367 383 H THR 51 HN THR 51 -4.610 6.616 -10.821 384 HA THR 51 HA THR 51 -3.615 3.968 -11.621 385 HB THR 51 HB THR 51 -1.805 5.669 -11.608 386 HG1 THR 51 HG1 THR 51 -1.738 3.702 -9.546 387 HG21 THR 51 HG21 THR 51 -2.735 7.198 -9.952 388 HG22 THR 51 HG22 THR 51 -1.108 6.697 -9.493 389 HG23 THR 51 HG23 THR 51 -2.507 5.983 -8.691 390 H ASP 52 HN ASP 52 -5.635 5.609 -9.753 391 HA ASP 52 HA ASP 52 -6.785 5.347 -7.886 392 HB2 ASP 52 HB2 ASP 52 -7.111 3.195 -9.092 393 HB3 ASP 52 HB1 ASP 52 -5.856 2.510 -8.075 394 H LYS 53 HN LYS 53 -6.749 4.681 -5.648 395 HA LYS 53 HA LYS 53 -4.033 4.700 -4.477 396 HB2 LYS 53 HB2 LYS 53 -6.506 5.511 -2.975 397 HB3 LYS 53 HB1 LYS 53 -4.835 5.952 -2.664 398 HG2 LYS 53 HG2 LYS 53 -5.153 7.859 -3.748 399 HG3 LYS 53 HG1 LYS 53 -5.520 6.958 -5.224 400 HD2 LYS 53 HD2 LYS 53 -7.380 8.409 -4.705 401 HD3 LYS 53 HD1 LYS 53 -7.862 6.727 -4.447 402 HE2 LYS 53 HE2 LYS 53 -7.380 7.006 -2.039 403 HE3 LYS 53 HE1 LYS 53 -7.015 8.703 -2.332 404 HZ1 LYS 53 HZ1 LYS 53 -9.643 7.486 -2.957 405 HZ2 LYS 53 HZ2 LYS 53 -9.252 9.136 -2.904 406 HZ3 LYS 53 HZ3 LYS 53 -9.283 8.214 -1.474 407 H GLY 54 HN GLY 54 -5.757 2.549 -5.446 408 HA2 GLY 54 HA2 GLY 54 -7.269 1.148 -3.695 409 HA3 GLY 54 HA1 GLY 54 -6.270 0.385 -4.927 410 H ILE 55 HN ILE 55 -3.773 0.690 -4.052 411 HA ILE 55 HA ILE 55 -3.819 -0.921 -1.604 412 HB ILE 55 HB ILE 55 -1.881 -0.949 -3.916 413 HG12 ILE 55 HG12 ILE 55 -3.923 -2.090 -4.441 414 HG13 ILE 55 HG11 ILE 55 -2.702 -3.312 -4.102 415 HG21 ILE 55 HG21 ILE 55 -1.780 -2.445 -1.302 416 HG22 ILE 55 HG22 ILE 55 -0.594 -1.304 -1.944 417 HG23 ILE 55 HG23 ILE 55 -0.826 -2.870 -2.727 418 HD11 ILE 55 HD11 ILE 55 -4.877 -3.856 -3.107 419 HD12 ILE 55 HD12 ILE 55 -4.798 -2.372 -2.145 420 HD13 ILE 55 HD13 ILE 55 -3.612 -3.660 -1.892 421 H TYR 56 HN TYR 56 -2.661 -0.380 0.082 422 HA TYR 56 HA TYR 56 -0.673 1.720 -0.007 423 HB2 TYR 56 HB2 TYR 56 -2.451 3.190 0.078 424 HB3 TYR 56 HB1 TYR 56 -3.471 2.057 0.934 425 HD1 TYR 56 HD1 TYR 56 -3.393 1.913 3.374 426 HD2 TYR 56 HD2 TYR 56 -0.996 4.708 1.254 427 HE1 TYR 56 HE1 TYR 56 -2.882 3.072 5.478 428 HE2 TYR 56 HE2 TYR 56 -0.494 5.885 3.348 429 HH TYR 56 HH TYR 56 -1.313 6.152 5.542 430 H VAL 57 HN VAL 57 0.816 1.296 1.482 431 HA VAL 57 HA VAL 57 0.549 -0.864 3.253 432 HB VAL 57 HB VAL 57 2.680 0.201 2.162 433 HG11 VAL 57 HG11 VAL 57 2.257 1.919 4.492 434 HG12 VAL 57 HG12 VAL 57 3.078 2.245 2.959 435 HG13 VAL 57 HG13 VAL 57 3.893 1.328 4.219 436 HG21 VAL 57 HG21 VAL 57 4.026 -0.973 3.688 437 HG22 VAL 57 HG22 VAL 57 2.480 -1.816 3.564 438 HG23 VAL 57 HG23 VAL 57 2.821 -0.788 4.962 439 H THR 58 HN THR 58 -0.154 -0.914 5.222 440 HA THR 58 HA THR 58 -1.037 1.613 6.408 441 HB THR 58 HB THR 58 -2.872 0.102 6.050 442 HG1 THR 58 HG1 THR 58 -2.072 0.780 8.585 443 HG21 THR 58 HG21 THR 58 -1.681 -2.005 5.898 444 HG22 THR 58 HG22 THR 58 -2.970 -2.125 7.095 445 HG23 THR 58 HG23 THR 58 -1.296 -1.938 7.619 446 H ARG 59 HN ARG 59 1.415 -0.667 6.658 447 HA ARG 59 HA ARG 59 2.525 0.639 8.886 448 HB2 ARG 59 HB2 ARG 59 2.050 -0.585 10.697 449 HB3 ARG 59 HB1 ARG 59 0.688 -1.136 9.760 450 HG2 ARG 59 HG2 ARG 59 1.833 -3.131 9.118 451 HG3 ARG 59 HG1 ARG 59 3.317 -2.560 9.876 452 HD2 ARG 59 HD2 ARG 59 0.741 -3.073 11.343 453 HD3 ARG 59 HD1 ARG 59 2.072 -4.223 11.237 454 HE ARG 59 HE ARG 59 3.062 -1.779 12.207 455 HH11 ARG 59 HH11 ARG 59 0.921 -4.380 13.206 456 HH12 ARG 59 HH12 ARG 59 1.304 -4.202 14.893 457 HH21 ARG 59 HH21 ARG 59 3.543 -1.546 14.432 458 HH22 ARG 59 HH22 ARG 59 2.783 -2.612 15.586 459 H VAL 60 HN VAL 60 4.367 -0.631 9.808 460 HA VAL 60 HA VAL 60 5.647 -2.416 7.931 461 HB VAL 60 HB VAL 60 6.913 0.181 8.820 462 HG11 VAL 60 HG11 VAL 60 8.087 -2.190 7.389 463 HG12 VAL 60 HG12 VAL 60 8.458 -1.645 9.021 464 HG13 VAL 60 HG13 VAL 60 8.910 -0.646 7.638 465 HG21 VAL 60 HG21 VAL 60 5.621 0.632 6.903 466 HG22 VAL 60 HG22 VAL 60 6.082 -0.895 6.142 467 HG23 VAL 60 HG23 VAL 60 7.268 0.401 6.312 468 H SER 61 HN SER 61 6.446 -4.039 9.091 469 HA SER 61 HA SER 61 6.811 -3.819 11.917 470 HB2 SER 61 HB2 SER 61 7.938 -6.066 11.647 471 HB3 SER 61 HB1 SER 61 6.282 -5.982 11.074 472 HG SER 61 HG SER 61 8.463 -5.528 9.341 473 H GLU 62 HN GLU 62 8.406 -2.733 12.746 474 HA GLU 62 HA GLU 62 10.584 -1.836 11.285 475 HB2 GLU 62 HB2 GLU 62 9.821 -1.753 14.152 476 HB3 GLU 62 HB1 GLU 62 11.407 -1.266 13.652 477 HG2 GLU 62 HG2 GLU 62 10.403 0.340 12.084 478 HG3 GLU 62 HG1 GLU 62 8.827 -0.104 12.715 479 H GLY 63 HN GLY 63 12.590 -2.295 11.489 480 HA2 GLY 63 HA2 GLY 63 14.323 -3.826 11.195 481 HA3 GLY 63 HA1 GLY 63 13.681 -4.670 12.614 482 H GLY 64 HN GLY 64 12.033 -3.929 9.613 483 HA2 GLY 64 HA2 GLY 64 11.760 -6.820 9.061 484 HA3 GLY 64 HA1 GLY 64 10.356 -5.754 9.104 485 HA PRO 65 HA PRO 65 14.220 -3.978 6.243 486 HB2 PRO 65 HB2 PRO 65 13.654 -6.490 4.748 487 HB3 PRO 65 HB1 PRO 65 15.039 -5.406 4.665 488 HG2 PRO 65 HG2 PRO 65 14.946 -7.562 6.344 489 HG3 PRO 65 HG1 PRO 65 15.889 -6.099 6.694 490 HD2 PRO 65 HD2 PRO 65 13.578 -7.075 8.099 491 HD3 PRO 65 HD1 PRO 65 14.475 -5.576 8.401 492 H ALA 66 HN ALA 66 11.130 -4.114 5.997 493 HA ALA 66 HA ALA 66 10.734 -3.230 3.286 494 HB1 ALA 66 HB1 ALA 66 8.626 -2.209 4.238 495 HB2 ALA 66 HB2 ALA 66 9.112 -2.850 5.809 496 HB3 ALA 66 HB3 ALA 66 8.780 -3.953 4.472 497 H GLU 67 HN GLU 67 11.596 -1.921 6.338 498 HA GLU 67 HA GLU 67 10.964 0.827 5.696 499 HB2 GLU 67 HB2 GLU 67 12.310 1.017 7.963 500 HB3 GLU 67 HB1 GLU 67 10.651 0.411 7.943 501 HG2 GLU 67 HG2 GLU 67 11.280 -1.723 8.363 502 HG3 GLU 67 HG1 GLU 67 12.793 -1.525 7.480 503 H ILE 68 HN ILE 68 13.772 -1.245 6.003 504 HA ILE 68 HA ILE 68 15.575 0.926 5.658 505 HB ILE 68 HB ILE 68 17.203 -0.974 5.522 506 HG12 ILE 68 HG12 ILE 68 14.891 -2.428 6.757 507 HG13 ILE 68 HG11 ILE 68 15.518 -2.732 5.137 508 HG21 ILE 68 HG21 ILE 68 15.623 -0.355 7.969 509 HG22 ILE 68 HG22 ILE 68 17.032 0.519 7.376 510 HG23 ILE 68 HG23 ILE 68 17.209 -1.126 7.996 511 HD11 ILE 68 HD11 ILE 68 17.098 -3.013 7.668 512 HD12 ILE 68 HD12 ILE 68 17.622 -3.430 6.037 513 HD13 ILE 68 HD13 ILE 68 16.320 -4.339 6.806 514 H ALA 69 HN ALA 69 14.089 -1.593 3.897 515 HA ALA 69 HA ALA 69 15.481 -1.309 1.485 516 HB1 ALA 69 HB1 ALA 69 13.400 -2.044 0.374 517 HB2 ALA 69 HB2 ALA 69 12.550 -1.864 1.908 518 HB3 ALA 69 HB3 ALA 69 13.825 -3.074 1.745 519 H GLY 70 HN GLY 70 13.185 0.575 3.196 520 HA2 GLY 70 HA2 GLY 70 13.445 3.013 2.831 521 HA3 GLY 70 HA1 GLY 70 13.390 2.666 1.101 522 H LEU 71 HN LEU 71 11.294 1.091 3.480 523 HA LEU 71 HA LEU 71 9.045 2.467 2.234 524 HB2 LEU 71 HB2 LEU 71 9.237 -0.056 2.267 525 HB3 LEU 71 HB1 LEU 71 9.054 0.039 4.013 526 HG LEU 71 HG LEU 71 6.838 1.216 3.571 527 HD11 LEU 71 HD11 LEU 71 7.258 1.736 1.204 528 HD12 LEU 71 HD12 LEU 71 5.785 0.790 1.428 529 HD13 LEU 71 HD13 LEU 71 7.253 0.010 0.838 530 HD21 LEU 71 HD21 LEU 71 5.711 -0.944 3.282 531 HD22 LEU 71 HD22 LEU 71 7.065 -1.040 4.412 532 HD23 LEU 71 HD23 LEU 71 7.248 -1.651 2.770 533 H GLN 72 HN GLN 72 7.197 2.424 4.012 534 HA GLN 72 HA GLN 72 7.961 3.335 6.582 535 HB2 GLN 72 HB2 GLN 72 6.534 5.493 5.120 536 HB3 GLN 72 HB1 GLN 72 7.593 5.608 6.503 537 HG2 GLN 72 HG2 GLN 72 8.731 6.723 4.857 538 HG3 GLN 72 HG1 GLN 72 9.471 5.126 4.840 539 HE21 GLN 72 HE21 GLN 72 6.320 5.929 3.493 540 HE22 GLN 72 HE22 GLN 72 6.731 5.558 1.857 541 H ILE 73 HN ILE 73 5.869 4.507 7.411 542 HA ILE 73 HA ILE 73 3.693 2.682 6.923 543 HB ILE 73 HB ILE 73 3.614 5.079 8.736 544 HG12 ILE 73 HG12 ILE 73 5.677 4.115 9.422 545 HG13 ILE 73 HG11 ILE 73 4.472 3.522 10.563 546 HG21 ILE 73 HG21 ILE 73 2.202 3.567 10.073 547 HG22 ILE 73 HG22 ILE 73 2.373 2.370 8.794 548 HG23 ILE 73 HG23 ILE 73 1.579 3.902 8.459 549 HD11 ILE 73 HD11 ILE 73 5.989 1.754 9.925 550 HD12 ILE 73 HD12 ILE 73 5.612 2.011 8.215 551 HD13 ILE 73 HD13 ILE 73 4.368 1.410 9.322 552 H GLY 74 HN GLY 74 2.474 3.169 5.141 553 HA2 GLY 74 HA2 GLY 74 0.548 4.514 4.549 554 HA3 GLY 74 HA1 GLY 74 1.419 5.929 5.142 555 H ASP 75 HN ASP 75 1.692 3.338 2.748 556 HA ASP 75 HA ASP 75 2.593 5.319 0.784 557 HB2 ASP 75 HB2 ASP 75 4.583 4.136 2.102 558 HB3 ASP 75 HB1 ASP 75 4.240 2.834 0.964 559 H LYS 76 HN LYS 76 1.968 4.758 -1.295 560 HA LYS 76 HA LYS 76 0.009 2.601 -1.242 561 HB2 LYS 76 HB2 LYS 76 0.497 4.631 -3.417 562 HB3 LYS 76 HB1 LYS 76 -0.931 3.630 -3.192 563 HG2 LYS 76 HG2 LYS 76 -1.645 4.870 -1.343 564 HG3 LYS 76 HG1 LYS 76 -0.064 5.632 -1.138 565 HD2 LYS 76 HD2 LYS 76 -0.387 6.728 -3.354 566 HD3 LYS 76 HD1 LYS 76 -2.033 6.086 -3.371 567 HE2 LYS 76 HE2 LYS 76 -1.969 8.407 -2.582 568 HE3 LYS 76 HE1 LYS 76 -2.558 7.303 -1.339 569 HZ1 LYS 76 HZ1 LYS 76 -0.469 7.377 -0.238 570 HZ2 LYS 76 HZ2 LYS 76 -0.929 8.982 -0.541 571 HZ3 LYS 76 HZ3 LYS 76 0.251 8.235 -1.504 572 H ILE 77 HN ILE 77 0.903 0.717 -1.665 573 HA ILE 77 HA ILE 77 3.038 0.318 -3.508 574 HB ILE 77 HB ILE 77 1.168 -1.777 -2.384 575 HG12 ILE 77 HG12 ILE 77 3.818 -0.857 -1.247 576 HG13 ILE 77 HG11 ILE 77 2.255 -0.310 -0.643 577 HG21 ILE 77 HG21 ILE 77 3.996 -1.962 -3.421 578 HG22 ILE 77 HG22 ILE 77 2.550 -2.509 -4.268 579 HG23 ILE 77 HG23 ILE 77 3.042 -3.294 -2.767 580 HD11 ILE 77 HD11 ILE 77 1.684 -2.609 -0.082 581 HD12 ILE 77 HD12 ILE 77 3.149 -2.072 0.739 582 HD13 ILE 77 HD13 ILE 77 3.261 -3.142 -0.661 583 H MET 78 HN MET 78 2.587 0.898 -5.527 584 HA MET 78 HA MET 78 -0.007 0.376 -6.693 585 HB2 MET 78 HB2 MET 78 2.451 1.467 -8.042 586 HB3 MET 78 HB1 MET 78 0.792 1.588 -8.609 587 HG2 MET 78 HG2 MET 78 1.710 2.758 -6.012 588 HG3 MET 78 HG1 MET 78 1.800 3.642 -7.533 589 HE1 MET 78 HE1 MET 78 -1.209 1.322 -5.887 590 HE2 MET 78 HE2 MET 78 -1.992 2.688 -5.096 591 HE3 MET 78 HE3 MET 78 -0.329 2.261 -4.685 592 H GLN 79 HN GLN 79 3.039 -1.176 -6.645 593 HA GLN 79 HA GLN 79 2.014 -3.443 -7.945 594 HB2 GLN 79 HB2 GLN 79 4.139 -3.289 -9.548 595 HB3 GLN 79 HB1 GLN 79 2.489 -2.930 -10.028 596 HG2 GLN 79 HG2 GLN 79 3.129 -0.527 -9.293 597 HG3 GLN 79 HG1 GLN 79 4.763 -1.153 -9.521 598 HE21 GLN 79 HE21 GLN 79 5.412 -1.882 -11.487 599 HE22 GLN 79 HE22 GLN 79 4.653 -1.364 -12.969 600 H VAL 80 HN VAL 80 3.434 -5.130 -8.142 601 HA VAL 80 HA VAL 80 5.834 -4.917 -6.421 602 HB VAL 80 HB VAL 80 4.651 -6.023 -4.857 603 HG11 VAL 80 HG11 VAL 80 2.803 -7.100 -6.973 604 HG12 VAL 80 HG12 VAL 80 2.562 -5.596 -6.071 605 HG13 VAL 80 HG13 VAL 80 2.550 -7.153 -5.225 606 HG21 VAL 80 HG21 VAL 80 5.117 -8.277 -6.831 607 HG22 VAL 80 HG22 VAL 80 4.639 -8.515 -5.142 608 HG23 VAL 80 HG23 VAL 80 6.194 -7.764 -5.523 609 H ASN 81 HN ASN 81 7.589 -5.977 -7.214 610 HA ASN 81 HA ASN 81 8.951 -6.918 -8.758 611 HB2 ASN 81 HB2 ASN 81 6.692 -8.870 -8.552 612 HB3 ASN 81 HB1 ASN 81 7.943 -9.131 -9.772 613 HD21 ASN 81 HD21 ASN 81 7.160 -9.291 -6.409 614 HD22 ASN 81 HD22 ASN 81 8.682 -9.921 -5.863 615 H GLY 82 HN GLY 82 6.692 -5.079 -9.628 616 HA2 GLY 82 HA2 GLY 82 6.585 -3.940 -11.709 617 HA3 GLY 82 HA1 GLY 82 7.108 -5.421 -12.508 618 H TRP 83 HN TRP 83 4.707 -6.126 -10.231 619 HA TRP 83 HA TRP 83 2.772 -6.424 -12.380 620 HB2 TRP 83 HB2 TRP 83 2.684 -7.640 -9.641 621 HB3 TRP 83 HB1 TRP 83 1.716 -8.067 -11.029 622 HD1 TRP 83 HD1 TRP 83 5.396 -7.774 -10.322 623 HE1 TRP 83 HE1 TRP 83 6.559 -9.858 -11.067 624 HE3 TRP 83 HE3 TRP 83 1.420 -10.314 -12.251 625 HZ2 TRP 83 HZ2 TRP 83 6.007 -12.273 -12.357 626 HZ3 TRP 83 HZ3 TRP 83 1.851 -12.529 -13.251 627 HH2 TRP 83 HH2 TRP 83 4.111 -13.464 -13.288 628 H ASP 84 HN ASP 84 2.469 -4.082 -12.050 629 HA ASP 84 HA ASP 84 1.167 -2.567 -10.446 630 HB2 ASP 84 HB2 ASP 84 1.014 -2.204 -12.860 631 HB3 ASP 84 HB1 ASP 84 -0.173 -3.497 -12.998 632 H MET 85 HN MET 85 0.260 -3.159 -8.615 633 HA MET 85 HA MET 85 -1.971 -5.066 -8.710 634 HB2 MET 85 HB2 MET 85 -1.707 -5.019 -6.166 635 HB3 MET 85 HB1 MET 85 -0.486 -5.853 -7.110 636 HG2 MET 85 HG2 MET 85 1.133 -4.347 -6.597 637 HG3 MET 85 HG1 MET 85 -0.003 -3.013 -6.417 638 HE1 MET 85 HE1 MET 85 -0.047 -6.313 -3.193 639 HE2 MET 85 HE2 MET 85 0.819 -6.565 -4.709 640 HE3 MET 85 HE3 MET 85 -0.934 -6.362 -4.716 641 H THR 86 HN THR 86 -2.397 -2.398 -9.600 642 HA THR 86 HA THR 86 -3.649 -0.883 -7.522 643 HB THR 86 HB THR 86 -4.470 0.567 -9.331 644 HG1 THR 86 HG1 THR 86 -3.119 -1.080 -11.213 645 HG21 THR 86 HG21 THR 86 -2.184 0.860 -8.493 646 HG22 THR 86 HG22 THR 86 -2.294 1.258 -10.208 647 HG23 THR 86 HG23 THR 86 -1.596 -0.282 -9.701 648 H MET 87 HN MET 87 -4.683 -3.425 -9.602 649 HA MET 87 HA MET 87 -7.403 -3.209 -8.500 650 HB2 MET 87 HB2 MET 87 -8.302 -3.977 -10.656 651 HB3 MET 87 HB1 MET 87 -7.546 -2.397 -10.771 652 HG2 MET 87 HG2 MET 87 -5.532 -3.496 -11.702 653 HG3 MET 87 HG1 MET 87 -6.402 -5.029 -11.685 654 HE1 MET 87 HE1 MET 87 -8.789 -5.307 -13.007 655 HE2 MET 87 HE2 MET 87 -9.419 -4.085 -14.109 656 HE3 MET 87 HE3 MET 87 -9.360 -3.762 -12.376 657 H VAL 88 HN VAL 88 -5.083 -4.658 -7.813 658 HA VAL 88 HA VAL 88 -5.261 -7.366 -8.699 659 HB VAL 88 HB VAL 88 -3.423 -5.601 -7.383 660 HG11 VAL 88 HG11 VAL 88 -2.265 -7.269 -5.991 661 HG12 VAL 88 HG12 VAL 88 -3.669 -8.331 -6.154 662 HG13 VAL 88 HG13 VAL 88 -3.828 -6.769 -5.346 663 HG21 VAL 88 HG21 VAL 88 -3.022 -6.613 -9.492 664 HG22 VAL 88 HG22 VAL 88 -3.138 -8.233 -8.795 665 HG23 VAL 88 HG23 VAL 88 -1.798 -7.174 -8.349 666 H THR 89 HN THR 89 -5.489 -9.214 -7.223 667 HA THR 89 HA THR 89 -7.553 -8.699 -5.230 668 HB THR 89 HB THR 89 -6.805 -10.937 -7.016 669 HG1 THR 89 HG1 THR 89 -8.689 -9.310 -7.130 670 HG21 THR 89 HG21 THR 89 -6.667 -12.039 -4.931 671 HG22 THR 89 HG22 THR 89 -8.144 -12.545 -5.757 672 HG23 THR 89 HG23 THR 89 -8.226 -11.388 -4.425 673 H HIS 90 HN HIS 90 -7.391 -9.752 -3.228 674 HA HIS 90 HA HIS 90 -5.020 -9.445 -1.845 675 HB2 HIS 90 HB2 HIS 90 -7.105 -9.514 -0.654 676 HB3 HIS 90 HB1 HIS 90 -7.488 -11.107 -1.290 677 HD1 HIS 90 HD1 HIS 90 -6.691 -13.121 0.039 678 HD2 HIS 90 HD2 HIS 90 -5.199 -9.502 1.453 679 HE1 HIS 90 HE1 HIS 90 -5.642 -13.635 2.265 680 HE2 HIS 90 HE2 HIS 90 -4.632 -11.460 3.035 681 H ASP 91 HN ASP 91 -6.420 -12.321 -3.113 682 HA ASP 91 HA ASP 91 -4.583 -14.192 -2.051 683 HB2 ASP 91 HB2 ASP 91 -6.779 -14.906 -2.845 684 HB3 ASP 91 HB1 ASP 91 -6.385 -14.329 -4.468 685 H GLN 92 HN GLN 92 -4.883 -12.608 -5.180 686 HA GLN 92 HA GLN 92 -2.553 -13.957 -6.091 687 HB2 GLN 92 HB2 GLN 92 -2.963 -12.716 -8.224 688 HB3 GLN 92 HB1 GLN 92 -4.204 -13.843 -7.724 689 HG2 GLN 92 HG2 GLN 92 -5.510 -12.131 -8.304 690 HG3 GLN 92 HG1 GLN 92 -5.160 -11.602 -6.657 691 HE21 GLN 92 HE21 GLN 92 -3.417 -10.270 -6.337 692 HE22 GLN 92 HE22 GLN 92 -2.905 -9.187 -7.571 693 H ALA 93 HN ALA 93 -3.250 -10.952 -4.564 694 HA ALA 93 HA ALA 93 -0.774 -9.685 -5.259 695 HB1 ALA 93 HB1 ALA 93 -2.481 -9.338 -2.785 696 HB2 ALA 93 HB2 ALA 93 -2.693 -8.441 -4.287 697 HB3 ALA 93 HB3 ALA 93 -1.216 -8.243 -3.345 698 H ARG 94 HN ARG 94 -2.045 -11.757 -2.758 699 HA ARG 94 HA ARG 94 0.130 -11.885 -1.069 700 HB2 ARG 94 HB2 ARG 94 -2.196 -13.666 -1.655 701 HB3 ARG 94 HB1 ARG 94 -0.876 -14.329 -0.683 702 HG2 ARG 94 HG2 ARG 94 -2.490 -11.851 -0.067 703 HG3 ARG 94 HG1 ARG 94 -2.624 -13.410 0.742 704 HD2 ARG 94 HD2 ARG 94 -0.249 -11.558 0.782 705 HD3 ARG 94 HD1 ARG 94 -1.314 -11.967 2.135 706 HE ARG 94 HE ARG 94 0.177 -14.138 0.853 707 HH11 ARG 94 HH11 ARG 94 -0.212 -12.012 3.610 708 HH12 ARG 94 HH12 ARG 94 0.837 -12.939 4.626 709 HH21 ARG 94 HH21 ARG 94 1.541 -15.352 2.187 710 HH22 ARG 94 HH22 ARG 94 1.846 -14.840 3.828 711 H LYS 95 HN LYS 95 -0.575 -13.804 -3.956 712 HA LYS 95 HA LYS 95 1.829 -15.339 -3.661 713 HB2 LYS 95 HB2 LYS 95 1.283 -16.290 -5.883 714 HB3 LYS 95 HB1 LYS 95 0.006 -16.449 -4.690 715 HG2 LYS 95 HG2 LYS 95 -0.550 -14.057 -6.069 716 HG3 LYS 95 HG1 LYS 95 -0.060 -15.249 -7.286 717 HD2 LYS 95 HD2 LYS 95 -2.150 -15.695 -5.163 718 HD3 LYS 95 HD1 LYS 95 -2.485 -15.300 -6.845 719 HE2 LYS 95 HE2 LYS 95 -1.635 -17.374 -7.592 720 HE3 LYS 95 HE1 LYS 95 -0.908 -17.717 -6.021 721 HZ1 LYS 95 HZ1 LYS 95 -3.347 -18.590 -6.849 722 HZ2 LYS 95 HZ2 LYS 95 -3.744 -17.258 -5.871 723 HZ3 LYS 95 HZ3 LYS 95 -2.813 -18.530 -5.241 724 H ARG 96 HN ARG 96 1.152 -12.279 -5.197 725 HA ARG 96 HA ARG 96 3.502 -12.358 -6.829 726 HB2 ARG 96 HB2 ARG 96 1.698 -10.113 -5.970 727 HB3 ARG 96 HB1 ARG 96 3.095 -9.875 -7.010 728 HG2 ARG 96 HG2 ARG 96 0.637 -11.493 -7.576 729 HG3 ARG 96 HG1 ARG 96 1.197 -10.035 -8.396 730 HD2 ARG 96 HD2 ARG 96 1.895 -11.642 -9.856 731 HD3 ARG 96 HD1 ARG 96 3.328 -11.462 -8.856 732 HE ARG 96 HE ARG 96 2.590 -13.494 -7.677 733 HH11 ARG 96 HH11 ARG 96 1.279 -12.842 -10.848 734 HH12 ARG 96 HH12 ARG 96 0.973 -14.506 -11.217 735 HH21 ARG 96 HH21 ARG 96 2.178 -15.710 -8.154 736 HH22 ARG 96 HH22 ARG 96 1.463 -16.138 -9.682 737 H LEU 97 HN LEU 97 2.751 -11.078 -3.644 738 HA LEU 97 HA LEU 97 5.288 -9.686 -3.570 739 HB2 LEU 97 HB2 LEU 97 4.406 -8.827 -1.378 740 HB3 LEU 97 HB1 LEU 97 3.555 -8.327 -2.826 741 HG LEU 97 HG LEU 97 2.014 -10.375 -2.231 742 HD11 LEU 97 HD11 LEU 97 1.826 -10.742 0.140 743 HD12 LEU 97 HD12 LEU 97 3.159 -9.624 0.437 744 HD13 LEU 97 HD13 LEU 97 3.454 -11.137 -0.421 745 HD21 LEU 97 HD21 LEU 97 0.629 -8.854 -0.853 746 HD22 LEU 97 HD22 LEU 97 1.198 -8.137 -2.360 747 HD23 LEU 97 HD23 LEU 97 1.975 -7.713 -0.831 748 H THR 98 HN THR 98 3.869 -12.545 -2.245 749 HA THR 98 HA THR 98 6.469 -13.155 -1.112 750 HB THR 98 HB THR 98 5.271 -12.210 0.792 751 HG1 THR 98 HG1 THR 98 5.811 -13.810 2.175 752 HG21 THR 98 HG21 THR 98 3.259 -14.433 0.416 753 HG22 THR 98 HG22 THR 98 2.969 -12.717 0.129 754 HG23 THR 98 HG23 THR 98 3.314 -13.290 1.759 755 H LYS 99 HN LYS 99 6.080 -14.307 -3.278 756 HA LYS 99 HA LYS 99 4.820 -16.878 -2.900 757 HB2 LYS 99 HB2 LYS 99 5.673 -17.355 -5.166 758 HB3 LYS 99 HB1 LYS 99 4.710 -15.887 -5.108 759 HG2 LYS 99 HG2 LYS 99 6.786 -14.561 -5.055 760 HG3 LYS 99 HG1 LYS 99 7.714 -16.054 -5.221 761 HD2 LYS 99 HD2 LYS 99 6.329 -16.491 -7.303 762 HD3 LYS 99 HD1 LYS 99 5.802 -14.814 -7.166 763 HE2 LYS 99 HE2 LYS 99 8.714 -15.468 -7.133 764 HE3 LYS 99 HE1 LYS 99 7.852 -15.437 -8.664 765 HZ1 LYS 99 HZ1 LYS 99 7.341 -13.166 -8.389 766 HZ2 LYS 99 HZ2 LYS 99 8.979 -13.311 -7.986 767 HZ3 LYS 99 HZ3 LYS 99 7.816 -13.158 -6.761 768 H ARG 100 HN ARG 100 6.493 -18.657 -3.911 769 HA ARG 100 HA ARG 100 8.544 -18.754 -1.822 770 HB2 ARG 100 HB2 ARG 100 7.437 -20.974 -3.547 771 HB3 ARG 100 HB1 ARG 100 8.644 -21.179 -2.288 772 HG2 ARG 100 HG2 ARG 100 6.702 -21.838 -1.242 773 HG3 ARG 100 HG1 ARG 100 6.847 -20.154 -0.738 774 HD2 ARG 100 HD2 ARG 100 4.549 -20.740 -1.420 775 HD3 ARG 100 HD1 ARG 100 5.250 -19.473 -2.429 776 HE ARG 100 HE ARG 100 5.720 -22.017 -3.592 777 HH11 ARG 100 HH11 ARG 100 3.098 -19.760 -2.992 778 HH12 ARG 100 HH12 ARG 100 2.223 -20.199 -4.422 779 HH21 ARG 100 HH21 ARG 100 4.564 -22.595 -5.494 780 HH22 ARG 100 HH22 ARG 100 3.060 -21.798 -5.846 781 H SER 101 HN SER 101 8.567 -17.468 -4.604 782 HA SER 101 HA SER 101 11.015 -18.771 -5.600 783 HB2 SER 101 HB2 SER 101 9.043 -18.832 -7.153 784 HB3 SER 101 HB1 SER 101 9.070 -17.068 -7.182 785 HG SER 101 HG SER 101 11.481 -17.659 -7.762 786 H GLU 102 HN GLU 102 10.186 -16.337 -3.707 787 HA GLU 102 HA GLU 102 12.547 -14.856 -4.311 788 HB2 GLU 102 HB2 GLU 102 11.552 -12.742 -4.631 789 HB3 GLU 102 HB1 GLU 102 10.650 -13.829 -5.674 790 HG2 GLU 102 HG2 GLU 102 8.920 -13.964 -3.864 791 HG3 GLU 102 HG1 GLU 102 9.788 -12.666 -3.046 792 H GLU 103 HN GLU 103 13.316 -13.895 -2.525 793 HA GLU 103 HA GLU 103 11.803 -14.203 -0.027 794 HB2 GLU 103 HB2 GLU 103 14.801 -14.461 -0.370 795 HB3 GLU 103 HB1 GLU 103 13.882 -14.750 1.108 796 HG2 GLU 103 HG2 GLU 103 12.747 -16.623 0.066 797 HG3 GLU 103 HG1 GLU 103 13.598 -16.315 -1.444 798 H VAL 104 HN VAL 104 12.088 -12.213 -2.019 799 HA VAL 104 HA VAL 104 12.410 -9.902 -0.356 800 HB VAL 104 HB VAL 104 14.712 -10.153 -1.085 801 HG11 VAL 104 HG11 VAL 104 15.280 -10.136 -3.496 802 HG12 VAL 104 HG12 VAL 104 13.558 -10.298 -3.856 803 HG13 VAL 104 HG13 VAL 104 14.404 -11.584 -2.994 804 HG21 VAL 104 HG21 VAL 104 13.340 -8.045 -2.748 805 HG22 VAL 104 HG22 VAL 104 15.039 -8.054 -2.278 806 HG23 VAL 104 HG23 VAL 104 13.786 -7.869 -1.051 807 H VAL 105 HN VAL 105 11.011 -8.347 -1.106 808 HA VAL 105 HA VAL 105 9.583 -9.093 -3.562 809 HB VAL 105 HB VAL 105 8.144 -9.332 -1.616 810 HG11 VAL 105 HG11 VAL 105 7.523 -7.437 -0.223 811 HG12 VAL 105 HG12 VAL 105 8.633 -6.399 -1.119 812 HG13 VAL 105 HG13 VAL 105 9.264 -7.723 -0.137 813 HG21 VAL 105 HG21 VAL 105 7.121 -8.608 -3.696 814 HG22 VAL 105 HG22 VAL 105 7.439 -6.925 -3.287 815 HG23 VAL 105 HG23 VAL 105 6.299 -7.865 -2.323 816 H ARG 106 HN ARG 106 9.883 -7.762 -5.187 817 HA ARG 106 HA ARG 106 10.830 -5.075 -4.772 818 HB2 ARG 106 HB2 ARG 106 11.118 -6.906 -6.790 819 HB3 ARG 106 HB1 ARG 106 9.820 -5.884 -7.397 820 HG2 ARG 106 HG2 ARG 106 11.178 -3.935 -7.191 821 HG3 ARG 106 HG1 ARG 106 12.477 -4.897 -6.474 822 HD2 ARG 106 HD2 ARG 106 12.830 -6.091 -8.490 823 HD3 ARG 106 HD1 ARG 106 11.356 -5.448 -9.207 824 HE ARG 106 HE ARG 106 13.159 -3.356 -8.547 825 HH11 ARG 106 HH11 ARG 106 12.729 -5.948 -10.876 826 HH12 ARG 106 HH12 ARG 106 13.475 -5.056 -12.171 827 HH21 ARG 106 HH21 ARG 106 14.120 -2.197 -10.254 828 HH22 ARG 106 HH22 ARG 106 14.256 -2.938 -11.826 829 H LEU 107 HN LEU 107 9.532 -3.272 -4.983 830 HA LEU 107 HA LEU 107 6.938 -3.587 -6.182 831 HB2 LEU 107 HB2 LEU 107 6.141 -2.266 -3.995 832 HB3 LEU 107 HB1 LEU 107 5.966 -3.986 -4.274 833 HG LEU 107 HG LEU 107 8.253 -4.190 -3.103 834 HD11 LEU 107 HD11 LEU 107 7.347 -1.547 -1.997 835 HD12 LEU 107 HD12 LEU 107 8.688 -1.757 -3.123 836 HD13 LEU 107 HD13 LEU 107 8.764 -2.487 -1.511 837 HD21 LEU 107 HD21 LEU 107 6.137 -5.006 -2.276 838 HD22 LEU 107 HD22 LEU 107 5.766 -3.414 -1.621 839 HD23 LEU 107 HD23 LEU 107 7.121 -4.345 -0.968 840 H LEU 108 HN LEU 108 5.727 -1.683 -6.335 841 HA LEU 108 HA LEU 108 7.350 0.775 -6.515 842 HB2 LEU 108 HB2 LEU 108 5.758 -0.539 -8.468 843 HB3 LEU 108 HB1 LEU 108 4.895 0.907 -7.992 844 HG LEU 108 HG LEU 108 6.828 2.293 -8.537 845 HD11 LEU 108 HD11 LEU 108 8.522 0.557 -8.012 846 HD12 LEU 108 HD12 LEU 108 8.802 1.386 -9.544 847 HD13 LEU 108 HD13 LEU 108 8.108 -0.239 -9.530 848 HD21 LEU 108 HD21 LEU 108 6.790 2.006 -10.958 849 HD22 LEU 108 HD22 LEU 108 5.170 1.863 -10.269 850 HD23 LEU 108 HD23 LEU 108 6.054 0.417 -10.760 851 H VAL 109 HN VAL 109 6.572 2.500 -5.326 852 HA VAL 109 HA VAL 109 3.884 2.301 -4.268 853 HB VAL 109 HB VAL 109 4.708 3.252 -2.155 854 HG11 VAL 109 HG11 VAL 109 5.402 1.229 -1.130 855 HG12 VAL 109 HG12 VAL 109 5.974 0.588 -2.674 856 HG13 VAL 109 HG13 VAL 109 4.246 0.826 -2.404 857 HG21 VAL 109 HG21 VAL 109 7.090 3.048 -1.571 858 HG22 VAL 109 HG22 VAL 109 6.814 4.180 -2.895 859 HG23 VAL 109 HG23 VAL 109 7.427 2.561 -3.232 860 H THR 110 HN THR 110 3.346 4.434 -3.212 861 HA THR 110 HA THR 110 4.573 6.708 -4.564 862 HB THR 110 HB THR 110 2.203 7.656 -4.846 863 HG1 THR 110 HG1 THR 110 1.582 4.874 -4.824 864 HG21 THR 110 HG21 THR 110 3.684 7.013 -6.685 865 HG22 THR 110 HG22 THR 110 1.988 6.670 -7.045 866 HG23 THR 110 HG23 THR 110 3.076 5.359 -6.581 867 H ARG 111 HN ARG 111 5.322 7.869 -2.966 868 HA ARG 111 HA ARG 111 3.549 8.391 -0.672 869 HB2 ARG 111 HB2 ARG 111 5.648 8.884 0.642 870 HB3 ARG 111 HB1 ARG 111 5.403 7.196 0.221 871 HG2 ARG 111 HG2 ARG 111 7.074 7.262 -1.431 872 HG3 ARG 111 HG1 ARG 111 7.154 9.022 -1.394 873 HD2 ARG 111 HD2 ARG 111 8.037 8.926 0.885 874 HD3 ARG 111 HD1 ARG 111 7.940 7.168 0.845 875 HE ARG 111 HE ARG 111 9.548 7.359 -1.101 876 HH11 ARG 111 HH11 ARG 111 9.502 9.646 1.550 877 HH12 ARG 111 HH12 ARG 111 11.166 10.096 1.350 878 HH21 ARG 111 HH21 ARG 111 11.745 7.960 -1.360 879 HH22 ARG 111 HH22 ARG 111 12.445 9.131 -0.288 880 H GLN 112 HN GLN 112 4.071 10.574 0.386 881 HA GLN 112 HA GLN 112 4.412 12.536 -1.738 882 HB2 GLN 112 HB2 GLN 112 3.214 12.761 0.990 883 HB3 GLN 112 HB1 GLN 112 3.300 14.065 -0.179 884 HG2 GLN 112 HG2 GLN 112 1.859 11.449 -0.515 885 HG3 GLN 112 HG1 GLN 112 1.114 12.996 -0.145 886 HE21 GLN 112 HE21 GLN 112 2.721 11.082 -2.510 887 HE22 GLN 112 HE22 GLN 112 2.341 12.057 -3.882 888 H SER 113 HN SER 113 5.518 11.712 1.416 889 HA SER 113 HA SER 113 7.302 12.277 2.666 890 HB2 SER 113 HB2 SER 113 8.048 13.870 0.244 891 HB3 SER 113 HB1 SER 113 9.067 13.722 1.676 892 HG SER 113 HG SER 113 9.265 12.188 -0.296 893 H LEU 114 HN LEU 114 4.803 13.810 2.011 894 HA LEU 114 HA LEU 114 3.597 15.507 2.869 895 HB2 LEU 114 HB2 LEU 114 5.811 15.177 4.817 896 HB3 LEU 114 HB1 LEU 114 4.438 16.228 5.145 897 HG LEU 114 HG LEU 114 3.674 14.326 6.178 898 HD11 LEU 114 HD11 LEU 114 2.323 12.952 4.518 899 HD12 LEU 114 HD12 LEU 114 3.006 14.007 3.268 900 HD13 LEU 114 HD13 LEU 114 2.013 14.686 4.563 901 HD21 LEU 114 HD21 LEU 114 5.256 12.724 4.166 902 HD22 LEU 114 HD22 LEU 114 4.279 12.035 5.467 903 HD23 LEU 114 HD23 LEU 114 5.687 13.029 5.848 904 H GLN 115 HN GLN 115 5.695 16.065 1.064 905 HA GLN 115 HA GLN 115 6.604 18.726 1.801 906 HB2 GLN 115 HB2 GLN 115 8.170 18.503 -0.014 907 HB3 GLN 115 HB1 GLN 115 8.262 17.090 1.006 908 HG2 GLN 115 HG2 GLN 115 8.257 16.024 -0.968 909 HG3 GLN 115 HG1 GLN 115 6.510 16.209 -0.816 910 HE21 GLN 115 HE21 GLN 115 8.663 18.879 -1.470 911 HE22 GLN 115 HE22 GLN 115 8.154 19.148 -3.097 912 H LYS 116 HN LYS 116 6.720 20.312 -0.052 913 HA LYS 116 HA LYS 116 4.464 20.107 -1.921 914 HB2 LYS 116 HB2 LYS 116 5.078 22.481 -0.144 915 HB3 LYS 116 HB1 LYS 116 3.964 22.532 -1.502 916 HG2 LYS 116 HG2 LYS 116 3.667 20.753 0.909 917 HG3 LYS 116 HG1 LYS 116 2.821 22.280 0.658 918 HD2 LYS 116 HD2 LYS 116 1.648 21.411 -1.225 919 HD3 LYS 116 HD1 LYS 116 2.659 19.968 -1.258 920 HE2 LYS 116 HE2 LYS 116 0.734 20.709 0.943 921 HE3 LYS 116 HE1 LYS 116 0.443 19.509 -0.317 922 HZ1 LYS 116 HZ1 LYS 116 2.274 19.385 1.985 923 HZ2 LYS 116 HZ2 LYS 116 2.632 18.495 0.593 924 HZ3 LYS 116 HZ3 LYS 116 1.177 18.219 1.424 925 H ALA 117 HN ALA 117 4.919 20.933 -3.943 926 HA ALA 117 HA ALA 117 7.430 22.356 -4.316 927 HB1 ALA 117 HB1 ALA 117 8.025 19.969 -4.462 928 HB2 ALA 117 HB2 ALA 117 8.221 20.787 -6.012 929 HB3 ALA 117 HB3 ALA 117 6.816 19.758 -5.729 930 H VAL 118 HN VAL 118 4.558 22.724 -4.522 931 HA VAL 118 HA VAL 118 4.254 23.198 -7.388 932 HB VAL 118 HB VAL 118 2.547 21.719 -6.584 933 HG11 VAL 118 HG11 VAL 118 2.561 22.251 -4.222 934 HG12 VAL 118 HG12 VAL 118 0.925 22.382 -4.867 935 HG13 VAL 118 HG13 VAL 118 1.866 23.839 -4.552 936 HG21 VAL 118 HG21 VAL 118 1.888 23.267 -8.285 937 HG22 VAL 118 HG22 VAL 118 1.502 24.489 -7.077 938 HG23 VAL 118 HG23 VAL 118 0.538 23.016 -7.176 939 H GLN 119 HN GLN 119 5.534 25.015 -7.182 940 HA GLN 119 HA GLN 119 4.207 27.346 -5.988 941 HB2 GLN 119 HB2 GLN 119 6.544 28.243 -5.629 942 HB3 GLN 119 HB1 GLN 119 6.085 26.881 -4.615 943 HG2 GLN 119 HG2 GLN 119 7.319 25.367 -6.045 944 HG3 GLN 119 HG1 GLN 119 7.753 26.702 -7.111 945 HE21 GLN 119 HE21 GLN 119 7.621 26.935 -3.628 946 HE22 GLN 119 HE22 GLN 119 9.338 27.114 -3.404 947 H GLN 120 HN GLN 120 4.184 26.176 -8.691 948 HA GLN 120 HA GLN 120 5.606 28.071 -10.357 949 HB2 GLN 120 HB2 GLN 120 3.495 26.038 -11.134 950 HB3 GLN 120 HB1 GLN 120 4.580 26.888 -12.224 951 HG2 GLN 120 HG2 GLN 120 6.480 25.727 -11.319 952 HG3 GLN 120 HG1 GLN 120 5.472 24.964 -10.089 953 HE21 GLN 120 HE21 GLN 120 6.391 24.991 -13.442 954 HE22 GLN 120 HE22 GLN 120 5.633 23.491 -13.859 955 H SER 121 HN SER 121 4.763 29.930 -11.163 956 HA SER 121 HA SER 121 1.891 30.355 -11.108 957 HB2 SER 121 HB2 SER 121 3.814 32.115 -9.567 958 HB3 SER 121 HB1 SER 121 2.112 32.479 -9.846 959 HG SER 121 HG SER 121 2.406 29.984 -8.853 960 H MET 122 HN MET 122 1.484 30.971 -13.075 961 HA MET 122 HA MET 122 1.524 31.990 -15.087 962 HB2 MET 122 HB2 MET 122 1.540 34.401 -15.032 963 HB3 MET 122 HB1 MET 122 0.688 33.776 -13.630 964 HG2 MET 122 HG2 MET 122 2.645 34.230 -12.242 965 HG3 MET 122 HG1 MET 122 3.501 34.849 -13.654 966 HE1 MET 122 HE1 MET 122 4.020 37.102 -12.347 967 HE2 MET 122 HE2 MET 122 3.153 36.500 -10.935 968 HE3 MET 122 HE3 MET 122 2.781 38.098 -11.584 969 H LEU 123 HN LEU 123 3.039 34.245 -15.983 970 HA LEU 123 HA LEU 123 5.294 32.833 -17.025 971 HB2 LEU 123 HB2 LEU 123 4.351 35.677 -17.366 972 HB3 LEU 123 HB1 LEU 123 5.782 35.047 -18.155 973 HG LEU 123 HG LEU 123 4.277 33.315 -19.242 974 HD11 LEU 123 HD11 LEU 123 2.374 33.507 -17.735 975 HD12 LEU 123 HD12 LEU 123 1.908 33.841 -19.403 976 HD13 LEU 123 HD13 LEU 123 2.117 35.169 -18.259 977 HD21 LEU 123 HD21 LEU 123 3.783 36.216 -19.880 978 HD22 LEU 123 HD22 LEU 123 3.499 34.854 -20.961 979 HD23 LEU 123 HD23 LEU 123 5.140 35.239 -20.449 980 H SER 124 HN SER 124 7.143 32.612 -15.999 981 HA SER 124 HA SER 124 7.879 34.219 -13.766 982 HB2 SER 124 HB2 SER 124 10.074 32.872 -14.039 983 HB3 SER 124 HB1 SER 124 8.597 31.978 -13.660 984 HG SER 124 HG SER 124 10.211 31.702 -15.781 985 H1 LYS 161 HN LYS 161 -11.509 -5.161 -4.384 986 HA LYS 161 HA LYS 161 -10.367 -2.455 -4.331 987 HB2 LYS 161 HB2 LYS 161 -11.870 -3.020 -6.381 988 HB3 LYS 161 HB1 LYS 161 -13.196 -2.991 -5.232 989 HG2 LYS 161 HG2 LYS 161 -12.924 -0.899 -6.516 990 HG3 LYS 161 HG1 LYS 161 -12.847 -0.664 -4.767 991 HD2 LYS 161 HD2 LYS 161 -11.135 0.617 -5.997 992 HD3 LYS 161 HD1 LYS 161 -10.440 -0.537 -4.861 993 HE2 LYS 161 HE2 LYS 161 -10.229 -2.115 -6.852 994 HE3 LYS 161 HE1 LYS 161 -10.564 -0.702 -7.857 995 HZ1 LYS 161 HZ1 LYS 161 -8.656 0.409 -6.850 996 HZ2 LYS 161 HZ2 LYS 161 -8.193 -1.031 -7.609 997 HZ3 LYS 161 HZ3 LYS 161 -8.332 -0.970 -5.925 998 H GLU 162 HN GLU 162 -12.875 -4.709 -3.322 999 HA GLU 162 HA GLU 162 -14.012 -3.175 -1.203 1000 HB2 GLU 162 HB2 GLU 162 -14.681 -5.516 -0.355 1001 HB3 GLU 162 HB1 GLU 162 -15.326 -4.968 -1.895 1002 HG2 GLU 162 HG2 GLU 162 -12.860 -6.669 -1.780 1003 HG3 GLU 162 HG1 GLU 162 -14.460 -7.394 -1.642 1004 H ASN 163 HN ASN 163 -13.713 -3.473 1.080 1005 HA ASN 163 HA ASN 163 -11.167 -3.225 2.052 1006 HB2 ASN 163 HB2 ASN 163 -13.565 -4.372 3.478 1007 HB3 ASN 163 HB1 ASN 163 -12.064 -3.964 4.294 1008 HD21 ASN 163 HD21 ASN 163 -11.726 -1.604 2.482 1009 HD22 ASN 163 HD22 ASN 163 -12.818 -0.418 3.119 1010 H LEU 164 HN LEU 164 -9.527 -4.619 1.574 1011 HA LEU 164 HA LEU 164 -9.588 -7.139 3.006 1012 HB2 LEU 164 HB2 LEU 164 -8.784 -8.457 1.082 1013 HB3 LEU 164 HB1 LEU 164 -10.421 -7.868 0.880 1014 HG LEU 164 HG LEU 164 -9.093 -5.925 -0.428 1015 HD11 LEU 164 HD11 LEU 164 -7.301 -6.807 -1.745 1016 HD12 LEU 164 HD12 LEU 164 -7.480 -8.412 -1.031 1017 HD13 LEU 164 HD13 LEU 164 -6.900 -7.059 -0.046 1018 HD21 LEU 164 HD21 LEU 164 -9.695 -7.116 -2.484 1019 HD22 LEU 164 HD22 LEU 164 -10.975 -7.184 -1.273 1020 HD23 LEU 164 HD23 LEU 164 -9.946 -8.590 -1.546 1021 H GLU 165 HN GLU 165 -7.402 -8.286 2.610 1022 HA GLU 165 HA GLU 165 -5.163 -8.226 1.935 1023 HB2 GLU 165 HB2 GLU 165 -5.545 -5.478 1.790 1024 HB3 GLU 165 HB1 GLU 165 -4.308 -5.709 3.021 1025 HG2 GLU 165 HG2 GLU 165 -4.038 -5.834 0.201 1026 HG3 GLU 165 HG1 GLU 165 -2.797 -6.019 1.441 1027 H SER 166 HN SER 166 -3.172 -7.040 3.789 1028 HA SER 166 HA SER 166 -3.714 -8.869 6.020 1029 HB2 SER 166 HB2 SER 166 -1.541 -9.559 4.085 1030 HB3 SER 166 HB1 SER 166 -2.351 -10.615 5.248 1031 HG SER 166 HG SER 166 -3.247 -9.669 2.738 1032 H MET 167 HN MET 167 -1.716 -9.290 7.361 1033 HA MET 167 HA MET 167 0.637 -7.698 6.630 1034 HB2 MET 167 HB2 MET 167 1.803 -8.900 8.470 1035 HB3 MET 167 HB1 MET 167 0.385 -8.010 9.045 1036 HG2 MET 167 HG2 MET 167 -0.902 -10.076 9.104 1037 HG3 MET 167 HG1 MET 167 0.482 -10.970 8.480 1038 HE1 MET 167 HE1 MET 167 -0.908 -8.861 11.531 1039 HE2 MET 167 HE2 MET 167 0.579 -8.031 11.072 1040 HE3 MET 167 HE3 MET 167 0.491 -8.889 12.608 1041 H VAL 168 HN VAL 168 2.524 -8.778 5.823 1042 HA VAL 168 HA VAL 168 1.774 -11.312 4.541 1043 HB VAL 168 HB VAL 168 3.077 -10.454 2.524 1044 HG11 VAL 168 HG11 VAL 168 0.509 -9.060 3.295 1045 HG12 VAL 168 HG12 VAL 168 0.628 -10.673 2.592 1046 HG13 VAL 168 HG13 VAL 168 1.121 -9.263 1.653 1047 HG21 VAL 168 HG21 VAL 168 3.160 -8.006 2.275 1048 HG22 VAL 168 HG22 VAL 168 4.185 -8.563 3.599 1049 HG23 VAL 168 HG23 VAL 168 2.620 -7.826 3.941 Start of MODEL 7 1 H1 MET 1 HT1 MET 1 0.288 32.077 -10.039 2 H2 MET 1 HT2 MET 1 1.296 32.918 -11.105 3 H3 MET 1 HT3 MET 1 -0.185 32.304 -11.650 4 HA MET 1 HA MET 1 0.170 34.449 -9.638 5 HB2 MET 1 HB2 MET 1 -0.702 34.482 -12.529 6 HB3 MET 1 HB1 MET 1 -0.972 35.825 -11.432 7 HG2 MET 1 HG2 MET 1 1.408 36.094 -11.122 8 HG3 MET 1 HG1 MET 1 1.717 34.687 -12.136 9 HE1 MET 1 HE1 MET 1 3.045 37.561 -12.542 10 HE2 MET 1 HE2 MET 1 2.956 37.736 -14.295 11 HE3 MET 1 HE3 MET 1 3.412 36.186 -13.583 12 H SER 2 HN SER 2 -1.715 31.857 -10.608 13 HA SER 2 HA SER 2 -4.255 33.185 -10.012 14 HB2 SER 2 HB2 SER 2 -3.708 30.446 -11.176 15 HB3 SER 2 HB1 SER 2 -5.292 31.205 -11.014 16 HG SER 2 HG SER 2 -4.560 31.534 -13.094 17 H TYR 3 HN TYR 3 -5.852 31.828 -8.798 18 HA TYR 3 HA TYR 3 -4.602 30.540 -6.489 19 HB2 TYR 3 HB2 TYR 3 -7.533 31.175 -6.896 20 HB3 TYR 3 HB1 TYR 3 -6.727 30.780 -5.382 21 HD1 TYR 3 HD1 TYR 3 -4.772 32.433 -4.736 22 HD2 TYR 3 HD2 TYR 3 -7.984 33.400 -7.343 23 HE1 TYR 3 HE1 TYR 3 -4.394 34.817 -4.296 24 HE2 TYR 3 HE2 TYR 3 -7.618 35.795 -6.914 25 HH TYR 3 HH TYR 3 -4.843 36.997 -5.525 26 H ILE 4 HN ILE 4 -5.216 28.417 -5.863 27 HA ILE 4 HA ILE 4 -6.427 26.866 -8.060 28 HB ILE 4 HB ILE 4 -4.300 25.829 -6.180 29 HG12 ILE 4 HG12 ILE 4 -3.984 26.776 -9.049 30 HG13 ILE 4 HG11 ILE 4 -3.395 27.632 -7.626 31 HG21 ILE 4 HG21 ILE 4 -5.754 24.115 -7.115 32 HG22 ILE 4 HG22 ILE 4 -4.144 24.003 -7.823 33 HG23 ILE 4 HG23 ILE 4 -5.462 24.727 -8.744 34 HD11 ILE 4 HD11 ILE 4 -1.607 26.424 -8.734 35 HD12 ILE 4 HD12 ILE 4 -2.494 24.911 -8.539 36 HD13 ILE 4 HD13 ILE 4 -1.900 25.776 -7.122 37 HA PRO 5 HA PRO 5 -9.092 25.925 -4.503 38 HB2 PRO 5 HB2 PRO 5 -11.224 25.657 -6.427 39 HB3 PRO 5 HB1 PRO 5 -11.018 26.900 -5.192 40 HG2 PRO 5 HG2 PRO 5 -10.848 27.390 -7.880 41 HG3 PRO 5 HG1 PRO 5 -10.010 28.358 -6.650 42 HD2 PRO 5 HD2 PRO 5 -8.948 26.137 -8.364 43 HD3 PRO 5 HD1 PRO 5 -8.200 27.698 -7.951 44 H GLY 6 HN GLY 6 -8.728 23.873 -3.876 45 HA2 GLY 6 HA2 GLY 6 -9.017 21.576 -3.829 46 HA3 GLY 6 HA1 GLY 6 -9.871 21.685 -5.371 47 H GLN 7 HN GLN 7 -6.596 22.559 -4.320 48 HA GLN 7 HA GLN 7 -5.427 21.704 -6.754 49 HB2 GLN 7 HB2 GLN 7 -3.265 22.082 -5.516 50 HB3 GLN 7 HB1 GLN 7 -4.342 23.465 -5.605 51 HG2 GLN 7 HG2 GLN 7 -5.141 22.781 -3.290 52 HG3 GLN 7 HG1 GLN 7 -3.742 21.708 -3.249 53 HE21 GLN 7 HE21 GLN 7 -4.414 24.063 -1.638 54 HE22 GLN 7 HE22 GLN 7 -3.080 25.154 -1.818 55 HA PRO 8 HA PRO 8 -5.294 17.369 -5.955 56 HB2 PRO 8 HB2 PRO 8 -3.205 17.346 -8.039 57 HB3 PRO 8 HB1 PRO 8 -4.772 16.531 -8.011 58 HG2 PRO 8 HG2 PRO 8 -4.322 18.632 -9.606 59 HG3 PRO 8 HG1 PRO 8 -5.894 18.390 -8.819 60 HD2 PRO 8 HD2 PRO 8 -3.660 20.242 -8.067 61 HD3 PRO 8 HD1 PRO 8 -5.416 20.534 -8.078 62 H VAL 9 HN VAL 9 -3.982 15.810 -5.059 63 HA VAL 9 HA VAL 9 -1.588 16.754 -3.725 64 HB VAL 9 HB VAL 9 -3.362 15.277 -2.656 65 HG11 VAL 9 HG11 VAL 9 -3.112 12.836 -2.994 66 HG12 VAL 9 HG12 VAL 9 -2.073 13.174 -4.381 67 HG13 VAL 9 HG13 VAL 9 -3.760 13.692 -4.393 68 HG21 VAL 9 HG21 VAL 9 -0.513 14.313 -2.546 69 HG22 VAL 9 HG22 VAL 9 -1.767 13.958 -1.356 70 HG23 VAL 9 HG23 VAL 9 -1.219 15.619 -1.593 71 H THR 10 HN THR 10 0.187 14.819 -3.669 72 HA THR 10 HA THR 10 0.912 14.511 -6.454 73 HB THR 10 HB THR 10 3.207 15.272 -5.842 74 HG1 THR 10 HG1 THR 10 3.464 15.499 -3.732 75 HG21 THR 10 HG21 THR 10 0.941 17.247 -5.546 76 HG22 THR 10 HG22 THR 10 1.651 16.685 -7.065 77 HG23 THR 10 HG23 THR 10 2.612 17.661 -5.951 78 H ALA 11 HN ALA 11 1.102 12.559 -6.703 79 HA ALA 11 HA ALA 11 2.096 10.679 -4.754 80 HB1 ALA 11 HB1 ALA 11 1.758 8.996 -6.552 81 HB2 ALA 11 HB2 ALA 11 1.184 10.291 -7.603 82 HB3 ALA 11 HB3 ALA 11 0.287 9.883 -6.137 83 H VAL 12 HN VAL 12 4.089 10.627 -4.434 84 HA VAL 12 HA VAL 12 6.025 10.843 -6.588 85 HB VAL 12 HB VAL 12 6.507 10.103 -3.755 86 HG11 VAL 12 HG11 VAL 12 8.333 9.618 -5.181 87 HG12 VAL 12 HG12 VAL 12 8.762 10.968 -4.131 88 HG13 VAL 12 HG13 VAL 12 8.330 11.265 -5.816 89 HG21 VAL 12 HG21 VAL 12 6.189 12.855 -4.892 90 HG22 VAL 12 HG22 VAL 12 7.146 12.562 -3.440 91 HG23 VAL 12 HG23 VAL 12 5.427 12.147 -3.456 92 H VAL 13 HN VAL 13 7.021 9.139 -7.370 93 HA VAL 13 HA VAL 13 6.039 6.491 -6.659 94 HB VAL 13 HB VAL 13 7.665 7.310 -9.082 95 HG11 VAL 13 HG11 VAL 13 6.932 5.148 -9.998 96 HG12 VAL 13 HG12 VAL 13 6.172 4.766 -8.454 97 HG13 VAL 13 HG13 VAL 13 7.922 4.963 -8.550 98 HG21 VAL 13 HG21 VAL 13 4.690 6.871 -8.820 99 HG22 VAL 13 HG22 VAL 13 5.557 7.106 -10.339 100 HG23 VAL 13 HG23 VAL 13 5.503 8.404 -9.148 101 H GLN 14 HN GLN 14 7.293 5.076 -5.666 102 HA GLN 14 HA GLN 14 10.186 5.447 -5.697 103 HB2 GLN 14 HB2 GLN 14 8.444 5.073 -3.274 104 HB3 GLN 14 HB1 GLN 14 10.123 4.554 -3.271 105 HG2 GLN 14 HG2 GLN 14 10.592 6.606 -2.568 106 HG3 GLN 14 HG1 GLN 14 10.303 7.104 -4.233 107 HE21 GLN 14 HE21 GLN 14 7.401 6.442 -3.875 108 HE22 GLN 14 HE22 GLN 14 6.758 7.801 -3.005 109 H ARG 15 HN ARG 15 11.345 3.600 -5.695 110 HA ARG 15 HA ARG 15 9.909 1.107 -6.022 111 HB2 ARG 15 HB2 ARG 15 12.536 1.932 -7.259 112 HB3 ARG 15 HB1 ARG 15 11.651 0.465 -7.551 113 HG2 ARG 15 HG2 ARG 15 11.180 1.761 -9.426 114 HG3 ARG 15 HG1 ARG 15 9.760 1.981 -8.387 115 HD2 ARG 15 HD2 ARG 15 10.546 4.036 -7.592 116 HD3 ARG 15 HD1 ARG 15 12.114 3.823 -8.364 117 HE ARG 15 HE ARG 15 10.264 3.748 -10.415 118 HH11 ARG 15 HH11 ARG 15 11.315 6.073 -7.993 119 HH12 ARG 15 HH12 ARG 15 10.838 7.444 -8.946 120 HH21 ARG 15 HH21 ARG 15 9.695 5.548 -11.667 121 HH22 ARG 15 HH22 ARG 15 9.913 7.156 -11.034 122 H VAL 16 HN VAL 16 10.299 -0.204 -4.461 123 HA VAL 16 HA VAL 16 12.895 -0.186 -3.152 124 HB VAL 16 HB VAL 16 11.497 1.222 -1.751 125 HG11 VAL 16 HG11 VAL 16 9.312 0.462 -2.446 126 HG12 VAL 16 HG12 VAL 16 9.463 0.360 -0.687 127 HG13 VAL 16 HG13 VAL 16 9.589 -1.099 -1.669 128 HG21 VAL 16 HG21 VAL 16 13.069 -0.236 -0.609 129 HG22 VAL 16 HG22 VAL 16 11.847 -1.503 -0.526 130 HG23 VAL 16 HG23 VAL 16 11.615 0.003 0.367 131 H GLU 17 HN GLU 17 13.391 -2.255 -2.232 132 HA GLU 17 HA GLU 17 11.597 -4.410 -3.056 133 HB2 GLU 17 HB2 GLU 17 14.618 -4.508 -2.901 134 HB3 GLU 17 HB1 GLU 17 13.566 -5.825 -3.399 135 HG2 GLU 17 HG2 GLU 17 12.809 -4.452 -5.307 136 HG3 GLU 17 HG1 GLU 17 13.960 -3.205 -4.832 137 H ILE 18 HN ILE 18 10.662 -5.241 -1.316 138 HA ILE 18 HA ILE 18 11.957 -5.116 1.267 139 HB ILE 18 HB ILE 18 9.101 -5.918 0.652 140 HG12 ILE 18 HG12 ILE 18 8.987 -3.670 0.113 141 HG13 ILE 18 HG11 ILE 18 8.704 -3.603 1.850 142 HG21 ILE 18 HG21 ILE 18 10.512 -5.184 3.207 143 HG22 ILE 18 HG22 ILE 18 9.998 -6.802 2.715 144 HG23 ILE 18 HG23 ILE 18 8.794 -5.556 3.057 145 HD11 ILE 18 HD11 ILE 18 10.276 -1.903 1.026 146 HD12 ILE 18 HD12 ILE 18 11.366 -3.211 0.541 147 HD13 ILE 18 HD13 ILE 18 10.969 -2.975 2.245 148 H HIS 19 HN HIS 19 13.017 -6.801 1.824 149 HA HIS 19 HA HIS 19 12.330 -9.291 0.546 150 HB2 HIS 19 HB2 HIS 19 14.620 -9.974 1.269 151 HB3 HIS 19 HB1 HIS 19 14.490 -8.659 0.109 152 HD1 HIS 19 HD1 HIS 19 15.349 -9.239 3.763 153 HD2 HIS 19 HD2 HIS 19 15.735 -6.401 0.747 154 HE1 HIS 19 HE1 HIS 19 16.886 -7.470 4.687 155 HE2 HIS 19 HE2 HIS 19 17.309 -5.911 2.744 156 H LYS 20 HN LYS 20 11.338 -10.733 1.450 157 HA LYS 20 HA LYS 20 10.170 -10.715 3.945 158 HB2 LYS 20 HB2 LYS 20 10.692 -12.984 2.013 159 HB3 LYS 20 HB1 LYS 20 9.541 -13.040 3.344 160 HG2 LYS 20 HG2 LYS 20 8.251 -11.242 2.358 161 HG3 LYS 20 HG1 LYS 20 9.435 -11.068 1.066 162 HD2 LYS 20 HD2 LYS 20 7.903 -13.622 1.538 163 HD3 LYS 20 HD1 LYS 20 7.303 -12.328 0.503 164 HE2 LYS 20 HE2 LYS 20 9.503 -12.523 -0.760 165 HE3 LYS 20 HE1 LYS 20 9.763 -14.019 0.135 166 HZ1 LYS 20 HZ1 LYS 20 7.401 -13.468 -1.593 167 HZ2 LYS 20 HZ2 LYS 20 7.755 -14.929 -0.814 168 HZ3 LYS 20 HZ3 LYS 20 8.747 -14.381 -2.074 169 H LEU 21 HN LEU 21 10.420 -12.664 5.594 170 HA LEU 21 HA LEU 21 13.283 -12.789 6.216 171 HB2 LEU 21 HB2 LEU 21 12.364 -10.792 7.296 172 HB3 LEU 21 HB1 LEU 21 11.129 -11.771 8.071 173 HG LEU 21 HG LEU 21 12.898 -12.964 9.322 174 HD11 LEU 21 HD11 LEU 21 15.159 -11.999 9.363 175 HD12 LEU 21 HD12 LEU 21 14.714 -10.950 8.016 176 HD13 LEU 21 HD13 LEU 21 14.741 -12.703 7.798 177 HD21 LEU 21 HD21 LEU 21 12.890 -9.965 9.615 178 HD22 LEU 21 HD22 LEU 21 13.437 -11.111 10.838 179 HD23 LEU 21 HD23 LEU 21 11.744 -11.094 10.342 180 H ARG 22 HN ARG 22 13.736 -14.217 7.963 181 HA ARG 22 HA ARG 22 12.628 -16.729 7.240 182 HB2 ARG 22 HB2 ARG 22 15.094 -16.058 7.842 183 HB3 ARG 22 HB1 ARG 22 14.574 -16.433 9.462 184 HG2 ARG 22 HG2 ARG 22 15.637 -18.346 8.590 185 HG3 ARG 22 HG1 ARG 22 13.903 -18.677 8.697 186 HD2 ARG 22 HD2 ARG 22 13.629 -18.699 6.456 187 HD3 ARG 22 HD1 ARG 22 14.880 -17.478 6.220 188 HE ARG 22 HE ARG 22 16.379 -19.173 5.854 189 HH11 ARG 22 HH11 ARG 22 13.658 -20.476 7.618 190 HH12 ARG 22 HH12 ARG 22 14.249 -22.107 7.590 191 HH21 ARG 22 HH21 ARG 22 17.162 -21.322 5.796 192 HH22 ARG 22 HH22 ARG 22 16.255 -22.579 6.589 193 H GLN 23 HN GLN 23 10.813 -17.459 8.059 194 HA GLN 23 HA GLN 23 10.829 -17.969 10.906 195 HB2 GLN 23 HB2 GLN 23 8.125 -17.817 10.251 196 HB3 GLN 23 HB1 GLN 23 9.041 -16.723 11.276 197 HG2 GLN 23 HG2 GLN 23 9.710 -15.592 9.072 198 HG3 GLN 23 HG1 GLN 23 8.313 -16.439 8.416 199 HE21 GLN 23 HE21 GLN 23 8.943 -13.592 8.903 200 HE22 GLN 23 HE22 GLN 23 7.579 -12.983 9.808 201 H GLY 24 HN GLY 24 11.861 -19.763 9.951 202 HA2 GLY 24 HA2 GLY 24 11.784 -22.039 9.635 203 HA3 GLY 24 HA1 GLY 24 10.028 -21.974 9.790 204 H GLU 25 HN GLU 25 8.956 -22.467 8.044 205 HA GLU 25 HA GLU 25 10.292 -22.676 5.499 206 HB2 GLU 25 HB2 GLU 25 8.403 -24.147 6.539 207 HB3 GLU 25 HB1 GLU 25 7.338 -22.926 5.870 208 HG2 GLU 25 HG2 GLU 25 8.620 -23.327 3.666 209 HG3 GLU 25 HG1 GLU 25 9.146 -24.825 4.432 210 H ASN 26 HN ASN 26 9.172 -20.146 7.172 211 HA ASN 26 HA ASN 26 7.730 -18.965 4.950 212 HB2 ASN 26 HB2 ASN 26 7.728 -18.250 7.863 213 HB3 ASN 26 HB1 ASN 26 6.851 -17.408 6.616 214 HD21 ASN 26 HD21 ASN 26 7.187 -20.271 8.378 215 HD22 ASN 26 HD22 ASN 26 5.579 -20.907 8.135 216 H LEU 27 HN LEU 27 8.487 -17.391 4.101 217 HA LEU 27 HA LEU 27 10.559 -15.753 5.341 218 HB2 LEU 27 HB2 LEU 27 10.103 -16.552 2.491 219 HB3 LEU 27 HB1 LEU 27 10.868 -15.032 2.850 220 HG LEU 27 HG LEU 27 12.529 -16.753 2.348 221 HD11 LEU 27 HD11 LEU 27 13.191 -15.006 3.874 222 HD12 LEU 27 HD12 LEU 27 13.921 -16.536 4.365 223 HD13 LEU 27 HD13 LEU 27 12.525 -15.902 5.237 224 HD21 LEU 27 HD21 LEU 27 11.319 -18.725 3.032 225 HD22 LEU 27 HD22 LEU 27 11.336 -18.199 4.716 226 HD23 LEU 27 HD23 LEU 27 12.845 -18.646 3.912 227 H ILE 28 HN ILE 28 9.466 -14.217 6.238 228 HA ILE 28 HA ILE 28 7.982 -12.265 4.748 229 HB ILE 28 HB ILE 28 6.044 -12.542 6.532 230 HG12 ILE 28 HG12 ILE 28 7.176 -15.321 6.154 231 HG13 ILE 28 HG11 ILE 28 7.052 -14.433 7.674 232 HG21 ILE 28 HG21 ILE 28 5.794 -12.465 4.143 233 HG22 ILE 28 HG22 ILE 28 4.820 -13.796 4.786 234 HG23 ILE 28 HG23 ILE 28 6.372 -14.121 4.001 235 HD11 ILE 28 HD11 ILE 28 5.343 -16.185 7.461 236 HD12 ILE 28 HD12 ILE 28 4.715 -15.375 6.022 237 HD13 ILE 28 HD13 ILE 28 4.636 -14.569 7.590 238 H LEU 29 HN LEU 29 7.140 -10.508 6.472 239 HA LEU 29 HA LEU 29 9.191 -10.486 8.584 240 HB2 LEU 29 HB2 LEU 29 9.554 -8.057 8.156 241 HB3 LEU 29 HB1 LEU 29 10.197 -9.157 6.956 242 HG LEU 29 HG LEU 29 7.534 -7.852 6.522 243 HD11 LEU 29 HD11 LEU 29 9.124 -6.082 7.116 244 HD12 LEU 29 HD12 LEU 29 8.653 -6.013 5.419 245 HD13 LEU 29 HD13 LEU 29 10.227 -6.668 5.870 246 HD21 LEU 29 HD21 LEU 29 8.143 -8.110 4.180 247 HD22 LEU 29 HD22 LEU 29 8.245 -9.662 5.013 248 HD23 LEU 29 HD23 LEU 29 9.715 -8.762 4.642 249 H GLY 30 HN GLY 30 6.013 -9.334 7.550 250 HA2 GLY 30 HA2 GLY 30 4.291 -9.376 9.216 251 HA3 GLY 30 HA1 GLY 30 5.486 -8.929 10.419 252 H PHE 31 HN PHE 31 5.635 -7.114 7.450 253 HA PHE 31 HA PHE 31 4.485 -4.841 8.884 254 HB2 PHE 31 HB2 PHE 31 5.363 -3.408 7.278 255 HB3 PHE 31 HB1 PHE 31 6.584 -4.647 7.447 256 HD1 PHE 31 HD1 PHE 31 4.028 -3.227 5.271 257 HD2 PHE 31 HD2 PHE 31 7.111 -6.121 5.627 258 HE1 PHE 31 HE1 PHE 31 3.930 -3.614 2.859 259 HE2 PHE 31 HE2 PHE 31 7.048 -6.505 3.210 260 HZ PHE 31 HZ PHE 31 5.608 -5.079 1.783 261 H SER 32 HN SER 32 2.773 -3.521 7.737 262 HA SER 32 HA SER 32 0.916 -5.504 6.579 263 HB2 SER 32 HB2 SER 32 0.549 -5.314 9.030 264 HB3 SER 32 HB1 SER 32 0.211 -3.596 8.825 265 HG SER 32 HG SER 32 -1.249 -5.347 7.238 266 H ILE 33 HN ILE 33 -0.560 -4.771 5.095 267 HA ILE 33 HA ILE 33 -0.544 -1.861 4.671 268 HB ILE 33 HB ILE 33 -0.320 -1.989 2.395 269 HG12 ILE 33 HG12 ILE 33 -2.271 -3.618 2.154 270 HG13 ILE 33 HG11 ILE 33 -1.008 -3.727 0.937 271 HG21 ILE 33 HG21 ILE 33 1.490 -3.458 1.842 272 HG22 ILE 33 HG22 ILE 33 1.079 -4.534 3.179 273 HG23 ILE 33 HG23 ILE 33 1.684 -2.912 3.511 274 HD11 ILE 33 HD11 ILE 33 -0.092 -5.687 2.086 275 HD12 ILE 33 HD12 ILE 33 -1.774 -5.916 1.595 276 HD13 ILE 33 HD13 ILE 33 -1.386 -5.575 3.284 277 H GLY 34 HN GLY 34 -2.569 -1.248 3.351 278 HA2 GLY 34 HA2 GLY 34 -4.781 -2.919 4.324 279 HA3 GLY 34 HA1 GLY 34 -4.698 -1.241 4.856 280 H GLY 35 HN GLY 35 -6.770 -2.655 3.310 281 HA2 GLY 35 HA2 GLY 35 -8.077 -0.865 2.019 282 HA3 GLY 35 HA1 GLY 35 -6.756 -1.008 0.869 283 H GLY 36 HN GLY 36 -7.202 -2.213 -0.790 284 HA2 GLY 36 HA2 GLY 36 -7.456 -4.834 -0.947 285 HA3 GLY 36 HA1 GLY 36 -9.138 -4.367 -0.678 286 H ILE 37 HN ILE 37 -9.699 -2.356 -2.050 287 HA ILE 37 HA ILE 37 -8.721 -2.338 -4.740 288 HB ILE 37 HB ILE 37 -11.329 -2.775 -5.286 289 HG12 ILE 37 HG12 ILE 37 -10.842 -4.948 -3.321 290 HG13 ILE 37 HG11 ILE 37 -11.284 -3.385 -2.663 291 HG21 ILE 37 HG21 ILE 37 -9.150 -4.819 -5.007 292 HG22 ILE 37 HG22 ILE 37 -9.502 -3.835 -6.428 293 HG23 ILE 37 HG23 ILE 37 -10.646 -5.070 -5.903 294 HD11 ILE 37 HD11 ILE 37 -12.875 -4.914 -4.684 295 HD12 ILE 37 HD12 ILE 37 -13.301 -3.370 -3.943 296 HD13 ILE 37 HD13 ILE 37 -13.197 -4.823 -2.953 297 H ASP 38 HN ASP 38 -11.540 -1.647 -2.785 298 HA ASP 38 HA ASP 38 -11.507 1.180 -3.426 299 HB2 ASP 38 HB2 ASP 38 -12.806 0.324 -5.269 300 HB3 ASP 38 HB1 ASP 38 -13.692 -0.757 -4.191 301 H GLN 39 HN GLN 39 -13.169 -1.544 -1.991 302 HA GLN 39 HA GLN 39 -14.489 -1.872 -0.185 303 HB2 GLN 39 HB2 GLN 39 -12.853 0.232 1.162 304 HB3 GLN 39 HB1 GLN 39 -13.561 -1.219 1.863 305 HG2 GLN 39 HG2 GLN 39 -11.327 -1.087 -0.113 306 HG3 GLN 39 HG1 GLN 39 -11.207 -1.498 1.579 307 HE21 GLN 39 HE21 GLN 39 -10.428 -3.062 -0.674 308 HE22 GLN 39 HE22 GLN 39 -11.339 -4.518 -0.636 309 H ASP 40 HN ASP 40 -13.796 1.520 0.138 310 HA ASP 40 HA ASP 40 -16.654 2.125 0.284 311 HB2 ASP 40 HB2 ASP 40 -15.798 1.506 2.586 312 HB3 ASP 40 HB1 ASP 40 -14.758 2.920 2.501 313 HA PRO 41 HA PRO 41 -15.282 5.645 -2.033 314 HB2 PRO 41 HB2 PRO 41 -17.517 7.134 -1.790 315 HB3 PRO 41 HB1 PRO 41 -17.478 5.658 -2.769 316 HG2 PRO 41 HG2 PRO 41 -18.355 5.974 0.098 317 HG3 PRO 41 HG1 PRO 41 -19.239 5.251 -1.240 318 HD2 PRO 41 HD2 PRO 41 -17.932 3.693 0.423 319 HD3 PRO 41 HD1 PRO 41 -17.838 3.368 -1.323 320 H SER 42 HN SER 42 -15.910 5.624 1.270 321 HA SER 42 HA SER 42 -15.472 8.316 1.970 322 HB2 SER 42 HB2 SER 42 -16.221 6.567 3.557 323 HB3 SER 42 HB1 SER 42 -14.629 5.809 3.453 324 HG SER 42 HG SER 42 -15.426 8.149 4.766 325 H GLN 43 HN GLN 43 -13.249 5.630 1.396 326 HA GLN 43 HA GLN 43 -10.952 7.296 1.882 327 HB2 GLN 43 HB2 GLN 43 -9.735 5.257 1.799 328 HB3 GLN 43 HB1 GLN 43 -11.219 4.942 2.677 329 HG2 GLN 43 HG2 GLN 43 -12.146 4.078 0.482 330 HG3 GLN 43 HG1 GLN 43 -10.476 4.069 -0.081 331 HE21 GLN 43 HE21 GLN 43 -12.748 2.735 2.157 332 HE22 GLN 43 HE22 GLN 43 -11.795 1.378 2.652 333 H ASN 44 HN ASN 44 -12.728 5.859 -0.694 334 HA ASN 44 HA ASN 44 -11.014 6.573 -2.850 335 HB2 ASN 44 HB2 ASN 44 -12.574 4.806 -3.162 336 HB3 ASN 44 HB1 ASN 44 -13.926 5.793 -2.637 337 HD21 ASN 44 HD21 ASN 44 -13.758 4.176 -4.887 338 HD22 ASN 44 HD22 ASN 44 -13.880 5.197 -6.291 339 HA PRO 45 HA PRO 45 -12.136 10.902 -2.326 340 HB2 PRO 45 HB2 PRO 45 -10.135 11.843 -3.894 341 HB3 PRO 45 HB1 PRO 45 -9.870 11.326 -2.218 342 HG2 PRO 45 HG2 PRO 45 -9.347 9.838 -4.766 343 HG3 PRO 45 HG1 PRO 45 -8.343 9.949 -3.308 344 HD2 PRO 45 HD2 PRO 45 -9.935 7.804 -3.826 345 HD3 PRO 45 HD1 PRO 45 -9.570 8.359 -2.184 346 H PHE 46 HN PHE 46 -11.682 9.077 -5.300 347 HA PHE 46 HA PHE 46 -13.626 10.521 -6.783 348 HB2 PHE 46 HB2 PHE 46 -11.158 11.792 -6.501 349 HB3 PHE 46 HB1 PHE 46 -11.160 11.133 -8.136 350 HD1 PHE 46 HD2 PHE 46 -13.631 11.478 -9.288 351 HD2 PHE 46 HD1 PHE 46 -11.803 13.974 -6.370 352 HE1 PHE 46 HE2 PHE 46 -15.020 13.367 -10.044 353 HE2 PHE 46 HE1 PHE 46 -13.199 15.869 -7.104 354 HZ PHE 46 HZ PHE 46 -14.771 15.569 -9.009 355 H SER 47 HN SER 47 -12.138 7.740 -6.374 356 HA SER 47 HA SER 47 -11.769 7.258 -9.259 357 HB2 SER 47 HB2 SER 47 -9.567 7.566 -8.063 358 HB3 SER 47 HB1 SER 47 -9.952 6.126 -7.121 359 HG SER 47 HG SER 47 -10.118 5.956 -9.914 360 H GLU 48 HN GLU 48 -10.804 4.511 -8.147 361 HA GLU 48 HA GLU 48 -12.659 3.142 -6.734 362 HB2 GLU 48 HB2 GLU 48 -14.251 2.220 -8.340 363 HB3 GLU 48 HB1 GLU 48 -14.349 3.984 -8.313 364 HG2 GLU 48 HG2 GLU 48 -12.959 4.055 -10.351 365 HG3 GLU 48 HG1 GLU 48 -12.982 2.293 -10.405 366 H ASP 49 HN ASP 49 -10.615 3.254 -9.524 367 HA ASP 49 HA ASP 49 -9.460 0.687 -8.816 368 HB2 ASP 49 HB2 ASP 49 -10.572 1.351 -11.550 369 HB3 ASP 49 HB1 ASP 49 -9.415 0.064 -11.273 370 H LYS 50 HN LYS 50 -7.319 0.456 -9.605 371 HA LYS 50 HA LYS 50 -5.340 0.993 -10.506 372 HB2 LYS 50 HB2 LYS 50 -6.681 1.439 -12.537 373 HB3 LYS 50 HB1 LYS 50 -6.853 3.112 -12.022 374 HG2 LYS 50 HG2 LYS 50 -5.121 2.823 -13.728 375 HG3 LYS 50 HG1 LYS 50 -4.471 3.449 -12.209 376 HD2 LYS 50 HD2 LYS 50 -3.725 1.244 -11.583 377 HD3 LYS 50 HD1 LYS 50 -4.424 0.563 -13.052 378 HE2 LYS 50 HE2 LYS 50 -2.919 2.053 -14.375 379 HE3 LYS 50 HE1 LYS 50 -2.146 2.529 -12.863 380 HZ1 LYS 50 HZ1 LYS 50 -1.403 0.302 -12.520 381 HZ2 LYS 50 HZ2 LYS 50 -0.984 0.749 -14.103 382 HZ3 LYS 50 HZ3 LYS 50 -2.306 -0.272 -13.834 383 H THR 51 HN THR 51 -6.612 4.269 -10.598 384 HA THR 51 HA THR 51 -4.093 5.165 -9.506 385 HB THR 51 HB THR 51 -4.971 6.299 -11.471 386 HG1 THR 51 HG1 THR 51 -4.782 7.769 -9.067 387 HG21 THR 51 HG21 THR 51 -7.357 5.998 -11.086 388 HG22 THR 51 HG22 THR 51 -6.985 7.706 -11.337 389 HG23 THR 51 HG23 THR 51 -7.285 7.097 -9.709 390 H ASP 52 HN ASP 52 -6.596 4.015 -7.889 391 HA ASP 52 HA ASP 52 -6.991 6.268 -6.104 392 HB2 ASP 52 HB2 ASP 52 -8.844 4.636 -6.832 393 HB3 ASP 52 HB1 ASP 52 -8.131 3.517 -5.674 394 H LYS 53 HN LYS 53 -7.284 4.800 -3.720 395 HA LYS 53 HA LYS 53 -4.441 4.256 -3.124 396 HB2 LYS 53 HB2 LYS 53 -5.129 4.798 -0.719 397 HB3 LYS 53 HB1 LYS 53 -5.029 6.150 -1.838 398 HG2 LYS 53 HG2 LYS 53 -7.675 4.893 -1.645 399 HG3 LYS 53 HG1 LYS 53 -7.102 5.679 -0.169 400 HD2 LYS 53 HD2 LYS 53 -6.968 7.053 -2.833 401 HD3 LYS 53 HD1 LYS 53 -8.434 7.088 -1.855 402 HE2 LYS 53 HE2 LYS 53 -5.736 7.939 -0.827 403 HE3 LYS 53 HE1 LYS 53 -6.886 9.054 -1.560 404 HZ1 LYS 53 HZ1 LYS 53 -7.192 7.506 0.954 405 HZ2 LYS 53 HZ2 LYS 53 -8.506 8.242 0.178 406 HZ3 LYS 53 HZ3 LYS 53 -7.221 9.194 0.755 407 H GLY 54 HN GLY 54 -6.636 2.554 -4.123 408 HA2 GLY 54 HA2 GLY 54 -7.810 0.836 -2.364 409 HA3 GLY 54 HA1 GLY 54 -7.178 0.322 -3.924 410 H ILE 55 HN ILE 55 -4.397 0.730 -3.299 411 HA ILE 55 HA ILE 55 -3.980 -1.276 -1.180 412 HB ILE 55 HB ILE 55 -2.544 -1.109 -3.843 413 HG12 ILE 55 HG12 ILE 55 -4.783 -2.182 -3.903 414 HG13 ILE 55 HG11 ILE 55 -3.474 -3.289 -4.302 415 HG21 ILE 55 HG21 ILE 55 -0.911 -1.694 -2.222 416 HG22 ILE 55 HG22 ILE 55 -1.371 -3.186 -3.053 417 HG23 ILE 55 HG23 ILE 55 -2.001 -2.840 -1.439 418 HD11 ILE 55 HD11 ILE 55 -4.985 -3.122 -1.706 419 HD12 ILE 55 HD12 ILE 55 -3.564 -4.136 -1.963 420 HD13 ILE 55 HD13 ILE 55 -5.036 -4.422 -2.896 421 H TYR 56 HN TYR 56 -3.032 -0.139 0.450 422 HA TYR 56 HA TYR 56 -0.466 1.056 -0.152 423 HB2 TYR 56 HB2 TYR 56 -0.872 3.212 0.789 424 HB3 TYR 56 HB1 TYR 56 -2.105 2.921 -0.427 425 HD1 TYR 56 HD1 TYR 56 -4.286 1.727 0.633 426 HD2 TYR 56 HD2 TYR 56 -1.572 4.248 2.714 427 HE1 TYR 56 HE1 TYR 56 -6.042 2.236 2.283 428 HE2 TYR 56 HE2 TYR 56 -3.316 4.765 4.378 429 HH TYR 56 HH TYR 56 -5.918 4.774 4.388 430 H VAL 57 HN VAL 57 0.918 1.251 1.610 431 HA VAL 57 HA VAL 57 0.492 -0.727 3.587 432 HB VAL 57 HB VAL 57 2.613 0.052 2.315 433 HG11 VAL 57 HG11 VAL 57 4.082 1.373 3.937 434 HG12 VAL 57 HG12 VAL 57 2.541 1.985 4.543 435 HG13 VAL 57 HG13 VAL 57 2.987 2.218 2.853 436 HG21 VAL 57 HG21 VAL 57 2.462 -1.806 3.865 437 HG22 VAL 57 HG22 VAL 57 2.765 -0.691 5.199 438 HG23 VAL 57 HG23 VAL 57 4.005 -0.963 3.978 439 H THR 58 HN THR 58 0.133 -0.516 5.723 440 HA THR 58 HA THR 58 -0.256 2.189 6.790 441 HB THR 58 HB THR 58 -2.409 1.048 6.535 442 HG1 THR 58 HG1 THR 58 -3.016 1.849 8.387 443 HG21 THR 58 HG21 THR 58 -1.649 -1.271 6.626 444 HG22 THR 58 HG22 THR 58 -2.935 -0.983 7.797 445 HG23 THR 58 HG23 THR 58 -1.261 -1.084 8.337 446 H ARG 59 HN ARG 59 1.556 -0.641 6.934 447 HA ARG 59 HA ARG 59 2.594 0.095 9.564 448 HB2 ARG 59 HB2 ARG 59 1.679 -2.676 8.866 449 HB3 ARG 59 HB1 ARG 59 2.686 -2.294 10.245 450 HG2 ARG 59 HG2 ARG 59 0.756 -0.640 10.745 451 HG3 ARG 59 HG1 ARG 59 -0.187 -1.808 9.821 452 HD2 ARG 59 HD2 ARG 59 0.712 -3.606 11.259 453 HD3 ARG 59 HD1 ARG 59 1.547 -2.396 12.223 454 HE ARG 59 HE ARG 59 -1.089 -1.644 12.263 455 HH11 ARG 59 HH11 ARG 59 0.704 -4.532 13.113 456 HH12 ARG 59 HH12 ARG 59 -0.345 -4.966 14.430 457 HH21 ARG 59 HH21 ARG 59 -2.508 -2.220 13.977 458 HH22 ARG 59 HH22 ARG 59 -2.211 -3.666 14.896 459 H VAL 60 HN VAL 60 4.459 -1.133 10.156 460 HA VAL 60 HA VAL 60 5.899 -2.585 8.130 461 HB VAL 60 HB VAL 60 7.029 -0.095 9.433 462 HG11 VAL 60 HG11 VAL 60 8.436 -2.203 7.804 463 HG12 VAL 60 HG12 VAL 60 8.581 -1.962 9.543 464 HG13 VAL 60 HG13 VAL 60 9.156 -0.716 8.432 465 HG21 VAL 60 HG21 VAL 60 5.749 0.289 7.378 466 HG22 VAL 60 HG22 VAL 60 6.786 -0.860 6.536 467 HG23 VAL 60 HG23 VAL 60 7.465 0.641 7.170 468 H SER 61 HN SER 61 6.841 -4.302 9.139 469 HA SER 61 HA SER 61 7.169 -4.444 11.954 470 HB2 SER 61 HB2 SER 61 9.065 -6.153 11.059 471 HB3 SER 61 HB1 SER 61 7.353 -6.555 11.182 472 HG SER 61 HG SER 61 7.816 -7.057 9.134 473 H GLU 62 HN GLU 62 8.315 -2.958 12.940 474 HA GLU 62 HA GLU 62 10.067 -1.261 11.638 475 HB2 GLU 62 HB2 GLU 62 10.196 -0.154 13.725 476 HB3 GLU 62 HB1 GLU 62 8.554 -0.664 13.499 477 HG2 GLU 62 HG2 GLU 62 9.157 -2.678 14.892 478 HG3 GLU 62 HG1 GLU 62 10.633 -1.821 15.304 479 H GLY 63 HN GLY 63 12.060 -0.878 11.959 480 HA2 GLY 63 HA2 GLY 63 14.318 -1.274 12.191 481 HA3 GLY 63 HA1 GLY 63 13.903 -2.259 13.597 482 H GLY 64 HN GLY 64 12.577 -2.978 10.416 483 HA2 GLY 64 HA2 GLY 64 14.038 -5.525 10.650 484 HA3 GLY 64 HA1 GLY 64 12.393 -5.358 10.052 485 HA PRO 65 HA PRO 65 14.704 -5.482 6.209 486 HB2 PRO 65 HB2 PRO 65 12.424 -6.679 5.049 487 HB3 PRO 65 HB1 PRO 65 13.906 -7.466 5.559 488 HG2 PRO 65 HG2 PRO 65 11.452 -7.898 6.719 489 HG3 PRO 65 HG1 PRO 65 13.004 -8.180 7.528 490 HD2 PRO 65 HD2 PRO 65 11.182 -5.790 7.708 491 HD3 PRO 65 HD1 PRO 65 12.065 -6.650 9.001 492 H ALA 66 HN ALA 66 11.344 -4.407 6.619 493 HA ALA 66 HA ALA 66 10.991 -3.779 3.837 494 HB1 ALA 66 HB1 ALA 66 9.002 -4.186 5.099 495 HB2 ALA 66 HB2 ALA 66 8.990 -2.469 4.656 496 HB3 ALA 66 HB3 ALA 66 9.436 -2.961 6.293 497 H GLU 67 HN GLU 67 11.740 -2.025 6.732 498 HA GLU 67 HA GLU 67 11.309 0.499 5.490 499 HB2 GLU 67 HB2 GLU 67 12.404 1.168 7.753 500 HB3 GLU 67 HB1 GLU 67 10.782 0.473 7.729 501 HG2 GLU 67 HG2 GLU 67 11.447 -1.468 8.660 502 HG3 GLU 67 HG1 GLU 67 13.006 -1.425 7.855 503 H ILE 68 HN ILE 68 13.980 -1.655 6.108 504 HA ILE 68 HA ILE 68 15.949 0.380 5.868 505 HB ILE 68 HB ILE 68 17.495 -1.496 5.782 506 HG12 ILE 68 HG12 ILE 68 16.105 -3.603 6.820 507 HG13 ILE 68 HG11 ILE 68 15.046 -3.008 5.553 508 HG21 ILE 68 HG21 ILE 68 17.066 -0.407 7.853 509 HG22 ILE 68 HG22 ILE 68 17.160 -2.145 8.153 510 HG23 ILE 68 HG23 ILE 68 15.589 -1.346 8.068 511 HD11 ILE 68 HD11 ILE 68 16.504 -4.753 4.718 512 HD12 ILE 68 HD12 ILE 68 17.920 -3.826 5.214 513 HD13 ILE 68 HD13 ILE 68 16.866 -3.213 3.941 514 H ALA 69 HN ALA 69 14.345 -1.969 4.017 515 HA ALA 69 HA ALA 69 15.797 -1.724 1.634 516 HB1 ALA 69 HB1 ALA 69 13.747 -2.511 0.526 517 HB2 ALA 69 HB2 ALA 69 12.852 -2.264 2.026 518 HB3 ALA 69 HB3 ALA 69 14.129 -3.481 1.950 519 H GLY 70 HN GLY 70 13.564 0.209 3.360 520 HA2 GLY 70 HA2 GLY 70 13.617 2.630 2.909 521 HA3 GLY 70 HA1 GLY 70 13.641 2.240 1.185 522 H LEU 71 HN LEU 71 11.661 1.010 3.854 523 HA LEU 71 HA LEU 71 9.277 1.881 2.417 524 HB2 LEU 71 HB2 LEU 71 9.886 -0.586 2.280 525 HB3 LEU 71 HB1 LEU 71 9.628 -0.658 4.011 526 HG LEU 71 HG LEU 71 7.807 -1.480 2.421 527 HD11 LEU 71 HD11 LEU 71 6.073 -0.789 4.011 528 HD12 LEU 71 HD12 LEU 71 7.213 0.385 4.679 529 HD13 LEU 71 HD13 LEU 71 7.559 -1.337 4.793 530 HD21 LEU 71 HD21 LEU 71 7.295 1.490 2.304 531 HD22 LEU 71 HD22 LEU 71 6.152 0.249 1.794 532 HD23 LEU 71 HD23 LEU 71 7.687 0.438 0.944 533 H GLN 72 HN GLN 72 7.440 2.051 4.001 534 HA GLN 72 HA GLN 72 7.998 2.571 6.677 535 HB2 GLN 72 HB2 GLN 72 7.769 5.069 6.580 536 HB3 GLN 72 HB1 GLN 72 9.258 4.400 5.968 537 HG2 GLN 72 HG2 GLN 72 8.213 6.346 4.719 538 HG3 GLN 72 HG1 GLN 72 8.848 4.977 3.806 539 HE21 GLN 72 HE21 GLN 72 7.543 3.869 2.536 540 HE22 GLN 72 HE22 GLN 72 5.866 4.187 2.336 541 H ILE 73 HN ILE 73 6.097 4.353 7.349 542 HA ILE 73 HA ILE 73 3.752 2.799 6.803 543 HB ILE 73 HB ILE 73 3.894 5.277 8.491 544 HG12 ILE 73 HG12 ILE 73 5.749 4.057 9.320 545 HG13 ILE 73 HG11 ILE 73 4.417 3.673 10.405 546 HG21 ILE 73 HG21 ILE 73 2.170 4.153 9.762 547 HG22 ILE 73 HG22 ILE 73 2.296 2.756 8.695 548 HG23 ILE 73 HG23 ILE 73 1.730 4.299 8.060 549 HD11 ILE 73 HD11 ILE 73 5.459 1.960 8.158 550 HD12 ILE 73 HD12 ILE 73 4.081 1.563 9.201 551 HD13 ILE 73 HD13 ILE 73 5.698 1.696 9.893 552 H GLY 74 HN GLY 74 2.710 3.277 4.931 553 HA2 GLY 74 HA2 GLY 74 0.741 4.634 4.390 554 HA3 GLY 74 HA1 GLY 74 1.684 6.054 4.835 555 H ASP 75 HN ASP 75 1.618 3.334 2.539 556 HA ASP 75 HA ASP 75 2.487 5.184 0.439 557 HB2 ASP 75 HB2 ASP 75 4.485 3.952 1.700 558 HB3 ASP 75 HB1 ASP 75 4.035 2.646 0.605 559 H LYS 76 HN LYS 76 1.736 4.613 -1.579 560 HA LYS 76 HA LYS 76 -0.242 2.498 -1.577 561 HB2 LYS 76 HB2 LYS 76 0.622 4.418 -3.732 562 HB3 LYS 76 HB1 LYS 76 -0.653 3.234 -3.914 563 HG2 LYS 76 HG2 LYS 76 -1.952 4.376 -2.195 564 HG3 LYS 76 HG1 LYS 76 -0.664 5.585 -2.043 565 HD2 LYS 76 HD2 LYS 76 -0.907 6.205 -4.358 566 HD3 LYS 76 HD1 LYS 76 -2.088 4.922 -4.616 567 HE2 LYS 76 HE2 LYS 76 -3.550 6.069 -2.923 568 HE3 LYS 76 HE1 LYS 76 -2.410 7.418 -2.964 569 HZ1 LYS 76 HZ1 LYS 76 -2.816 7.633 -5.339 570 HZ2 LYS 76 HZ2 LYS 76 -4.261 7.784 -4.477 571 HZ3 LYS 76 HZ3 LYS 76 -3.913 6.343 -5.298 572 H ILE 77 HN ILE 77 0.628 0.515 -1.785 573 HA ILE 77 HA ILE 77 2.814 -0.074 -3.533 574 HB ILE 77 HB ILE 77 0.758 -1.990 -2.423 575 HG12 ILE 77 HG12 ILE 77 3.502 -1.348 -1.345 576 HG13 ILE 77 HG11 ILE 77 2.026 -0.620 -0.718 577 HG21 ILE 77 HG21 ILE 77 3.518 -2.429 -3.578 578 HG22 ILE 77 HG22 ILE 77 1.984 -2.945 -4.284 579 HG23 ILE 77 HG23 ILE 77 2.551 -3.667 -2.777 580 HD11 ILE 77 HD11 ILE 77 2.783 -2.486 0.645 581 HD12 ILE 77 HD12 ILE 77 2.654 -3.557 -0.751 582 HD13 ILE 77 HD13 ILE 77 1.207 -2.802 -0.083 583 H MET 78 HN MET 78 2.494 0.511 -5.599 584 HA MET 78 HA MET 78 -0.104 0.000 -6.866 585 HB2 MET 78 HB2 MET 78 2.326 1.386 -8.003 586 HB3 MET 78 HB1 MET 78 0.707 1.385 -8.679 587 HG2 MET 78 HG2 MET 78 1.310 2.497 -5.981 588 HG3 MET 78 HG1 MET 78 1.466 3.462 -7.447 589 HE1 MET 78 HE1 MET 78 -0.752 2.069 -4.744 590 HE2 MET 78 HE2 MET 78 -1.298 0.886 -5.932 591 HE3 MET 78 HE3 MET 78 -2.400 2.139 -5.365 592 H GLN 79 HN GLN 79 3.050 -1.284 -6.728 593 HA GLN 79 HA GLN 79 2.445 -3.349 -8.585 594 HB2 GLN 79 HB2 GLN 79 3.212 -1.795 -10.200 595 HB3 GLN 79 HB1 GLN 79 4.514 -1.244 -9.160 596 HG2 GLN 79 HG2 GLN 79 4.866 -3.898 -9.279 597 HG3 GLN 79 HG1 GLN 79 4.370 -3.517 -10.921 598 HE21 GLN 79 HE21 GLN 79 5.639 -1.946 -12.007 599 HE22 GLN 79 HE22 GLN 79 7.312 -1.842 -11.684 600 H VAL 80 HN VAL 80 3.918 -4.980 -8.565 601 HA VAL 80 HA VAL 80 5.715 -4.991 -6.272 602 HB VAL 80 HB VAL 80 3.655 -5.527 -5.275 603 HG11 VAL 80 HG11 VAL 80 2.326 -5.847 -7.182 604 HG12 VAL 80 HG12 VAL 80 2.178 -7.307 -6.187 605 HG13 VAL 80 HG13 VAL 80 3.198 -7.323 -7.627 606 HG21 VAL 80 HG21 VAL 80 5.433 -7.004 -4.554 607 HG22 VAL 80 HG22 VAL 80 5.140 -8.084 -5.918 608 HG23 VAL 80 HG23 VAL 80 3.926 -7.927 -4.642 609 H ASN 81 HN ASN 81 7.359 -6.426 -6.528 610 HA ASN 81 HA ASN 81 8.796 -7.856 -7.531 611 HB2 ASN 81 HB2 ASN 81 6.287 -9.095 -8.667 612 HB3 ASN 81 HB1 ASN 81 7.889 -9.816 -8.717 613 HD21 ASN 81 HD21 ASN 81 8.932 -10.111 -6.602 614 HD22 ASN 81 HD22 ASN 81 7.937 -10.672 -5.295 615 H GLY 82 HN GLY 82 7.169 -5.605 -9.147 616 HA2 GLY 82 HA2 GLY 82 8.199 -4.479 -10.982 617 HA3 GLY 82 HA1 GLY 82 8.776 -6.029 -11.574 618 H TRP 83 HN TRP 83 5.466 -6.171 -10.608 619 HA TRP 83 HA TRP 83 4.588 -5.397 -13.266 620 HB2 TRP 83 HB2 TRP 83 2.811 -7.277 -12.601 621 HB3 TRP 83 HB1 TRP 83 4.207 -7.572 -13.626 622 HD1 TRP 83 HD1 TRP 83 3.130 -7.763 -10.000 623 HE1 TRP 83 HE1 TRP 83 4.367 -9.727 -8.908 624 HE3 TRP 83 HE3 TRP 83 5.995 -9.277 -13.936 625 HZ2 TRP 83 HZ2 TRP 83 6.223 -11.681 -9.584 626 HZ3 TRP 83 HZ3 TRP 83 7.475 -11.219 -13.624 627 HH2 TRP 83 HH2 TRP 83 7.567 -12.381 -11.476 628 H ASP 84 HN ASP 84 3.321 -3.815 -13.076 629 HA ASP 84 HA ASP 84 2.294 -2.705 -10.801 630 HB2 ASP 84 HB2 ASP 84 2.446 -1.534 -12.975 631 HB3 ASP 84 HB1 ASP 84 1.097 -2.490 -13.579 632 H MET 85 HN MET 85 0.858 -3.548 -9.391 633 HA MET 85 HA MET 85 -1.066 -5.532 -10.220 634 HB2 MET 85 HB2 MET 85 -1.856 -5.034 -7.705 635 HB3 MET 85 HB1 MET 85 -0.528 -6.114 -8.105 636 HG2 MET 85 HG2 MET 85 1.076 -4.603 -7.432 637 HG3 MET 85 HG1 MET 85 0.002 -3.220 -7.601 638 HE1 MET 85 HE1 MET 85 -0.722 -6.657 -5.966 639 HE2 MET 85 HE2 MET 85 -0.554 -6.335 -4.239 640 HE3 MET 85 HE3 MET 85 0.879 -6.397 -5.265 641 H THR 86 HN THR 86 -2.236 -3.317 -7.918 642 HA THR 86 HA THR 86 -3.871 -1.827 -7.725 643 HB THR 86 HB THR 86 -4.272 -0.169 -9.524 644 HG1 THR 86 HG1 THR 86 -2.150 -1.362 -10.972 645 HG21 THR 86 HG21 THR 86 -2.509 0.180 -7.885 646 HG22 THR 86 HG22 THR 86 -2.028 0.807 -9.462 647 HG23 THR 86 HG23 THR 86 -1.377 -0.729 -8.889 648 H MET 87 HN MET 87 -4.225 -3.695 -10.650 649 HA MET 87 HA MET 87 -7.155 -3.375 -10.518 650 HB2 MET 87 HB2 MET 87 -5.379 -4.269 -12.794 651 HB3 MET 87 HB1 MET 87 -7.125 -4.124 -12.869 652 HG2 MET 87 HG2 MET 87 -5.191 -1.873 -12.395 653 HG3 MET 87 HG1 MET 87 -6.022 -2.226 -13.908 654 HE1 MET 87 HE1 MET 87 -9.763 -1.544 -12.935 655 HE2 MET 87 HE2 MET 87 -8.912 -3.086 -12.845 656 HE3 MET 87 HE3 MET 87 -8.661 -2.019 -14.227 657 H VAL 88 HN VAL 88 -5.592 -5.212 -8.867 658 HA VAL 88 HA VAL 88 -6.398 -7.836 -9.964 659 HB VAL 88 HB VAL 88 -4.560 -8.833 -8.862 660 HG11 VAL 88 HG11 VAL 88 -2.609 -7.681 -9.739 661 HG12 VAL 88 HG12 VAL 88 -3.551 -6.205 -9.945 662 HG13 VAL 88 HG13 VAL 88 -3.934 -7.636 -10.902 663 HG21 VAL 88 HG21 VAL 88 -4.848 -7.654 -6.748 664 HG22 VAL 88 HG22 VAL 88 -4.089 -6.210 -7.447 665 HG23 VAL 88 HG23 VAL 88 -3.146 -7.690 -7.242 666 H THR 89 HN THR 89 -6.117 -9.402 -7.731 667 HA THR 89 HA THR 89 -7.676 -8.052 -5.641 668 HB THR 89 HB THR 89 -8.931 -9.837 -6.644 669 HG1 THR 89 HG1 THR 89 -9.620 -10.667 -4.754 670 HG21 THR 89 HG21 THR 89 -8.308 -12.126 -6.627 671 HG22 THR 89 HG22 THR 89 -6.888 -11.776 -5.648 672 HG23 THR 89 HG23 THR 89 -6.957 -11.229 -7.323 673 H HIS 90 HN HIS 90 -7.188 -8.743 -3.469 674 HA HIS 90 HA HIS 90 -4.433 -8.536 -2.964 675 HB2 HIS 90 HB2 HIS 90 -6.251 -7.771 -1.445 676 HB3 HIS 90 HB1 HIS 90 -6.601 -9.462 -1.083 677 HD1 HIS 90 HD1 HIS 90 -3.713 -7.009 -0.770 678 HD2 HIS 90 HD2 HIS 90 -5.200 -10.456 1.006 679 HE1 HIS 90 HE1 HIS 90 -2.158 -7.509 1.140 680 HE2 HIS 90 HE2 HIS 90 -3.279 -9.399 2.370 681 H ASP 91 HN ASP 91 -6.576 -11.213 -3.298 682 HA ASP 91 HA ASP 91 -4.942 -13.154 -1.999 683 HB2 ASP 91 HB2 ASP 91 -7.376 -13.462 -2.381 684 HB3 ASP 91 HB1 ASP 91 -7.049 -13.600 -4.113 685 H GLN 92 HN GLN 92 -5.177 -12.000 -5.340 686 HA GLN 92 HA GLN 92 -3.307 -14.038 -6.134 687 HB2 GLN 92 HB2 GLN 92 -3.598 -13.324 -8.396 688 HB3 GLN 92 HB1 GLN 92 -5.159 -13.557 -7.642 689 HG2 GLN 92 HG2 GLN 92 -5.506 -11.662 -8.798 690 HG3 GLN 92 HG1 GLN 92 -5.017 -10.994 -7.245 691 HE21 GLN 92 HE21 GLN 92 -3.019 -10.148 -7.019 692 HE22 GLN 92 HE22 GLN 92 -2.072 -9.672 -8.367 693 H ALA 93 HN ALA 93 -3.422 -10.845 -5.053 694 HA ALA 93 HA ALA 93 -0.819 -10.038 -5.870 695 HB1 ALA 93 HB1 ALA 93 -1.038 -8.364 -4.068 696 HB2 ALA 93 HB2 ALA 93 -2.523 -9.157 -3.536 697 HB3 ALA 93 HB3 ALA 93 -2.450 -8.395 -5.125 698 H ARG 94 HN ARG 94 -2.267 -11.701 -3.139 699 HA ARG 94 HA ARG 94 -0.086 -12.045 -1.528 700 HB2 ARG 94 HB2 ARG 94 -2.623 -13.506 -2.036 701 HB3 ARG 94 HB1 ARG 94 -1.390 -14.326 -1.069 702 HG2 ARG 94 HG2 ARG 94 -1.370 -12.063 0.241 703 HG3 ARG 94 HG1 ARG 94 -2.973 -11.881 -0.472 704 HD2 ARG 94 HD2 ARG 94 -2.036 -14.256 1.085 705 HD3 ARG 94 HD1 ARG 94 -3.004 -12.945 1.764 706 HE ARG 94 HE ARG 94 -4.182 -14.246 -0.535 707 HH11 ARG 94 HH11 ARG 94 -3.853 -14.312 2.956 708 HH12 ARG 94 HH12 ARG 94 -5.308 -15.231 3.213 709 HH21 ARG 94 HH21 ARG 94 -6.088 -15.484 -0.212 710 HH22 ARG 94 HH22 ARG 94 -6.560 -15.900 1.411 711 H LYS 95 HN LYS 95 -1.195 -14.154 -4.178 712 HA LYS 95 HA LYS 95 0.951 -15.981 -3.920 713 HB2 LYS 95 HB2 LYS 95 0.285 -16.880 -6.073 714 HB3 LYS 95 HB1 LYS 95 -1.138 -16.559 -5.093 715 HG2 LYS 95 HG2 LYS 95 -1.657 -14.608 -6.344 716 HG3 LYS 95 HG1 LYS 95 -0.121 -14.670 -7.196 717 HD2 LYS 95 HD2 LYS 95 -1.992 -15.439 -8.577 718 HD3 LYS 95 HD1 LYS 95 -0.783 -16.700 -8.323 719 HE2 LYS 95 HE2 LYS 95 -2.195 -17.659 -6.552 720 HE3 LYS 95 HE1 LYS 95 -3.408 -16.418 -6.861 721 HZ1 LYS 95 HZ1 LYS 95 -3.915 -18.527 -7.976 722 HZ2 LYS 95 HZ2 LYS 95 -2.470 -18.399 -8.861 723 HZ3 LYS 95 HZ3 LYS 95 -3.699 -17.256 -9.079 724 H ARG 96 HN ARG 96 0.809 -12.829 -5.410 725 HA ARG 96 HA ARG 96 3.111 -13.295 -7.081 726 HB2 ARG 96 HB2 ARG 96 1.834 -10.691 -6.241 727 HB3 ARG 96 HB1 ARG 96 3.061 -10.871 -7.485 728 HG2 ARG 96 HG2 ARG 96 0.290 -12.034 -7.571 729 HG3 ARG 96 HG1 ARG 96 0.836 -10.594 -8.428 730 HD2 ARG 96 HD2 ARG 96 2.602 -12.106 -9.479 731 HD3 ARG 96 HD1 ARG 96 1.636 -13.455 -8.870 732 HE ARG 96 HE ARG 96 -0.246 -12.294 -10.177 733 HH11 ARG 96 HH11 ARG 96 3.110 -12.429 -11.156 734 HH12 ARG 96 HH12 ARG 96 2.767 -12.168 -12.845 735 HH21 ARG 96 HH21 ARG 96 -0.723 -11.957 -12.397 736 HH22 ARG 96 HH22 ARG 96 0.587 -11.883 -13.544 737 H LEU 97 HN LEU 97 2.542 -11.344 -4.151 738 HA LEU 97 HA LEU 97 5.275 -10.636 -3.919 739 HB2 LEU 97 HB2 LEU 97 4.529 -9.910 -1.562 740 HB3 LEU 97 HB1 LEU 97 3.999 -9.034 -2.981 741 HG LEU 97 HG LEU 97 1.917 -10.662 -2.760 742 HD11 LEU 97 HD11 LEU 97 2.934 -10.417 0.057 743 HD12 LEU 97 HD12 LEU 97 2.748 -11.912 -0.864 744 HD13 LEU 97 HD13 LEU 97 1.324 -10.971 -0.415 745 HD21 LEU 97 HD21 LEU 97 0.818 -8.841 -1.704 746 HD22 LEU 97 HD22 LEU 97 2.068 -8.224 -2.791 747 HD23 LEU 97 HD23 LEU 97 2.347 -8.253 -1.052 748 H THR 98 HN THR 98 3.305 -13.111 -2.428 749 HA THR 98 HA THR 98 5.714 -14.005 -1.000 750 HB THR 98 HB THR 98 4.048 -15.255 0.523 751 HG1 THR 98 HG1 THR 98 2.275 -14.325 -1.060 752 HG21 THR 98 HG21 THR 98 3.851 -13.323 1.994 753 HG22 THR 98 HG22 THR 98 4.219 -12.246 0.648 754 HG23 THR 98 HG23 THR 98 5.443 -13.372 1.238 755 H LYS 99 HN LYS 99 5.578 -14.777 -3.558 756 HA LYS 99 HA LYS 99 4.542 -17.473 -3.535 757 HB2 LYS 99 HB2 LYS 99 5.495 -17.607 -5.824 758 HB3 LYS 99 HB1 LYS 99 4.368 -16.274 -5.630 759 HG2 LYS 99 HG2 LYS 99 6.398 -14.810 -5.245 760 HG3 LYS 99 HG1 LYS 99 7.360 -16.169 -5.821 761 HD2 LYS 99 HD2 LYS 99 5.170 -14.766 -7.355 762 HD3 LYS 99 HD1 LYS 99 6.904 -14.588 -7.624 763 HE2 LYS 99 HE2 LYS 99 6.986 -17.043 -8.103 764 HE3 LYS 99 HE1 LYS 99 5.223 -17.052 -8.034 765 HZ1 LYS 99 HZ1 LYS 99 6.862 -15.433 -9.915 766 HZ2 LYS 99 HZ2 LYS 99 5.165 -15.475 -9.856 767 HZ3 LYS 99 HZ3 LYS 99 6.028 -16.855 -10.310 768 H ARG 100 HN ARG 100 6.657 -18.738 -4.916 769 HA ARG 100 HA ARG 100 8.615 -18.903 -2.720 770 HB2 ARG 100 HB2 ARG 100 7.619 -21.047 -4.594 771 HB3 ARG 100 HB1 ARG 100 8.910 -21.275 -3.428 772 HG2 ARG 100 HG2 ARG 100 6.072 -20.546 -2.738 773 HG3 ARG 100 HG1 ARG 100 6.752 -22.172 -2.657 774 HD2 ARG 100 HD2 ARG 100 8.378 -21.403 -0.996 775 HD3 ARG 100 HD1 ARG 100 7.696 -19.778 -1.081 776 HE ARG 100 HE ARG 100 5.540 -21.091 -0.390 777 HH11 ARG 100 HH11 ARG 100 8.795 -21.540 0.806 778 HH12 ARG 100 HH12 ARG 100 8.284 -22.142 2.347 779 HH21 ARG 100 HH21 ARG 100 4.861 -21.929 1.635 780 HH22 ARG 100 HH22 ARG 100 6.049 -22.423 2.805 781 H SER 101 HN SER 101 8.674 -17.244 -5.190 782 HA SER 101 HA SER 101 10.813 -18.570 -6.703 783 HB2 SER 101 HB2 SER 101 9.041 -16.241 -7.464 784 HB3 SER 101 HB1 SER 101 10.271 -16.969 -8.493 785 HG SER 101 HG SER 101 9.071 -18.976 -8.230 786 H GLU 102 HN GLU 102 10.237 -16.025 -4.505 787 HA GLU 102 HA GLU 102 12.973 -15.134 -4.846 788 HB2 GLU 102 HB2 GLU 102 12.384 -12.828 -4.760 789 HB3 GLU 102 HB1 GLU 102 11.395 -13.551 -6.021 790 HG2 GLU 102 HG2 GLU 102 10.464 -13.006 -3.212 791 HG3 GLU 102 HG1 GLU 102 10.166 -11.954 -4.591 792 H GLU 103 HN GLU 103 13.509 -13.697 -3.008 793 HA GLU 103 HA GLU 103 12.065 -14.352 -0.543 794 HB2 GLU 103 HB2 GLU 103 14.188 -14.285 0.673 795 HB3 GLU 103 HB1 GLU 103 14.172 -15.553 -0.536 796 HG2 GLU 103 HG2 GLU 103 15.492 -14.126 -2.030 797 HG3 GLU 103 HG1 GLU 103 15.542 -12.888 -0.776 798 H VAL 104 HN VAL 104 12.674 -12.145 -2.722 799 HA VAL 104 HA VAL 104 12.361 -9.952 -0.811 800 HB VAL 104 HB VAL 104 14.689 -9.858 -1.409 801 HG11 VAL 104 HG11 VAL 104 15.423 -9.527 -3.712 802 HG12 VAL 104 HG12 VAL 104 13.768 -9.786 -4.268 803 HG13 VAL 104 HG13 VAL 104 14.652 -11.095 -3.482 804 HG21 VAL 104 HG21 VAL 104 14.795 -7.618 -2.422 805 HG22 VAL 104 HG22 VAL 104 13.566 -7.726 -1.165 806 HG23 VAL 104 HG23 VAL 104 13.091 -7.754 -2.865 807 H VAL 105 HN VAL 105 11.045 -8.300 -1.478 808 HA VAL 105 HA VAL 105 9.402 -9.009 -3.823 809 HB VAL 105 HB VAL 105 8.510 -7.231 -1.565 810 HG11 VAL 105 HG11 VAL 105 7.029 -8.999 -3.495 811 HG12 VAL 105 HG12 VAL 105 7.130 -7.239 -3.535 812 HG13 VAL 105 HG13 VAL 105 6.287 -8.045 -2.212 813 HG21 VAL 105 HG21 VAL 105 9.253 -9.194 -0.427 814 HG22 VAL 105 HG22 VAL 105 8.422 -10.242 -1.585 815 HG23 VAL 105 HG23 VAL 105 7.487 -9.222 -0.489 816 H ARG 106 HN ARG 106 9.218 -7.483 -5.415 817 HA ARG 106 HA ARG 106 10.558 -4.932 -5.033 818 HB2 ARG 106 HB2 ARG 106 9.437 -6.391 -7.385 819 HB3 ARG 106 HB1 ARG 106 9.544 -4.638 -7.476 820 HG2 ARG 106 HG2 ARG 106 11.909 -4.786 -6.929 821 HG3 ARG 106 HG1 ARG 106 11.805 -6.542 -6.950 822 HD2 ARG 106 HD2 ARG 106 11.123 -6.452 -9.299 823 HD3 ARG 106 HD1 ARG 106 11.233 -4.689 -9.261 824 HE ARG 106 HE ARG 106 13.685 -5.816 -8.421 825 HH11 ARG 106 HH11 ARG 106 11.750 -5.354 -11.320 826 HH12 ARG 106 HH12 ARG 106 13.116 -5.384 -12.391 827 HH21 ARG 106 HH21 ARG 106 15.474 -5.879 -9.836 828 HH22 ARG 106 HH22 ARG 106 15.231 -5.680 -11.545 829 H LEU 107 HN LEU 107 9.572 -3.026 -4.786 830 HA LEU 107 HA LEU 107 6.637 -3.006 -4.908 831 HB2 LEU 107 HB2 LEU 107 8.221 -1.417 -2.882 832 HB3 LEU 107 HB1 LEU 107 6.479 -1.535 -3.006 833 HG LEU 107 HG LEU 107 7.160 -2.815 -1.122 834 HD11 LEU 107 HD11 LEU 107 6.565 -5.139 -1.824 835 HD12 LEU 107 HD12 LEU 107 6.521 -4.538 -3.486 836 HD13 LEU 107 HD13 LEU 107 5.401 -3.891 -2.284 837 HD21 LEU 107 HD21 LEU 107 9.082 -4.095 -3.015 838 HD22 LEU 107 HD22 LEU 107 8.751 -4.689 -1.384 839 HD23 LEU 107 HD23 LEU 107 9.467 -3.091 -1.616 840 H LEU 108 HN LEU 108 5.960 -1.677 -6.219 841 HA LEU 108 HA LEU 108 7.355 0.850 -6.730 842 HB2 LEU 108 HB2 LEU 108 5.772 -0.991 -8.334 843 HB3 LEU 108 HB1 LEU 108 5.344 0.692 -8.548 844 HG LEU 108 HG LEU 108 6.965 -0.211 -10.218 845 HD11 LEU 108 HD11 LEU 108 6.772 2.174 -9.712 846 HD12 LEU 108 HD12 LEU 108 8.388 1.696 -10.224 847 HD13 LEU 108 HD13 LEU 108 8.061 2.009 -8.512 848 HD21 LEU 108 HD21 LEU 108 9.280 -0.550 -9.530 849 HD22 LEU 108 HD22 LEU 108 8.186 -1.695 -8.735 850 HD23 LEU 108 HD23 LEU 108 8.823 -0.302 -7.842 851 H VAL 109 HN VAL 109 6.550 2.372 -5.461 852 HA VAL 109 HA VAL 109 3.772 2.165 -4.635 853 HB VAL 109 HB VAL 109 4.513 3.072 -2.439 854 HG11 VAL 109 HG11 VAL 109 5.748 0.411 -3.076 855 HG12 VAL 109 HG12 VAL 109 4.028 0.677 -2.780 856 HG13 VAL 109 HG13 VAL 109 5.202 0.990 -1.498 857 HG21 VAL 109 HG21 VAL 109 7.246 2.384 -3.477 858 HG22 VAL 109 HG22 VAL 109 6.870 2.818 -1.808 859 HG23 VAL 109 HG23 VAL 109 6.639 3.996 -3.101 860 H THR 110 HN THR 110 3.103 4.249 -3.550 861 HA THR 110 HA THR 110 4.306 6.594 -4.786 862 HB THR 110 HB THR 110 1.986 7.425 -5.379 863 HG1 THR 110 HG1 THR 110 1.453 4.690 -4.898 864 HG21 THR 110 HG21 THR 110 3.672 6.674 -7.001 865 HG22 THR 110 HG22 THR 110 2.014 6.369 -7.534 866 HG23 THR 110 HG23 THR 110 2.990 5.044 -6.899 867 H ARG 111 HN ARG 111 4.802 7.780 -3.102 868 HA ARG 111 HA ARG 111 2.591 8.488 -1.332 869 HB2 ARG 111 HB2 ARG 111 3.830 8.223 0.666 870 HB3 ARG 111 HB1 ARG 111 4.018 6.725 -0.238 871 HG2 ARG 111 HG2 ARG 111 6.209 7.276 -0.886 872 HG3 ARG 111 HG1 ARG 111 6.020 8.949 -0.357 873 HD2 ARG 111 HD2 ARG 111 6.383 6.482 1.259 874 HD3 ARG 111 HD1 ARG 111 7.232 8.011 1.325 875 HE ARG 111 HE ARG 111 4.446 7.741 2.235 876 HH11 ARG 111 HH11 ARG 111 7.712 8.884 2.725 877 HH12 ARG 111 HH12 ARG 111 7.423 9.439 4.350 878 HH21 ARG 111 HH21 ARG 111 4.033 8.514 4.356 879 HH22 ARG 111 HH22 ARG 111 5.316 9.248 5.270 880 H GLN 112 HN GLN 112 3.267 10.410 0.064 881 HA GLN 112 HA GLN 112 4.314 12.448 -1.650 882 HB2 GLN 112 HB2 GLN 112 3.161 12.482 1.123 883 HB3 GLN 112 HB1 GLN 112 3.759 13.920 0.312 884 HG2 GLN 112 HG2 GLN 112 1.357 13.777 0.160 885 HG3 GLN 112 HG1 GLN 112 2.091 13.632 -1.430 886 HE21 GLN 112 HE21 GLN 112 1.838 11.808 -2.600 887 HE22 GLN 112 HE22 GLN 112 0.823 10.480 -2.105 888 H SER 113 HN SER 113 4.868 11.654 1.664 889 HA SER 113 HA SER 113 6.704 11.410 2.978 890 HB2 SER 113 HB2 SER 113 8.143 12.083 0.453 891 HB3 SER 113 HB1 SER 113 8.969 11.727 1.968 892 HG SER 113 HG SER 113 8.399 9.981 0.225 893 H LEU 114 HN LEU 114 5.236 13.865 2.209 894 HA LEU 114 HA LEU 114 7.174 15.860 3.105 895 HB2 LEU 114 HB2 LEU 114 6.026 17.454 1.658 896 HB3 LEU 114 HB1 LEU 114 6.724 16.111 0.782 897 HG LEU 114 HG LEU 114 4.202 15.209 1.194 898 HD11 LEU 114 HD11 LEU 114 3.429 17.279 2.158 899 HD12 LEU 114 HD12 LEU 114 2.678 17.033 0.580 900 HD13 LEU 114 HD13 LEU 114 4.005 18.183 0.754 901 HD21 LEU 114 HD21 LEU 114 5.278 16.804 -1.120 902 HD22 LEU 114 HD22 LEU 114 3.832 15.796 -1.170 903 HD23 LEU 114 HD23 LEU 114 5.409 15.061 -0.871 904 H GLN 115 HN GLN 115 4.898 14.219 4.074 905 HA GLN 115 HA GLN 115 3.678 16.258 5.784 906 HB2 GLN 115 HB2 GLN 115 2.383 14.111 4.167 907 HB3 GLN 115 HB1 GLN 115 1.661 14.586 5.688 908 HG2 GLN 115 HG2 GLN 115 2.255 16.412 3.378 909 HG3 GLN 115 HG1 GLN 115 0.668 15.766 3.794 910 HE21 GLN 115 HE21 GLN 115 3.169 18.018 4.657 911 HE22 GLN 115 HE22 GLN 115 2.228 18.935 5.788 912 H LYS 116 HN LYS 116 2.920 15.449 7.857 913 HA LYS 116 HA LYS 116 4.597 13.290 8.848 914 HB2 LYS 116 HB2 LYS 116 2.664 15.102 10.312 915 HB3 LYS 116 HB1 LYS 116 3.741 13.941 11.070 916 HG2 LYS 116 HG2 LYS 116 5.669 15.192 10.199 917 HG3 LYS 116 HG1 LYS 116 4.560 16.371 9.499 918 HD2 LYS 116 HD2 LYS 116 4.667 15.719 12.440 919 HD3 LYS 116 HD1 LYS 116 5.582 17.027 11.698 920 HE2 LYS 116 HE2 LYS 116 3.621 18.003 12.608 921 HE3 LYS 116 HE1 LYS 116 3.396 17.952 10.865 922 HZ1 LYS 116 HZ1 LYS 116 1.419 17.277 12.173 923 HZ2 LYS 116 HZ2 LYS 116 2.278 15.931 12.731 924 HZ3 LYS 116 HZ3 LYS 116 1.943 16.097 11.081 925 H ALA 117 HN ALA 117 3.883 11.296 9.333 926 HA ALA 117 HA ALA 117 0.980 10.836 9.306 927 HB1 ALA 117 HB1 ALA 117 1.836 10.063 7.157 928 HB2 ALA 117 HB2 ALA 117 1.350 8.687 8.147 929 HB3 ALA 117 HB3 ALA 117 3.057 9.091 7.979 930 H VAL 118 HN VAL 118 3.090 11.247 11.238 931 HA VAL 118 HA VAL 118 3.028 8.702 12.686 932 HB VAL 118 HB VAL 118 5.184 10.792 12.993 933 HG11 VAL 118 HG11 VAL 118 4.847 9.275 14.862 934 HG12 VAL 118 HG12 VAL 118 6.389 8.960 14.062 935 HG13 VAL 118 HG13 VAL 118 5.010 7.896 13.781 936 HG21 VAL 118 HG21 VAL 118 5.255 9.953 10.698 937 HG22 VAL 118 HG22 VAL 118 5.262 8.294 11.297 938 HG23 VAL 118 HG23 VAL 118 6.627 9.359 11.630 939 H GLN 119 HN GLN 119 1.077 9.383 13.630 940 HA GLN 119 HA GLN 119 1.395 11.481 15.668 941 HB2 GLN 119 HB2 GLN 119 -1.201 10.870 14.234 942 HB3 GLN 119 HB1 GLN 119 -0.881 12.202 15.336 943 HG2 GLN 119 HG2 GLN 119 0.358 11.857 12.608 944 HG3 GLN 119 HG1 GLN 119 -0.999 12.908 12.997 945 HE21 GLN 119 HE21 GLN 119 0.113 13.723 15.552 946 HE22 GLN 119 HE22 GLN 119 1.391 14.835 15.170 947 H GLN 120 HN GLN 120 1.678 8.528 15.608 948 HA GLN 120 HA GLN 120 -0.646 7.562 17.059 949 HB2 GLN 120 HB2 GLN 120 1.805 6.129 16.038 950 HB3 GLN 120 HB1 GLN 120 0.506 5.347 16.919 951 HG2 GLN 120 HG2 GLN 120 0.119 4.889 14.653 952 HG3 GLN 120 HG1 GLN 120 -1.052 6.126 15.102 953 HE21 GLN 120 HE21 GLN 120 -1.331 6.784 12.981 954 HE22 GLN 120 HE22 GLN 120 -0.108 7.655 12.108 955 H SER 121 HN SER 121 -0.729 7.268 19.160 956 HA SER 121 HA SER 121 1.772 6.874 20.650 957 HB2 SER 121 HB2 SER 121 0.930 9.183 21.073 958 HB3 SER 121 HB1 SER 121 -0.601 8.501 21.617 959 HG SER 121 HG SER 121 0.267 8.051 23.470 960 H MET 122 HN MET 122 1.648 4.757 21.122 961 HA MET 122 HA MET 122 -0.975 3.578 21.637 962 HB2 MET 122 HB2 MET 122 1.697 2.340 20.996 963 HB3 MET 122 HB1 MET 122 0.279 1.397 21.424 964 HG2 MET 122 HG2 MET 122 0.507 3.242 19.059 965 HG3 MET 122 HG1 MET 122 0.630 1.487 19.016 966 HE1 MET 122 HE1 MET 122 -1.620 0.689 21.174 967 HE2 MET 122 HE2 MET 122 -1.416 -0.150 19.635 968 HE3 MET 122 HE3 MET 122 -3.009 0.434 20.116 969 H LEU 123 HN LEU 123 -1.169 1.935 23.300 970 HA LEU 123 HA LEU 123 0.589 2.395 25.617 971 HB2 LEU 123 HB2 LEU 123 -1.537 3.567 25.940 972 HB3 LEU 123 HB1 LEU 123 -2.419 2.091 25.608 973 HG LEU 123 HG LEU 123 -1.374 1.085 27.646 974 HD11 LEU 123 HD11 LEU 123 -0.428 3.907 28.115 975 HD12 LEU 123 HD12 LEU 123 0.586 2.494 27.819 976 HD13 LEU 123 HD13 LEU 123 -0.376 2.594 29.294 977 HD21 LEU 123 HD21 LEU 123 -3.012 3.586 28.042 978 HD22 LEU 123 HD22 LEU 123 -2.810 2.295 29.225 979 HD23 LEU 123 HD23 LEU 123 -3.632 1.971 27.700 980 H SER 124 HN SER 124 1.116 0.572 26.788 981 HA SER 124 HA SER 124 0.423 -1.960 25.529 982 HB2 SER 124 HB2 SER 124 2.466 -1.368 27.690 983 HB3 SER 124 HB1 SER 124 2.274 -2.896 26.829 984 HG SER 124 HG SER 124 3.405 -0.489 25.987 985 H1 LYS 161 HN LYS 161 -9.753 3.074 6.800 986 HA LYS 161 HA LYS 161 -12.593 3.017 6.801 987 HB2 LYS 161 HB2 LYS 161 -12.333 5.205 5.751 988 HB3 LYS 161 HB1 LYS 161 -11.267 4.517 4.535 989 HG2 LYS 161 HG2 LYS 161 -13.578 4.952 3.746 990 HG3 LYS 161 HG1 LYS 161 -13.049 3.282 3.560 991 HD2 LYS 161 HD2 LYS 161 -15.301 3.259 4.378 992 HD3 LYS 161 HD1 LYS 161 -14.241 2.725 5.683 993 HE2 LYS 161 HE2 LYS 161 -14.428 4.811 6.796 994 HE3 LYS 161 HE1 LYS 161 -15.191 5.566 5.396 995 HZ1 LYS 161 HZ1 LYS 161 -16.864 5.081 7.007 996 HZ2 LYS 161 HZ2 LYS 161 -16.360 3.465 7.146 997 HZ3 LYS 161 HZ3 LYS 161 -17.070 4.013 5.709 998 H GLU 162 HN GLU 162 -9.575 1.904 5.831 999 HA GLU 162 HA GLU 162 -10.300 0.260 3.646 1000 HB2 GLU 162 HB2 GLU 162 -8.212 -1.024 4.254 1001 HB3 GLU 162 HB1 GLU 162 -7.998 0.690 3.932 1002 HG2 GLU 162 HG2 GLU 162 -8.341 -0.279 6.739 1003 HG3 GLU 162 HG1 GLU 162 -6.782 -0.427 5.935 1004 H ASN 163 HN ASN 163 -10.849 -1.941 3.565 1005 HA ASN 163 HA ASN 163 -12.311 -2.707 5.965 1006 HB2 ASN 163 HB2 ASN 163 -13.671 -2.246 3.954 1007 HB3 ASN 163 HB1 ASN 163 -12.847 -3.566 3.131 1008 HD21 ASN 163 HD21 ASN 163 -13.369 -5.668 3.623 1009 HD22 ASN 163 HD22 ASN 163 -14.747 -6.096 4.592 1010 H LEU 164 HN LEU 164 -10.089 -3.937 3.635 1011 HA LEU 164 HA LEU 164 -9.627 -6.232 5.397 1012 HB2 LEU 164 HB2 LEU 164 -9.714 -7.853 3.670 1013 HB3 LEU 164 HB1 LEU 164 -11.190 -6.920 3.534 1014 HG LEU 164 HG LEU 164 -9.521 -5.617 1.778 1015 HD11 LEU 164 HD11 LEU 164 -7.775 -7.287 1.946 1016 HD12 LEU 164 HD12 LEU 164 -8.536 -7.381 0.354 1017 HD13 LEU 164 HD13 LEU 164 -8.936 -8.572 1.591 1018 HD21 LEU 164 HD21 LEU 164 -11.450 -7.874 1.245 1019 HD22 LEU 164 HD22 LEU 164 -10.851 -6.742 0.033 1020 HD23 LEU 164 HD23 LEU 164 -11.843 -6.161 1.370 1021 H GLU 165 HN GLU 165 -7.522 -7.176 5.147 1022 HA GLU 165 HA GLU 165 -5.848 -7.010 3.062 1023 HB2 GLU 165 HB2 GLU 165 -5.984 -4.440 3.918 1024 HB3 GLU 165 HB1 GLU 165 -4.562 -5.014 4.779 1025 HG2 GLU 165 HG2 GLU 165 -3.990 -4.036 2.626 1026 HG3 GLU 165 HG1 GLU 165 -3.557 -5.743 2.705 1027 H SER 166 HN SER 166 -3.333 -6.297 4.769 1028 HA SER 166 HA SER 166 -3.253 -8.668 6.450 1029 HB2 SER 166 HB2 SER 166 -1.862 -8.661 3.776 1030 HB3 SER 166 HB1 SER 166 -1.731 -9.926 5.001 1031 HG SER 166 HG SER 166 -4.288 -9.671 4.613 1032 H MET 167 HN MET 167 -1.101 -9.250 7.159 1033 HA MET 167 HA MET 167 0.978 -7.228 6.683 1034 HB2 MET 167 HB2 MET 167 2.120 -8.077 8.691 1035 HB3 MET 167 HB1 MET 167 0.510 -7.467 9.085 1036 HG2 MET 167 HG2 MET 167 -0.316 -9.815 9.055 1037 HG3 MET 167 HG1 MET 167 1.341 -10.352 8.803 1038 HE1 MET 167 HE1 MET 167 -1.256 -8.829 11.245 1039 HE2 MET 167 HE2 MET 167 -0.128 -7.483 11.088 1040 HE3 MET 167 HE3 MET 167 -0.270 -8.342 12.623 1041 H VAL 168 HN VAL 168 2.984 -7.955 5.983 1042 HA VAL 168 HA VAL 168 3.158 -10.806 5.334 1043 HB VAL 168 HB VAL 168 4.466 -10.104 3.252 1044 HG11 VAL 168 HG11 VAL 168 1.510 -9.498 3.394 1045 HG12 VAL 168 HG12 VAL 168 2.233 -11.092 3.177 1046 HG13 VAL 168 HG13 VAL 168 2.420 -9.863 1.927 1047 HG21 VAL 168 HG21 VAL 168 4.792 -7.755 3.780 1048 HG22 VAL 168 HG22 VAL 168 3.047 -7.500 3.825 1049 HG23 VAL 168 HG23 VAL 168 3.839 -7.910 2.303 Start of MODEL 8 1 H1 MET 1 HT1 MET 1 9.738 20.820 11.010 2 H2 MET 1 HT2 MET 1 9.359 21.101 12.635 3 H3 MET 1 HT3 MET 1 10.961 20.788 12.188 4 HA MET 1 HA MET 1 10.708 23.107 12.618 5 HB2 MET 1 HB2 MET 1 11.972 22.101 10.511 6 HB3 MET 1 HB1 MET 1 10.741 22.989 9.625 7 HG2 MET 1 HG2 MET 1 11.429 25.054 10.714 8 HG3 MET 1 HG1 MET 1 12.650 24.171 11.631 9 HE1 MET 1 HE1 MET 1 14.886 26.177 9.186 10 HE2 MET 1 HE2 MET 1 14.603 25.696 10.860 11 HE3 MET 1 HE3 MET 1 13.427 26.710 10.023 12 H SER 2 HN SER 2 9.865 24.889 10.444 13 HA SER 2 HA SER 2 7.281 25.464 11.415 14 HB2 SER 2 HB2 SER 2 8.578 26.577 8.923 15 HB3 SER 2 HB1 SER 2 7.354 27.350 9.932 16 HG SER 2 HG SER 2 8.999 28.172 10.953 17 H TYR 3 HN TYR 3 8.426 23.939 8.456 18 HA TYR 3 HA TYR 3 7.399 22.775 6.811 19 HB2 TYR 3 HB2 TYR 3 5.048 22.907 8.698 20 HB3 TYR 3 HB1 TYR 3 4.923 22.179 7.103 21 HD1 TYR 3 HD1 TYR 3 6.460 20.231 6.564 22 HD2 TYR 3 HD2 TYR 3 5.857 21.675 10.514 23 HE1 TYR 3 HE1 TYR 3 7.244 18.081 7.458 24 HE2 TYR 3 HE2 TYR 3 6.648 19.534 11.424 25 HH TYR 3 HH TYR 3 8.256 17.229 9.545 26 H ILE 4 HN ILE 4 5.786 23.032 5.052 27 HA ILE 4 HA ILE 4 4.872 25.830 4.842 28 HB ILE 4 HB ILE 4 5.626 24.027 2.531 29 HG12 ILE 4 HG12 ILE 4 7.142 26.359 3.736 30 HG13 ILE 4 HG11 ILE 4 7.594 24.663 3.883 31 HG21 ILE 4 HG21 ILE 4 3.923 25.681 1.985 32 HG22 ILE 4 HG22 ILE 4 5.451 26.085 1.201 33 HG23 ILE 4 HG23 ILE 4 4.938 26.965 2.641 34 HD11 ILE 4 HD11 ILE 4 7.451 26.219 1.313 35 HD12 ILE 4 HD12 ILE 4 7.936 24.531 1.483 36 HD13 ILE 4 HD13 ILE 4 8.922 25.809 2.197 37 HA PRO 5 HA PRO 5 1.061 23.319 4.762 38 HB2 PRO 5 HB2 PRO 5 -0.184 25.641 5.988 39 HB3 PRO 5 HB1 PRO 5 0.033 24.022 6.655 40 HG2 PRO 5 HG2 PRO 5 1.349 26.209 7.599 41 HG3 PRO 5 HG1 PRO 5 2.023 24.569 7.668 42 HD2 PRO 5 HD2 PRO 5 2.583 26.771 5.711 43 HD3 PRO 5 HD1 PRO 5 3.719 25.653 6.498 44 H GLY 6 HN GLY 6 -0.280 23.298 3.083 45 HA2 GLY 6 HA2 GLY 6 -2.065 24.597 1.938 46 HA3 GLY 6 HA1 GLY 6 -0.864 25.875 1.750 47 H GLN 7 HN GLN 7 1.273 23.925 1.158 48 HA GLN 7 HA GLN 7 0.482 23.311 -1.605 49 HB2 GLN 7 HB2 GLN 7 3.159 24.094 -0.441 50 HB3 GLN 7 HB1 GLN 7 2.918 23.584 -2.100 51 HG2 GLN 7 HG2 GLN 7 1.532 25.492 -2.552 52 HG3 GLN 7 HG1 GLN 7 1.560 25.960 -0.853 53 HE21 GLN 7 HE21 GLN 7 3.385 26.962 -0.021 54 HE22 GLN 7 HE22 GLN 7 4.647 27.585 -1.034 55 HA PRO 8 HA PRO 8 1.641 19.200 -0.061 56 HB2 PRO 8 HB2 PRO 8 -0.498 17.879 -0.906 57 HB3 PRO 8 HB1 PRO 8 -0.601 18.950 0.498 58 HG2 PRO 8 HG2 PRO 8 -1.581 19.363 -2.276 59 HG3 PRO 8 HG1 PRO 8 -2.248 19.959 -0.748 60 HD2 PRO 8 HD2 PRO 8 -0.576 21.369 -2.571 61 HD3 PRO 8 HD1 PRO 8 -1.114 21.909 -0.963 62 H VAL 9 HN VAL 9 1.369 16.995 -1.405 63 HA VAL 9 HA VAL 9 2.114 17.530 -4.204 64 HB VAL 9 HB VAL 9 4.090 16.917 -2.780 65 HG11 VAL 9 HG11 VAL 9 2.709 14.248 -2.576 66 HG12 VAL 9 HG12 VAL 9 3.043 15.366 -1.252 67 HG13 VAL 9 HG13 VAL 9 4.374 14.580 -2.100 68 HG21 VAL 9 HG21 VAL 9 5.028 15.295 -4.341 69 HG22 VAL 9 HG22 VAL 9 4.149 16.572 -5.179 70 HG23 VAL 9 HG23 VAL 9 3.416 14.979 -4.983 71 H THR 10 HN THR 10 1.874 15.622 -5.581 72 HA THR 10 HA THR 10 -0.819 14.666 -5.177 73 HB THR 10 HB THR 10 -0.717 14.144 -7.595 74 HG1 THR 10 HG1 THR 10 1.227 13.948 -8.447 75 HG21 THR 10 HG21 THR 10 -0.386 16.522 -8.349 76 HG22 THR 10 HG22 THR 10 0.191 16.893 -6.713 77 HG23 THR 10 HG23 THR 10 -1.470 16.341 -6.967 78 H ALA 11 HN ALA 11 2.112 13.301 -6.439 79 HA ALA 11 HA ALA 11 2.019 10.974 -4.765 80 HB1 ALA 11 HB1 ALA 11 0.343 10.247 -6.377 81 HB2 ALA 11 HB2 ALA 11 1.837 9.324 -6.588 82 HB3 ALA 11 HB3 ALA 11 1.438 10.626 -7.708 83 H VAL 12 HN VAL 12 3.978 10.544 -4.344 84 HA VAL 12 HA VAL 12 6.060 11.047 -6.334 85 HB VAL 12 HB VAL 12 6.407 9.998 -3.582 86 HG11 VAL 12 HG11 VAL 12 8.326 9.719 -4.926 87 HG12 VAL 12 HG12 VAL 12 8.655 11.028 -3.789 88 HG13 VAL 12 HG13 VAL 12 8.258 11.395 -5.468 89 HG21 VAL 12 HG21 VAL 12 6.055 12.842 -4.405 90 HG22 VAL 12 HG22 VAL 12 7.019 12.426 -2.989 91 HG23 VAL 12 HG23 VAL 12 5.310 11.971 -3.056 92 H VAL 13 HN VAL 13 7.156 9.390 -7.186 93 HA VAL 13 HA VAL 13 6.069 6.705 -6.746 94 HB VAL 13 HB VAL 13 7.591 7.681 -9.163 95 HG11 VAL 13 HG11 VAL 13 7.801 5.281 -8.793 96 HG12 VAL 13 HG12 VAL 13 6.810 5.609 -10.215 97 HG13 VAL 13 HG13 VAL 13 6.046 5.134 -8.699 98 HG21 VAL 13 HG21 VAL 13 5.441 7.696 -10.327 99 HG22 VAL 13 HG22 VAL 13 5.434 8.820 -8.966 100 HG23 VAL 13 HG23 VAL 13 4.624 7.260 -8.825 101 H GLN 14 HN GLN 14 7.312 5.249 -5.817 102 HA GLN 14 HA GLN 14 10.211 5.548 -5.948 103 HB2 GLN 14 HB2 GLN 14 8.546 5.157 -3.468 104 HB3 GLN 14 HB1 GLN 14 10.216 4.615 -3.542 105 HG2 GLN 14 HG2 GLN 14 10.687 6.646 -2.753 106 HG3 GLN 14 HG1 GLN 14 10.459 7.164 -4.421 107 HE21 GLN 14 HE21 GLN 14 7.565 6.626 -4.258 108 HE22 GLN 14 HE22 GLN 14 6.906 7.965 -3.369 109 H ARG 15 HN ARG 15 11.322 3.632 -5.741 110 HA ARG 15 HA ARG 15 9.812 1.205 -6.199 111 HB2 ARG 15 HB2 ARG 15 12.514 1.909 -7.354 112 HB3 ARG 15 HB1 ARG 15 11.494 0.561 -7.758 113 HG2 ARG 15 HG2 ARG 15 11.274 2.030 -9.570 114 HG3 ARG 15 HG1 ARG 15 9.809 2.275 -8.602 115 HD2 ARG 15 HD2 ARG 15 10.601 4.238 -7.671 116 HD3 ARG 15 HD1 ARG 15 12.252 3.941 -8.197 117 HE ARG 15 HE ARG 15 10.577 4.158 -10.465 118 HH11 ARG 15 HH11 ARG 15 11.913 6.125 -7.902 119 HH12 ARG 15 HH12 ARG 15 12.007 7.569 -8.861 120 HH21 ARG 15 HH21 ARG 15 10.710 6.046 -11.758 121 HH22 ARG 15 HH22 ARG 15 11.330 7.518 -11.077 122 H VAL 16 HN VAL 16 10.060 0.129 -4.386 123 HA VAL 16 HA VAL 16 12.708 0.039 -3.137 124 HB VAL 16 HB VAL 16 11.242 1.434 -1.754 125 HG11 VAL 16 HG11 VAL 16 9.420 -0.951 -1.671 126 HG12 VAL 16 HG12 VAL 16 9.096 0.599 -2.457 127 HG13 VAL 16 HG13 VAL 16 9.235 0.506 -0.697 128 HG21 VAL 16 HG21 VAL 16 11.693 -1.262 -0.480 129 HG22 VAL 16 HG22 VAL 16 11.413 0.249 0.391 130 HG23 VAL 16 HG23 VAL 16 12.873 0.043 -0.584 131 H GLU 17 HN GLU 17 13.207 -1.989 -2.242 132 HA GLU 17 HA GLU 17 11.527 -4.169 -3.225 133 HB2 GLU 17 HB2 GLU 17 14.528 -4.139 -2.852 134 HB3 GLU 17 HB1 GLU 17 13.583 -5.488 -3.461 135 HG2 GLU 17 HG2 GLU 17 12.933 -4.181 -5.407 136 HG3 GLU 17 HG1 GLU 17 13.844 -2.802 -4.792 137 H ILE 18 HN ILE 18 10.472 -5.003 -1.527 138 HA ILE 18 HA ILE 18 11.621 -4.922 1.106 139 HB ILE 18 HB ILE 18 8.862 -5.864 0.298 140 HG12 ILE 18 HG12 ILE 18 8.592 -3.615 -0.056 141 HG13 ILE 18 HG11 ILE 18 8.354 -3.650 1.688 142 HG21 ILE 18 HG21 ILE 18 8.402 -5.705 2.689 143 HG22 ILE 18 HG22 ILE 18 10.083 -5.243 2.970 144 HG23 ILE 18 HG23 ILE 18 9.701 -6.846 2.342 145 HD11 ILE 18 HD11 ILE 18 10.653 -2.985 2.027 146 HD12 ILE 18 HD12 ILE 18 9.815 -1.829 0.990 147 HD13 ILE 18 HD13 ILE 18 10.922 -3.017 0.289 148 H HIS 19 HN HIS 19 12.718 -6.468 1.756 149 HA HIS 19 HA HIS 19 12.385 -9.095 0.570 150 HB2 HIS 19 HB2 HIS 19 14.455 -8.112 0.096 151 HB3 HIS 19 HB1 HIS 19 14.670 -7.588 1.740 152 HD1 HIS 19 HD1 HIS 19 16.843 -8.790 2.298 153 HD2 HIS 19 HD2 HIS 19 13.925 -11.280 0.708 154 HE1 HIS 19 HE1 HIS 19 17.743 -11.123 2.542 155 HE2 HIS 19 HE2 HIS 19 16.051 -12.598 1.398 156 H LYS 20 HN LYS 20 10.636 -9.510 1.959 157 HA LYS 20 HA LYS 20 10.659 -9.750 4.742 158 HB2 LYS 20 HB2 LYS 20 8.968 -11.587 4.329 159 HB3 LYS 20 HB1 LYS 20 8.600 -10.043 3.571 160 HG2 LYS 20 HG2 LYS 20 9.355 -10.851 1.441 161 HG3 LYS 20 HG1 LYS 20 9.900 -12.363 2.168 162 HD2 LYS 20 HD2 LYS 20 7.619 -12.945 2.731 163 HD3 LYS 20 HD1 LYS 20 7.046 -11.396 2.104 164 HE2 LYS 20 HE2 LYS 20 6.747 -13.310 0.533 165 HE3 LYS 20 HE1 LYS 20 7.693 -11.970 -0.115 166 HZ1 LYS 20 HZ1 LYS 20 8.815 -14.484 1.012 167 HZ2 LYS 20 HZ2 LYS 20 9.706 -13.202 0.366 168 HZ3 LYS 20 HZ3 LYS 20 8.702 -14.113 -0.642 169 H LEU 21 HN LEU 21 10.477 -12.249 5.698 170 HA LEU 21 HA LEU 21 13.132 -13.239 4.972 171 HB2 LEU 21 HB2 LEU 21 12.523 -11.801 7.267 172 HB3 LEU 21 HB1 LEU 21 12.567 -13.473 7.803 173 HG LEU 21 HG LEU 21 14.739 -12.434 8.110 174 HD11 LEU 21 HD11 LEU 21 14.905 -14.350 5.797 175 HD12 LEU 21 HD12 LEU 21 14.567 -14.839 7.455 176 HD13 LEU 21 HD13 LEU 21 16.109 -14.076 7.054 177 HD21 LEU 21 HD21 LEU 21 14.631 -11.915 5.139 178 HD22 LEU 21 HD22 LEU 21 16.064 -11.707 6.148 179 HD23 LEU 21 HD23 LEU 21 14.636 -10.710 6.425 180 H ARG 22 HN ARG 22 13.491 -15.296 5.178 181 HA ARG 22 HA ARG 22 11.472 -17.069 6.273 182 HB2 ARG 22 HB2 ARG 22 11.836 -17.230 3.766 183 HB3 ARG 22 HB1 ARG 22 13.491 -17.706 4.109 184 HG2 ARG 22 HG2 ARG 22 11.131 -19.249 5.117 185 HG3 ARG 22 HG1 ARG 22 11.878 -19.552 3.547 186 HD2 ARG 22 HD2 ARG 22 14.056 -19.815 4.797 187 HD3 ARG 22 HD1 ARG 22 13.093 -19.815 6.275 188 HE ARG 22 HE ARG 22 13.340 -21.931 4.322 189 HH11 ARG 22 HH11 ARG 22 11.342 -20.625 6.895 190 HH12 ARG 22 HH12 ARG 22 10.589 -22.154 7.253 191 HH21 ARG 22 HH21 ARG 22 12.386 -23.928 4.812 192 HH22 ARG 22 HH22 ARG 22 11.213 -24.036 6.091 193 H GLN 23 HN GLN 23 12.162 -17.733 8.201 194 HA GLN 23 HA GLN 23 15.057 -18.011 8.592 195 HB2 GLN 23 HB2 GLN 23 13.222 -17.657 10.900 196 HB3 GLN 23 HB1 GLN 23 14.872 -17.098 10.667 197 HG2 GLN 23 HG2 GLN 23 13.877 -15.609 8.844 198 HG3 GLN 23 HG1 GLN 23 12.338 -15.937 9.638 199 HE21 GLN 23 HE21 GLN 23 13.748 -13.487 9.260 200 HE22 GLN 23 HE22 GLN 23 14.034 -12.808 10.843 201 H GLY 24 HN GLY 24 14.325 -20.086 7.529 202 HA2 GLY 24 HA2 GLY 24 13.733 -22.358 7.738 203 HA3 GLY 24 HA1 GLY 24 15.234 -22.213 8.626 204 H GLU 25 HN GLU 25 11.814 -21.958 8.984 205 HA GLU 25 HA GLU 25 10.827 -23.531 10.752 206 HB2 GLU 25 HB2 GLU 25 12.713 -23.227 12.348 207 HB3 GLU 25 HB1 GLU 25 12.382 -21.500 12.400 208 HG2 GLU 25 HG2 GLU 25 10.043 -22.168 13.205 209 HG3 GLU 25 HG1 GLU 25 10.740 -23.760 13.498 210 H ASN 26 HN ASN 26 11.643 -20.417 9.816 211 HA ASN 26 HA ASN 26 9.045 -19.373 10.576 212 HB2 ASN 26 HB2 ASN 26 11.701 -17.950 10.588 213 HB3 ASN 26 HB1 ASN 26 10.146 -17.219 10.886 214 HD21 ASN 26 HD21 ASN 26 12.472 -19.421 11.974 215 HD22 ASN 26 HD22 ASN 26 12.012 -19.455 13.638 216 H LEU 27 HN LEU 27 8.191 -18.155 9.325 217 HA LEU 27 HA LEU 27 9.456 -17.064 6.924 218 HB2 LEU 27 HB2 LEU 27 6.745 -18.338 7.318 219 HB3 LEU 27 HB1 LEU 27 6.907 -17.009 6.202 220 HG LEU 27 HG LEU 27 7.004 -19.103 5.002 221 HD11 LEU 27 HD11 LEU 27 9.038 -18.787 3.786 222 HD12 LEU 27 HD12 LEU 27 9.775 -17.928 5.138 223 HD13 LEU 27 HD13 LEU 27 8.424 -17.203 4.260 224 HD21 LEU 27 HD21 LEU 27 9.311 -19.755 6.834 225 HD22 LEU 27 HD22 LEU 27 8.861 -20.686 5.397 226 HD23 LEU 27 HD23 LEU 27 7.747 -20.573 6.759 227 H ILE 28 HN ILE 28 9.407 -14.932 7.068 228 HA ILE 28 HA ILE 28 7.915 -13.755 9.286 229 HB ILE 28 HB ILE 28 10.198 -12.581 7.733 230 HG12 ILE 28 HG12 ILE 28 10.955 -14.662 8.752 231 HG13 ILE 28 HG11 ILE 28 11.632 -13.295 9.626 232 HG21 ILE 28 HG21 ILE 28 8.867 -10.978 8.895 233 HG22 ILE 28 HG22 ILE 28 10.437 -11.140 9.679 234 HG23 ILE 28 HG23 ILE 28 9.010 -11.893 10.395 235 HD11 ILE 28 HD11 ILE 28 9.202 -14.828 10.533 236 HD12 ILE 28 HD12 ILE 28 10.124 -13.641 11.454 237 HD13 ILE 28 HD13 ILE 28 10.847 -15.209 11.057 238 H LEU 29 HN LEU 29 6.338 -12.714 8.957 239 HA LEU 29 HA LEU 29 5.676 -11.415 6.423 240 HB2 LEU 29 HB2 LEU 29 4.471 -13.667 7.578 241 HB3 LEU 29 HB1 LEU 29 3.430 -12.340 8.051 242 HG LEU 29 HG LEU 29 3.019 -11.768 5.740 243 HD11 LEU 29 HD11 LEU 29 3.978 -13.046 3.908 244 HD12 LEU 29 HD12 LEU 29 4.891 -14.032 5.051 245 HD13 LEU 29 HD13 LEU 29 5.251 -12.312 4.887 246 HD21 LEU 29 HD21 LEU 29 2.742 -14.739 6.215 247 HD22 LEU 29 HD22 LEU 29 1.830 -13.791 5.037 248 HD23 LEU 29 HD23 LEU 29 1.619 -13.495 6.763 249 H GLY 30 HN GLY 30 6.628 -9.611 7.474 250 HA2 GLY 30 HA2 GLY 30 5.866 -8.966 10.190 251 HA3 GLY 30 HA1 GLY 30 7.061 -8.128 9.219 252 H PHE 31 HN PHE 31 6.281 -6.523 7.666 253 HA PHE 31 HA PHE 31 4.556 -4.801 9.154 254 HB2 PHE 31 HB2 PHE 31 5.101 -3.112 7.564 255 HB3 PHE 31 HB1 PHE 31 6.563 -4.043 7.866 256 HD1 PHE 31 HD2 PHE 31 7.082 -5.928 6.191 257 HD2 PHE 31 HD1 PHE 31 4.421 -2.706 5.423 258 HE1 PHE 31 HE2 PHE 31 7.327 -6.304 3.783 259 HE2 PHE 31 HE1 PHE 31 4.654 -3.079 3.020 260 HZ PHE 31 HZ PHE 31 6.160 -4.837 2.177 261 H SER 32 HN SER 32 2.755 -3.496 7.899 262 HA SER 32 HA SER 32 1.143 -5.611 6.631 263 HB2 SER 32 HB2 SER 32 0.524 -5.143 9.050 264 HB3 SER 32 HB1 SER 32 -0.002 -3.549 8.508 265 HG SER 32 HG SER 32 -1.561 -5.461 8.597 266 H ILE 33 HN ILE 33 -0.361 -4.963 5.109 267 HA ILE 33 HA ILE 33 0.039 -2.235 4.116 268 HB ILE 33 HB ILE 33 0.181 -3.034 1.819 269 HG12 ILE 33 HG12 ILE 33 0.427 -5.847 2.896 270 HG13 ILE 33 HG11 ILE 33 -1.098 -5.197 2.311 271 HG21 ILE 33 HG21 ILE 33 2.257 -2.652 2.927 272 HG22 ILE 33 HG22 ILE 33 2.430 -4.118 1.959 273 HG23 ILE 33 HG23 ILE 33 2.197 -4.234 3.707 274 HD11 ILE 33 HD11 ILE 33 1.411 -5.396 0.666 275 HD12 ILE 33 HD12 ILE 33 -0.192 -4.908 0.104 276 HD13 ILE 33 HD13 ILE 33 0.092 -6.566 0.643 277 H GLY 34 HN GLY 34 -1.709 -1.293 3.250 278 HA2 GLY 34 HA2 GLY 34 -4.207 -2.638 3.933 279 HA3 GLY 34 HA1 GLY 34 -4.016 -0.933 3.516 280 H GLY 35 HN GLY 35 -5.897 -3.006 2.509 281 HA2 GLY 35 HA2 GLY 35 -5.335 -2.533 -0.349 282 HA3 GLY 35 HA1 GLY 35 -5.775 -4.147 0.203 283 H GLY 36 HN GLY 36 -6.972 -1.493 -1.240 284 HA2 GLY 36 HA2 GLY 36 -9.693 -2.368 -0.673 285 HA3 GLY 36 HA1 GLY 36 -9.314 -0.688 -0.295 286 H ILE 37 HN ILE 37 -9.483 -3.067 -2.867 287 HA ILE 37 HA ILE 37 -10.410 -1.002 -4.672 288 HB ILE 37 HB ILE 37 -8.862 -2.231 -6.454 289 HG12 ILE 37 HG12 ILE 37 -6.608 -2.045 -4.763 290 HG13 ILE 37 HG11 ILE 37 -7.773 -3.058 -3.926 291 HG21 ILE 37 HG21 ILE 37 -7.336 -0.336 -6.249 292 HG22 ILE 37 HG22 ILE 37 -7.995 -0.007 -4.645 293 HG23 ILE 37 HG23 ILE 37 -9.023 0.151 -6.068 294 HD11 ILE 37 HD11 ILE 37 -7.901 -4.521 -5.862 295 HD12 ILE 37 HD12 ILE 37 -6.248 -4.380 -5.265 296 HD13 ILE 37 HD13 ILE 37 -6.743 -3.502 -6.714 297 H ASP 38 HN ASP 38 -9.352 -4.388 -4.803 298 HA ASP 38 HA ASP 38 -11.824 -5.020 -6.274 299 HB2 ASP 38 HB2 ASP 38 -9.703 -5.416 -7.504 300 HB3 ASP 38 HB1 ASP 38 -9.166 -6.484 -6.215 301 H GLN 39 HN GLN 39 -11.244 -4.734 -3.412 302 HA GLN 39 HA GLN 39 -11.108 -7.400 -2.339 303 HB2 GLN 39 HB2 GLN 39 -11.738 -5.014 -0.670 304 HB3 GLN 39 HB1 GLN 39 -10.794 -6.440 -0.261 305 HG2 GLN 39 HG2 GLN 39 -9.972 -4.147 -2.015 306 HG3 GLN 39 HG1 GLN 39 -9.328 -4.575 -0.433 307 HE21 GLN 39 HE21 GLN 39 -9.432 -7.465 -1.227 308 HE22 GLN 39 HE22 GLN 39 -8.060 -7.701 -2.236 309 H ASP 40 HN ASP 40 -13.326 -4.819 -1.521 310 HA ASP 40 HA ASP 40 -15.593 -6.590 -1.880 311 HB2 ASP 40 HB2 ASP 40 -14.779 -7.130 0.374 312 HB3 ASP 40 HB1 ASP 40 -14.880 -5.431 0.824 313 HA PRO 41 HA PRO 41 -17.094 -2.672 -3.305 314 HB2 PRO 41 HB2 PRO 41 -19.624 -3.431 -3.831 315 HB3 PRO 41 HB1 PRO 41 -18.264 -3.997 -4.812 316 HG2 PRO 41 HG2 PRO 41 -19.605 -5.365 -2.492 317 HG3 PRO 41 HG1 PRO 41 -19.273 -6.012 -4.100 318 HD2 PRO 41 HD2 PRO 41 -17.649 -6.561 -2.071 319 HD3 PRO 41 HD1 PRO 41 -16.982 -6.220 -3.685 320 H SER 42 HN SER 42 -18.334 -4.369 -0.582 321 HA SER 42 HA SER 42 -20.295 -2.505 0.270 322 HB2 SER 42 HB2 SER 42 -20.075 -4.875 1.070 323 HB3 SER 42 HB1 SER 42 -18.615 -4.385 1.941 324 HG SER 42 HG SER 42 -20.222 -2.696 2.835 325 H GLN 43 HN GLN 43 -16.844 -2.717 0.510 326 HA GLN 43 HA GLN 43 -16.640 -0.691 2.559 327 HB2 GLN 43 HB2 GLN 43 -14.470 -1.922 0.886 328 HB3 GLN 43 HB1 GLN 43 -14.339 -1.225 2.494 329 HG2 GLN 43 HG2 GLN 43 -15.409 -3.096 3.486 330 HG3 GLN 43 HG1 GLN 43 -15.892 -3.711 1.906 331 HE21 GLN 43 HE21 GLN 43 -13.490 -2.949 0.716 332 HE22 GLN 43 HE22 GLN 43 -12.360 -4.182 1.143 333 H ASN 44 HN ASN 44 -15.510 -1.273 -0.701 334 HA ASN 44 HA ASN 44 -14.787 1.498 -1.108 335 HB2 ASN 44 HB2 ASN 44 -14.331 -0.914 -2.847 336 HB3 ASN 44 HB1 ASN 44 -13.479 0.614 -2.879 337 HD21 ASN 44 HD21 ASN 44 -12.045 1.119 -1.169 338 HD22 ASN 44 HD22 ASN 44 -11.324 -0.120 -0.213 339 HA PRO 45 HA PRO 45 -18.733 1.655 -3.414 340 HB2 PRO 45 HB2 PRO 45 -18.845 4.373 -3.441 341 HB3 PRO 45 HB1 PRO 45 -19.389 3.399 -2.061 342 HG2 PRO 45 HG2 PRO 45 -16.785 4.830 -2.461 343 HG3 PRO 45 HG1 PRO 45 -17.809 4.760 -1.014 344 HD2 PRO 45 HD2 PRO 45 -15.603 3.225 -1.286 345 HD3 PRO 45 HD1 PRO 45 -17.048 2.663 -0.429 346 H PHE 46 HN PHE 46 -15.692 3.329 -3.991 347 HA PHE 46 HA PHE 46 -16.347 3.441 -6.861 348 HB2 PHE 46 HB2 PHE 46 -14.698 5.447 -5.299 349 HB3 PHE 46 HB1 PHE 46 -15.032 5.506 -7.033 350 HD1 PHE 46 HD2 PHE 46 -17.497 5.650 -7.736 351 HD2 PHE 46 HD1 PHE 46 -16.126 6.508 -3.803 352 HE1 PHE 46 HE2 PHE 46 -19.556 6.924 -7.303 353 HE2 PHE 46 HE1 PHE 46 -18.182 7.791 -3.362 354 HZ PHE 46 HZ PHE 46 -19.901 8.001 -5.113 355 H SER 47 HN SER 47 -13.680 3.278 -4.483 356 HA SER 47 HA SER 47 -12.214 1.436 -6.092 357 HB2 SER 47 HB2 SER 47 -11.484 4.330 -5.830 358 HB3 SER 47 HB1 SER 47 -10.200 3.135 -5.836 359 HG SER 47 HG SER 47 -12.077 2.794 -7.821 360 H GLU 48 HN GLU 48 -11.596 3.925 -3.771 361 HA GLU 48 HA GLU 48 -11.500 2.039 -1.557 362 HB2 GLU 48 HB2 GLU 48 -9.181 2.379 -2.149 363 HB3 GLU 48 HB1 GLU 48 -9.451 4.112 -2.255 364 HG2 GLU 48 HG2 GLU 48 -8.236 3.271 -0.196 365 HG3 GLU 48 HG1 GLU 48 -9.613 4.332 0.090 366 H ASP 49 HN ASP 49 -10.859 5.423 -2.199 367 HA ASP 49 HA ASP 49 -13.335 6.132 -0.785 368 HB2 ASP 49 HB2 ASP 49 -11.407 7.016 0.440 369 HB3 ASP 49 HB1 ASP 49 -10.798 7.761 -1.033 370 H LYS 50 HN LYS 50 -11.516 8.477 -2.576 371 HA LYS 50 HA LYS 50 -13.245 8.040 -4.916 372 HB2 LYS 50 HB2 LYS 50 -12.185 10.716 -4.029 373 HB3 LYS 50 HB1 LYS 50 -13.443 10.397 -5.217 374 HG2 LYS 50 HG2 LYS 50 -15.031 9.926 -3.606 375 HG3 LYS 50 HG1 LYS 50 -13.816 9.557 -2.377 376 HD2 LYS 50 HD2 LYS 50 -13.165 12.068 -2.700 377 HD3 LYS 50 HD1 LYS 50 -14.810 12.203 -3.338 378 HE2 LYS 50 HE2 LYS 50 -13.977 11.217 -0.611 379 HE3 LYS 50 HE1 LYS 50 -14.845 12.706 -0.984 380 HZ1 LYS 50 HZ1 LYS 50 -16.747 11.478 -1.639 381 HZ2 LYS 50 HZ2 LYS 50 -16.245 10.843 -0.146 382 HZ3 LYS 50 HZ3 LYS 50 -15.907 10.007 -1.576 383 H THR 51 HN THR 51 -10.375 9.915 -4.021 384 HA THR 51 HA THR 51 -9.296 9.504 -6.690 385 HB THR 51 HB THR 51 -7.589 11.202 -5.915 386 HG1 THR 51 HG1 THR 51 -8.372 12.384 -3.975 387 HG21 THR 51 HG21 THR 51 -9.192 13.077 -5.996 388 HG22 THR 51 HG22 THR 51 -10.511 11.928 -5.758 389 HG23 THR 51 HG23 THR 51 -9.530 11.854 -7.220 390 H ASP 52 HN ASP 52 -9.202 7.670 -4.060 391 HA ASP 52 HA ASP 52 -6.358 7.384 -3.783 392 HB2 ASP 52 HB2 ASP 52 -8.223 7.072 -1.919 393 HB3 ASP 52 HB1 ASP 52 -8.236 5.408 -2.534 394 H LYS 53 HN LYS 53 -5.684 5.051 -3.642 395 HA LYS 53 HA LYS 53 -6.357 3.767 -6.208 396 HB2 LYS 53 HB2 LYS 53 -3.619 3.737 -4.925 397 HB3 LYS 53 HB1 LYS 53 -4.053 3.221 -6.548 398 HG2 LYS 53 HG2 LYS 53 -3.974 6.033 -5.483 399 HG3 LYS 53 HG1 LYS 53 -2.924 5.309 -6.702 400 HD2 LYS 53 HD2 LYS 53 -4.785 5.114 -8.238 401 HD3 LYS 53 HD1 LYS 53 -5.899 5.711 -7.006 402 HE2 LYS 53 HE2 LYS 53 -4.548 7.828 -6.957 403 HE3 LYS 53 HE1 LYS 53 -3.669 7.220 -8.355 404 HZ1 LYS 53 HZ1 LYS 53 -6.606 7.667 -8.264 405 HZ2 LYS 53 HZ2 LYS 53 -5.715 7.157 -9.609 406 HZ3 LYS 53 HZ3 LYS 53 -5.482 8.718 -8.976 407 H GLY 54 HN GLY 54 -6.195 3.483 -2.853 408 HA2 GLY 54 HA2 GLY 54 -7.304 1.781 -1.705 409 HA3 GLY 54 HA1 GLY 54 -7.200 0.771 -3.143 410 H ILE 55 HN ILE 55 -4.435 0.742 -3.551 411 HA ILE 55 HA ILE 55 -3.672 -0.990 -1.326 412 HB ILE 55 HB ILE 55 -2.306 -0.577 -3.992 413 HG12 ILE 55 HG12 ILE 55 -4.524 -1.607 -4.221 414 HG13 ILE 55 HG11 ILE 55 -3.246 -2.762 -4.590 415 HG21 ILE 55 HG21 ILE 55 -1.837 -2.625 -1.834 416 HG22 ILE 55 HG22 ILE 55 -0.747 -1.317 -2.296 417 HG23 ILE 55 HG23 ILE 55 -1.079 -2.629 -3.427 418 HD11 ILE 55 HD11 ILE 55 -4.957 -3.834 -3.299 419 HD12 ILE 55 HD12 ILE 55 -4.846 -2.593 -2.049 420 HD13 ILE 55 HD13 ILE 55 -3.494 -3.698 -2.319 421 H TYR 56 HN TYR 56 -2.212 -0.421 0.181 422 HA TYR 56 HA TYR 56 0.019 1.273 -0.354 423 HB2 TYR 56 HB2 TYR 56 -0.553 3.133 1.113 424 HB3 TYR 56 HB1 TYR 56 -1.732 3.008 -0.187 425 HD1 TYR 56 HD2 TYR 56 -3.988 2.051 0.309 426 HD2 TYR 56 HD1 TYR 56 -1.185 2.944 3.370 427 HE1 TYR 56 HE2 TYR 56 -5.812 2.020 1.974 428 HE2 TYR 56 HE1 TYR 56 -2.986 2.913 5.048 429 HH TYR 56 HH TYR 56 -5.430 3.209 5.133 430 H VAL 57 HN VAL 57 1.266 1.725 1.793 431 HA VAL 57 HA VAL 57 1.106 -0.607 3.496 432 HB VAL 57 HB VAL 57 3.018 1.643 3.095 433 HG11 VAL 57 HG11 VAL 57 2.771 1.473 5.483 434 HG12 VAL 57 HG12 VAL 57 4.346 0.856 4.991 435 HG13 VAL 57 HG13 VAL 57 3.048 -0.266 5.415 436 HG21 VAL 57 HG21 VAL 57 4.637 -0.179 2.897 437 HG22 VAL 57 HG22 VAL 57 3.337 -0.253 1.701 438 HG23 VAL 57 HG23 VAL 57 3.309 -1.327 3.106 439 H THR 58 HN THR 58 0.309 -0.538 5.494 440 HA THR 58 HA THR 58 -0.341 2.100 6.629 441 HB THR 58 HB THR 58 -2.398 0.920 6.078 442 HG1 THR 58 HG1 THR 58 -1.676 1.318 8.767 443 HG21 THR 58 HG21 THR 58 -1.368 -1.283 7.872 444 HG22 THR 58 HG22 THR 58 -1.588 -1.377 6.124 445 HG23 THR 58 HG23 THR 58 -2.988 -1.193 7.180 446 H ARG 59 HN ARG 59 1.633 -0.561 6.899 447 HA ARG 59 HA ARG 59 2.367 0.142 9.611 448 HB2 ARG 59 HB2 ARG 59 1.304 -2.570 8.967 449 HB3 ARG 59 HB1 ARG 59 2.429 -2.319 10.279 450 HG2 ARG 59 HG2 ARG 59 0.390 -0.413 10.461 451 HG3 ARG 59 HG1 ARG 59 -0.357 -1.997 10.295 452 HD2 ARG 59 HD2 ARG 59 1.806 -1.315 12.285 453 HD3 ARG 59 HD1 ARG 59 0.085 -1.337 12.654 454 HE ARG 59 HE ARG 59 1.166 -3.792 11.545 455 HH11 ARG 59 HH11 ARG 59 0.329 -2.005 14.432 456 HH12 ARG 59 HH12 ARG 59 0.228 -3.415 15.433 457 HH21 ARG 59 HH21 ARG 59 1.061 -5.670 12.858 458 HH22 ARG 59 HH22 ARG 59 0.616 -5.511 14.533 459 H VAL 60 HN VAL 60 4.144 -0.919 10.395 460 HA VAL 60 HA VAL 60 5.830 -2.456 8.624 461 HB VAL 60 HB VAL 60 6.726 0.185 9.799 462 HG11 VAL 60 HG11 VAL 60 8.333 -1.561 10.254 463 HG12 VAL 60 HG12 VAL 60 8.974 -0.439 9.052 464 HG13 VAL 60 HG13 VAL 60 8.359 -2.017 8.548 465 HG21 VAL 60 HG21 VAL 60 6.907 -0.829 6.972 466 HG22 VAL 60 HG22 VAL 60 7.325 0.787 7.554 467 HG23 VAL 60 HG23 VAL 60 5.645 0.250 7.556 468 H SER 61 HN SER 61 6.473 -4.135 9.837 469 HA SER 61 HA SER 61 6.539 -3.875 12.726 470 HB2 SER 61 HB2 SER 61 7.487 -6.152 11.017 471 HB3 SER 61 HB1 SER 61 7.229 -6.194 12.757 472 HG SER 61 HG SER 61 5.291 -6.813 12.229 473 H GLU 62 HN GLU 62 8.089 -2.638 13.405 474 HA GLU 62 HA GLU 62 10.171 -1.779 11.911 475 HB2 GLU 62 HB2 GLU 62 10.747 -0.462 13.754 476 HB3 GLU 62 HB1 GLU 62 9.017 -0.577 13.744 477 HG2 GLU 62 HG2 GLU 62 9.407 -2.526 15.395 478 HG3 GLU 62 HG1 GLU 62 10.987 -1.785 15.612 479 H GLY 63 HN GLY 63 12.173 -1.937 11.998 480 HA2 GLY 63 HA2 GLY 63 14.264 -2.934 12.130 481 HA3 GLY 63 HA1 GLY 63 13.691 -3.817 13.549 482 H GLY 64 HN GLY 64 11.955 -3.857 10.493 483 HA2 GLY 64 HA2 GLY 64 12.538 -6.741 10.394 484 HA3 GLY 64 HA1 GLY 64 11.081 -5.957 9.784 485 HA PRO 65 HA PRO 65 13.491 -6.206 6.025 486 HB2 PRO 65 HB2 PRO 65 11.398 -6.798 4.498 487 HB3 PRO 65 HB1 PRO 65 12.177 -7.990 5.527 488 HG2 PRO 65 HG2 PRO 65 9.533 -6.790 5.769 489 HG3 PRO 65 HG1 PRO 65 10.185 -8.209 6.602 490 HD2 PRO 65 HD2 PRO 65 9.950 -5.457 7.557 491 HD3 PRO 65 HD1 PRO 65 10.376 -6.932 8.460 492 H ALA 66 HN ALA 66 10.571 -4.304 6.485 493 HA ALA 66 HA ALA 66 10.542 -3.589 3.650 494 HB1 ALA 66 HB1 ALA 66 8.539 -2.223 4.317 495 HB2 ALA 66 HB2 ALA 66 8.751 -2.826 5.963 496 HB3 ALA 66 HB3 ALA 66 8.390 -3.949 4.650 497 H GLU 67 HN GLU 67 11.101 -2.277 6.773 498 HA GLU 67 HA GLU 67 11.031 0.446 5.963 499 HB2 GLU 67 HB2 GLU 67 11.930 0.743 8.300 500 HB3 GLU 67 HB1 GLU 67 10.413 -0.159 8.189 501 HG2 GLU 67 HG2 GLU 67 12.786 -1.762 7.907 502 HG3 GLU 67 HG1 GLU 67 12.634 -1.008 9.486 503 H ILE 68 HN ILE 68 13.412 -2.093 6.276 504 HA ILE 68 HA ILE 68 15.624 -0.299 6.395 505 HB ILE 68 HB ILE 68 16.910 -2.335 6.097 506 HG12 ILE 68 HG12 ILE 68 14.318 -3.785 6.431 507 HG13 ILE 68 HG11 ILE 68 15.145 -3.598 4.886 508 HG21 ILE 68 HG21 ILE 68 14.915 -2.282 8.322 509 HG22 ILE 68 HG22 ILE 68 16.467 -1.445 8.285 510 HG23 ILE 68 HG23 ILE 68 16.416 -3.208 8.354 511 HD11 ILE 68 HD11 ILE 68 16.279 -4.942 7.311 512 HD12 ILE 68 HD12 ILE 68 17.046 -4.799 5.733 513 HD13 ILE 68 HD13 ILE 68 15.578 -5.761 5.912 514 H ALA 69 HN ALA 69 13.766 -2.057 4.212 515 HA ALA 69 HA ALA 69 15.457 -1.800 1.944 516 HB1 ALA 69 HB1 ALA 69 12.481 -2.252 2.169 517 HB2 ALA 69 HB2 ALA 69 13.726 -3.475 1.912 518 HB3 ALA 69 HB3 ALA 69 13.377 -2.292 0.650 519 H GLY 70 HN GLY 70 13.383 0.187 3.741 520 HA2 GLY 70 HA2 GLY 70 13.530 2.603 3.472 521 HA3 GLY 70 HA1 GLY 70 13.688 2.355 1.728 522 H LEU 71 HN LEU 71 11.452 1.000 4.087 523 HA LEU 71 HA LEU 71 9.203 2.019 2.510 524 HB2 LEU 71 HB2 LEU 71 9.652 -0.442 2.402 525 HB3 LEU 71 HB1 LEU 71 9.448 -0.499 4.142 526 HG LEU 71 HG LEU 71 7.567 -1.355 2.751 527 HD11 LEU 71 HD11 LEU 71 5.864 -0.516 4.248 528 HD12 LEU 71 HD12 LEU 71 6.932 0.810 4.720 529 HD13 LEU 71 HD13 LEU 71 7.371 -0.850 5.110 530 HD21 LEU 71 HD21 LEU 71 7.142 1.579 2.225 531 HD22 LEU 71 HD22 LEU 71 5.955 0.315 1.908 532 HD23 LEU 71 HD23 LEU 71 7.483 0.326 1.029 533 H GLN 72 HN GLN 72 7.302 2.362 3.844 534 HA GLN 72 HA GLN 72 7.494 2.795 6.582 535 HB2 GLN 72 HB2 GLN 72 7.717 5.170 6.763 536 HB3 GLN 72 HB1 GLN 72 9.095 4.555 5.875 537 HG2 GLN 72 HG2 GLN 72 6.729 6.031 4.757 538 HG3 GLN 72 HG1 GLN 72 8.383 6.616 4.920 539 HE21 GLN 72 HE21 GLN 72 6.167 4.915 2.995 540 HE22 GLN 72 HE22 GLN 72 7.248 4.469 1.727 541 H ILE 73 HN ILE 73 5.667 4.493 7.170 542 HA ILE 73 HA ILE 73 3.409 3.044 6.232 543 HB ILE 73 HB ILE 73 3.507 5.319 8.206 544 HG12 ILE 73 HG12 ILE 73 5.040 3.766 9.082 545 HG13 ILE 73 HG11 ILE 73 3.516 3.318 9.849 546 HG21 ILE 73 HG21 ILE 73 1.501 4.230 9.092 547 HG22 ILE 73 HG22 ILE 73 1.578 3.061 7.775 548 HG23 ILE 73 HG23 ILE 73 1.298 4.764 7.426 549 HD11 ILE 73 HD11 ILE 73 4.706 1.993 7.413 550 HD12 ILE 73 HD12 ILE 73 3.209 1.532 8.232 551 HD13 ILE 73 HD13 ILE 73 4.752 1.366 9.067 552 H GLY 74 HN GLY 74 2.422 3.523 4.532 553 HA2 GLY 74 HA2 GLY 74 0.535 4.988 3.836 554 HA3 GLY 74 HA1 GLY 74 1.635 6.349 4.077 555 H ASP 75 HN ASP 75 2.189 3.186 2.578 556 HA ASP 75 HA ASP 75 3.259 4.700 0.258 557 HB2 ASP 75 HB2 ASP 75 4.656 3.045 1.900 558 HB3 ASP 75 HB1 ASP 75 4.113 1.927 0.649 559 H LYS 76 HN LYS 76 1.961 4.496 -1.480 560 HA LYS 76 HA LYS 76 0.014 2.366 -1.515 561 HB2 LYS 76 HB2 LYS 76 0.519 4.568 -3.524 562 HB3 LYS 76 HB1 LYS 76 -0.847 3.465 -3.537 563 HG2 LYS 76 HG2 LYS 76 -1.663 4.400 -1.462 564 HG3 LYS 76 HG1 LYS 76 -0.247 5.453 -1.361 565 HD2 LYS 76 HD2 LYS 76 -0.896 6.535 -3.451 566 HD3 LYS 76 HD1 LYS 76 -2.309 5.479 -3.560 567 HE2 LYS 76 HE2 LYS 76 -1.746 7.510 -1.398 568 HE3 LYS 76 HE1 LYS 76 -2.957 7.647 -2.671 569 HZ1 LYS 76 HZ1 LYS 76 -4.026 6.961 -0.658 570 HZ2 LYS 76 HZ2 LYS 76 -2.940 5.681 -0.442 571 HZ3 LYS 76 HZ3 LYS 76 -4.044 5.645 -1.721 572 H ILE 77 HN ILE 77 0.767 0.465 -2.100 573 HA ILE 77 HA ILE 77 2.921 0.121 -3.947 574 HB ILE 77 HB ILE 77 1.002 -1.990 -2.948 575 HG12 ILE 77 HG12 ILE 77 3.690 -1.242 -1.786 576 HG13 ILE 77 HG11 ILE 77 2.168 -0.631 -1.148 577 HG21 ILE 77 HG21 ILE 77 2.335 -2.682 -4.868 578 HG22 ILE 77 HG22 ILE 77 2.879 -3.514 -3.410 579 HG23 ILE 77 HG23 ILE 77 3.808 -2.158 -4.048 580 HD11 ILE 77 HD11 ILE 77 3.044 -2.544 0.113 581 HD12 ILE 77 HD12 ILE 77 2.917 -3.536 -1.340 582 HD13 ILE 77 HD13 ILE 77 1.465 -2.866 -0.599 583 H MET 78 HN MET 78 2.617 0.611 -6.034 584 HA MET 78 HA MET 78 0.012 0.061 -7.261 585 HB2 MET 78 HB2 MET 78 2.383 1.477 -8.478 586 HB3 MET 78 HB1 MET 78 0.722 1.506 -9.047 587 HG2 MET 78 HG2 MET 78 1.478 2.570 -6.362 588 HG3 MET 78 HG1 MET 78 1.631 3.548 -7.817 589 HE1 MET 78 HE1 MET 78 -2.292 2.242 -5.782 590 HE2 MET 78 HE2 MET 78 -0.665 2.081 -5.123 591 HE3 MET 78 HE3 MET 78 -1.202 1.014 -6.421 592 H GLN 79 HN GLN 79 3.159 -1.174 -6.998 593 HA GLN 79 HA GLN 79 2.646 -3.190 -8.988 594 HB2 GLN 79 HB2 GLN 79 5.086 -1.429 -9.236 595 HB3 GLN 79 HB1 GLN 79 4.743 -2.836 -10.204 596 HG2 GLN 79 HG2 GLN 79 2.782 -1.717 -11.107 597 HG3 GLN 79 HG1 GLN 79 3.150 -0.291 -10.137 598 HE21 GLN 79 HE21 GLN 79 5.679 -2.172 -11.567 599 HE22 GLN 79 HE22 GLN 79 6.073 -1.055 -12.836 600 H VAL 80 HN VAL 80 3.474 -5.029 -8.432 601 HA VAL 80 HA VAL 80 5.649 -5.014 -6.425 602 HB VAL 80 HB VAL 80 4.022 -5.926 -5.155 603 HG11 VAL 80 HG11 VAL 80 2.105 -7.170 -5.967 604 HG12 VAL 80 HG12 VAL 80 2.787 -7.187 -7.595 605 HG13 VAL 80 HG13 VAL 80 2.297 -5.651 -6.858 606 HG21 VAL 80 HG21 VAL 80 4.185 -8.415 -5.199 607 HG22 VAL 80 HG22 VAL 80 5.751 -7.605 -5.319 608 HG23 VAL 80 HG23 VAL 80 5.006 -8.298 -6.769 609 H ASN 81 HN ASN 81 7.482 -5.922 -7.054 610 HA ASN 81 HA ASN 81 9.042 -6.960 -8.333 611 HB2 ASN 81 HB2 ASN 81 6.882 -8.952 -8.078 612 HB3 ASN 81 HB1 ASN 81 8.021 -9.230 -9.402 613 HD21 ASN 81 HD21 ASN 81 7.558 -9.159 -5.995 614 HD22 ASN 81 HD22 ASN 81 9.113 -9.820 -5.560 615 H GLY 82 HN GLY 82 7.170 -5.115 -9.494 616 HA2 GLY 82 HA2 GLY 82 7.341 -4.069 -11.608 617 HA3 GLY 82 HA1 GLY 82 7.766 -5.632 -12.308 618 H TRP 83 HN TRP 83 5.129 -6.114 -10.293 619 HA TRP 83 HA TRP 83 3.428 -6.309 -12.609 620 HB2 TRP 83 HB2 TRP 83 2.850 -7.166 -9.795 621 HB3 TRP 83 HB1 TRP 83 1.947 -7.597 -11.228 622 HD1 TRP 83 HD1 TRP 83 5.660 -7.641 -10.953 623 HE1 TRP 83 HE1 TRP 83 6.490 -9.962 -11.034 624 HE3 TRP 83 HE3 TRP 83 1.210 -10.100 -11.123 625 HZ2 TRP 83 HZ2 TRP 83 5.526 -12.587 -11.271 626 HZ3 TRP 83 HZ3 TRP 83 1.268 -12.557 -11.298 627 HH2 TRP 83 HH2 TRP 83 3.402 -13.751 -11.370 628 H ASP 84 HN ASP 84 2.829 -4.108 -12.864 629 HA ASP 84 HA ASP 84 1.633 -2.414 -11.114 630 HB2 ASP 84 HB2 ASP 84 1.777 -1.906 -13.519 631 HB3 ASP 84 HB1 ASP 84 0.553 -3.124 -13.860 632 H MET 85 HN MET 85 0.428 -3.043 -9.459 633 HA MET 85 HA MET 85 -1.348 -5.279 -9.533 634 HB2 MET 85 HB2 MET 85 -1.460 -3.087 -7.476 635 HB3 MET 85 HB1 MET 85 -1.818 -4.797 -7.274 636 HG2 MET 85 HG2 MET 85 0.554 -5.317 -7.572 637 HG3 MET 85 HG1 MET 85 0.897 -3.596 -7.740 638 HE1 MET 85 HE1 MET 85 -1.415 -5.696 -5.259 639 HE2 MET 85 HE2 MET 85 -0.306 -5.788 -3.889 640 HE3 MET 85 HE3 MET 85 0.121 -6.546 -5.427 641 H THR 86 HN THR 86 -2.623 -2.463 -8.088 642 HA THR 86 HA THR 86 -4.300 -1.035 -8.370 643 HB THR 86 HB THR 86 -4.788 -0.113 -10.563 644 HG1 THR 86 HG1 THR 86 -2.949 -1.500 -12.014 645 HG21 THR 86 HG21 THR 86 -2.532 0.661 -11.104 646 HG22 THR 86 HG22 THR 86 -1.845 -0.656 -10.151 647 HG23 THR 86 HG23 THR 86 -2.784 0.609 -9.357 648 H MET 87 HN MET 87 -4.712 -3.770 -10.500 649 HA MET 87 HA MET 87 -7.586 -3.811 -9.820 650 HB2 MET 87 HB2 MET 87 -8.014 -4.727 -12.078 651 HB3 MET 87 HB1 MET 87 -7.332 -3.107 -12.125 652 HG2 MET 87 HG2 MET 87 -5.093 -4.170 -12.516 653 HG3 MET 87 HG1 MET 87 -5.939 -5.704 -12.707 654 HE1 MET 87 HE1 MET 87 -6.454 -2.052 -15.482 655 HE2 MET 87 HE2 MET 87 -5.287 -2.144 -14.164 656 HE3 MET 87 HE3 MET 87 -7.013 -2.078 -13.809 657 H VAL 88 HN VAL 88 -4.656 -5.390 -9.718 658 HA VAL 88 HA VAL 88 -5.520 -8.099 -9.671 659 HB VAL 88 HB VAL 88 -3.054 -6.654 -8.695 660 HG11 VAL 88 HG11 VAL 88 -3.533 -9.623 -8.603 661 HG12 VAL 88 HG12 VAL 88 -3.571 -8.552 -7.207 662 HG13 VAL 88 HG13 VAL 88 -2.066 -8.768 -8.111 663 HG21 VAL 88 HG21 VAL 88 -1.953 -7.852 -10.495 664 HG22 VAL 88 HG22 VAL 88 -3.325 -6.932 -11.115 665 HG23 VAL 88 HG23 VAL 88 -3.461 -8.677 -10.893 666 H THR 89 HN THR 89 -5.870 -9.394 -7.745 667 HA THR 89 HA THR 89 -7.045 -7.715 -5.709 668 HB THR 89 HB THR 89 -8.079 -9.873 -6.703 669 HG1 THR 89 HG1 THR 89 -9.375 -9.012 -5.260 670 HG21 THR 89 HG21 THR 89 -6.230 -11.368 -6.019 671 HG22 THR 89 HG22 THR 89 -7.810 -11.863 -5.414 672 HG23 THR 89 HG23 THR 89 -6.674 -11.049 -4.342 673 H HIS 90 HN HIS 90 -6.649 -7.952 -3.552 674 HA HIS 90 HA HIS 90 -3.888 -7.679 -3.031 675 HB2 HIS 90 HB2 HIS 90 -6.020 -6.651 -1.888 676 HB3 HIS 90 HB1 HIS 90 -5.938 -8.094 -0.885 677 HD1 HIS 90 HD1 HIS 90 -3.681 -5.196 -1.867 678 HD2 HIS 90 HD2 HIS 90 -4.414 -7.742 1.326 679 HE1 HIS 90 HE1 HIS 90 -2.248 -4.349 0.009 680 HE2 HIS 90 HE2 HIS 90 -2.908 -5.751 1.994 681 H ASP 91 HN ASP 91 -6.069 -10.318 -2.854 682 HA ASP 91 HA ASP 91 -4.501 -11.832 -0.967 683 HB2 ASP 91 HB2 ASP 91 -6.972 -12.031 -1.054 684 HB3 ASP 91 HB1 ASP 91 -6.824 -12.705 -2.684 685 H GLN 92 HN GLN 92 -4.998 -11.704 -4.473 686 HA GLN 92 HA GLN 92 -3.347 -13.994 -4.879 687 HB2 GLN 92 HB2 GLN 92 -3.911 -13.845 -7.079 688 HB3 GLN 92 HB1 GLN 92 -5.349 -13.279 -6.246 689 HG2 GLN 92 HG2 GLN 92 -5.280 -11.333 -7.273 690 HG3 GLN 92 HG1 GLN 92 -3.560 -11.114 -6.952 691 HE21 GLN 92 HE21 GLN 92 -4.932 -13.877 -8.382 692 HE22 GLN 92 HE22 GLN 92 -4.173 -13.689 -9.896 693 H ALA 93 HN ALA 93 -3.033 -10.570 -4.622 694 HA ALA 93 HA ALA 93 -0.435 -10.340 -5.749 695 HB1 ALA 93 HB1 ALA 93 -0.297 -8.295 -4.387 696 HB2 ALA 93 HB2 ALA 93 -1.779 -8.758 -3.550 697 HB3 ALA 93 HB3 ALA 93 -1.821 -8.378 -5.273 698 H ARG 94 HN ARG 94 -1.823 -10.966 -2.579 699 HA ARG 94 HA ARG 94 0.498 -11.312 -1.137 700 HB2 ARG 94 HB2 ARG 94 -2.295 -12.367 -0.875 701 HB3 ARG 94 HB1 ARG 94 -1.034 -12.930 0.234 702 HG2 ARG 94 HG2 ARG 94 -0.574 -10.463 0.671 703 HG3 ARG 94 HG1 ARG 94 -2.109 -10.159 -0.141 704 HD2 ARG 94 HD2 ARG 94 -1.623 -11.743 2.370 705 HD3 ARG 94 HD1 ARG 94 -2.515 -10.233 2.181 706 HE ARG 94 HE ARG 94 -3.609 -12.455 0.703 707 HH11 ARG 94 HH11 ARG 94 -3.615 -10.626 3.674 708 HH12 ARG 94 HH12 ARG 94 -5.139 -11.255 4.232 709 HH21 ARG 94 HH21 ARG 94 -5.626 -13.310 1.406 710 HH22 ARG 94 HH22 ARG 94 -6.274 -12.783 2.936 711 H LYS 95 HN LYS 95 -1.347 -13.700 -3.000 712 HA LYS 95 HA LYS 95 0.218 -15.866 -2.085 713 HB2 LYS 95 HB2 LYS 95 -1.025 -17.248 -3.520 714 HB3 LYS 95 HB1 LYS 95 -2.135 -16.001 -2.986 715 HG2 LYS 95 HG2 LYS 95 -1.775 -14.830 -5.161 716 HG3 LYS 95 HG1 LYS 95 -0.793 -16.205 -5.673 717 HD2 LYS 95 HD2 LYS 95 -3.702 -16.288 -4.870 718 HD3 LYS 95 HD1 LYS 95 -3.070 -16.409 -6.512 719 HE2 LYS 95 HE2 LYS 95 -1.881 -18.473 -5.872 720 HE3 LYS 95 HE1 LYS 95 -2.585 -18.359 -4.261 721 HZ1 LYS 95 HZ1 LYS 95 -4.147 -18.616 -6.782 722 HZ2 LYS 95 HZ2 LYS 95 -4.777 -18.614 -5.206 723 HZ3 LYS 95 HZ3 LYS 95 -3.798 -19.894 -5.723 724 H ARG 96 HN ARG 96 0.710 -13.587 -4.750 725 HA ARG 96 HA ARG 96 2.578 -15.398 -5.991 726 HB2 ARG 96 HB2 ARG 96 2.733 -13.769 -7.722 727 HB3 ARG 96 HB1 ARG 96 1.039 -13.987 -7.312 728 HG2 ARG 96 HG2 ARG 96 0.932 -11.775 -7.215 729 HG3 ARG 96 HG1 ARG 96 1.822 -11.908 -5.692 730 HD2 ARG 96 HD2 ARG 96 3.232 -11.922 -8.284 731 HD3 ARG 96 HD1 ARG 96 2.745 -10.389 -7.569 732 HE ARG 96 HE ARG 96 4.074 -11.485 -5.561 733 HH11 ARG 96 HH11 ARG 96 4.915 -11.206 -8.937 734 HH12 ARG 96 HH12 ARG 96 6.620 -11.400 -8.662 735 HH21 ARG 96 HH21 ARG 96 6.336 -11.726 -5.197 736 HH22 ARG 96 HH22 ARG 96 7.419 -11.695 -6.552 737 H LEU 97 HN LEU 97 2.586 -12.729 -3.740 738 HA LEU 97 HA LEU 97 5.346 -12.105 -4.223 739 HB2 LEU 97 HB2 LEU 97 5.159 -10.640 -2.247 740 HB3 LEU 97 HB1 LEU 97 4.041 -10.283 -3.544 741 HG LEU 97 HG LEU 97 2.376 -11.702 -2.107 742 HD11 LEU 97 HD11 LEU 97 4.302 -10.746 0.003 743 HD12 LEU 97 HD12 LEU 97 4.143 -12.418 -0.530 744 HD13 LEU 97 HD13 LEU 97 2.783 -11.610 0.256 745 HD21 LEU 97 HD21 LEU 97 2.098 -9.352 -2.621 746 HD22 LEU 97 HD22 LEU 97 3.258 -8.911 -1.367 747 HD23 LEU 97 HD23 LEU 97 1.716 -9.645 -0.925 748 H THR 98 HN THR 98 3.633 -14.228 -2.102 749 HA THR 98 HA THR 98 6.127 -14.858 -0.685 750 HB THR 98 HB THR 98 4.593 -16.335 0.722 751 HG1 THR 98 HG1 THR 98 2.812 -16.373 -0.692 752 HG21 THR 98 HG21 THR 98 5.451 -14.175 1.512 753 HG22 THR 98 HG22 THR 98 3.815 -14.478 2.096 754 HG23 THR 98 HG23 THR 98 4.080 -13.359 0.759 755 H LYS 99 HN LYS 99 5.878 -15.709 -3.436 756 HA LYS 99 HA LYS 99 5.027 -18.453 -3.380 757 HB2 LYS 99 HB2 LYS 99 5.648 -18.469 -5.763 758 HB3 LYS 99 HB1 LYS 99 4.582 -17.123 -5.367 759 HG2 LYS 99 HG2 LYS 99 6.620 -15.687 -5.191 760 HG3 LYS 99 HG1 LYS 99 7.547 -17.046 -5.815 761 HD2 LYS 99 HD2 LYS 99 6.238 -17.045 -7.847 762 HD3 LYS 99 HD1 LYS 99 5.248 -15.724 -7.214 763 HE2 LYS 99 HE2 LYS 99 7.054 -14.210 -7.266 764 HE3 LYS 99 HE1 LYS 99 8.230 -15.504 -7.501 765 HZ1 LYS 99 HZ1 LYS 99 7.326 -15.899 -9.690 766 HZ2 LYS 99 HZ2 LYS 99 7.801 -14.279 -9.552 767 HZ3 LYS 99 HZ3 LYS 99 6.158 -14.696 -9.474 768 H ARG 100 HN ARG 100 7.715 -16.913 -2.490 769 HA ARG 100 HA ARG 100 9.815 -17.500 -1.880 770 HB2 ARG 100 HB2 ARG 100 8.552 -20.195 -2.159 771 HB3 ARG 100 HB1 ARG 100 10.262 -20.048 -1.784 772 HG2 ARG 100 HG2 ARG 100 9.392 -20.197 0.323 773 HG3 ARG 100 HG1 ARG 100 9.367 -18.448 0.104 774 HD2 ARG 100 HD2 ARG 100 7.266 -19.005 0.997 775 HD3 ARG 100 HD1 ARG 100 6.984 -18.729 -0.722 776 HE ARG 100 HE ARG 100 7.497 -21.461 -0.308 777 HH11 ARG 100 HH11 ARG 100 5.007 -19.061 0.215 778 HH12 ARG 100 HH12 ARG 100 3.739 -20.233 0.423 779 HH21 ARG 100 HH21 ARG 100 5.859 -22.993 -0.059 780 HH22 ARG 100 HH22 ARG 100 4.228 -22.482 0.277 781 H SER 101 HN SER 101 8.844 -17.367 -4.784 782 HA SER 101 HA SER 101 11.179 -18.602 -6.056 783 HB2 SER 101 HB2 SER 101 8.764 -17.337 -7.371 784 HB3 SER 101 HB1 SER 101 9.989 -18.342 -8.135 785 HG SER 101 HG SER 101 8.758 -19.517 -5.972 786 H GLU 102 HN GLU 102 10.631 -16.009 -4.440 787 HA GLU 102 HA GLU 102 12.200 -14.254 -6.134 788 HB2 GLU 102 HB2 GLU 102 10.973 -12.371 -5.429 789 HB3 GLU 102 HB1 GLU 102 9.753 -13.569 -5.820 790 HG2 GLU 102 HG2 GLU 102 10.723 -12.907 -3.050 791 HG3 GLU 102 HG1 GLU 102 9.231 -12.325 -3.780 792 H GLU 103 HN GLU 103 13.561 -12.915 -4.975 793 HA GLU 103 HA GLU 103 14.338 -13.898 -2.327 794 HB2 GLU 103 HB2 GLU 103 16.538 -12.954 -2.787 795 HB3 GLU 103 HB1 GLU 103 16.086 -14.175 -3.963 796 HG2 GLU 103 HG2 GLU 103 15.673 -11.258 -4.481 797 HG3 GLU 103 HG1 GLU 103 17.208 -12.051 -4.792 798 H VAL 104 HN VAL 104 12.444 -11.792 -3.482 799 HA VAL 104 HA VAL 104 12.508 -9.894 -1.437 800 HB VAL 104 HB VAL 104 14.726 -9.468 -2.421 801 HG11 VAL 104 HG11 VAL 104 14.206 -10.057 -4.713 802 HG12 VAL 104 HG12 VAL 104 14.905 -8.438 -4.635 803 HG13 VAL 104 HG13 VAL 104 13.167 -8.643 -4.867 804 HG21 VAL 104 HG21 VAL 104 13.446 -7.674 -1.295 805 HG22 VAL 104 HG22 VAL 104 12.814 -7.177 -2.865 806 HG23 VAL 104 HG23 VAL 104 14.543 -7.059 -2.529 807 H VAL 105 HN VAL 105 11.007 -8.022 -1.905 808 HA VAL 105 HA VAL 105 9.510 -8.586 -4.397 809 HB VAL 105 HB VAL 105 7.452 -7.851 -3.415 810 HG11 VAL 105 HG11 VAL 105 8.806 -9.879 -1.659 811 HG12 VAL 105 HG12 VAL 105 7.984 -10.198 -3.186 812 HG13 VAL 105 HG13 VAL 105 7.064 -9.633 -1.792 813 HG21 VAL 105 HG21 VAL 105 8.297 -6.173 -1.861 814 HG22 VAL 105 HG22 VAL 105 8.931 -7.454 -0.827 815 HG23 VAL 105 HG23 VAL 105 7.190 -7.295 -1.071 816 H ARG 106 HN ARG 106 9.333 -7.012 -5.821 817 HA ARG 106 HA ARG 106 10.478 -4.422 -5.249 818 HB2 ARG 106 HB2 ARG 106 9.328 -5.733 -7.705 819 HB3 ARG 106 HB1 ARG 106 9.695 -4.016 -7.678 820 HG2 ARG 106 HG2 ARG 106 11.484 -5.212 -8.685 821 HG3 ARG 106 HG1 ARG 106 11.993 -4.534 -7.151 822 HD2 ARG 106 HD2 ARG 106 11.737 -6.730 -6.095 823 HD3 ARG 106 HD1 ARG 106 11.202 -7.402 -7.635 824 HE ARG 106 HE ARG 106 13.909 -6.281 -7.196 825 HH11 ARG 106 HH11 ARG 106 11.791 -8.796 -8.459 826 HH12 ARG 106 HH12 ARG 106 13.054 -9.591 -9.336 827 HH21 ARG 106 HH21 ARG 106 15.562 -7.343 -8.347 828 HH22 ARG 106 HH22 ARG 106 15.212 -8.785 -9.257 829 H LEU 107 HN LEU 107 9.326 -2.634 -4.784 830 HA LEU 107 HA LEU 107 6.422 -2.762 -5.281 831 HB2 LEU 107 HB2 LEU 107 7.657 -1.126 -3.059 832 HB3 LEU 107 HB1 LEU 107 5.960 -1.442 -3.342 833 HG LEU 107 HG LEU 107 6.574 -2.729 -1.464 834 HD11 LEU 107 HD11 LEU 107 6.528 -4.401 -3.949 835 HD12 LEU 107 HD12 LEU 107 5.171 -3.996 -2.891 836 HD13 LEU 107 HD13 LEU 107 6.451 -5.077 -2.318 837 HD21 LEU 107 HD21 LEU 107 8.898 -3.570 -3.141 838 HD22 LEU 107 HD22 LEU 107 8.472 -4.323 -1.597 839 HD23 LEU 107 HD23 LEU 107 8.933 -2.618 -1.656 840 H LEU 108 HN LEU 108 6.070 -1.515 -6.905 841 HA LEU 108 HA LEU 108 7.351 1.115 -7.059 842 HB2 LEU 108 HB2 LEU 108 5.347 -0.213 -8.876 843 HB3 LEU 108 HB1 LEU 108 5.847 1.448 -9.050 844 HG LEU 108 HG LEU 108 7.076 -0.939 -10.059 845 HD11 LEU 108 HD11 LEU 108 8.185 0.630 -11.484 846 HD12 LEU 108 HD12 LEU 108 7.834 1.957 -10.373 847 HD13 LEU 108 HD13 LEU 108 6.516 1.155 -11.241 848 HD21 LEU 108 HD21 LEU 108 9.411 -0.415 -9.539 849 HD22 LEU 108 HD22 LEU 108 8.508 -0.870 -8.096 850 HD23 LEU 108 HD23 LEU 108 8.881 0.829 -8.401 851 H VAL 109 HN VAL 109 6.529 2.589 -5.753 852 HA VAL 109 HA VAL 109 3.741 2.293 -4.968 853 HB VAL 109 HB VAL 109 4.428 3.154 -2.764 854 HG11 VAL 109 HG11 VAL 109 5.842 0.613 -3.544 855 HG12 VAL 109 HG12 VAL 109 4.139 0.747 -3.107 856 HG13 VAL 109 HG13 VAL 109 5.385 1.098 -1.909 857 HG21 VAL 109 HG21 VAL 109 6.451 4.299 -3.434 858 HG22 VAL 109 HG22 VAL 109 7.213 2.759 -3.830 859 HG23 VAL 109 HG23 VAL 109 6.804 3.136 -2.156 860 H THR 110 HN THR 110 2.891 4.209 -3.972 861 HA THR 110 HA THR 110 4.034 6.714 -4.951 862 HB THR 110 HB THR 110 1.661 7.564 -5.182 863 HG1 THR 110 HG1 THR 110 0.878 4.896 -5.569 864 HG21 THR 110 HG21 THR 110 1.402 6.662 -7.399 865 HG22 THR 110 HG22 THR 110 2.483 5.326 -6.999 866 HG23 THR 110 HG23 THR 110 3.109 6.976 -7.062 867 H ARG 111 HN ARG 111 4.722 7.713 -3.225 868 HA ARG 111 HA ARG 111 2.830 7.919 -0.983 869 HB2 ARG 111 HB2 ARG 111 4.654 7.857 0.611 870 HB3 ARG 111 HB1 ARG 111 4.715 6.415 -0.394 871 HG2 ARG 111 HG2 ARG 111 6.476 7.444 -1.745 872 HG3 ARG 111 HG1 ARG 111 6.432 8.863 -0.698 873 HD2 ARG 111 HD2 ARG 111 8.177 7.665 0.214 874 HD3 ARG 111 HD1 ARG 111 6.816 7.145 1.190 875 HE ARG 111 HE ARG 111 6.725 5.168 -0.381 876 HH11 ARG 111 HH11 ARG 111 9.727 6.893 0.215 877 HH12 ARG 111 HH12 ARG 111 10.708 5.471 0.137 878 HH21 ARG 111 HH21 ARG 111 8.014 3.294 -0.488 879 HH22 ARG 111 HH22 ARG 111 9.742 3.422 -0.283 880 H GLN 112 HN GLN 112 3.111 9.897 0.273 881 HA GLN 112 HA GLN 112 4.021 12.181 -1.205 882 HB2 GLN 112 HB2 GLN 112 2.907 11.856 1.575 883 HB3 GLN 112 HB1 GLN 112 3.341 13.401 0.869 884 HG2 GLN 112 HG2 GLN 112 0.955 12.969 0.824 885 HG3 GLN 112 HG1 GLN 112 1.619 13.176 -0.785 886 HE21 GLN 112 HE21 GLN 112 1.508 11.517 -2.236 887 HE22 GLN 112 HE22 GLN 112 0.630 10.050 -1.929 888 H SER 113 HN SER 113 4.624 10.608 1.777 889 HA SER 113 HA SER 113 6.643 9.772 2.580 890 HB2 SER 113 HB2 SER 113 7.729 10.483 0.399 891 HB3 SER 113 HB1 SER 113 8.040 12.029 1.180 892 HG SER 113 HG SER 113 9.290 10.945 2.729 893 H LEU 114 HN LEU 114 4.823 12.005 3.177 894 HA LEU 114 HA LEU 114 6.086 12.889 5.600 895 HB2 LEU 114 HB2 LEU 114 5.602 15.223 5.159 896 HB3 LEU 114 HB1 LEU 114 6.621 14.564 3.895 897 HG LEU 114 HG LEU 114 4.003 14.214 2.980 898 HD11 LEU 114 HD11 LEU 114 3.122 16.500 3.028 899 HD12 LEU 114 HD12 LEU 114 4.416 16.963 4.132 900 HD13 LEU 114 HD13 LEU 114 3.210 15.779 4.634 901 HD21 LEU 114 HD21 LEU 114 4.702 15.889 1.297 902 HD22 LEU 114 HD22 LEU 114 5.899 14.622 1.567 903 HD23 LEU 114 HD23 LEU 114 6.132 16.225 2.273 904 H GLN 115 HN GLN 115 3.473 12.531 3.497 905 HA GLN 115 HA GLN 115 1.465 12.783 5.600 906 HB2 GLN 115 HB2 GLN 115 1.361 12.621 2.594 907 HB3 GLN 115 HB1 GLN 115 -0.072 12.372 3.570 908 HG2 GLN 115 HG2 GLN 115 -0.017 14.570 4.411 909 HG3 GLN 115 HG1 GLN 115 1.622 14.827 3.816 910 HE21 GLN 115 HE21 GLN 115 -1.748 14.617 2.946 911 HE22 GLN 115 HE22 GLN 115 -1.584 15.332 1.378 912 H LYS 116 HN LYS 116 0.843 11.020 6.651 913 HA LYS 116 HA LYS 116 1.449 8.390 5.524 914 HB2 LYS 116 HB2 LYS 116 1.045 7.566 7.848 915 HB3 LYS 116 HB1 LYS 116 2.369 8.711 7.719 916 HG2 LYS 116 HG2 LYS 116 0.671 10.486 8.428 917 HG3 LYS 116 HG1 LYS 116 -0.357 9.130 8.898 918 HD2 LYS 116 HD2 LYS 116 1.332 8.316 10.417 919 HD3 LYS 116 HD1 LYS 116 2.468 9.549 9.870 920 HE2 LYS 116 HE2 LYS 116 1.642 10.374 11.895 921 HE3 LYS 116 HE1 LYS 116 0.739 11.251 10.661 922 HZ1 LYS 116 HZ1 LYS 116 -0.782 10.562 12.324 923 HZ2 LYS 116 HZ2 LYS 116 -0.209 8.965 12.305 924 HZ3 LYS 116 HZ3 LYS 116 -1.063 9.576 10.978 925 H ALA 117 HN ALA 117 -0.261 6.642 6.288 926 HA ALA 117 HA ALA 117 -2.910 7.732 5.648 927 HB1 ALA 117 HB1 ALA 117 -1.904 6.954 3.555 928 HB2 ALA 117 HB2 ALA 117 -3.270 5.942 4.020 929 HB3 ALA 117 HB3 ALA 117 -1.622 5.374 4.284 930 H VAL 118 HN VAL 118 -1.635 6.828 8.007 931 HA VAL 118 HA VAL 118 -3.000 4.326 8.594 932 HB VAL 118 HB VAL 118 -0.612 4.218 8.958 933 HG11 VAL 118 HG11 VAL 118 -0.938 6.458 10.948 934 HG12 VAL 118 HG12 VAL 118 -0.166 6.591 9.369 935 HG13 VAL 118 HG13 VAL 118 0.545 5.561 10.612 936 HG21 VAL 118 HG21 VAL 118 -1.970 2.891 10.381 937 HG22 VAL 118 HG22 VAL 118 -2.234 4.245 11.476 938 HG23 VAL 118 HG23 VAL 118 -0.627 3.528 11.329 939 H GLN 119 HN GLN 119 -4.945 5.379 8.749 940 HA GLN 119 HA GLN 119 -5.300 7.258 10.974 941 HB2 GLN 119 HB2 GLN 119 -6.950 6.751 8.500 942 HB3 GLN 119 HB1 GLN 119 -7.459 7.814 9.804 943 HG2 GLN 119 HG2 GLN 119 -5.663 9.312 9.408 944 HG3 GLN 119 HG1 GLN 119 -4.877 8.185 8.306 945 HE21 GLN 119 HE21 GLN 119 -5.708 7.897 6.253 946 HE22 GLN 119 HE22 GLN 119 -6.798 9.038 5.526 947 H GLN 120 HN GLN 120 -5.107 4.440 11.452 948 HA GLN 120 HA GLN 120 -7.634 3.233 11.767 949 HB2 GLN 120 HB2 GLN 120 -5.523 1.963 11.824 950 HB3 GLN 120 HB1 GLN 120 -5.089 2.750 13.334 951 HG2 GLN 120 HG2 GLN 120 -6.963 1.700 14.450 952 HG3 GLN 120 HG1 GLN 120 -7.481 0.967 12.933 953 HE21 GLN 120 HE21 GLN 120 -4.750 0.371 12.093 954 HE22 GLN 120 HE22 GLN 120 -4.240 -0.971 13.051 955 H SER 121 HN SER 121 -9.198 4.297 12.813 956 HA SER 121 HA SER 121 -8.596 5.888 15.168 957 HB2 SER 121 HB2 SER 121 -11.304 5.417 13.910 958 HB3 SER 121 HB1 SER 121 -10.804 6.764 14.933 959 HG SER 121 HG SER 121 -9.158 6.645 12.842 960 H MET 122 HN MET 122 -9.785 2.756 14.431 961 HA MET 122 HA MET 122 -10.609 2.404 17.229 962 HB2 MET 122 HB2 MET 122 -12.622 2.505 15.858 963 HB3 MET 122 HB1 MET 122 -11.979 1.273 14.783 964 HG2 MET 122 HG2 MET 122 -13.652 0.374 16.309 965 HG3 MET 122 HG1 MET 122 -12.075 -0.375 16.549 966 HE1 MET 122 HE1 MET 122 -13.969 2.747 19.386 967 HE2 MET 122 HE2 MET 122 -14.755 2.108 17.940 968 HE3 MET 122 HE3 MET 122 -13.361 3.177 17.787 969 H LEU 123 HN LEU 123 -9.655 0.779 18.235 970 HA LEU 123 HA LEU 123 -7.859 -0.962 16.766 971 HB2 LEU 123 HB2 LEU 123 -7.142 0.061 18.890 972 HB3 LEU 123 HB1 LEU 123 -8.447 -0.765 19.722 973 HG LEU 123 HG LEU 123 -7.407 -2.939 19.151 974 HD11 LEU 123 HD11 LEU 123 -5.173 -1.223 18.068 975 HD12 LEU 123 HD12 LEU 123 -6.238 -2.261 17.118 976 HD13 LEU 123 HD13 LEU 123 -5.119 -2.972 18.280 977 HD21 LEU 123 HD21 LEU 123 -6.937 -1.901 21.295 978 HD22 LEU 123 HD22 LEU 123 -5.624 -0.969 20.579 979 HD23 LEU 123 HD23 LEU 123 -5.499 -2.724 20.692 980 H SER 124 HN SER 124 -8.455 -2.905 16.056 981 HA SER 124 HA SER 124 -11.041 -3.932 16.832 982 HB2 SER 124 HB2 SER 124 -10.291 -3.859 14.442 983 HB3 SER 124 HB1 SER 124 -9.101 -5.098 14.833 984 HG SER 124 HG SER 124 -11.910 -5.355 15.159 985 H1 LYS 161 HN LYS 161 -16.204 -1.855 8.169 986 HA LYS 161 HA LYS 161 -15.852 -3.092 6.296 987 HB2 LYS 161 HB2 LYS 161 -18.361 -2.094 5.943 988 HB3 LYS 161 HB1 LYS 161 -17.553 -1.432 4.528 989 HG2 LYS 161 HG2 LYS 161 -18.506 -3.448 3.814 990 HG3 LYS 161 HG1 LYS 161 -16.789 -3.798 4.029 991 HD2 LYS 161 HD2 LYS 161 -17.180 -4.898 6.099 992 HD3 LYS 161 HD1 LYS 161 -18.840 -4.309 6.174 993 HE2 LYS 161 HE2 LYS 161 -18.845 -6.635 5.554 994 HE3 LYS 161 HE1 LYS 161 -19.381 -5.665 4.186 995 HZ1 LYS 161 HZ1 LYS 161 -17.365 -5.995 3.071 996 HZ2 LYS 161 HZ2 LYS 161 -17.746 -7.515 3.720 997 HZ3 LYS 161 HZ3 LYS 161 -16.571 -6.547 4.469 998 H GLU 162 HN GLU 162 -13.643 -2.265 6.130 999 HA GLU 162 HA GLU 162 -13.142 -1.882 3.438 1000 HB2 GLU 162 HB2 GLU 162 -12.441 0.278 3.093 1001 HB3 GLU 162 HB1 GLU 162 -13.865 0.512 4.092 1002 HG2 GLU 162 HG2 GLU 162 -11.089 0.456 5.239 1003 HG3 GLU 162 HG1 GLU 162 -11.841 1.929 4.644 1004 H ASN 163 HN ASN 163 -10.870 -1.582 2.913 1005 HA ASN 163 HA ASN 163 -8.668 -2.002 3.094 1006 HB2 ASN 163 HB2 ASN 163 -8.634 0.015 4.390 1007 HB3 ASN 163 HB1 ASN 163 -9.143 -0.843 5.840 1008 HD21 ASN 163 HD21 ASN 163 -7.367 -0.149 6.996 1009 HD22 ASN 163 HD22 ASN 163 -5.770 -0.783 6.717 1010 H LEU 164 HN LEU 164 -8.499 -4.201 2.894 1011 HA LEU 164 HA LEU 164 -8.401 -5.765 5.355 1012 HB2 LEU 164 HB2 LEU 164 -8.414 -7.679 4.116 1013 HB3 LEU 164 HB1 LEU 164 -9.294 -6.610 3.044 1014 HG LEU 164 HG LEU 164 -6.337 -7.039 2.723 1015 HD11 LEU 164 HD11 LEU 164 -6.857 -8.818 1.131 1016 HD12 LEU 164 HD12 LEU 164 -8.567 -8.693 1.549 1017 HD13 LEU 164 HD13 LEU 164 -7.402 -9.231 2.758 1018 HD21 LEU 164 HD21 LEU 164 -7.375 -5.180 1.517 1019 HD22 LEU 164 HD22 LEU 164 -8.531 -6.298 0.791 1020 HD23 LEU 164 HD23 LEU 164 -6.812 -6.438 0.419 1021 H GLU 165 HN GLU 165 -6.577 -6.047 6.459 1022 HA GLU 165 HA GLU 165 -4.170 -4.819 5.433 1023 HB2 GLU 165 HB2 GLU 165 -3.514 -4.672 7.595 1024 HB3 GLU 165 HB1 GLU 165 -5.189 -5.064 7.954 1025 HG2 GLU 165 HG2 GLU 165 -4.621 -7.408 8.207 1026 HG3 GLU 165 HG1 GLU 165 -2.951 -7.068 7.744 1027 H SER 166 HN SER 166 -2.126 -5.954 5.379 1028 HA SER 166 HA SER 166 -2.178 -8.838 5.441 1029 HB2 SER 166 HB2 SER 166 -1.519 -7.342 2.896 1030 HB3 SER 166 HB1 SER 166 -1.236 -9.065 3.158 1031 HG SER 166 HG SER 166 -3.787 -8.271 3.773 1032 H MET 167 HN MET 167 -0.614 -9.007 6.895 1033 HA MET 167 HA MET 167 1.793 -7.471 6.759 1034 HB2 MET 167 HB2 MET 167 2.585 -9.088 8.537 1035 HB3 MET 167 HB1 MET 167 1.158 -8.133 8.938 1036 HG2 MET 167 HG2 MET 167 -0.185 -10.176 8.146 1037 HG3 MET 167 HG1 MET 167 1.341 -11.050 8.258 1038 HE1 MET 167 HE1 MET 167 0.162 -8.084 10.555 1039 HE2 MET 167 HE2 MET 167 -0.670 -8.954 11.845 1040 HE3 MET 167 HE3 MET 167 -1.335 -8.949 10.211 1041 H VAL 168 HN VAL 168 3.746 -8.027 5.955 1042 HA VAL 168 HA VAL 168 4.152 -10.696 4.850 1043 HB VAL 168 HB VAL 168 5.036 -9.768 2.723 1044 HG11 VAL 168 HG11 VAL 168 2.784 -10.707 2.793 1045 HG12 VAL 168 HG12 VAL 168 2.875 -9.363 1.655 1046 HG13 VAL 168 HG13 VAL 168 2.130 -9.131 3.237 1047 HG21 VAL 168 HG21 VAL 168 4.532 -7.506 2.062 1048 HG22 VAL 168 HG22 VAL 168 5.433 -7.487 3.582 1049 HG23 VAL 168 HG23 VAL 168 3.691 -7.215 3.585 Start of MODEL 9 1 H1 MET 1 HT1 MET 1 -0.926 15.417 15.659 2 H2 MET 1 HT2 MET 1 -2.136 14.842 16.699 3 H3 MET 1 HT3 MET 1 -1.944 16.507 16.460 4 HA MET 1 HA MET 1 -2.690 14.602 14.324 5 HB2 MET 1 HB2 MET 1 -4.444 16.470 15.938 6 HB3 MET 1 HB1 MET 1 -4.966 15.551 14.535 7 HG2 MET 1 HG2 MET 1 -5.710 14.464 16.545 8 HG3 MET 1 HG1 MET 1 -4.500 13.462 15.750 9 HE1 MET 1 HE1 MET 1 -3.797 12.663 19.502 10 HE2 MET 1 HE2 MET 1 -4.232 12.026 17.915 11 HE3 MET 1 HE3 MET 1 -5.389 12.997 18.826 12 H SER 2 HN SER 2 -0.639 16.329 13.968 13 HA SER 2 HA SER 2 -1.508 18.920 13.098 14 HB2 SER 2 HB2 SER 2 1.138 17.586 12.515 15 HB3 SER 2 HB1 SER 2 0.792 19.314 12.585 16 HG SER 2 HG SER 2 0.754 19.248 14.741 17 H TYR 3 HN TYR 3 -2.698 19.108 11.298 18 HA TYR 3 HA TYR 3 -1.725 17.829 8.853 19 HB2 TYR 3 HB2 TYR 3 -4.513 17.535 9.958 20 HB3 TYR 3 HB1 TYR 3 -4.155 17.313 8.247 21 HD1 TYR 3 HD2 TYR 3 -2.428 15.534 7.622 22 HD2 TYR 3 HD1 TYR 3 -4.199 15.791 11.477 23 HE1 TYR 3 HE2 TYR 3 -1.816 13.197 8.053 24 HE2 TYR 3 HE1 TYR 3 -3.587 13.452 11.923 25 HH TYR 3 HH TYR 3 -1.404 11.731 10.025 26 H ILE 4 HN ILE 4 -2.901 18.698 6.902 27 HA ILE 4 HA ILE 4 -3.703 21.499 7.295 28 HB ILE 4 HB ILE 4 -2.057 20.494 4.961 29 HG12 ILE 4 HG12 ILE 4 -1.164 22.170 7.319 30 HG13 ILE 4 HG11 ILE 4 -0.754 20.477 7.070 31 HG21 ILE 4 HG21 ILE 4 -2.816 23.290 5.799 32 HG22 ILE 4 HG22 ILE 4 -3.516 22.387 4.455 33 HG23 ILE 4 HG23 ILE 4 -1.816 22.855 4.414 34 HD11 ILE 4 HD11 ILE 4 1.092 21.886 6.425 35 HD12 ILE 4 HD12 ILE 4 0.057 22.786 5.317 36 HD13 ILE 4 HD13 ILE 4 0.426 21.090 4.999 37 HA PRO 5 HA PRO 5 -7.094 19.357 5.197 38 HB2 PRO 5 HB2 PRO 5 -8.718 21.598 6.135 39 HB3 PRO 5 HB1 PRO 5 -8.823 19.887 6.559 40 HG2 PRO 5 HG2 PRO 5 -7.974 21.750 8.321 41 HG3 PRO 5 HG1 PRO 5 -7.342 20.092 8.316 42 HD2 PRO 5 HD2 PRO 5 -6.125 22.580 7.152 43 HD3 PRO 5 HD1 PRO 5 -5.361 21.298 8.124 44 H GLY 6 HN GLY 6 -7.286 19.560 3.063 45 HA2 GLY 6 HA2 GLY 6 -8.461 20.615 1.267 46 HA3 GLY 6 HA1 GLY 6 -8.125 22.180 2.017 47 H GLN 7 HN GLN 7 -5.250 20.994 2.401 48 HA GLN 7 HA GLN 7 -4.390 21.653 -0.323 49 HB2 GLN 7 HB2 GLN 7 -2.936 22.154 2.270 50 HB3 GLN 7 HB1 GLN 7 -2.360 22.573 0.669 51 HG2 GLN 7 HG2 GLN 7 -4.364 24.043 0.420 52 HG3 GLN 7 HG1 GLN 7 -4.727 23.722 2.113 53 HE21 GLN 7 HE21 GLN 7 -1.791 23.654 2.705 54 HE22 GLN 7 HE22 GLN 7 -1.320 25.322 2.751 55 HA PRO 8 HA PRO 8 -2.559 17.550 0.239 56 HB2 PRO 8 HB2 PRO 8 -3.563 16.426 -1.966 57 HB3 PRO 8 HB1 PRO 8 -4.560 16.683 -0.531 58 HG2 PRO 8 HG2 PRO 8 -4.606 18.092 -3.125 59 HG3 PRO 8 HG1 PRO 8 -5.883 17.934 -1.910 60 HD2 PRO 8 HD2 PRO 8 -4.055 20.134 -2.325 61 HD3 PRO 8 HD1 PRO 8 -5.399 20.016 -1.167 62 H VAL 9 HN VAL 9 -1.587 16.129 -1.709 63 HA VAL 9 HA VAL 9 0.054 17.826 -3.462 64 HB VAL 9 HB VAL 9 1.251 16.962 -1.334 65 HG11 VAL 9 HG11 VAL 9 2.124 14.690 -1.427 66 HG12 VAL 9 HG12 VAL 9 1.184 14.380 -2.888 67 HG13 VAL 9 HG13 VAL 9 0.360 14.696 -1.359 68 HG21 VAL 9 HG21 VAL 9 3.334 16.545 -2.553 69 HG22 VAL 9 HG22 VAL 9 2.444 17.911 -3.226 70 HG23 VAL 9 HG23 VAL 9 2.417 16.351 -4.048 71 H THR 10 HN THR 10 1.396 15.719 -4.701 72 HA THR 10 HA THR 10 -0.843 14.611 -6.191 73 HB THR 10 HB THR 10 0.722 14.530 -8.099 74 HG1 THR 10 HG1 THR 10 2.569 16.241 -7.052 75 HG21 THR 10 HG21 THR 10 0.335 17.153 -6.636 76 HG22 THR 10 HG22 THR 10 -0.699 16.446 -7.891 77 HG23 THR 10 HG23 THR 10 0.909 17.041 -8.307 78 H ALA 11 HN ALA 11 2.286 13.481 -6.694 79 HA ALA 11 HA ALA 11 2.333 11.272 -4.908 80 HB1 ALA 11 HB1 ALA 11 1.577 10.630 -7.756 81 HB2 ALA 11 HB2 ALA 11 0.570 10.370 -6.330 82 HB3 ALA 11 HB3 ALA 11 2.072 9.456 -6.535 83 H VAL 12 HN VAL 12 4.243 10.616 -4.679 84 HA VAL 12 HA VAL 12 6.251 11.128 -6.752 85 HB VAL 12 HB VAL 12 6.737 9.959 -4.067 86 HG11 VAL 12 HG11 VAL 12 8.578 9.856 -5.619 87 HG12 VAL 12 HG12 VAL 12 8.959 10.988 -4.320 88 HG13 VAL 12 HG13 VAL 12 8.467 11.595 -5.900 89 HG21 VAL 12 HG21 VAL 12 7.229 12.247 -3.205 90 HG22 VAL 12 HG22 VAL 12 5.522 11.928 -3.519 91 HG23 VAL 12 HG23 VAL 12 6.466 12.887 -4.663 92 H VAL 13 HN VAL 13 7.299 9.402 -7.661 93 HA VAL 13 HA VAL 13 6.284 6.725 -6.988 94 HB VAL 13 HB VAL 13 7.161 7.584 -9.746 95 HG11 VAL 13 HG11 VAL 13 6.155 5.470 -10.461 96 HG12 VAL 13 HG12 VAL 13 5.770 5.085 -8.784 97 HG13 VAL 13 HG13 VAL 13 7.454 5.209 -9.298 98 HG21 VAL 13 HG21 VAL 13 4.800 7.554 -10.372 99 HG22 VAL 13 HG22 VAL 13 5.110 8.758 -9.122 100 HG23 VAL 13 HG23 VAL 13 4.354 7.223 -8.696 101 H GLN 14 HN GLN 14 7.775 5.395 -6.274 102 HA GLN 14 HA GLN 14 10.488 5.501 -7.203 103 HB2 GLN 14 HB2 GLN 14 11.374 5.515 -4.884 104 HB3 GLN 14 HB1 GLN 14 10.652 7.035 -5.367 105 HG2 GLN 14 HG2 GLN 14 9.059 5.033 -3.837 106 HG3 GLN 14 HG1 GLN 14 10.218 6.066 -3.004 107 HE21 GLN 14 HE21 GLN 14 7.179 5.904 -4.629 108 HE22 GLN 14 HE22 GLN 14 6.692 7.544 -4.346 109 H ARG 15 HN ARG 15 11.712 3.731 -5.960 110 HA ARG 15 HA ARG 15 10.077 1.353 -5.939 111 HB2 ARG 15 HB2 ARG 15 12.800 1.936 -7.054 112 HB3 ARG 15 HB1 ARG 15 12.099 0.339 -6.932 113 HG2 ARG 15 HG2 ARG 15 10.237 1.076 -8.320 114 HG3 ARG 15 HG1 ARG 15 11.028 2.643 -8.515 115 HD2 ARG 15 HD2 ARG 15 12.438 0.091 -9.113 116 HD3 ARG 15 HD1 ARG 15 11.343 0.803 -10.298 117 HE ARG 15 HE ARG 15 12.775 2.825 -10.210 118 HH11 ARG 15 HH11 ARG 15 14.141 -0.188 -9.040 119 HH12 ARG 15 HH12 ARG 15 15.772 0.255 -9.449 120 HH21 ARG 15 HH21 ARG 15 14.907 3.391 -10.734 121 HH22 ARG 15 HH22 ARG 15 16.196 2.269 -10.437 122 H VAL 16 HN VAL 16 10.511 -0.081 -4.441 123 HA VAL 16 HA VAL 16 12.880 0.206 -2.832 124 HB VAL 16 HB VAL 16 11.440 1.548 -1.547 125 HG11 VAL 16 HG11 VAL 16 9.372 -0.620 -1.724 126 HG12 VAL 16 HG12 VAL 16 9.331 0.946 -2.547 127 HG13 VAL 16 HG13 VAL 16 9.228 0.865 -0.783 128 HG21 VAL 16 HG21 VAL 16 11.474 -1.191 -0.305 129 HG22 VAL 16 HG22 VAL 16 11.189 0.320 0.563 130 HG23 VAL 16 HG23 VAL 16 12.748 0.024 -0.208 131 H GLU 17 HN GLU 17 13.698 -1.750 -2.356 132 HA GLU 17 HA GLU 17 12.123 -4.079 -3.204 133 HB2 GLU 17 HB2 GLU 17 15.050 -4.197 -2.532 134 HB3 GLU 17 HB1 GLU 17 14.137 -5.167 -3.675 135 HG2 GLU 17 HG2 GLU 17 14.785 -2.260 -4.085 136 HG3 GLU 17 HG1 GLU 17 15.786 -3.583 -4.675 137 H ILE 18 HN ILE 18 11.124 -4.971 -1.482 138 HA ILE 18 HA ILE 18 12.261 -4.756 1.170 139 HB ILE 18 HB ILE 18 9.469 -5.439 0.236 140 HG12 ILE 18 HG12 ILE 18 8.950 -3.524 1.849 141 HG13 ILE 18 HG11 ILE 18 10.677 -3.175 1.809 142 HG21 ILE 18 HG21 ILE 18 10.044 -6.940 2.059 143 HG22 ILE 18 HG22 ILE 18 8.861 -5.743 2.585 144 HG23 ILE 18 HG23 ILE 18 10.557 -5.571 3.045 145 HD11 ILE 18 HD11 ILE 18 8.816 -3.217 -0.541 146 HD12 ILE 18 HD12 ILE 18 10.551 -2.917 -0.614 147 HD13 ILE 18 HD13 ILE 18 9.495 -1.789 0.242 148 H HIS 19 HN HIS 19 13.579 -6.272 1.571 149 HA HIS 19 HA HIS 19 13.405 -8.828 0.312 150 HB2 HIS 19 HB2 HIS 19 15.445 -7.533 0.295 151 HB3 HIS 19 HB1 HIS 19 15.477 -7.518 2.053 152 HD1 HIS 19 HD1 HIS 19 17.985 -8.579 1.106 153 HD2 HIS 19 HD2 HIS 19 14.594 -10.959 1.244 154 HE1 HIS 19 HE1 HIS 19 18.835 -10.950 1.115 155 HE2 HIS 19 HE2 HIS 19 16.759 -12.380 0.972 156 H LYS 20 HN LYS 20 11.790 -9.873 1.265 157 HA LYS 20 HA LYS 20 11.348 -10.056 4.083 158 HB2 LYS 20 HB2 LYS 20 9.457 -11.302 3.502 159 HB3 LYS 20 HB1 LYS 20 9.659 -10.206 2.150 160 HG2 LYS 20 HG2 LYS 20 10.695 -13.023 2.097 161 HG3 LYS 20 HG1 LYS 20 9.053 -12.601 1.615 162 HD2 LYS 20 HD2 LYS 20 9.986 -11.043 -0.058 163 HD3 LYS 20 HD1 LYS 20 11.608 -11.576 0.397 164 HE2 LYS 20 HE2 LYS 20 10.842 -12.744 -1.594 165 HE3 LYS 20 HE1 LYS 20 11.050 -13.859 -0.243 166 HZ1 LYS 20 HZ1 LYS 20 9.008 -14.291 -1.481 167 HZ2 LYS 20 HZ2 LYS 20 8.451 -12.723 -1.151 168 HZ3 LYS 20 HZ3 LYS 20 8.664 -13.826 0.114 169 H LEU 21 HN LEU 21 11.285 -12.226 5.229 170 HA LEU 21 HA LEU 21 13.330 -14.059 4.208 171 HB2 LEU 21 HB2 LEU 21 14.647 -12.636 5.552 172 HB3 LEU 21 HB1 LEU 21 13.438 -12.592 6.828 173 HG LEU 21 HG LEU 21 13.938 -14.875 7.456 174 HD11 LEU 21 HD11 LEU 21 15.825 -14.864 5.106 175 HD12 LEU 21 HD12 LEU 21 14.382 -15.867 5.317 176 HD13 LEU 21 HD13 LEU 21 15.785 -16.104 6.360 177 HD21 LEU 21 HD21 LEU 21 15.317 -13.185 8.472 178 HD22 LEU 21 HD22 LEU 21 16.410 -13.188 7.089 179 HD23 LEU 21 HD23 LEU 21 16.306 -14.605 8.134 180 H ARG 22 HN ARG 22 12.513 -16.010 4.246 181 HA ARG 22 HA ARG 22 10.472 -16.839 6.049 182 HB2 ARG 22 HB2 ARG 22 10.207 -18.420 4.524 183 HB3 ARG 22 HB1 ARG 22 11.552 -17.750 3.621 184 HG2 ARG 22 HG2 ARG 22 12.150 -19.963 3.841 185 HG3 ARG 22 HG1 ARG 22 12.975 -19.215 5.214 186 HD2 ARG 22 HD2 ARG 22 11.900 -21.224 5.940 187 HD3 ARG 22 HD1 ARG 22 11.123 -19.824 6.653 188 HE ARG 22 HE ARG 22 9.195 -20.316 5.508 189 HH11 ARG 22 HH11 ARG 22 11.803 -22.272 4.265 190 HH12 ARG 22 HH12 ARG 22 10.757 -23.419 3.487 191 HH21 ARG 22 HH21 ARG 22 7.801 -21.802 4.488 192 HH22 ARG 22 HH22 ARG 22 8.469 -23.118 3.573 193 H GLN 23 HN GLN 23 10.650 -17.801 7.925 194 HA GLN 23 HA GLN 23 13.243 -18.731 8.847 195 HB2 GLN 23 HB2 GLN 23 11.667 -17.693 11.018 196 HB3 GLN 23 HB1 GLN 23 13.309 -17.314 10.546 197 HG2 GLN 23 HG2 GLN 23 12.343 -15.793 8.797 198 HG3 GLN 23 HG1 GLN 23 10.788 -16.024 9.595 199 HE21 GLN 23 HE21 GLN 23 12.398 -13.618 9.241 200 HE22 GLN 23 HE22 GLN 23 12.667 -12.992 10.842 201 H GLY 24 HN GLY 24 11.963 -20.526 7.866 202 HA2 GLY 24 HA2 GLY 24 11.493 -22.718 8.418 203 HA3 GLY 24 HA1 GLY 24 11.316 -22.217 10.100 204 H GLU 25 HN GLU 25 9.389 -21.977 10.915 205 HA GLU 25 HA GLU 25 7.051 -22.516 9.339 206 HB2 GLU 25 HB2 GLU 25 7.718 -22.184 12.180 207 HB3 GLU 25 HB1 GLU 25 6.130 -21.571 11.732 208 HG2 GLU 25 HG2 GLU 25 5.564 -23.756 10.785 209 HG3 GLU 25 HG1 GLU 25 7.151 -24.359 11.255 210 H ASN 26 HN ASN 26 8.955 -19.888 9.577 211 HA ASN 26 HA ASN 26 6.751 -18.014 9.591 212 HB2 ASN 26 HB2 ASN 26 9.653 -17.665 10.237 213 HB3 ASN 26 HB1 ASN 26 8.552 -16.336 10.002 214 HD21 ASN 26 HD21 ASN 26 9.349 -19.035 11.875 215 HD22 ASN 26 HD22 ASN 26 8.497 -18.586 13.333 216 H LEU 27 HN LEU 27 6.436 -16.934 8.067 217 HA LEU 27 HA LEU 27 8.344 -16.506 5.890 218 HB2 LEU 27 HB2 LEU 27 5.399 -17.111 5.820 219 HB3 LEU 27 HB1 LEU 27 6.091 -16.084 4.596 220 HG LEU 27 HG LEU 27 5.895 -18.371 3.790 221 HD11 LEU 27 HD11 LEU 27 8.153 -18.716 3.019 222 HD12 LEU 27 HD12 LEU 27 8.782 -17.681 4.297 223 HD13 LEU 27 HD13 LEU 27 7.786 -16.990 3.013 224 HD21 LEU 27 HD21 LEU 27 7.219 -20.169 4.815 225 HD22 LEU 27 HD22 LEU 27 5.986 -19.535 5.907 226 HD23 LEU 27 HD23 LEU 27 7.676 -19.065 6.118 227 H ILE 28 HN ILE 28 9.006 -14.500 6.229 228 HA ILE 28 HA ILE 28 7.114 -12.533 7.331 229 HB ILE 28 HB ILE 28 10.066 -12.209 7.332 230 HG12 ILE 28 HG12 ILE 28 9.568 -14.468 8.266 231 HG13 ILE 28 HG11 ILE 28 10.351 -13.363 9.382 232 HG21 ILE 28 HG21 ILE 28 8.853 -10.319 7.938 233 HG22 ILE 28 HG22 ILE 28 9.542 -10.986 9.421 234 HG23 ILE 28 HG23 ILE 28 7.836 -11.237 9.048 235 HD11 ILE 28 HD11 ILE 28 7.410 -14.036 9.359 236 HD12 ILE 28 HD12 ILE 28 8.228 -12.992 10.522 237 HD13 ILE 28 HD13 ILE 28 8.612 -14.716 10.460 238 H LEU 29 HN LEU 29 6.460 -11.103 5.705 239 HA LEU 29 HA LEU 29 8.671 -9.904 4.170 240 HB2 LEU 29 HB2 LEU 29 5.681 -9.550 3.979 241 HB3 LEU 29 HB1 LEU 29 6.814 -8.498 3.147 242 HG LEU 29 HG LEU 29 7.762 -10.700 2.192 243 HD11 LEU 29 HD11 LEU 29 6.140 -12.477 1.898 244 HD12 LEU 29 HD12 LEU 29 4.991 -11.600 2.910 245 HD13 LEU 29 HD13 LEU 29 6.495 -12.204 3.606 246 HD21 LEU 29 HD21 LEU 29 6.243 -10.565 0.295 247 HD22 LEU 29 HD22 LEU 29 6.670 -8.956 0.875 248 HD23 LEU 29 HD23 LEU 29 5.095 -9.647 1.269 249 H GLY 30 HN GLY 30 6.383 -9.433 6.707 250 HA2 GLY 30 HA2 GLY 30 7.027 -8.516 8.741 251 HA3 GLY 30 HA1 GLY 30 8.468 -7.871 7.983 252 H PHE 31 HN PHE 31 5.205 -7.218 6.809 253 HA PHE 31 HA PHE 31 4.838 -5.021 8.576 254 HB2 PHE 31 HB2 PHE 31 4.762 -3.212 6.918 255 HB3 PHE 31 HB1 PHE 31 6.370 -3.903 7.073 256 HD1 PHE 31 HD2 PHE 31 7.105 -5.574 5.333 257 HD2 PHE 31 HD1 PHE 31 3.728 -3.058 4.890 258 HE1 PHE 31 HE2 PHE 31 7.190 -5.903 2.920 259 HE2 PHE 31 HE1 PHE 31 3.794 -3.367 2.476 260 HZ PHE 31 HZ PHE 31 5.533 -4.802 1.455 261 H SER 32 HN SER 32 2.846 -3.598 7.568 262 HA SER 32 HA SER 32 0.905 -5.703 6.837 263 HB2 SER 32 HB2 SER 32 0.658 -5.053 9.228 264 HB3 SER 32 HB1 SER 32 0.355 -3.389 8.720 265 HG SER 32 HG SER 32 -1.661 -4.132 8.762 266 H ILE 33 HN ILE 33 -0.854 -5.035 5.541 267 HA ILE 33 HA ILE 33 -0.365 -2.523 4.112 268 HB ILE 33 HB ILE 33 -0.658 -3.659 1.958 269 HG12 ILE 33 HG12 ILE 33 -0.418 -6.240 3.518 270 HG13 ILE 33 HG11 ILE 33 -1.929 -5.612 2.879 271 HG21 ILE 33 HG21 ILE 33 1.542 -4.842 1.925 272 HG22 ILE 33 HG22 ILE 33 1.597 -4.642 3.682 273 HG23 ILE 33 HG23 ILE 33 1.573 -3.226 2.631 274 HD11 ILE 33 HD11 ILE 33 -1.001 -5.759 0.600 275 HD12 ILE 33 HD12 ILE 33 -1.081 -7.320 1.422 276 HD13 ILE 33 HD13 ILE 33 0.463 -6.479 1.278 277 H GLY 34 HN GLY 34 -2.166 -1.637 3.144 278 HA2 GLY 34 HA2 GLY 34 -4.690 -2.763 4.146 279 HA3 GLY 34 HA1 GLY 34 -4.453 -1.099 3.593 280 H GLY 35 HN GLY 35 -6.353 -3.332 2.844 281 HA2 GLY 35 HA2 GLY 35 -5.870 -3.169 -0.073 282 HA3 GLY 35 HA1 GLY 35 -6.485 -4.637 0.690 283 H GLY 36 HN GLY 36 -7.396 -2.113 -1.127 284 HA2 GLY 36 HA2 GLY 36 -10.163 -2.284 -0.222 285 HA3 GLY 36 HA1 GLY 36 -9.407 -0.698 -0.143 286 H ILE 37 HN ILE 37 -9.658 -3.364 -2.513 287 HA ILE 37 HA ILE 37 -10.310 -1.320 -4.500 288 HB ILE 37 HB ILE 37 -9.404 -3.010 -6.199 289 HG12 ILE 37 HG12 ILE 37 -9.136 -4.793 -4.339 290 HG13 ILE 37 HG11 ILE 37 -7.867 -4.628 -5.542 291 HG21 ILE 37 HG21 ILE 37 -7.600 -1.528 -4.337 292 HG22 ILE 37 HG22 ILE 37 -8.414 -0.881 -5.760 293 HG23 ILE 37 HG23 ILE 37 -7.149 -2.099 -5.943 294 HD11 ILE 37 HD11 ILE 37 -7.806 -3.477 -2.768 295 HD12 ILE 37 HD12 ILE 37 -6.527 -3.348 -3.975 296 HD13 ILE 37 HD13 ILE 37 -6.958 -4.925 -3.314 297 H ASP 38 HN ASP 38 -10.684 -4.807 -3.949 298 HA ASP 38 HA ASP 38 -13.414 -4.547 -4.990 299 HB2 ASP 38 HB2 ASP 38 -11.241 -5.910 -6.300 300 HB3 ASP 38 HB1 ASP 38 -12.470 -7.080 -5.822 301 H GLN 39 HN GLN 39 -11.990 -4.835 -2.404 302 HA GLN 39 HA GLN 39 -12.214 -7.443 -1.406 303 HB2 GLN 39 HB2 GLN 39 -12.698 -5.049 0.324 304 HB3 GLN 39 HB1 GLN 39 -11.937 -6.578 0.752 305 HG2 GLN 39 HG2 GLN 39 -10.848 -4.450 -1.033 306 HG3 GLN 39 HG1 GLN 39 -10.285 -4.852 0.579 307 HE21 GLN 39 HE21 GLN 39 -8.704 -4.799 -1.789 308 HE22 GLN 39 HE22 GLN 39 -8.123 -6.397 -2.066 309 H ASP 40 HN ASP 40 -14.373 -4.902 -0.262 310 HA ASP 40 HA ASP 40 -16.647 -6.621 -0.863 311 HB2 ASP 40 HB2 ASP 40 -15.575 -6.988 1.538 312 HB3 ASP 40 HB1 ASP 40 -16.529 -5.556 1.921 313 HA PRO 41 HA PRO 41 -17.986 -2.492 -2.054 314 HB2 PRO 41 HB2 PRO 41 -20.504 -3.209 -2.775 315 HB3 PRO 41 HB1 PRO 41 -19.093 -3.570 -3.782 316 HG2 PRO 41 HG2 PRO 41 -20.443 -5.339 -1.751 317 HG3 PRO 41 HG1 PRO 41 -20.047 -5.706 -3.431 318 HD2 PRO 41 HD2 PRO 41 -18.448 -6.545 -1.526 319 HD3 PRO 41 HD1 PRO 41 -17.748 -5.826 -2.992 320 H SER 42 HN SER 42 -19.095 -4.490 0.333 321 HA SER 42 HA SER 42 -21.257 -3.422 1.583 322 HB2 SER 42 HB2 SER 42 -19.934 -5.425 2.278 323 HB3 SER 42 HB1 SER 42 -18.696 -4.343 2.923 324 HG SER 42 HG SER 42 -20.934 -5.212 4.097 325 H GLN 43 HN GLN 43 -17.855 -2.351 1.960 326 HA GLN 43 HA GLN 43 -18.869 -0.549 4.025 327 HB2 GLN 43 HB2 GLN 43 -16.167 -0.475 4.253 328 HB3 GLN 43 HB1 GLN 43 -17.248 -1.548 5.134 329 HG2 GLN 43 HG2 GLN 43 -15.633 -2.945 4.320 330 HG3 GLN 43 HG1 GLN 43 -16.953 -3.158 3.191 331 HE21 GLN 43 HE21 GLN 43 -14.276 -3.769 2.693 332 HE22 GLN 43 HE22 GLN 43 -13.702 -2.728 1.443 333 H ASN 44 HN ASN 44 -17.486 -0.512 0.888 334 HA ASN 44 HA ASN 44 -17.694 2.375 0.805 335 HB2 ASN 44 HB2 ASN 44 -15.351 1.507 1.742 336 HB3 ASN 44 HB1 ASN 44 -15.021 1.354 0.009 337 HD21 ASN 44 HD21 ASN 44 -13.836 3.180 1.941 338 HD22 ASN 44 HD22 ASN 44 -14.145 4.777 1.353 339 HA PRO 45 HA PRO 45 -18.669 0.720 -3.266 340 HB2 PRO 45 HB2 PRO 45 -20.220 2.773 -4.041 341 HB3 PRO 45 HB1 PRO 45 -20.783 1.558 -2.881 342 HG2 PRO 45 HG2 PRO 45 -19.702 4.307 -2.361 343 HG3 PRO 45 HG1 PRO 45 -21.118 3.512 -1.646 344 HD2 PRO 45 HD2 PRO 45 -18.697 3.652 -0.401 345 HD3 PRO 45 HD1 PRO 45 -19.842 2.322 -0.152 346 H PHE 46 HN PHE 46 -16.889 3.537 -2.397 347 HA PHE 46 HA PHE 46 -16.002 3.851 -5.184 348 HB2 PHE 46 HB2 PHE 46 -17.894 5.466 -4.448 349 HB3 PHE 46 HB1 PHE 46 -16.622 6.282 -3.536 350 HD1 PHE 46 HD1 PHE 46 -17.562 5.184 -6.956 351 HD2 PHE 46 HD2 PHE 46 -15.230 7.829 -4.574 352 HE1 PHE 46 HE1 PHE 46 -16.935 6.449 -8.974 353 HE2 PHE 46 HE2 PHE 46 -14.605 9.099 -6.585 354 HZ PHE 46 HZ PHE 46 -15.457 8.408 -8.790 355 H SER 47 HN SER 47 -15.274 3.967 -1.847 356 HA SER 47 HA SER 47 -13.635 4.540 -0.536 357 HB2 SER 47 HB2 SER 47 -11.388 4.066 -1.188 358 HB3 SER 47 HB1 SER 47 -12.434 2.786 -1.756 359 HG SER 47 HG SER 47 -10.723 3.670 -3.210 360 H GLU 48 HN GLU 48 -11.957 5.854 -3.292 361 HA GLU 48 HA GLU 48 -11.405 7.969 -3.867 362 HB2 GLU 48 HB2 GLU 48 -13.799 8.169 -4.168 363 HB3 GLU 48 HB1 GLU 48 -14.030 8.502 -2.456 364 HG2 GLU 48 HG2 GLU 48 -12.725 10.594 -2.766 365 HG3 GLU 48 HG1 GLU 48 -12.641 10.231 -4.489 366 H ASP 49 HN ASP 49 -10.887 6.812 -1.015 367 HA ASP 49 HA ASP 49 -10.498 9.095 0.643 368 HB2 ASP 49 HB2 ASP 49 -9.619 6.231 0.785 369 HB3 ASP 49 HB1 ASP 49 -8.928 7.418 1.885 370 H LYS 50 HN LYS 50 -9.551 10.312 -1.100 371 HA LYS 50 HA LYS 50 -7.853 11.448 -2.035 372 HB2 LYS 50 HB2 LYS 50 -6.167 10.328 0.173 373 HB3 LYS 50 HB1 LYS 50 -5.871 11.794 -0.750 374 HG2 LYS 50 HG2 LYS 50 -7.940 11.291 1.366 375 HG3 LYS 50 HG1 LYS 50 -6.715 12.561 1.293 376 HD2 LYS 50 HD2 LYS 50 -7.874 13.644 -0.524 377 HD3 LYS 50 HD1 LYS 50 -9.042 12.322 -0.611 378 HE2 LYS 50 HE2 LYS 50 -9.644 12.885 1.786 379 HE3 LYS 50 HE1 LYS 50 -8.686 14.353 1.581 380 HZ1 LYS 50 HZ1 LYS 50 -11.119 13.571 0.063 381 HZ2 LYS 50 HZ2 LYS 50 -10.135 14.884 -0.353 382 HZ3 LYS 50 HZ3 LYS 50 -10.946 14.876 1.134 383 H THR 51 HN THR 51 -8.122 9.785 -3.690 384 HA THR 51 HA THR 51 -7.307 8.463 -5.283 385 HB THR 51 HB THR 51 -5.844 10.490 -5.571 386 HG1 THR 51 HG1 THR 51 -5.345 9.391 -7.284 387 HG21 THR 51 HG21 THR 51 -4.415 10.305 -3.603 388 HG22 THR 51 HG22 THR 51 -3.448 10.275 -5.077 389 HG23 THR 51 HG23 THR 51 -3.761 8.777 -4.202 390 H ASP 52 HN ASP 52 -7.604 7.385 -2.779 391 HA ASP 52 HA ASP 52 -5.905 5.823 -1.520 392 HB2 ASP 52 HB2 ASP 52 -8.418 5.806 -1.366 393 HB3 ASP 52 HB1 ASP 52 -8.413 4.651 -2.707 394 H LYS 53 HN LYS 53 -7.395 4.669 -4.518 395 HA LYS 53 HA LYS 53 -6.624 3.409 -6.238 396 HB2 LYS 53 HB2 LYS 53 -4.441 4.565 -5.954 397 HB3 LYS 53 HB1 LYS 53 -3.967 3.325 -4.803 398 HG2 LYS 53 HG2 LYS 53 -3.019 2.963 -7.028 399 HG3 LYS 53 HG1 LYS 53 -4.068 1.638 -6.520 400 HD2 LYS 53 HD2 LYS 53 -5.882 2.549 -7.865 401 HD3 LYS 53 HD1 LYS 53 -4.846 3.891 -8.363 402 HE2 LYS 53 HE2 LYS 53 -3.272 2.274 -9.356 403 HE3 LYS 53 HE1 LYS 53 -4.368 0.967 -8.913 404 HZ1 LYS 53 HZ1 LYS 53 -4.619 1.605 -11.222 405 HZ2 LYS 53 HZ2 LYS 53 -4.993 3.195 -10.770 406 HZ3 LYS 53 HZ3 LYS 53 -6.043 1.929 -10.361 407 H GLY 54 HN GLY 54 -6.017 2.446 -2.952 408 HA2 GLY 54 HA2 GLY 54 -7.370 0.730 -2.050 409 HA3 GLY 54 HA1 GLY 54 -7.422 -0.020 -3.644 410 H ILE 55 HN ILE 55 -4.286 0.611 -3.410 411 HA ILE 55 HA ILE 55 -3.647 -1.625 -1.611 412 HB ILE 55 HB ILE 55 -2.317 -1.112 -4.282 413 HG12 ILE 55 HG12 ILE 55 -4.574 -2.228 -4.367 414 HG13 ILE 55 HG11 ILE 55 -3.255 -3.185 -5.032 415 HG21 ILE 55 HG21 ILE 55 -0.682 -1.855 -2.699 416 HG22 ILE 55 HG22 ILE 55 -1.066 -3.208 -3.765 417 HG23 ILE 55 HG23 ILE 55 -1.737 -3.152 -2.135 418 HD11 ILE 55 HD11 ILE 55 -3.145 -4.458 -2.927 419 HD12 ILE 55 HD12 ILE 55 -4.727 -4.578 -3.702 420 HD13 ILE 55 HD13 ILE 55 -4.504 -3.518 -2.311 421 H TYR 56 HN TYR 56 -2.613 -0.703 0.048 422 HA TYR 56 HA TYR 56 -0.245 0.861 -0.502 423 HB2 TYR 56 HB2 TYR 56 -0.895 2.841 0.693 424 HB3 TYR 56 HB1 TYR 56 -2.108 2.536 -0.542 425 HD1 TYR 56 HD1 TYR 56 -4.332 1.712 0.080 426 HD2 TYR 56 HD2 TYR 56 -1.456 2.761 3.032 427 HE1 TYR 56 HE1 TYR 56 -6.111 1.793 1.772 428 HE2 TYR 56 HE2 TYR 56 -3.232 2.841 4.737 429 HH TYR 56 HH TYR 56 -5.536 2.976 5.017 430 H VAL 57 HN VAL 57 1.127 1.120 1.377 431 HA VAL 57 HA VAL 57 0.784 -0.896 3.344 432 HB VAL 57 HB VAL 57 2.932 0.169 2.297 433 HG11 VAL 57 HG11 VAL 57 2.243 2.086 4.374 434 HG12 VAL 57 HG12 VAL 57 3.231 2.273 2.921 435 HG13 VAL 57 HG13 VAL 57 3.912 1.524 4.361 436 HG21 VAL 57 HG21 VAL 57 2.834 -0.628 5.164 437 HG22 VAL 57 HG22 VAL 57 4.212 -0.767 4.069 438 HG23 VAL 57 HG23 VAL 57 2.767 -1.741 3.798 439 H THR 58 HN THR 58 -0.001 -0.715 5.295 440 HA THR 58 HA THR 58 -0.872 1.939 6.175 441 HB THR 58 HB THR 58 -2.667 0.258 5.940 442 HG1 THR 58 HG1 THR 58 -3.640 0.838 7.792 443 HG21 THR 58 HG21 THR 58 -1.345 -1.745 6.430 444 HG22 THR 58 HG22 THR 58 -2.788 -1.656 7.439 445 HG23 THR 58 HG23 THR 58 -1.211 -1.248 8.118 446 H ARG 59 HN ARG 59 1.383 -0.562 6.794 447 HA ARG 59 HA ARG 59 2.727 0.942 8.710 448 HB2 ARG 59 HB2 ARG 59 2.522 -0.869 10.512 449 HB3 ARG 59 HB1 ARG 59 1.342 0.426 10.455 450 HG2 ARG 59 HG2 ARG 59 -0.170 -1.127 9.260 451 HG3 ARG 59 HG1 ARG 59 1.054 -2.388 9.471 452 HD2 ARG 59 HD2 ARG 59 0.772 -2.461 11.768 453 HD3 ARG 59 HD1 ARG 59 0.048 -0.857 11.828 454 HE ARG 59 HE ARG 59 -1.707 -2.390 10.362 455 HH11 ARG 59 HH11 ARG 59 -0.320 -2.574 13.581 456 HH12 ARG 59 HH12 ARG 59 -1.723 -3.330 14.271 457 HH21 ARG 59 HH21 ARG 59 -3.547 -3.337 11.262 458 HH22 ARG 59 HH22 ARG 59 -3.571 -3.755 12.956 459 H VAL 60 HN VAL 60 4.303 -0.576 9.976 460 HA VAL 60 HA VAL 60 5.508 -2.445 8.108 461 HB VAL 60 HB VAL 60 6.900 -0.066 9.370 462 HG11 VAL 60 HG11 VAL 60 8.900 -0.833 8.208 463 HG12 VAL 60 HG12 VAL 60 8.002 -2.215 7.579 464 HG13 VAL 60 HG13 VAL 60 8.287 -2.066 9.310 465 HG21 VAL 60 HG21 VAL 60 7.269 0.702 7.088 466 HG22 VAL 60 HG22 VAL 60 5.547 0.555 7.437 467 HG23 VAL 60 HG23 VAL 60 6.359 -0.679 6.475 468 H SER 61 HN SER 61 6.718 -4.053 9.217 469 HA SER 61 HA SER 61 6.600 -3.940 12.121 470 HB2 SER 61 HB2 SER 61 6.419 -6.136 10.934 471 HB3 SER 61 HB1 SER 61 8.104 -5.947 10.461 472 HG SER 61 HG SER 61 7.088 -6.826 12.793 473 H GLU 62 HN GLU 62 8.090 -3.200 13.298 474 HA GLU 62 HA GLU 62 9.897 -1.410 12.173 475 HB2 GLU 62 HB2 GLU 62 9.260 -2.212 14.958 476 HB3 GLU 62 HB1 GLU 62 10.467 -1.033 14.580 477 HG2 GLU 62 HG2 GLU 62 8.948 0.471 13.702 478 HG3 GLU 62 HG1 GLU 62 7.709 -0.769 13.525 479 H GLY 63 HN GLY 63 11.835 -1.381 12.037 480 HA2 GLY 63 HA2 GLY 63 14.055 -2.013 11.873 481 HA3 GLY 63 HA1 GLY 63 13.805 -2.899 13.378 482 H GLY 64 HN GLY 64 12.035 -3.458 10.382 483 HA2 GLY 64 HA2 GLY 64 13.036 -6.214 10.521 484 HA3 GLY 64 HA1 GLY 64 11.487 -5.708 9.845 485 HA PRO 65 HA PRO 65 13.948 -5.956 6.113 486 HB2 PRO 65 HB2 PRO 65 11.731 -6.702 4.674 487 HB3 PRO 65 HB1 PRO 65 12.851 -7.797 5.464 488 HG2 PRO 65 HG2 PRO 65 10.134 -7.424 6.109 489 HG3 PRO 65 HG1 PRO 65 11.328 -8.332 7.049 490 HD2 PRO 65 HD2 PRO 65 10.332 -5.547 7.438 491 HD3 PRO 65 HD1 PRO 65 10.896 -6.744 8.633 492 H ALA 66 HN ALA 66 10.857 -4.319 6.445 493 HA ALA 66 HA ALA 66 10.804 -3.526 3.660 494 HB1 ALA 66 HB1 ALA 66 9.008 -2.891 6.004 495 HB2 ALA 66 HB2 ALA 66 8.669 -3.942 4.627 496 HB3 ALA 66 HB3 ALA 66 8.780 -2.192 4.398 497 H GLU 67 HN GLU 67 11.475 -2.124 6.773 498 HA GLU 67 HA GLU 67 11.253 0.540 5.744 499 HB2 GLU 67 HB2 GLU 67 12.148 1.020 8.100 500 HB3 GLU 67 HB1 GLU 67 10.552 0.280 7.954 501 HG2 GLU 67 HG2 GLU 67 11.222 -1.665 8.835 502 HG3 GLU 67 HG1 GLU 67 12.775 -1.580 8.022 503 H ILE 68 HN ILE 68 13.686 -1.895 6.250 504 HA ILE 68 HA ILE 68 15.852 -0.043 6.191 505 HB ILE 68 HB ILE 68 17.192 -2.034 5.913 506 HG12 ILE 68 HG12 ILE 68 14.685 -3.580 6.384 507 HG13 ILE 68 HG11 ILE 68 15.419 -3.376 4.796 508 HG21 ILE 68 HG21 ILE 68 16.802 -2.881 8.201 509 HG22 ILE 68 HG22 ILE 68 15.282 -1.982 8.203 510 HG23 ILE 68 HG23 ILE 68 16.817 -1.120 8.092 511 HD11 ILE 68 HD11 ILE 68 17.445 -4.436 5.610 512 HD12 ILE 68 HD12 ILE 68 16.036 -5.494 5.745 513 HD13 ILE 68 HD13 ILE 68 16.678 -4.680 7.176 514 H ALA 69 HN ALA 69 13.948 -1.942 4.174 515 HA ALA 69 HA ALA 69 15.416 -1.714 1.783 516 HB1 ALA 69 HB1 ALA 69 12.433 -1.946 2.188 517 HB2 ALA 69 HB2 ALA 69 13.557 -3.286 1.959 518 HB3 ALA 69 HB3 ALA 69 13.263 -2.140 0.646 519 H GLY 70 HN GLY 70 13.511 0.349 3.711 520 HA2 GLY 70 HA2 GLY 70 13.744 2.769 3.454 521 HA3 GLY 70 HA1 GLY 70 13.780 2.527 1.703 522 H LEU 71 HN LEU 71 11.613 1.154 4.131 523 HA LEU 71 HA LEU 71 9.336 2.293 2.675 524 HB2 LEU 71 HB2 LEU 71 9.878 -0.180 2.378 525 HB3 LEU 71 HB1 LEU 71 9.533 -0.374 4.083 526 HG LEU 71 HG LEU 71 7.784 -1.046 2.391 527 HD11 LEU 71 HD11 LEU 71 7.341 -1.013 4.715 528 HD12 LEU 71 HD12 LEU 71 5.959 -0.297 3.882 529 HD13 LEU 71 HD13 LEU 71 7.138 0.736 4.699 530 HD21 LEU 71 HD21 LEU 71 6.234 0.730 1.689 531 HD22 LEU 71 HD22 LEU 71 7.836 0.916 0.974 532 HD23 LEU 71 HD23 LEU 71 7.352 1.932 2.331 533 H GLN 72 HN GLN 72 7.466 2.458 4.112 534 HA GLN 72 HA GLN 72 7.787 2.685 6.852 535 HB2 GLN 72 HB2 GLN 72 7.743 5.204 6.998 536 HB3 GLN 72 HB1 GLN 72 9.240 4.458 6.514 537 HG2 GLN 72 HG2 GLN 72 8.881 6.485 5.295 538 HG3 GLN 72 HG1 GLN 72 8.892 5.090 4.221 539 HE21 GLN 72 HE21 GLN 72 7.088 4.522 3.170 540 HE22 GLN 72 HE22 GLN 72 5.656 5.468 3.170 541 H ILE 73 HN ILE 73 5.932 4.589 7.482 542 HA ILE 73 HA ILE 73 3.689 2.956 6.829 543 HB ILE 73 HB ILE 73 3.577 5.402 8.546 544 HG12 ILE 73 HG12 ILE 73 5.603 4.406 9.340 545 HG13 ILE 73 HG11 ILE 73 4.336 3.925 10.463 546 HG21 ILE 73 HG21 ILE 73 1.552 4.210 8.184 547 HG22 ILE 73 HG22 ILE 73 2.079 3.964 9.848 548 HG23 ILE 73 HG23 ILE 73 2.315 2.694 8.648 549 HD11 ILE 73 HD11 ILE 73 5.520 2.235 8.259 550 HD12 ILE 73 HD12 ILE 73 4.213 1.737 9.349 551 HD13 ILE 73 HD13 ILE 73 5.820 2.075 9.996 552 H GLY 74 HN GLY 74 2.694 3.383 4.909 553 HA2 GLY 74 HA2 GLY 74 0.508 4.420 4.546 554 HA3 GLY 74 HA1 GLY 74 1.215 5.949 5.048 555 H ASP 75 HN ASP 75 1.897 3.433 2.575 556 HA ASP 75 HA ASP 75 1.911 5.567 0.577 557 HB2 ASP 75 HB2 ASP 75 3.963 4.580 -0.395 558 HB3 ASP 75 HB1 ASP 75 4.197 5.398 1.142 559 H LYS 76 HN LYS 76 1.611 4.809 -1.578 560 HA LYS 76 HA LYS 76 -0.111 2.461 -1.487 561 HB2 LYS 76 HB2 LYS 76 0.127 4.522 -3.677 562 HB3 LYS 76 HB1 LYS 76 -1.137 3.313 -3.492 563 HG2 LYS 76 HG2 LYS 76 -2.292 4.572 -2.055 564 HG3 LYS 76 HG1 LYS 76 -0.837 5.073 -1.180 565 HD2 LYS 76 HD2 LYS 76 -0.322 6.668 -2.959 566 HD3 LYS 76 HD1 LYS 76 -1.786 6.179 -3.823 567 HE2 LYS 76 HE2 LYS 76 -1.716 7.397 -1.059 568 HE3 LYS 76 HE1 LYS 76 -2.099 8.264 -2.545 569 HZ1 LYS 76 HZ1 LYS 76 -3.975 6.669 -2.843 570 HZ2 LYS 76 HZ2 LYS 76 -4.127 7.682 -1.497 571 HZ3 LYS 76 HZ3 LYS 76 -3.659 6.067 -1.288 572 H ILE 77 HN ILE 77 0.897 0.697 -1.898 573 HA ILE 77 HA ILE 77 3.103 0.438 -3.695 574 HB ILE 77 HB ILE 77 1.380 -1.739 -2.500 575 HG12 ILE 77 HG12 ILE 77 3.973 -0.645 -1.411 576 HG13 ILE 77 HG11 ILE 77 2.389 -0.135 -0.833 577 HG21 ILE 77 HG21 ILE 77 4.179 -1.781 -3.621 578 HG22 ILE 77 HG22 ILE 77 2.747 -2.522 -4.340 579 HG23 ILE 77 HG23 ILE 77 3.386 -3.132 -2.813 580 HD11 ILE 77 HD11 ILE 77 3.357 -1.799 0.633 581 HD12 ILE 77 HD12 ILE 77 3.504 -2.928 -0.713 582 HD13 ILE 77 HD13 ILE 77 1.908 -2.427 -0.150 583 H MET 78 HN MET 78 2.743 0.655 -5.825 584 HA MET 78 HA MET 78 0.116 0.067 -6.905 585 HB2 MET 78 HB2 MET 78 2.557 1.146 -8.297 586 HB3 MET 78 HB1 MET 78 0.918 1.128 -8.931 587 HG2 MET 78 HG2 MET 78 1.722 2.580 -6.436 588 HG3 MET 78 HG1 MET 78 1.713 3.324 -8.031 589 HE1 MET 78 HE1 MET 78 -0.235 2.158 -4.971 590 HE2 MET 78 HE2 MET 78 -1.019 0.962 -6.006 591 HE3 MET 78 HE3 MET 78 -1.934 2.337 -5.406 592 H GLN 79 HN GLN 79 3.349 -1.237 -7.078 593 HA GLN 79 HA GLN 79 2.295 -3.671 -8.215 594 HB2 GLN 79 HB2 GLN 79 4.619 -3.295 -9.656 595 HB3 GLN 79 HB1 GLN 79 2.974 -3.363 -10.266 596 HG2 GLN 79 HG2 GLN 79 3.048 -0.812 -9.600 597 HG3 GLN 79 HG1 GLN 79 4.772 -1.115 -9.852 598 HE21 GLN 79 HE21 GLN 79 5.482 -1.870 -11.806 599 HE22 GLN 79 HE22 GLN 79 4.617 -1.560 -13.285 600 H VAL 80 HN VAL 80 3.709 -5.307 -8.411 601 HA VAL 80 HA VAL 80 5.790 -5.217 -6.332 602 HB VAL 80 HB VAL 80 3.880 -6.374 -5.478 603 HG11 VAL 80 HG11 VAL 80 4.000 -8.216 -7.858 604 HG12 VAL 80 HG12 VAL 80 2.849 -6.895 -7.665 605 HG13 VAL 80 HG13 VAL 80 2.828 -8.252 -6.538 606 HG21 VAL 80 HG21 VAL 80 6.033 -8.314 -6.346 607 HG22 VAL 80 HG22 VAL 80 4.847 -8.624 -5.071 608 HG23 VAL 80 HG23 VAL 80 6.033 -7.331 -4.880 609 H ASN 81 HN ASN 81 7.727 -5.677 -7.085 610 HA ASN 81 HA ASN 81 9.428 -6.493 -8.321 611 HB2 ASN 81 HB2 ASN 81 7.389 -8.673 -8.765 612 HB3 ASN 81 HB1 ASN 81 9.040 -8.775 -9.359 613 HD21 ASN 81 HD21 ASN 81 7.325 -10.082 -7.182 614 HD22 ASN 81 HD22 ASN 81 8.395 -10.130 -5.813 615 H GLY 82 HN GLY 82 6.740 -5.237 -9.650 616 HA2 GLY 82 HA2 GLY 82 7.443 -3.783 -11.584 617 HA3 GLY 82 HA1 GLY 82 7.944 -5.282 -12.356 618 H TRP 83 HN TRP 83 5.139 -6.112 -10.759 619 HA TRP 83 HA TRP 83 3.543 -5.278 -13.048 620 HB2 TRP 83 HB2 TRP 83 2.263 -7.465 -12.311 621 HB3 TRP 83 HB1 TRP 83 3.575 -7.488 -13.480 622 HD1 TRP 83 HD1 TRP 83 3.072 -7.861 -9.718 623 HE1 TRP 83 HE1 TRP 83 4.651 -9.693 -8.897 624 HE3 TRP 83 HE3 TRP 83 5.428 -9.015 -14.096 625 HZ2 TRP 83 HZ2 TRP 83 6.567 -11.424 -9.888 626 HZ3 TRP 83 HZ3 TRP 83 7.134 -10.792 -14.066 627 HH2 TRP 83 HH2 TRP 83 7.680 -11.964 -11.976 628 H ASP 84 HN ASP 84 2.312 -3.791 -12.401 629 HA ASP 84 HA ASP 84 1.144 -2.803 -10.359 630 HB2 ASP 84 HB2 ASP 84 0.490 -2.387 -12.733 631 HB3 ASP 84 HB1 ASP 84 -0.575 -3.785 -12.649 632 H MET 85 HN MET 85 0.428 -3.527 -8.502 633 HA MET 85 HA MET 85 -0.838 -6.127 -8.208 634 HB2 MET 85 HB2 MET 85 -0.620 -4.051 -6.045 635 HB3 MET 85 HB1 MET 85 -0.672 -5.799 -5.885 636 HG2 MET 85 HG2 MET 85 1.557 -5.892 -6.963 637 HG3 MET 85 HG1 MET 85 1.596 -4.139 -6.913 638 HE1 MET 85 HE1 MET 85 1.399 -6.759 -3.124 639 HE2 MET 85 HE2 MET 85 1.411 -7.416 -4.761 640 HE3 MET 85 HE3 MET 85 0.020 -6.488 -4.190 641 H THR 86 HN THR 86 -1.898 -2.901 -8.693 642 HA THR 86 HA THR 86 -4.199 -3.056 -6.987 643 HB THR 86 HB THR 86 -4.800 -0.854 -7.936 644 HG1 THR 86 HG1 THR 86 -2.997 -1.650 -9.852 645 HG21 THR 86 HG21 THR 86 -1.910 -1.147 -7.127 646 HG22 THR 86 HG22 THR 86 -3.283 -0.996 -6.029 647 HG23 THR 86 HG23 THR 86 -2.841 0.348 -7.082 648 H MET 87 HN MET 87 -3.561 -3.828 -10.282 649 HA MET 87 HA MET 87 -6.380 -3.900 -10.984 650 HB2 MET 87 HB2 MET 87 -3.927 -4.765 -12.519 651 HB3 MET 87 HB1 MET 87 -5.563 -4.811 -13.155 652 HG2 MET 87 HG2 MET 87 -4.029 -2.362 -12.312 653 HG3 MET 87 HG1 MET 87 -4.416 -2.855 -13.958 654 HE1 MET 87 HE1 MET 87 -7.386 -3.883 -13.684 655 HE2 MET 87 HE2 MET 87 -6.892 -2.803 -14.989 656 HE3 MET 87 HE3 MET 87 -8.319 -2.427 -14.020 657 H VAL 88 HN VAL 88 -4.566 -5.741 -9.093 658 HA VAL 88 HA VAL 88 -5.913 -8.242 -9.836 659 HB VAL 88 HB VAL 88 -3.671 -8.335 -7.904 660 HG11 VAL 88 HG11 VAL 88 -4.431 -9.928 -10.331 661 HG12 VAL 88 HG12 VAL 88 -4.733 -10.345 -8.641 662 HG13 VAL 88 HG13 VAL 88 -3.082 -10.302 -9.259 663 HG21 VAL 88 HG21 VAL 88 -1.934 -8.217 -9.621 664 HG22 VAL 88 HG22 VAL 88 -2.783 -6.680 -9.462 665 HG23 VAL 88 HG23 VAL 88 -3.142 -7.751 -10.818 666 H THR 89 HN THR 89 -6.080 -9.650 -7.539 667 HA THR 89 HA THR 89 -7.534 -7.787 -5.784 668 HB THR 89 HB THR 89 -7.956 -10.554 -6.625 669 HG1 THR 89 HG1 THR 89 -9.421 -8.849 -7.031 670 HG21 THR 89 HG21 THR 89 -7.365 -11.163 -4.395 671 HG22 THR 89 HG22 THR 89 -9.119 -11.269 -4.565 672 HG23 THR 89 HG23 THR 89 -8.396 -9.896 -3.727 673 H HIS 90 HN HIS 90 -7.410 -8.433 -3.390 674 HA HIS 90 HA HIS 90 -4.716 -7.951 -2.641 675 HB2 HIS 90 HB2 HIS 90 -6.715 -7.120 -1.400 676 HB3 HIS 90 HB1 HIS 90 -7.043 -8.768 -0.877 677 HD1 HIS 90 HD1 HIS 90 -4.908 -5.810 -0.147 678 HD2 HIS 90 HD2 HIS 90 -5.259 -9.764 1.095 679 HE1 HIS 90 HE1 HIS 90 -3.602 -5.961 1.997 680 HE2 HIS 90 HE2 HIS 90 -3.976 -8.320 2.816 681 H ASP 91 HN ASP 91 -6.746 -10.765 -2.645 682 HA ASP 91 HA ASP 91 -4.880 -12.485 -1.310 683 HB2 ASP 91 HB2 ASP 91 -7.412 -12.759 -1.419 684 HB3 ASP 91 HB1 ASP 91 -7.180 -13.304 -3.085 685 H GLN 92 HN GLN 92 -5.611 -11.611 -4.603 686 HA GLN 92 HA GLN 92 -3.972 -13.479 -5.928 687 HB2 GLN 92 HB2 GLN 92 -4.337 -10.688 -6.901 688 HB3 GLN 92 HB1 GLN 92 -4.214 -12.177 -7.825 689 HG2 GLN 92 HG2 GLN 92 -6.512 -11.372 -6.106 690 HG3 GLN 92 HG1 GLN 92 -6.461 -11.244 -7.859 691 HE21 GLN 92 HE21 GLN 92 -5.017 -13.722 -8.103 692 HE22 GLN 92 HE22 GLN 92 -6.192 -14.939 -7.838 693 H ALA 93 HN ALA 93 -3.475 -10.196 -4.794 694 HA ALA 93 HA ALA 93 -0.799 -9.890 -5.561 695 HB1 ALA 93 HB1 ALA 93 -0.767 -8.161 -3.738 696 HB2 ALA 93 HB2 ALA 93 -2.399 -8.669 -3.308 697 HB3 ALA 93 HB3 ALA 93 -2.080 -7.975 -4.897 698 H ARG 94 HN ARG 94 -2.388 -11.227 -2.762 699 HA ARG 94 HA ARG 94 -0.308 -11.744 -1.072 700 HB2 ARG 94 HB2 ARG 94 -2.907 -13.034 -1.646 701 HB3 ARG 94 HB1 ARG 94 -1.754 -13.991 -0.734 702 HG2 ARG 94 HG2 ARG 94 -1.684 -12.306 1.002 703 HG3 ARG 94 HG1 ARG 94 -2.764 -11.269 0.055 704 HD2 ARG 94 HD2 ARG 94 -4.546 -12.837 0.212 705 HD3 ARG 94 HD1 ARG 94 -3.486 -14.068 0.897 706 HE ARG 94 HE ARG 94 -3.413 -11.983 2.681 707 HH11 ARG 94 HH11 ARG 94 -5.895 -13.993 1.245 708 HH12 ARG 94 HH12 ARG 94 -6.899 -13.997 2.669 709 HH21 ARG 94 HH21 ARG 94 -4.739 -11.972 4.565 710 HH22 ARG 94 HH22 ARG 94 -6.242 -12.838 4.551 711 H LYS 95 HN LYS 95 -1.486 -13.704 -3.743 712 HA LYS 95 HA LYS 95 0.221 -15.896 -3.309 713 HB2 LYS 95 HB2 LYS 95 -1.235 -15.090 -5.835 714 HB3 LYS 95 HB1 LYS 95 -0.606 -16.692 -5.469 715 HG2 LYS 95 HG2 LYS 95 -2.165 -16.966 -3.674 716 HG3 LYS 95 HG1 LYS 95 -2.693 -15.287 -3.817 717 HD2 LYS 95 HD2 LYS 95 -3.602 -15.768 -6.044 718 HD3 LYS 95 HD1 LYS 95 -3.089 -17.452 -5.885 719 HE2 LYS 95 HE2 LYS 95 -4.574 -17.817 -4.058 720 HE3 LYS 95 HE1 LYS 95 -4.931 -16.096 -3.926 721 HZ1 LYS 95 HZ1 LYS 95 -6.039 -16.196 -6.061 722 HZ2 LYS 95 HZ2 LYS 95 -6.727 -17.318 -4.998 723 HZ3 LYS 95 HZ3 LYS 95 -5.676 -17.842 -6.221 724 H ARG 96 HN ARG 96 0.622 -12.963 -5.247 725 HA ARG 96 HA ARG 96 2.892 -14.113 -6.618 726 HB2 ARG 96 HB2 ARG 96 2.986 -11.756 -7.622 727 HB3 ARG 96 HB1 ARG 96 1.725 -12.881 -8.089 728 HG2 ARG 96 HG2 ARG 96 0.144 -11.784 -6.648 729 HG3 ARG 96 HG1 ARG 96 1.409 -10.687 -6.071 730 HD2 ARG 96 HD2 ARG 96 0.069 -9.630 -7.820 731 HD3 ARG 96 HD1 ARG 96 1.752 -9.890 -8.302 732 HE ARG 96 HE ARG 96 0.207 -12.081 -9.150 733 HH11 ARG 96 HH11 ARG 96 0.630 -8.675 -9.930 734 HH12 ARG 96 HH12 ARG 96 0.317 -8.905 -11.625 735 HH21 ARG 96 HH21 ARG 96 -0.140 -12.364 -11.383 736 HH22 ARG 96 HH22 ARG 96 -0.112 -10.982 -12.438 737 H LEU 97 HN LEU 97 2.426 -12.177 -3.818 738 HA LEU 97 HA LEU 97 5.181 -11.273 -3.827 739 HB2 LEU 97 HB2 LEU 97 4.627 -10.345 -1.593 740 HB3 LEU 97 HB1 LEU 97 3.664 -9.712 -2.912 741 HG LEU 97 HG LEU 97 1.960 -11.555 -2.132 742 HD11 LEU 97 HD11 LEU 97 2.042 -12.048 0.204 743 HD12 LEU 97 HD12 LEU 97 3.439 -10.996 0.428 744 HD13 LEU 97 HD13 LEU 97 3.600 -12.486 -0.503 745 HD21 LEU 97 HD21 LEU 97 1.495 -9.186 -2.133 746 HD22 LEU 97 HD22 LEU 97 2.453 -8.962 -0.669 747 HD23 LEU 97 HD23 LEU 97 0.951 -9.886 -0.607 748 H THR 98 HN THR 98 3.324 -13.873 -2.578 749 HA THR 98 HA THR 98 5.783 -14.952 -1.366 750 HB THR 98 HB THR 98 4.200 -16.539 -0.147 751 HG1 THR 98 HG1 THR 98 2.323 -14.542 -0.956 752 HG21 THR 98 HG21 THR 98 4.140 -13.605 0.544 753 HG22 THR 98 HG22 THR 98 5.383 -14.763 1.011 754 HG23 THR 98 HG23 THR 98 3.746 -14.921 1.649 755 H LYS 99 HN LYS 99 5.723 -15.196 -4.011 756 HA LYS 99 HA LYS 99 4.334 -17.598 -4.810 757 HB2 LYS 99 HB2 LYS 99 5.373 -17.216 -7.006 758 HB3 LYS 99 HB1 LYS 99 4.559 -15.766 -6.420 759 HG2 LYS 99 HG2 LYS 99 6.826 -15.038 -5.563 760 HG3 LYS 99 HG1 LYS 99 7.491 -16.362 -6.522 761 HD2 LYS 99 HD2 LYS 99 6.533 -15.397 -8.541 762 HD3 LYS 99 HD1 LYS 99 5.830 -14.087 -7.585 763 HE2 LYS 99 HE2 LYS 99 8.039 -13.348 -6.915 764 HE3 LYS 99 HE1 LYS 99 8.775 -14.696 -7.777 765 HZ1 LYS 99 HZ1 LYS 99 7.920 -13.790 -9.852 766 HZ2 LYS 99 HZ2 LYS 99 8.914 -12.661 -9.066 767 HZ3 LYS 99 HZ3 LYS 99 7.231 -12.487 -9.019 768 H ARG 100 HN ARG 100 7.028 -16.936 -3.197 769 HA ARG 100 HA ARG 100 8.794 -18.124 -2.412 770 HB2 ARG 100 HB2 ARG 100 7.150 -20.293 -3.653 771 HB3 ARG 100 HB1 ARG 100 8.694 -20.653 -2.889 772 HG2 ARG 100 HG2 ARG 100 6.422 -19.236 -1.511 773 HG3 ARG 100 HG1 ARG 100 6.685 -20.978 -1.438 774 HD2 ARG 100 HD2 ARG 100 8.809 -19.001 -0.650 775 HD3 ARG 100 HD1 ARG 100 7.597 -19.581 0.493 776 HE ARG 100 HE ARG 100 8.514 -21.885 -0.339 777 HH11 ARG 100 HH11 ARG 100 10.377 -18.998 0.314 778 HH12 ARG 100 HH12 ARG 100 11.802 -19.864 0.796 779 HH21 ARG 100 HH21 ARG 100 10.345 -23.042 0.343 780 HH22 ARG 100 HH22 ARG 100 11.762 -22.179 0.881 781 H SER 101 HN SER 101 8.483 -17.191 -5.360 782 HA SER 101 HA SER 101 10.818 -18.613 -6.440 783 HB2 SER 101 HB2 SER 101 8.715 -18.703 -7.768 784 HB3 SER 101 HB1 SER 101 8.752 -16.949 -7.910 785 HG SER 101 HG SER 101 10.430 -18.884 -9.075 786 H GLU 102 HN GLU 102 10.448 -16.158 -4.548 787 HA GLU 102 HA GLU 102 12.391 -14.497 -5.909 788 HB2 GLU 102 HB2 GLU 102 11.297 -12.485 -5.389 789 HB3 GLU 102 HB1 GLU 102 10.036 -13.523 -6.035 790 HG2 GLU 102 HG2 GLU 102 10.547 -13.123 -3.098 791 HG3 GLU 102 HG1 GLU 102 9.396 -12.173 -4.036 792 H GLU 103 HN GLU 103 13.633 -13.272 -4.522 793 HA GLU 103 HA GLU 103 14.003 -14.405 -1.854 794 HB2 GLU 103 HB2 GLU 103 15.855 -12.710 -3.516 795 HB3 GLU 103 HB1 GLU 103 16.236 -13.383 -1.937 796 HG2 GLU 103 HG2 GLU 103 15.559 -15.020 -4.352 797 HG3 GLU 103 HG1 GLU 103 17.207 -14.634 -3.843 798 H VAL 104 HN VAL 104 12.504 -11.995 -3.312 799 HA VAL 104 HA VAL 104 12.561 -10.197 -1.090 800 HB VAL 104 HB VAL 104 14.799 -9.953 -2.039 801 HG11 VAL 104 HG11 VAL 104 13.381 -9.031 -4.528 802 HG12 VAL 104 HG12 VAL 104 14.313 -10.516 -4.335 803 HG13 VAL 104 HG13 VAL 104 15.119 -8.947 -4.242 804 HG21 VAL 104 HG21 VAL 104 13.070 -7.519 -2.509 805 HG22 VAL 104 HG22 VAL 104 14.822 -7.509 -2.307 806 HG23 VAL 104 HG23 VAL 104 13.783 -8.003 -0.971 807 H VAL 105 HN VAL 105 11.126 -8.351 -1.435 808 HA VAL 105 HA VAL 105 9.453 -8.769 -3.830 809 HB VAL 105 HB VAL 105 8.233 -9.434 -1.815 810 HG11 VAL 105 HG11 VAL 105 9.350 -8.007 -0.178 811 HG12 VAL 105 HG12 VAL 105 7.594 -7.873 -0.088 812 HG13 VAL 105 HG13 VAL 105 8.537 -6.596 -0.858 813 HG21 VAL 105 HG21 VAL 105 7.183 -6.877 -3.001 814 HG22 VAL 105 HG22 VAL 105 6.230 -8.083 -2.134 815 HG23 VAL 105 HG23 VAL 105 6.993 -8.497 -3.670 816 H ARG 106 HN ARG 106 9.864 -7.252 -5.225 817 HA ARG 106 HA ARG 106 10.828 -4.685 -4.296 818 HB2 ARG 106 HB2 ARG 106 12.112 -5.061 -6.056 819 HB3 ARG 106 HB1 ARG 106 11.028 -6.255 -6.744 820 HG2 ARG 106 HG2 ARG 106 9.738 -4.524 -7.789 821 HG3 ARG 106 HG1 ARG 106 10.682 -3.282 -6.960 822 HD2 ARG 106 HD2 ARG 106 12.617 -3.780 -8.192 823 HD3 ARG 106 HD1 ARG 106 11.964 -5.314 -8.755 824 HE ARG 106 HE ARG 106 10.757 -2.781 -9.648 825 HH11 ARG 106 HH11 ARG 106 12.451 -5.749 -10.306 826 HH12 ARG 106 HH12 ARG 106 12.269 -5.654 -12.029 827 HH21 ARG 106 HH21 ARG 106 10.518 -2.598 -11.953 828 HH22 ARG 106 HH22 ARG 106 11.171 -3.858 -12.959 829 H LEU 107 HN LEU 107 9.835 -2.779 -4.673 830 HA LEU 107 HA LEU 107 6.982 -3.051 -5.346 831 HB2 LEU 107 HB2 LEU 107 8.328 -1.953 -2.983 832 HB3 LEU 107 HB1 LEU 107 6.993 -1.010 -3.603 833 HG LEU 107 HG LEU 107 5.422 -2.672 -3.122 834 HD11 LEU 107 HD11 LEU 107 7.711 -4.604 -2.784 835 HD12 LEU 107 HD12 LEU 107 6.549 -4.585 -4.111 836 HD13 LEU 107 HD13 LEU 107 6.012 -4.967 -2.474 837 HD21 LEU 107 HD21 LEU 107 6.537 -1.553 -1.190 838 HD22 LEU 107 HD22 LEU 107 7.466 -3.048 -0.968 839 HD23 LEU 107 HD23 LEU 107 5.701 -3.062 -0.832 840 H LEU 108 HN LEU 108 6.016 -1.532 -6.481 841 HA LEU 108 HA LEU 108 7.538 0.950 -7.050 842 HB2 LEU 108 HB2 LEU 108 5.222 -0.240 -8.590 843 HB3 LEU 108 HB1 LEU 108 5.888 1.355 -8.876 844 HG LEU 108 HG LEU 108 7.049 -1.320 -9.521 845 HD11 LEU 108 HD11 LEU 108 6.824 1.296 -11.001 846 HD12 LEU 108 HD12 LEU 108 5.811 -0.129 -11.230 847 HD13 LEU 108 HD13 LEU 108 7.523 -0.191 -11.644 848 HD21 LEU 108 HD21 LEU 108 8.600 1.227 -9.105 849 HD22 LEU 108 HD22 LEU 108 9.203 -0.199 -9.955 850 HD23 LEU 108 HD23 LEU 108 8.797 -0.299 -8.241 851 H VAL 109 HN VAL 109 6.867 2.558 -5.705 852 HA VAL 109 HA VAL 109 4.165 2.336 -4.629 853 HB VAL 109 HB VAL 109 5.889 1.507 -3.079 854 HG11 VAL 109 HG11 VAL 109 6.933 4.327 -3.165 855 HG12 VAL 109 HG12 VAL 109 7.779 2.877 -3.707 856 HG13 VAL 109 HG13 VAL 109 7.425 3.103 -1.994 857 HG21 VAL 109 HG21 VAL 109 3.826 2.408 -2.231 858 HG22 VAL 109 HG22 VAL 109 4.543 4.019 -2.189 859 HG23 VAL 109 HG23 VAL 109 5.166 2.751 -1.136 860 H THR 110 HN THR 110 3.503 4.316 -3.548 861 HA THR 110 HA THR 110 4.506 6.697 -4.959 862 HB THR 110 HB THR 110 2.053 7.516 -4.829 863 HG1 THR 110 HG1 THR 110 1.650 4.689 -4.803 864 HG21 THR 110 HG21 THR 110 1.575 6.568 -7.020 865 HG22 THR 110 HG22 THR 110 2.824 5.345 -6.789 866 HG23 THR 110 HG23 THR 110 3.267 7.051 -6.913 867 H ARG 111 HN ARG 111 5.394 7.949 -3.523 868 HA ARG 111 HA ARG 111 4.420 8.122 -0.829 869 HB2 ARG 111 HB2 ARG 111 6.791 9.285 -2.267 870 HB3 ARG 111 HB1 ARG 111 6.394 9.688 -0.601 871 HG2 ARG 111 HG2 ARG 111 6.669 6.848 -1.418 872 HG3 ARG 111 HG1 ARG 111 8.096 7.837 -1.110 873 HD2 ARG 111 HD2 ARG 111 7.358 6.575 0.844 874 HD3 ARG 111 HD1 ARG 111 7.356 8.304 1.093 875 HE ARG 111 HE ARG 111 4.935 6.696 0.640 876 HH11 ARG 111 HH11 ARG 111 6.593 9.417 2.076 877 HH12 ARG 111 HH12 ARG 111 5.221 9.918 3.029 878 HH21 ARG 111 HH21 ARG 111 3.120 7.360 1.889 879 HH22 ARG 111 HH22 ARG 111 3.264 8.753 2.917 880 H GLN 112 HN GLN 112 3.963 10.076 0.169 881 HA GLN 112 HA GLN 112 2.774 12.111 -1.482 882 HB2 GLN 112 HB2 GLN 112 2.855 11.750 1.489 883 HB3 GLN 112 HB1 GLN 112 1.801 12.805 0.599 884 HG2 GLN 112 HG2 GLN 112 1.747 9.813 0.642 885 HG3 GLN 112 HG1 GLN 112 0.526 10.914 1.266 886 HE21 GLN 112 HE21 GLN 112 1.871 9.442 -1.564 887 HE22 GLN 112 HE22 GLN 112 0.637 9.936 -2.678 888 H SER 113 HN SER 113 5.252 11.495 0.757 889 HA SER 113 HA SER 113 7.397 12.339 0.839 890 HB2 SER 113 HB2 SER 113 6.932 13.116 -1.523 891 HB3 SER 113 HB1 SER 113 6.399 14.635 -0.800 892 HG SER 113 HG SER 113 8.503 14.889 0.047 893 H LEU 114 HN LEU 114 5.015 13.117 2.417 894 HA LEU 114 HA LEU 114 5.943 15.693 3.479 895 HB2 LEU 114 HB2 LEU 114 3.532 15.831 4.241 896 HB3 LEU 114 HB1 LEU 114 3.883 16.029 2.536 897 HG LEU 114 HG LEU 114 3.421 13.407 2.563 898 HD11 LEU 114 HD11 LEU 114 1.484 12.937 3.982 899 HD12 LEU 114 HD12 LEU 114 1.682 14.512 4.751 900 HD13 LEU 114 HD13 LEU 114 2.947 13.286 4.910 901 HD21 LEU 114 HD21 LEU 114 2.417 14.902 1.034 902 HD22 LEU 114 HD22 LEU 114 1.444 15.656 2.306 903 HD23 LEU 114 HD23 LEU 114 1.119 13.993 1.814 904 H GLN 115 HN GLN 115 6.878 13.223 4.093 905 HA GLN 115 HA GLN 115 5.988 12.088 6.489 906 HB2 GLN 115 HB2 GLN 115 8.612 12.129 5.042 907 HB3 GLN 115 HB1 GLN 115 8.465 11.342 6.602 908 HG2 GLN 115 HG2 GLN 115 7.245 9.629 5.782 909 HG3 GLN 115 HG1 GLN 115 6.454 10.630 4.566 910 HE21 GLN 115 HE21 GLN 115 9.294 8.793 5.359 911 HE22 GLN 115 HE22 GLN 115 9.908 8.663 3.748 912 H LYS 116 HN LYS 116 5.514 14.212 7.583 913 HA LYS 116 HA LYS 116 5.785 15.380 9.502 914 HB2 LYS 116 HB2 LYS 116 8.479 14.035 9.653 915 HB3 LYS 116 HB1 LYS 116 7.809 15.067 10.909 916 HG2 LYS 116 HG2 LYS 116 5.927 13.510 11.162 917 HG3 LYS 116 HG1 LYS 116 6.646 12.465 9.933 918 HD2 LYS 116 HD2 LYS 116 7.882 13.217 12.582 919 HD3 LYS 116 HD1 LYS 116 7.158 11.660 12.177 920 HE2 LYS 116 HE2 LYS 116 9.616 12.888 10.931 921 HE3 LYS 116 HE1 LYS 116 9.564 11.504 12.023 922 HZ1 LYS 116 HZ1 LYS 116 8.450 11.636 9.278 923 HZ2 LYS 116 HZ2 LYS 116 8.236 10.328 10.329 924 HZ3 LYS 116 HZ3 LYS 116 9.792 10.730 9.779 925 H ALA 117 HN ALA 117 6.528 17.393 10.127 926 HA ALA 117 HA ALA 117 8.795 18.688 8.999 927 HB1 ALA 117 HB1 ALA 117 6.099 19.532 7.944 928 HB2 ALA 117 HB2 ALA 117 7.331 18.684 7.013 929 HB3 ALA 117 HB3 ALA 117 7.644 20.313 7.610 930 H VAL 118 HN VAL 118 7.846 18.257 11.516 931 HA VAL 118 HA VAL 118 6.531 20.722 12.380 932 HB VAL 118 HB VAL 118 6.761 18.164 13.968 933 HG11 VAL 118 HG11 VAL 118 6.393 20.186 15.274 934 HG12 VAL 118 HG12 VAL 118 4.964 19.150 15.305 935 HG13 VAL 118 HG13 VAL 118 4.994 20.584 14.279 936 HG21 VAL 118 HG21 VAL 118 5.479 17.756 11.908 937 HG22 VAL 118 HG22 VAL 118 4.415 19.105 12.314 938 HG23 VAL 118 HG23 VAL 118 4.461 17.674 13.345 939 H GLN 119 HN GLN 119 8.459 21.844 12.329 940 HA GLN 119 HA GLN 119 10.153 21.404 14.693 941 HB2 GLN 119 HB2 GLN 119 11.050 22.234 11.926 942 HB3 GLN 119 HB1 GLN 119 12.053 22.379 13.363 943 HG2 GLN 119 HG2 GLN 119 10.890 19.782 12.396 944 HG3 GLN 119 HG1 GLN 119 12.499 20.369 11.974 945 HE21 GLN 119 HE21 GLN 119 10.472 19.147 14.544 946 HE22 GLN 119 HE22 GLN 119 11.773 18.784 15.643 947 H GLN 120 HN GLN 120 10.439 23.131 15.954 948 HA GLN 120 HA GLN 120 10.088 25.149 16.889 949 HB2 GLN 120 HB2 GLN 120 10.922 25.919 14.118 950 HB3 GLN 120 HB1 GLN 120 10.569 27.134 15.343 951 HG2 GLN 120 HG2 GLN 120 12.253 26.205 16.796 952 HG3 GLN 120 HG1 GLN 120 12.573 24.917 15.640 953 HE21 GLN 120 HE21 GLN 120 14.684 25.480 15.542 954 HE22 GLN 120 HE22 GLN 120 15.265 26.869 14.691 955 H SER 121 HN SER 121 7.843 24.719 17.276 956 HA SER 121 HA SER 121 5.875 25.734 15.426 957 HB2 SER 121 HB2 SER 121 5.441 24.841 18.282 958 HB3 SER 121 HB1 SER 121 4.251 24.897 16.982 959 HG SER 121 HG SER 121 6.405 23.117 17.360 960 H MET 122 HN MET 122 7.868 27.163 17.681 961 HA MET 122 HA MET 122 5.929 29.109 18.654 962 HB2 MET 122 HB2 MET 122 8.888 28.797 19.215 963 HB3 MET 122 HB1 MET 122 7.860 30.013 19.957 964 HG2 MET 122 HG2 MET 122 6.528 28.291 21.016 965 HG3 MET 122 HG1 MET 122 7.489 27.041 20.222 966 HE1 MET 122 HE1 MET 122 8.538 26.788 24.016 967 HE2 MET 122 HE2 MET 122 7.909 25.897 22.628 968 HE3 MET 122 HE3 MET 122 6.943 27.175 23.364 969 H LEU 123 HN LEU 123 8.694 28.937 16.497 970 HA LEU 123 HA LEU 123 8.330 31.778 15.846 971 HB2 LEU 123 HB2 LEU 123 10.722 29.979 15.465 972 HB3 LEU 123 HB1 LEU 123 10.596 31.575 14.758 973 HG LEU 123 HG LEU 123 11.934 31.837 16.667 974 HD11 LEU 123 HD11 LEU 123 10.293 33.586 16.454 975 HD12 LEU 123 HD12 LEU 123 10.608 33.261 18.158 976 HD13 LEU 123 HD13 LEU 123 9.132 32.659 17.403 977 HD21 LEU 123 HD21 LEU 123 11.346 31.036 18.890 978 HD22 LEU 123 HD22 LEU 123 11.454 29.703 17.739 979 HD23 LEU 123 HD23 LEU 123 9.875 30.302 18.250 980 H SER 124 HN SER 124 6.906 31.902 14.238 981 HA SER 124 HA SER 124 6.445 30.002 12.246 982 HB2 SER 124 HB2 SER 124 6.006 32.986 12.016 983 HB3 SER 124 HB1 SER 124 5.131 31.710 11.168 984 HG SER 124 HG SER 124 3.858 31.575 12.825 985 H1 LYS 161 HN LYS 161 -12.623 -1.450 -2.927 986 HA LYS 161 HA LYS 161 -14.260 -0.307 -0.758 987 HB2 LYS 161 HB2 LYS 161 -14.350 -3.227 -1.441 988 HB3 LYS 161 HB1 LYS 161 -15.514 -2.275 -0.539 989 HG2 LYS 161 HG2 LYS 161 -16.657 -2.625 -2.485 990 HG3 LYS 161 HG1 LYS 161 -15.876 -1.081 -2.845 991 HD2 LYS 161 HD2 LYS 161 -14.038 -2.350 -3.951 992 HD3 LYS 161 HD1 LYS 161 -14.973 -3.830 -3.715 993 HE2 LYS 161 HE2 LYS 161 -16.754 -2.968 -5.096 994 HE3 LYS 161 HE1 LYS 161 -15.942 -1.409 -5.231 995 HZ1 LYS 161 HZ1 LYS 161 -15.030 -4.003 -6.356 996 HZ2 LYS 161 HZ2 LYS 161 -14.081 -2.604 -6.333 997 HZ3 LYS 161 HZ3 LYS 161 -15.529 -2.628 -7.213 998 H GLU 162 HN GLU 162 -13.240 -0.450 1.224 999 HA GLU 162 HA GLU 162 -10.893 -2.236 1.359 1000 HB2 GLU 162 HB2 GLU 162 -10.180 0.075 1.177 1001 HB3 GLU 162 HB1 GLU 162 -11.262 0.501 2.496 1002 HG2 GLU 162 HG2 GLU 162 -9.868 -1.187 3.875 1003 HG3 GLU 162 HG1 GLU 162 -8.672 -0.984 2.596 1004 H ASN 163 HN ASN 163 -10.747 -3.605 2.931 1005 HA ASN 163 HA ASN 163 -11.363 -2.934 5.612 1006 HB2 ASN 163 HB2 ASN 163 -13.646 -3.542 4.638 1007 HB3 ASN 163 HB1 ASN 163 -13.042 -5.189 4.513 1008 HD21 ASN 163 HD21 ASN 163 -13.059 -6.468 6.288 1009 HD22 ASN 163 HD22 ASN 163 -13.533 -5.936 7.880 1010 H LEU 164 HN LEU 164 -9.386 -4.206 3.602 1011 HA LEU 164 HA LEU 164 -8.758 -6.575 5.220 1012 HB2 LEU 164 HB2 LEU 164 -8.610 -6.039 2.367 1013 HB3 LEU 164 HB1 LEU 164 -7.119 -6.703 3.016 1014 HG LEU 164 HG LEU 164 -9.843 -7.923 3.362 1015 HD11 LEU 164 HD11 LEU 164 -9.020 -9.668 1.818 1016 HD12 LEU 164 HD12 LEU 164 -7.547 -8.732 1.567 1017 HD13 LEU 164 HD13 LEU 164 -9.101 -8.089 1.038 1018 HD21 LEU 164 HD21 LEU 164 -8.335 -8.433 5.212 1019 HD22 LEU 164 HD22 LEU 164 -7.101 -8.967 4.070 1020 HD23 LEU 164 HD23 LEU 164 -8.612 -9.866 4.219 1021 H GLU 165 HN GLU 165 -7.064 -6.622 6.431 1022 HA GLU 165 HA GLU 165 -4.673 -5.098 5.621 1023 HB2 GLU 165 HB2 GLU 165 -5.759 -5.647 8.345 1024 HB3 GLU 165 HB1 GLU 165 -4.015 -5.666 8.120 1025 HG2 GLU 165 HG2 GLU 165 -4.269 -3.362 7.091 1026 HG3 GLU 165 HG1 GLU 165 -5.912 -3.373 7.746 1027 H SER 166 HN SER 166 -2.669 -6.225 5.915 1028 HA SER 166 HA SER 166 -2.709 -8.965 6.803 1029 HB2 SER 166 HB2 SER 166 -1.931 -8.370 3.934 1030 HB3 SER 166 HB1 SER 166 -1.866 -9.942 4.729 1031 HG SER 166 HG SER 166 -4.314 -9.143 5.072 1032 H MET 167 HN MET 167 -0.910 -9.046 8.078 1033 HA MET 167 HA MET 167 1.497 -7.684 7.190 1034 HB2 MET 167 HB2 MET 167 1.071 -9.577 9.510 1035 HB3 MET 167 HB1 MET 167 2.642 -8.880 9.063 1036 HG2 MET 167 HG2 MET 167 1.693 -6.632 9.438 1037 HG3 MET 167 HG1 MET 167 0.172 -7.370 9.940 1038 HE1 MET 167 HE1 MET 167 4.135 -7.986 12.232 1039 HE2 MET 167 HE2 MET 167 4.012 -6.993 10.779 1040 HE3 MET 167 HE3 MET 167 3.775 -8.738 10.678 1041 H VAL 168 HN VAL 168 2.305 -8.494 5.457 1042 HA VAL 168 HA VAL 168 2.250 -11.325 4.933 1043 HB VAL 168 HB VAL 168 3.662 -10.623 2.900 1044 HG11 VAL 168 HG11 VAL 168 1.689 -9.762 1.715 1045 HG12 VAL 168 HG12 VAL 168 0.897 -9.467 3.264 1046 HG13 VAL 168 HG13 VAL 168 1.276 -11.115 2.766 1047 HG21 VAL 168 HG21 VAL 168 3.566 -8.257 2.293 1048 HG22 VAL 168 HG22 VAL 168 4.440 -8.475 3.811 1049 HG23 VAL 168 HG23 VAL 168 2.777 -7.886 3.825 Start of MODEL 10 1 H1 MET 1 HT1 MET 1 11.495 31.656 7.393 2 H2 MET 1 HT2 MET 1 10.126 30.813 7.930 3 H3 MET 1 HT3 MET 1 11.259 30.042 6.933 4 HA MET 1 HA MET 1 12.936 30.189 8.629 5 HB2 MET 1 HB2 MET 1 10.716 31.399 10.292 6 HB3 MET 1 HB1 MET 1 12.263 30.852 10.928 7 HG2 MET 1 HG2 MET 1 13.375 32.481 9.398 8 HG3 MET 1 HG1 MET 1 11.774 33.112 9.008 9 HE1 MET 1 HE1 MET 1 10.425 32.638 11.950 10 HE2 MET 1 HE2 MET 1 10.096 34.046 10.944 11 HE3 MET 1 HE3 MET 1 10.592 34.259 12.624 12 H SER 2 HN SER 2 9.492 29.453 9.198 13 HA SER 2 HA SER 2 10.194 27.093 10.717 14 HB2 SER 2 HB2 SER 2 8.289 28.470 11.428 15 HB3 SER 2 HB1 SER 2 7.489 28.169 9.887 16 HG SER 2 HG SER 2 8.226 26.154 11.747 17 H TYR 3 HN TYR 3 7.989 27.548 7.929 18 HA TYR 3 HA TYR 3 8.952 24.957 6.912 19 HB2 TYR 3 HB2 TYR 3 6.313 26.353 6.442 20 HB3 TYR 3 HB1 TYR 3 6.806 24.859 5.654 21 HD1 TYR 3 HD2 TYR 3 7.339 22.852 7.179 22 HD2 TYR 3 HD1 TYR 3 5.208 26.297 8.487 23 HE1 TYR 3 HE2 TYR 3 6.426 21.564 9.065 24 HE2 TYR 3 HE1 TYR 3 4.285 25.021 10.371 25 HH TYR 3 HH TYR 3 5.496 21.972 11.293 26 H ILE 4 HN ILE 4 8.250 24.972 4.358 27 HA ILE 4 HA ILE 4 9.412 27.405 3.190 28 HB ILE 4 HB ILE 4 9.993 24.603 2.210 29 HG12 ILE 4 HG12 ILE 4 11.800 26.531 3.698 30 HG13 ILE 4 HG11 ILE 4 11.109 25.058 4.371 31 HG21 ILE 4 HG21 ILE 4 9.986 26.256 0.445 32 HG22 ILE 4 HG22 ILE 4 11.641 25.744 0.778 33 HG23 ILE 4 HG23 ILE 4 11.060 27.298 1.377 34 HD11 ILE 4 HD11 ILE 4 13.059 25.212 2.085 35 HD12 ILE 4 HD12 ILE 4 12.367 23.735 2.752 36 HD13 ILE 4 HD13 ILE 4 13.429 24.737 3.740 37 HA PRO 5 HA PRO 5 5.492 26.734 1.005 38 HB2 PRO 5 HB2 PRO 5 5.582 29.603 0.551 39 HB3 PRO 5 HB1 PRO 5 4.410 28.665 1.477 40 HG2 PRO 5 HG2 PRO 5 6.158 30.380 2.640 41 HG3 PRO 5 HG1 PRO 5 5.562 28.915 3.446 42 HD2 PRO 5 HD2 PRO 5 8.169 29.365 2.031 43 HD3 PRO 5 HD1 PRO 5 7.854 28.546 3.578 44 H GLY 6 HN GLY 6 5.185 26.505 -1.154 45 HA2 GLY 6 HA2 GLY 6 5.505 27.494 -3.382 46 HA3 GLY 6 HA1 GLY 6 7.186 27.772 -2.915 47 H GLN 7 HN GLN 7 7.575 25.191 -1.661 48 HA GLN 7 HA GLN 7 7.532 23.536 -4.089 49 HB2 GLN 7 HB2 GLN 7 9.650 23.967 -2.027 50 HB3 GLN 7 HB1 GLN 7 9.591 22.452 -2.912 51 HG2 GLN 7 HG2 GLN 7 9.821 25.197 -4.121 52 HG3 GLN 7 HG1 GLN 7 11.127 24.024 -3.950 53 HE21 GLN 7 HE21 GLN 7 10.035 25.275 -6.344 54 HE22 GLN 7 HE22 GLN 7 9.519 23.973 -7.371 55 HA PRO 8 HA PRO 8 5.662 20.538 -1.302 56 HB2 PRO 8 HB2 PRO 8 3.188 20.450 -2.342 57 HB3 PRO 8 HB1 PRO 8 3.648 21.689 -1.170 58 HG2 PRO 8 HG2 PRO 8 3.129 21.948 -4.053 59 HG3 PRO 8 HG1 PRO 8 3.114 23.190 -2.792 60 HD2 PRO 8 HD2 PRO 8 5.236 22.527 -4.663 61 HD3 PRO 8 HD1 PRO 8 5.154 23.874 -3.504 62 H VAL 9 HN VAL 9 5.398 18.331 -1.857 63 HA VAL 9 HA VAL 9 5.680 17.730 -4.728 64 HB VAL 9 HB VAL 9 7.470 16.825 -3.256 65 HG11 VAL 9 HG11 VAL 9 5.276 15.113 -2.107 66 HG12 VAL 9 HG12 VAL 9 6.119 16.416 -1.264 67 HG13 VAL 9 HG13 VAL 9 7.000 14.969 -1.757 68 HG21 VAL 9 HG21 VAL 9 7.015 15.739 -5.367 69 HG22 VAL 9 HG22 VAL 9 5.760 14.752 -4.616 70 HG23 VAL 9 HG23 VAL 9 7.449 14.535 -4.151 71 H THR 10 HN THR 10 4.513 16.002 -5.576 72 HA THR 10 HA THR 10 1.775 16.165 -4.682 73 HB THR 10 HB THR 10 1.240 15.277 -6.908 74 HG1 THR 10 HG1 THR 10 3.172 15.059 -8.343 75 HG21 THR 10 HG21 THR 10 3.300 17.486 -6.835 76 HG22 THR 10 HG22 THR 10 1.540 17.655 -6.771 77 HG23 THR 10 HG23 THR 10 2.320 17.102 -8.254 78 H ALA 11 HN ALA 11 3.972 13.719 -5.726 79 HA ALA 11 HA ALA 11 3.355 11.826 -3.725 80 HB1 ALA 11 HB1 ALA 11 2.368 10.104 -5.169 81 HB2 ALA 11 HB2 ALA 11 2.239 11.282 -6.476 82 HB3 ALA 11 HB3 ALA 11 1.310 11.502 -4.993 83 H VAL 12 HN VAL 12 4.676 10.150 -3.768 84 HA VAL 12 HA VAL 12 7.066 10.611 -5.395 85 HB VAL 12 HB VAL 12 6.896 8.841 -3.042 86 HG11 VAL 12 HG11 VAL 12 8.935 8.916 -4.462 87 HG12 VAL 12 HG12 VAL 12 9.232 9.324 -2.771 88 HG13 VAL 12 HG13 VAL 12 9.144 10.602 -3.987 89 HG21 VAL 12 HG21 VAL 12 5.821 10.799 -2.253 90 HG22 VAL 12 HG22 VAL 12 7.096 11.829 -2.934 91 HG23 VAL 12 HG23 VAL 12 7.457 10.757 -1.578 92 H VAL 13 HN VAL 13 7.278 9.266 -7.012 93 HA VAL 13 HA VAL 13 6.148 6.576 -6.854 94 HB VAL 13 HB VAL 13 7.482 7.863 -9.228 95 HG11 VAL 13 HG11 VAL 13 5.742 5.409 -9.026 96 HG12 VAL 13 HG12 VAL 13 7.486 5.428 -9.285 97 HG13 VAL 13 HG13 VAL 13 6.407 6.081 -10.515 98 HG21 VAL 13 HG21 VAL 13 4.552 7.661 -8.559 99 HG22 VAL 13 HG22 VAL 13 5.197 8.185 -10.116 100 HG23 VAL 13 HG23 VAL 13 5.508 9.140 -8.665 101 H GLN 14 HN GLN 14 7.463 5.271 -5.823 102 HA GLN 14 HA GLN 14 10.281 5.276 -6.572 103 HB2 GLN 14 HB2 GLN 14 10.855 4.894 -4.164 104 HB3 GLN 14 HB1 GLN 14 10.263 6.503 -4.542 105 HG2 GLN 14 HG2 GLN 14 8.041 5.835 -3.724 106 HG3 GLN 14 HG1 GLN 14 8.714 4.271 -3.269 107 HE21 GLN 14 HE21 GLN 14 11.257 5.504 -2.473 108 HE22 GLN 14 HE22 GLN 14 10.947 6.234 -0.926 109 H ARG 15 HN ARG 15 11.388 3.371 -6.046 110 HA ARG 15 HA ARG 15 9.742 0.987 -6.229 111 HB2 ARG 15 HB2 ARG 15 12.394 1.718 -7.484 112 HB3 ARG 15 HB1 ARG 15 11.648 0.142 -7.576 113 HG2 ARG 15 HG2 ARG 15 9.748 2.099 -8.360 114 HG3 ARG 15 HG1 ARG 15 11.247 2.337 -9.262 115 HD2 ARG 15 HD2 ARG 15 10.179 -0.420 -8.971 116 HD3 ARG 15 HD1 ARG 15 9.393 0.675 -10.106 117 HE ARG 15 HE ARG 15 12.291 0.435 -10.328 118 HH11 ARG 15 HH11 ARG 15 9.150 -0.625 -11.438 119 HH12 ARG 15 HH12 ARG 15 9.711 -1.082 -13.018 120 HH21 ARG 15 HH21 ARG 15 13.063 -0.178 -12.387 121 HH22 ARG 15 HH22 ARG 15 11.964 -0.825 -13.565 122 H VAL 16 HN VAL 16 10.073 -0.410 -4.608 123 HA VAL 16 HA VAL 16 12.593 -0.268 -3.175 124 HB VAL 16 HB VAL 16 11.200 1.250 -1.954 125 HG11 VAL 16 HG11 VAL 16 9.075 0.600 -0.958 126 HG12 VAL 16 HG12 VAL 16 9.177 -0.960 -1.776 127 HG13 VAL 16 HG13 VAL 16 9.032 0.526 -2.724 128 HG21 VAL 16 HG21 VAL 16 11.370 -1.372 -0.504 129 HG22 VAL 16 HG22 VAL 16 11.146 0.207 0.250 130 HG23 VAL 16 HG23 VAL 16 12.638 -0.151 -0.619 131 H GLU 17 HN GLU 17 13.261 -2.198 -2.467 132 HA GLU 17 HA GLU 17 11.545 -4.479 -3.115 133 HB2 GLU 17 HB2 GLU 17 13.823 -5.709 -3.182 134 HB3 GLU 17 HB1 GLU 17 13.378 -4.666 -4.527 135 HG2 GLU 17 HG2 GLU 17 14.729 -2.858 -3.457 136 HG3 GLU 17 HG1 GLU 17 15.290 -4.048 -2.286 137 H ILE 18 HN ILE 18 10.675 -5.293 -1.404 138 HA ILE 18 HA ILE 18 11.846 -4.998 1.201 139 HB ILE 18 HB ILE 18 9.111 -6.085 0.521 140 HG12 ILE 18 HG12 ILE 18 9.118 -3.938 -0.450 141 HG13 ILE 18 HG11 ILE 18 8.348 -3.746 1.124 142 HG21 ILE 18 HG21 ILE 18 9.904 -6.560 2.758 143 HG22 ILE 18 HG22 ILE 18 8.637 -5.335 2.827 144 HG23 ILE 18 HG23 ILE 18 10.330 -4.867 2.992 145 HD11 ILE 18 HD11 ILE 18 10.267 -2.733 2.025 146 HD12 ILE 18 HD12 ILE 18 9.984 -1.974 0.462 147 HD13 ILE 18 HD13 ILE 18 11.246 -3.199 0.638 148 H HIS 19 HN HIS 19 12.983 -6.525 2.013 149 HA HIS 19 HA HIS 19 12.021 -9.251 1.862 150 HB2 HIS 19 HB2 HIS 19 14.239 -10.048 1.405 151 HB3 HIS 19 HB1 HIS 19 13.736 -8.941 0.159 152 HD1 HIS 19 HD1 HIS 19 16.302 -9.447 2.809 153 HD2 HIS 19 HD2 HIS 19 15.202 -6.536 0.050 154 HE1 HIS 19 HE1 HIS 19 18.232 -7.849 2.703 155 HE2 HIS 19 HE2 HIS 19 17.654 -6.276 0.822 156 H LYS 20 HN LYS 20 11.611 -9.838 3.932 157 HA LYS 20 HA LYS 20 13.173 -8.761 6.093 158 HB2 LYS 20 HB2 LYS 20 10.607 -9.424 6.012 159 HB3 LYS 20 HB1 LYS 20 11.255 -10.957 6.570 160 HG2 LYS 20 HG2 LYS 20 11.694 -8.299 7.897 161 HG3 LYS 20 HG1 LYS 20 10.521 -9.511 8.401 162 HD2 LYS 20 HD2 LYS 20 12.286 -11.072 8.919 163 HD3 LYS 20 HD1 LYS 20 13.502 -9.965 8.276 164 HE2 LYS 20 HE2 LYS 20 11.699 -9.319 10.608 165 HE3 LYS 20 HE1 LYS 20 13.316 -9.995 10.779 166 HZ1 LYS 20 HZ1 LYS 20 14.237 -8.050 9.722 167 HZ2 LYS 20 HZ2 LYS 20 13.260 -7.568 11.025 168 HZ3 LYS 20 HZ3 LYS 20 12.690 -7.419 9.442 169 H LEU 21 HN LEU 21 12.176 -12.097 5.634 170 HA LEU 21 HA LEU 21 14.933 -12.998 5.655 171 HB2 LEU 21 HB2 LEU 21 14.638 -12.712 8.001 172 HB3 LEU 21 HB1 LEU 21 13.071 -13.500 7.969 173 HG LEU 21 HG LEU 21 14.085 -15.652 7.600 174 HD11 LEU 21 HD11 LEU 21 16.676 -14.134 7.389 175 HD12 LEU 21 HD12 LEU 21 15.884 -15.098 6.136 176 HD13 LEU 21 HD13 LEU 21 16.560 -15.886 7.562 177 HD21 LEU 21 HD21 LEU 21 15.368 -15.882 9.678 178 HD22 LEU 21 HD22 LEU 21 13.937 -14.872 9.907 179 HD23 LEU 21 HD23 LEU 21 15.530 -14.125 9.767 180 H ARG 22 HN ARG 22 14.960 -14.480 4.110 181 HA ARG 22 HA ARG 22 12.833 -16.316 3.647 182 HB2 ARG 22 HB2 ARG 22 14.665 -15.547 1.984 183 HB3 ARG 22 HB1 ARG 22 15.710 -16.684 2.820 184 HG2 ARG 22 HG2 ARG 22 13.120 -17.462 1.524 185 HG3 ARG 22 HG1 ARG 22 14.691 -17.544 0.721 186 HD2 ARG 22 HD2 ARG 22 13.936 -18.967 3.263 187 HD3 ARG 22 HD1 ARG 22 13.961 -19.707 1.658 188 HE ARG 22 HE ARG 22 16.388 -18.592 2.925 189 HH11 ARG 22 HH11 ARG 22 14.724 -21.163 1.220 190 HH12 ARG 22 HH12 ARG 22 16.145 -22.152 1.072 191 HH21 ARG 22 HH21 ARG 22 18.243 -19.934 2.786 192 HH22 ARG 22 HH22 ARG 22 18.116 -21.480 1.990 193 H GLN 23 HN GLN 23 12.357 -17.829 5.068 194 HA GLN 23 HA GLN 23 14.549 -19.234 6.387 195 HB2 GLN 23 HB2 GLN 23 12.447 -19.590 8.103 196 HB3 GLN 23 HB1 GLN 23 13.792 -18.479 8.330 197 HG2 GLN 23 HG2 GLN 23 12.455 -16.751 7.135 198 HG3 GLN 23 HG1 GLN 23 11.094 -17.869 7.183 199 HE21 GLN 23 HE21 GLN 23 11.526 -15.229 8.391 200 HE22 GLN 23 HE22 GLN 23 11.205 -15.439 10.094 201 H GLY 24 HN GLY 24 14.220 -20.333 4.344 202 HA2 GLY 24 HA2 GLY 24 13.966 -22.485 3.571 203 HA3 GLY 24 HA1 GLY 24 13.126 -22.853 5.069 204 H GLU 25 HN GLU 25 11.032 -22.958 5.128 205 HA GLU 25 HA GLU 25 9.530 -22.958 2.693 206 HB2 GLU 25 HB2 GLU 25 8.960 -23.486 5.581 207 HB3 GLU 25 HB1 GLU 25 7.620 -23.183 4.483 208 HG2 GLU 25 HG2 GLU 25 8.063 -25.579 4.804 209 HG3 GLU 25 HG1 GLU 25 8.247 -25.080 3.126 210 H ASN 26 HN ASN 26 10.616 -20.555 4.667 211 HA ASN 26 HA ASN 26 8.196 -18.979 4.382 212 HB2 ASN 26 HB2 ASN 26 10.393 -18.781 6.406 213 HB3 ASN 26 HB1 ASN 26 9.073 -17.655 6.245 214 HD21 ASN 26 HD21 ASN 26 10.033 -20.775 7.035 215 HD22 ASN 26 HD22 ASN 26 8.655 -21.221 8.008 216 H LEU 27 HN LEU 27 8.283 -17.392 3.385 217 HA LEU 27 HA LEU 27 10.725 -15.852 2.904 218 HB2 LEU 27 HB2 LEU 27 8.418 -16.526 1.108 219 HB3 LEU 27 HB1 LEU 27 9.122 -14.935 0.980 220 HG LEU 27 HG LEU 27 10.097 -16.408 -0.685 221 HD11 LEU 27 HD11 LEU 27 12.072 -15.887 1.532 222 HD12 LEU 27 HD12 LEU 27 11.502 -14.675 0.384 223 HD13 LEU 27 HD13 LEU 27 12.429 -16.062 -0.189 224 HD21 LEU 27 HD21 LEU 27 11.481 -18.338 0.051 225 HD22 LEU 27 HD22 LEU 27 9.759 -18.549 0.363 226 HD23 LEU 27 HD23 LEU 27 10.848 -18.122 1.686 227 H ILE 28 HN ILE 28 10.618 -14.220 4.269 228 HA ILE 28 HA ILE 28 7.989 -13.367 5.222 229 HB ILE 28 HB ILE 28 10.704 -12.964 6.427 230 HG12 ILE 28 HG12 ILE 28 10.206 -15.334 6.330 231 HG13 ILE 28 HG11 ILE 28 10.106 -14.767 7.989 232 HG21 ILE 28 HG21 ILE 28 7.966 -12.370 7.415 233 HG22 ILE 28 HG22 ILE 28 9.376 -11.302 7.274 234 HG23 ILE 28 HG23 ILE 28 9.339 -12.573 8.503 235 HD11 ILE 28 HD11 ILE 28 7.699 -14.868 7.919 236 HD12 ILE 28 HD12 ILE 28 8.363 -16.415 7.368 237 HD13 ILE 28 HD13 ILE 28 7.728 -15.248 6.198 238 H LEU 29 HN LEU 29 7.275 -11.433 4.848 239 HA LEU 29 HA LEU 29 9.071 -9.295 3.923 240 HB2 LEU 29 HB2 LEU 29 6.060 -9.563 3.904 241 HB3 LEU 29 HB1 LEU 29 6.928 -8.144 3.357 242 HG LEU 29 HG LEU 29 8.055 -9.654 1.675 243 HD11 LEU 29 HD11 LEU 29 6.872 -11.698 1.040 244 HD12 LEU 29 HD12 LEU 29 5.821 -11.517 2.447 245 HD13 LEU 29 HD13 LEU 29 7.548 -11.808 2.666 246 HD21 LEU 29 HD21 LEU 29 6.140 -9.558 0.137 247 HD22 LEU 29 HD22 LEU 29 6.341 -8.065 1.053 248 HD23 LEU 29 HD23 LEU 29 5.084 -9.217 1.506 249 H GLY 30 HN GLY 30 6.804 -10.302 6.313 250 HA2 GLY 30 HA2 GLY 30 6.903 -9.820 8.602 251 HA3 GLY 30 HA1 GLY 30 8.048 -8.538 8.266 252 H PHE 31 HN PHE 31 6.782 -6.801 6.732 253 HA PHE 31 HA PHE 31 5.009 -5.540 8.592 254 HB2 PHE 31 HB2 PHE 31 5.042 -3.655 7.132 255 HB3 PHE 31 HB1 PHE 31 6.668 -4.317 7.219 256 HD1 PHE 31 HD2 PHE 31 7.159 -6.112 5.300 257 HD2 PHE 31 HD1 PHE 31 4.293 -2.987 5.120 258 HE1 PHE 31 HE2 PHE 31 7.261 -6.159 2.860 259 HE2 PHE 31 HE1 PHE 31 4.388 -3.025 2.682 260 HZ PHE 31 HZ PHE 31 5.877 -4.613 1.529 261 H SER 32 HN SER 32 3.070 -4.241 7.226 262 HA SER 32 HA SER 32 1.488 -6.331 5.860 263 HB2 SER 32 HB2 SER 32 0.419 -4.675 8.156 264 HB3 SER 32 HB1 SER 32 -0.433 -5.950 7.277 265 HG SER 32 HG SER 32 1.856 -6.966 8.181 266 H ILE 33 HN ILE 33 -0.274 -5.502 4.533 267 HA ILE 33 HA ILE 33 -0.221 -2.587 4.173 268 HB ILE 33 HB ILE 33 -0.178 -2.729 1.761 269 HG12 ILE 33 HG12 ILE 33 0.715 -5.208 1.022 270 HG13 ILE 33 HG11 ILE 33 -0.475 -5.614 2.253 271 HG21 ILE 33 HG21 ILE 33 1.939 -2.472 2.831 272 HG22 ILE 33 HG22 ILE 33 2.128 -3.530 1.431 273 HG23 ILE 33 HG23 ILE 33 2.084 -4.218 3.057 274 HD11 ILE 33 HD11 ILE 33 -2.147 -4.301 1.029 275 HD12 ILE 33 HD12 ILE 33 -1.497 -5.640 0.083 276 HD13 ILE 33 HD13 ILE 33 -0.952 -3.986 -0.228 277 H GLY 34 HN GLY 34 -2.121 -1.694 3.587 278 HA2 GLY 34 HA2 GLY 34 -4.396 -3.546 3.826 279 HA3 GLY 34 HA1 GLY 34 -4.426 -1.844 4.284 280 H GLY 35 HN GLY 35 -5.596 -3.899 2.114 281 HA2 GLY 35 HA2 GLY 35 -6.246 -1.804 0.254 282 HA3 GLY 35 HA1 GLY 35 -5.128 -3.002 -0.415 283 H GLY 36 HN GLY 36 -8.202 -2.176 -0.431 284 HA2 GLY 36 HA2 GLY 36 -9.352 -4.116 -1.755 285 HA3 GLY 36 HA1 GLY 36 -9.241 -4.943 -0.203 286 H ILE 37 HN ILE 37 -9.614 -2.045 0.885 287 HA ILE 37 HA ILE 37 -11.909 -2.828 2.182 288 HB ILE 37 HB ILE 37 -12.104 -0.597 3.100 289 HG12 ILE 37 HG12 ILE 37 -10.295 0.123 0.808 290 HG13 ILE 37 HG11 ILE 37 -11.847 0.823 1.234 291 HG21 ILE 37 HG21 ILE 37 -9.839 -0.368 4.003 292 HG22 ILE 37 HG22 ILE 37 -9.236 -1.446 2.744 293 HG23 ILE 37 HG23 ILE 37 -10.359 -2.053 3.962 294 HD11 ILE 37 HD11 ILE 37 -9.284 1.144 2.748 295 HD12 ILE 37 HD12 ILE 37 -10.837 1.846 3.201 296 HD13 ILE 37 HD13 ILE 37 -10.044 2.337 1.703 297 H ASP 38 HN ASP 38 -11.791 -0.478 -0.461 298 HA ASP 38 HA ASP 38 -14.582 -1.199 -1.060 299 HB2 ASP 38 HB2 ASP 38 -14.096 1.139 0.110 300 HB3 ASP 38 HB1 ASP 38 -13.624 1.606 -1.519 301 H GLN 39 HN GLN 39 -11.531 -1.402 -1.940 302 HA GLN 39 HA GLN 39 -11.887 -0.402 -4.672 303 HB2 GLN 39 HB2 GLN 39 -9.376 -0.514 -4.772 304 HB3 GLN 39 HB1 GLN 39 -10.079 0.699 -3.711 305 HG2 GLN 39 HG2 GLN 39 -9.470 -1.918 -2.508 306 HG3 GLN 39 HG1 GLN 39 -8.105 -0.919 -2.976 307 HE21 GLN 39 HE21 GLN 39 -9.829 1.484 -2.546 308 HE22 GLN 39 HE22 GLN 39 -9.847 1.701 -0.843 309 H ASP 40 HN ASP 40 -11.588 -3.309 -2.995 310 HA ASP 40 HA ASP 40 -10.017 -4.853 -4.648 311 HB2 ASP 40 HB2 ASP 40 -10.496 -6.082 -2.802 312 HB3 ASP 40 HB1 ASP 40 -12.101 -5.384 -2.627 313 HA PRO 41 HA PRO 41 -12.079 -4.652 -8.464 314 HB2 PRO 41 HB2 PRO 41 -10.992 -6.884 -9.598 315 HB3 PRO 41 HB1 PRO 41 -10.095 -5.376 -9.368 316 HG2 PRO 41 HG2 PRO 41 -10.147 -7.817 -7.621 317 HG3 PRO 41 HG1 PRO 41 -8.757 -6.904 -8.199 318 HD2 PRO 41 HD2 PRO 41 -9.669 -6.518 -5.745 319 HD3 PRO 41 HD1 PRO 41 -9.145 -5.125 -6.709 320 H SER 42 HN SER 42 -12.366 -7.327 -6.335 321 HA SER 42 HA SER 42 -14.307 -8.786 -7.840 322 HB2 SER 42 HB2 SER 42 -13.983 -8.842 -4.839 323 HB3 SER 42 HB1 SER 42 -14.568 -10.127 -5.899 324 HG SER 42 HG SER 42 -11.966 -9.260 -5.378 325 H GLN 43 HN GLN 43 -14.440 -6.284 -5.292 326 HA GLN 43 HA GLN 43 -17.362 -6.258 -5.498 327 HB2 GLN 43 HB2 GLN 43 -17.284 -5.090 -3.414 328 HB3 GLN 43 HB1 GLN 43 -16.196 -6.465 -3.320 329 HG2 GLN 43 HG2 GLN 43 -14.350 -4.814 -3.897 330 HG3 GLN 43 HG1 GLN 43 -15.522 -3.559 -3.491 331 HE21 GLN 43 HE21 GLN 43 -13.651 -6.231 -2.319 332 HE22 GLN 43 HE22 GLN 43 -13.820 -5.891 -0.606 333 H ASN 44 HN ASN 44 -14.594 -4.662 -6.485 334 HA ASN 44 HA ASN 44 -16.135 -2.415 -7.634 335 HB2 ASN 44 HB2 ASN 44 -14.855 -1.829 -5.463 336 HB3 ASN 44 HB1 ASN 44 -13.407 -1.959 -6.469 337 HD21 ASN 44 HD21 ASN 44 -14.638 0.343 -5.120 338 HD22 ASN 44 HD22 ASN 44 -14.893 1.520 -6.364 339 HA PRO 45 HA PRO 45 -13.679 -4.544 -10.867 340 HB2 PRO 45 HB2 PRO 45 -15.413 -3.860 -12.871 341 HB3 PRO 45 HB1 PRO 45 -15.608 -5.305 -11.861 342 HG2 PRO 45 HG2 PRO 45 -16.940 -2.632 -11.639 343 HG3 PRO 45 HG1 PRO 45 -17.642 -4.250 -11.457 344 HD2 PRO 45 HD2 PRO 45 -17.009 -2.718 -9.334 345 HD3 PRO 45 HD1 PRO 45 -16.853 -4.486 -9.295 346 H PHE 46 HN PHE 46 -14.559 -1.368 -10.176 347 HA PHE 46 HA PHE 46 -13.120 -0.223 -12.444 348 HB2 PHE 46 HB2 PHE 46 -14.577 1.129 -10.161 349 HB3 PHE 46 HB1 PHE 46 -13.888 1.944 -11.570 350 HD1 PHE 46 HD2 PHE 46 -14.847 1.439 -13.838 351 HD2 PHE 46 HD1 PHE 46 -16.735 0.209 -10.226 352 HE1 PHE 46 HE2 PHE 46 -16.964 1.129 -15.053 353 HE2 PHE 46 HE1 PHE 46 -18.855 -0.093 -11.433 354 HZ PHE 46 HZ PHE 46 -18.987 0.375 -13.827 355 H SER 47 HN SER 47 -13.141 0.281 -8.892 356 HA SER 47 HA SER 47 -10.607 -0.128 -8.148 357 HB2 SER 47 HB2 SER 47 -10.074 1.455 -10.107 358 HB3 SER 47 HB1 SER 47 -10.664 2.739 -9.073 359 HG SER 47 HG SER 47 -8.696 0.937 -8.166 360 H GLU 48 HN GLU 48 -12.186 2.984 -8.233 361 HA GLU 48 HA GLU 48 -13.710 2.921 -5.970 362 HB2 GLU 48 HB2 GLU 48 -11.326 2.530 -5.056 363 HB3 GLU 48 HB1 GLU 48 -11.103 4.253 -5.353 364 HG2 GLU 48 HG2 GLU 48 -13.317 3.125 -3.691 365 HG3 GLU 48 HG1 GLU 48 -11.774 3.643 -3.015 366 H ASP 49 HN ASP 49 -11.162 5.087 -7.037 367 HA ASP 49 HA ASP 49 -13.206 6.955 -8.030 368 HB2 ASP 49 HB2 ASP 49 -12.145 8.064 -6.208 369 HB3 ASP 49 HB1 ASP 49 -10.551 7.508 -6.705 370 H LYS 50 HN LYS 50 -9.738 6.941 -8.431 371 HA LYS 50 HA LYS 50 -9.624 5.366 -10.741 372 HB2 LYS 50 HB2 LYS 50 -9.653 6.766 -12.498 373 HB3 LYS 50 HB1 LYS 50 -10.691 7.697 -11.442 374 HG2 LYS 50 HG2 LYS 50 -7.751 8.218 -11.524 375 HG3 LYS 50 HG1 LYS 50 -8.814 8.883 -12.764 376 HD2 LYS 50 HD2 LYS 50 -9.183 9.292 -9.801 377 HD3 LYS 50 HD1 LYS 50 -8.371 10.433 -10.871 378 HE2 LYS 50 HE2 LYS 50 -10.387 10.776 -12.122 379 HE3 LYS 50 HE1 LYS 50 -11.213 9.503 -11.223 380 HZ1 LYS 50 HZ1 LYS 50 -11.747 11.789 -10.470 381 HZ2 LYS 50 HZ2 LYS 50 -10.139 11.978 -9.983 382 HZ3 LYS 50 HZ3 LYS 50 -11.119 10.797 -9.245 383 H THR 51 HN THR 51 -8.297 8.026 -8.925 384 HA THR 51 HA THR 51 -5.612 7.063 -9.453 385 HB THR 51 HB THR 51 -5.921 9.469 -9.627 386 HG1 THR 51 HG1 THR 51 -4.406 8.557 -7.406 387 HG21 THR 51 HG21 THR 51 -6.597 10.840 -7.744 388 HG22 THR 51 HG22 THR 51 -6.784 9.404 -6.738 389 HG23 THR 51 HG23 THR 51 -7.853 9.657 -8.119 390 H ASP 52 HN ASP 52 -8.008 6.089 -7.614 391 HA ASP 52 HA ASP 52 -6.806 6.241 -4.988 392 HB2 ASP 52 HB2 ASP 52 -9.284 6.101 -5.260 393 HB3 ASP 52 HB1 ASP 52 -9.101 4.431 -5.816 394 H LYS 53 HN LYS 53 -7.726 3.386 -6.866 395 HA LYS 53 HA LYS 53 -6.688 1.417 -7.311 396 HB2 LYS 53 HB2 LYS 53 -4.309 2.698 -5.959 397 HB3 LYS 53 HB1 LYS 53 -4.311 1.018 -6.470 398 HG2 LYS 53 HG2 LYS 53 -3.263 2.099 -8.219 399 HG3 LYS 53 HG1 LYS 53 -4.922 1.942 -8.787 400 HD2 LYS 53 HD2 LYS 53 -5.390 4.230 -8.290 401 HD3 LYS 53 HD1 LYS 53 -3.849 4.419 -7.451 402 HE2 LYS 53 HE2 LYS 53 -4.206 3.857 -10.394 403 HE3 LYS 53 HE1 LYS 53 -3.788 5.416 -9.687 404 HZ1 LYS 53 HZ1 LYS 53 -1.761 4.368 -8.793 405 HZ2 LYS 53 HZ2 LYS 53 -1.811 4.360 -10.488 406 HZ3 LYS 53 HZ3 LYS 53 -2.149 2.945 -9.620 407 H GLY 54 HN GLY 54 -6.023 2.738 -4.135 408 HA2 GLY 54 HA2 GLY 54 -7.034 2.186 -2.174 409 HA3 GLY 54 HA1 GLY 54 -7.878 0.886 -2.996 410 H ILE 55 HN ILE 55 -4.467 1.076 -3.267 411 HA ILE 55 HA ILE 55 -4.129 -1.139 -1.354 412 HB ILE 55 HB ILE 55 -2.791 -0.835 -4.052 413 HG12 ILE 55 HG12 ILE 55 -5.110 -1.583 -4.240 414 HG13 ILE 55 HG11 ILE 55 -3.991 -2.865 -4.688 415 HG21 ILE 55 HG21 ILE 55 -1.832 -3.081 -3.582 416 HG22 ILE 55 HG22 ILE 55 -2.417 -2.928 -1.926 417 HG23 ILE 55 HG23 ILE 55 -1.216 -1.795 -2.545 418 HD11 ILE 55 HD11 ILE 55 -4.319 -3.903 -2.489 419 HD12 ILE 55 HD12 ILE 55 -5.828 -3.747 -3.388 420 HD13 ILE 55 HD13 ILE 55 -5.478 -2.632 -2.067 421 H TYR 56 HN TYR 56 -2.943 -0.345 0.279 422 HA TYR 56 HA TYR 56 -0.444 0.999 -0.319 423 HB2 TYR 56 HB2 TYR 56 -0.905 2.925 1.127 424 HB3 TYR 56 HB1 TYR 56 -2.015 2.880 -0.235 425 HD1 TYR 56 HD1 TYR 56 -4.361 2.020 0.163 426 HD2 TYR 56 HD2 TYR 56 -1.693 2.974 3.334 427 HE1 TYR 56 HE1 TYR 56 -6.270 2.190 1.707 428 HE2 TYR 56 HE2 TYR 56 -3.590 3.140 4.891 429 HH TYR 56 HH TYR 56 -6.682 2.001 4.154 430 H VAL 57 HN VAL 57 0.982 1.128 1.533 431 HA VAL 57 HA VAL 57 0.698 -1.055 3.299 432 HB VAL 57 HB VAL 57 2.811 0.032 2.326 433 HG11 VAL 57 HG11 VAL 57 2.178 1.918 4.456 434 HG12 VAL 57 HG12 VAL 57 3.008 2.166 2.910 435 HG13 VAL 57 HG13 VAL 57 3.859 1.431 4.267 436 HG21 VAL 57 HG21 VAL 57 2.706 -0.829 5.167 437 HG22 VAL 57 HG22 VAL 57 4.150 -0.806 4.154 438 HG23 VAL 57 HG23 VAL 57 2.806 -1.879 3.757 439 H THR 58 HN THR 58 0.056 -1.094 5.308 440 HA THR 58 HA THR 58 -1.137 1.317 6.455 441 HB THR 58 HB THR 58 -2.247 -0.395 7.983 442 HG1 THR 58 HG1 THR 58 -1.870 -2.485 7.623 443 HG21 THR 58 HG21 THR 58 -3.857 -1.086 6.268 444 HG22 THR 58 HG22 THR 58 -2.707 -0.601 5.021 445 HG23 THR 58 HG23 THR 58 -3.407 0.614 6.091 446 H ARG 59 HN ARG 59 1.244 -1.115 6.883 447 HA ARG 59 HA ARG 59 2.522 0.390 8.945 448 HB2 ARG 59 HB2 ARG 59 2.655 -1.678 10.402 449 HB3 ARG 59 HB1 ARG 59 1.208 -0.691 10.508 450 HG2 ARG 59 HG2 ARG 59 0.048 -2.314 9.103 451 HG3 ARG 59 HG1 ARG 59 1.549 -3.247 8.982 452 HD2 ARG 59 HD2 ARG 59 1.335 -4.112 11.044 453 HD3 ARG 59 HD1 ARG 59 0.741 -2.599 11.723 454 HE ARG 59 HE ARG 59 -1.228 -3.818 10.072 455 HH11 ARG 59 HH11 ARG 59 0.292 -4.022 13.222 456 HH12 ARG 59 HH12 ARG 59 -1.082 -4.759 13.988 457 HH21 ARG 59 HH21 ARG 59 -3.056 -4.780 11.073 458 HH22 ARG 59 HH22 ARG 59 -2.976 -5.202 12.769 459 H VAL 60 HN VAL 60 4.365 -0.909 9.844 460 HA VAL 60 HA VAL 60 5.683 -2.623 7.950 461 HB VAL 60 HB VAL 60 6.832 0.005 8.932 462 HG11 VAL 60 HG11 VAL 60 8.846 -0.666 7.645 463 HG12 VAL 60 HG12 VAL 60 8.103 -2.257 7.432 464 HG13 VAL 60 HG13 VAL 60 8.492 -1.678 9.046 465 HG21 VAL 60 HG21 VAL 60 5.496 0.496 7.045 466 HG22 VAL 60 HG22 VAL 60 6.063 -0.941 6.185 467 HG23 VAL 60 HG23 VAL 60 7.157 0.418 6.454 468 H SER 61 HN SER 61 6.936 -4.093 9.070 469 HA SER 61 HA SER 61 6.927 -3.948 11.947 470 HB2 SER 61 HB2 SER 61 8.726 -5.879 11.509 471 HB3 SER 61 HB1 SER 61 6.984 -6.146 11.427 472 HG SER 61 HG SER 61 7.100 -6.354 9.311 473 H GLU 62 HN GLU 62 8.064 -2.407 12.833 474 HA GLU 62 HA GLU 62 9.904 -0.939 11.414 475 HB2 GLU 62 HB2 GLU 62 8.580 -0.768 13.951 476 HB3 GLU 62 HB1 GLU 62 10.205 -0.163 14.026 477 HG2 GLU 62 HG2 GLU 62 9.626 1.189 11.952 478 HG3 GLU 62 HG1 GLU 62 7.951 0.766 12.286 479 H GLY 63 HN GLY 63 11.850 -0.522 11.683 480 HA2 GLY 63 HA2 GLY 63 14.113 -0.947 11.864 481 HA3 GLY 63 HA1 GLY 63 13.747 -1.811 13.362 482 H GLY 64 HN GLY 64 12.331 -2.565 10.225 483 HA2 GLY 64 HA2 GLY 64 13.643 -5.189 10.474 484 HA3 GLY 64 HA1 GLY 64 11.997 -4.938 9.909 485 HA PRO 65 HA PRO 65 14.069 -5.257 6.025 486 HB2 PRO 65 HB2 PRO 65 11.980 -6.225 4.743 487 HB3 PRO 65 HB1 PRO 65 12.845 -7.190 5.938 488 HG2 PRO 65 HG2 PRO 65 10.183 -5.926 6.094 489 HG3 PRO 65 HG1 PRO 65 10.806 -7.336 6.963 490 HD2 PRO 65 HD2 PRO 65 10.600 -4.640 7.901 491 HD3 PRO 65 HD1 PRO 65 11.292 -6.044 8.747 492 H ALA 66 HN ALA 66 10.963 -3.656 6.431 493 HA ALA 66 HA ALA 66 10.781 -3.152 3.574 494 HB1 ALA 66 HB1 ALA 66 8.789 -3.750 4.877 495 HB2 ALA 66 HB2 ALA 66 8.615 -2.178 4.097 496 HB3 ALA 66 HB3 ALA 66 8.968 -2.273 5.819 497 H GLU 67 HN GLU 67 11.511 -1.509 6.511 498 HA GLU 67 HA GLU 67 11.197 1.152 5.410 499 HB2 GLU 67 HB2 GLU 67 12.204 1.738 7.641 500 HB3 GLU 67 HB1 GLU 67 10.666 0.872 7.684 501 HG2 GLU 67 HG2 GLU 67 12.992 -0.819 7.571 502 HG3 GLU 67 HG1 GLU 67 12.895 0.148 9.033 503 H ILE 68 HN ILE 68 13.676 -1.225 5.902 504 HA ILE 68 HA ILE 68 15.777 0.676 5.679 505 HB ILE 68 HB ILE 68 17.189 -1.282 5.642 506 HG12 ILE 68 HG12 ILE 68 15.629 -3.290 6.679 507 HG13 ILE 68 HG11 ILE 68 14.680 -2.653 5.345 508 HG21 ILE 68 HG21 ILE 68 15.264 -1.004 7.904 509 HG22 ILE 68 HG22 ILE 68 16.801 -0.160 7.706 510 HG23 ILE 68 HG23 ILE 68 16.781 -1.896 8.020 511 HD11 ILE 68 HD11 ILE 68 17.513 -3.660 5.173 512 HD12 ILE 68 HD12 ILE 68 16.560 -3.019 3.832 513 HD13 ILE 68 HD13 ILE 68 16.067 -4.514 4.630 514 H ALA 69 HN ALA 69 13.994 -1.550 3.870 515 HA ALA 69 HA ALA 69 15.437 -1.314 1.446 516 HB1 ALA 69 HB1 ALA 69 13.350 -2.084 0.374 517 HB2 ALA 69 HB2 ALA 69 12.511 -1.890 1.912 518 HB3 ALA 69 HB3 ALA 69 13.795 -3.089 1.754 519 H GLY 70 HN GLY 70 13.219 0.601 3.236 520 HA2 GLY 70 HA2 GLY 70 13.411 3.030 2.885 521 HA3 GLY 70 HA1 GLY 70 13.426 2.704 1.152 522 H LEU 71 HN LEU 71 11.245 1.352 3.633 523 HA LEU 71 HA LEU 71 8.999 2.590 2.212 524 HB2 LEU 71 HB2 LEU 71 9.287 0.055 2.247 525 HB3 LEU 71 HB1 LEU 71 9.010 0.144 3.980 526 HG LEU 71 HG LEU 71 6.790 1.282 3.396 527 HD11 LEU 71 HD11 LEU 71 7.305 1.716 1.037 528 HD12 LEU 71 HD12 LEU 71 5.861 0.721 1.225 529 HD13 LEU 71 HD13 LEU 71 7.387 -0.022 0.743 530 HD21 LEU 71 HD21 LEU 71 7.294 -1.601 2.726 531 HD22 LEU 71 HD22 LEU 71 5.732 -0.904 3.172 532 HD23 LEU 71 HD23 LEU 71 7.059 -0.934 4.338 533 H GLN 72 HN GLN 72 7.076 2.401 3.948 534 HA GLN 72 HA GLN 72 7.766 3.615 6.450 535 HB2 GLN 72 HB2 GLN 72 6.570 5.120 4.162 536 HB3 GLN 72 HB1 GLN 72 6.428 5.660 5.823 537 HG2 GLN 72 HG2 GLN 72 8.876 5.875 5.918 538 HG3 GLN 72 HG1 GLN 72 8.954 5.423 4.205 539 HE21 GLN 72 HE21 GLN 72 6.435 6.620 3.585 540 HE22 GLN 72 HE22 GLN 72 6.622 8.342 3.668 541 H ILE 73 HN ILE 73 5.600 4.583 7.273 542 HA ILE 73 HA ILE 73 3.519 2.633 6.895 543 HB ILE 73 HB ILE 73 3.338 5.000 8.717 544 HG12 ILE 73 HG12 ILE 73 5.537 4.167 9.244 545 HG13 ILE 73 HG11 ILE 73 4.440 3.583 10.489 546 HG21 ILE 73 HG21 ILE 73 2.363 2.173 8.815 547 HG22 ILE 73 HG22 ILE 73 1.410 3.622 8.497 548 HG23 ILE 73 HG23 ILE 73 2.120 3.365 10.091 549 HD11 ILE 73 HD11 ILE 73 5.977 1.841 9.857 550 HD12 ILE 73 HD12 ILE 73 5.520 2.007 8.155 551 HD13 ILE 73 HD13 ILE 73 4.349 1.403 9.338 552 H GLY 74 HN GLY 74 2.268 3.029 5.117 553 HA2 GLY 74 HA2 GLY 74 0.107 4.037 4.694 554 HA3 GLY 74 HA1 GLY 74 0.732 5.545 5.336 555 H ASP 75 HN ASP 75 1.588 3.242 2.734 556 HA ASP 75 HA ASP 75 1.713 5.499 0.872 557 HB2 ASP 75 HB2 ASP 75 3.954 3.544 1.353 558 HB3 ASP 75 HB1 ASP 75 3.856 4.632 -0.013 559 H LYS 76 HN LYS 76 1.431 4.852 -1.320 560 HA LYS 76 HA LYS 76 -0.289 2.504 -1.328 561 HB2 LYS 76 HB2 LYS 76 -0.074 4.682 -3.407 562 HB3 LYS 76 HB1 LYS 76 -1.248 3.379 -3.402 563 HG2 LYS 76 HG2 LYS 76 -2.553 4.970 -2.502 564 HG3 LYS 76 HG1 LYS 76 -1.777 4.452 -1.006 565 HD2 LYS 76 HD2 LYS 76 -0.150 6.245 -1.206 566 HD3 LYS 76 HD1 LYS 76 -0.858 6.733 -2.749 567 HE2 LYS 76 HE2 LYS 76 -2.298 6.737 -0.091 568 HE3 LYS 76 HE1 LYS 76 -1.613 8.157 -0.880 569 HZ1 LYS 76 HZ1 LYS 76 -3.134 7.797 -2.747 570 HZ2 LYS 76 HZ2 LYS 76 -3.984 8.002 -1.299 571 HZ3 LYS 76 HZ3 LYS 76 -3.810 6.454 -1.962 572 H ILE 77 HN ILE 77 0.670 0.714 -1.850 573 HA ILE 77 HA ILE 77 2.841 0.499 -3.690 574 HB ILE 77 HB ILE 77 1.061 -1.690 -2.619 575 HG12 ILE 77 HG12 ILE 77 3.734 -0.751 -1.571 576 HG13 ILE 77 HG11 ILE 77 2.189 -0.270 -0.877 577 HG21 ILE 77 HG21 ILE 77 3.838 -1.802 -3.794 578 HG22 ILE 77 HG22 ILE 77 2.361 -2.351 -4.584 579 HG23 ILE 77 HG23 ILE 77 2.939 -3.168 -3.131 580 HD11 ILE 77 HD11 ILE 77 3.234 -2.084 0.369 581 HD12 ILE 77 HD12 ILE 77 3.205 -3.094 -1.077 582 HD13 ILE 77 HD13 ILE 77 1.692 -2.572 -0.335 583 H MET 78 HN MET 78 2.722 0.497 -5.822 584 HA MET 78 HA MET 78 0.046 0.121 -7.028 585 HB2 MET 78 HB2 MET 78 2.429 1.553 -8.197 586 HB3 MET 78 HB1 MET 78 0.797 1.524 -8.842 587 HG2 MET 78 HG2 MET 78 1.403 2.613 -6.133 588 HG3 MET 78 HG1 MET 78 1.549 3.601 -7.582 589 HE1 MET 78 HE1 MET 78 -1.011 1.044 -5.920 590 HE2 MET 78 HE2 MET 78 -2.340 2.162 -5.593 591 HE3 MET 78 HE3 MET 78 -0.779 2.391 -4.805 592 H GLN 79 HN GLN 79 3.188 -1.186 -6.889 593 HA GLN 79 HA GLN 79 2.512 -3.184 -8.867 594 HB2 GLN 79 HB2 GLN 79 3.877 -2.436 -10.464 595 HB3 GLN 79 HB1 GLN 79 4.132 -0.993 -9.519 596 HG2 GLN 79 HG2 GLN 79 5.980 -2.076 -8.362 597 HG3 GLN 79 HG1 GLN 79 5.762 -3.498 -9.393 598 HE21 GLN 79 HE21 GLN 79 5.217 -2.061 -11.746 599 HE22 GLN 79 HE22 GLN 79 6.676 -1.316 -12.288 600 H VAL 80 HN VAL 80 3.963 -4.936 -8.969 601 HA VAL 80 HA VAL 80 5.647 -5.217 -6.577 602 HB VAL 80 HB VAL 80 3.477 -5.824 -5.745 603 HG11 VAL 80 HG11 VAL 80 3.389 -7.838 -7.983 604 HG12 VAL 80 HG12 VAL 80 2.364 -6.411 -7.790 605 HG13 VAL 80 HG13 VAL 80 2.236 -7.753 -6.646 606 HG21 VAL 80 HG21 VAL 80 5.237 -8.263 -6.193 607 HG22 VAL 80 HG22 VAL 80 4.028 -8.097 -4.913 608 HG23 VAL 80 HG23 VAL 80 5.459 -7.057 -4.920 609 H ASN 81 HN ASN 81 7.360 -6.504 -6.918 610 HA ASN 81 HA ASN 81 8.756 -8.011 -7.873 611 HB2 ASN 81 HB2 ASN 81 6.086 -9.060 -8.647 612 HB3 ASN 81 HB1 ASN 81 7.459 -9.642 -9.577 613 HD21 ASN 81 HD21 ASN 81 7.766 -8.808 -6.184 614 HD22 ASN 81 HD22 ASN 81 7.961 -10.432 -5.615 615 H GLY 82 HN GLY 82 7.184 -5.619 -9.340 616 HA2 GLY 82 HA2 GLY 82 8.602 -4.317 -10.860 617 HA3 GLY 82 HA1 GLY 82 8.857 -5.807 -11.753 618 H TRP 83 HN TRP 83 5.625 -5.636 -10.731 619 HA TRP 83 HA TRP 83 4.865 -4.307 -13.170 620 HB2 TRP 83 HB2 TRP 83 3.187 -6.024 -13.506 621 HB3 TRP 83 HB1 TRP 83 4.819 -6.598 -13.708 622 HD1 TRP 83 HD1 TRP 83 5.769 -8.101 -11.698 623 HE1 TRP 83 HE1 TRP 83 4.513 -9.730 -10.189 624 HE3 TRP 83 HE3 TRP 83 1.018 -6.519 -12.541 625 HZ2 TRP 83 HZ2 TRP 83 1.883 -10.340 -9.479 626 HZ3 TRP 83 HZ3 TRP 83 -0.830 -7.698 -11.416 627 HH2 TRP 83 HH2 TRP 83 -0.375 -9.573 -9.918 628 H ASP 84 HN ASP 84 3.385 -2.986 -12.984 629 HA ASP 84 HA ASP 84 1.997 -2.049 -10.869 630 HB2 ASP 84 HB2 ASP 84 2.007 -1.000 -13.079 631 HB3 ASP 84 HB1 ASP 84 0.974 -2.279 -13.707 632 H MET 85 HN MET 85 0.817 -3.059 -9.442 633 HA MET 85 HA MET 85 -0.823 -5.387 -10.193 634 HB2 MET 85 HB2 MET 85 -0.786 -5.802 -7.720 635 HB3 MET 85 HB1 MET 85 0.772 -5.911 -8.527 636 HG2 MET 85 HG2 MET 85 1.600 -4.439 -7.107 637 HG3 MET 85 HG1 MET 85 0.458 -3.233 -7.693 638 HE1 MET 85 HE1 MET 85 1.070 -6.116 -5.148 639 HE2 MET 85 HE2 MET 85 -0.446 -6.567 -5.928 640 HE3 MET 85 HE3 MET 85 -0.437 -6.101 -4.222 641 H THR 86 HN THR 86 -1.762 -2.612 -10.570 642 HA THR 86 HA THR 86 -3.202 -1.699 -8.334 643 HB THR 86 HB THR 86 -4.344 -0.157 -9.952 644 HG1 THR 86 HG1 THR 86 -2.515 -1.103 -11.902 645 HG21 THR 86 HG21 THR 86 -2.290 0.488 -8.816 646 HG22 THR 86 HG22 THR 86 -2.300 1.102 -10.467 647 HG23 THR 86 HG23 THR 86 -1.330 -0.313 -10.060 648 H MET 87 HN MET 87 -4.312 -3.468 -11.194 649 HA MET 87 HA MET 87 -7.022 -3.455 -10.104 650 HB2 MET 87 HB2 MET 87 -7.779 -4.116 -12.261 651 HB3 MET 87 HB1 MET 87 -6.600 -2.838 -12.466 652 HG2 MET 87 HG2 MET 87 -4.916 -4.464 -13.113 653 HG3 MET 87 HG1 MET 87 -6.075 -5.770 -12.867 654 HE1 MET 87 HE1 MET 87 -5.754 -5.719 -16.762 655 HE2 MET 87 HE2 MET 87 -5.771 -6.742 -15.325 656 HE3 MET 87 HE3 MET 87 -4.494 -5.545 -15.537 657 H VAL 88 HN VAL 88 -4.625 -5.092 -9.306 658 HA VAL 88 HA VAL 88 -5.615 -7.822 -9.524 659 HB VAL 88 HB VAL 88 -3.170 -6.534 -8.298 660 HG11 VAL 88 HG11 VAL 88 -2.359 -8.715 -7.690 661 HG12 VAL 88 HG12 VAL 88 -3.827 -9.474 -8.328 662 HG13 VAL 88 HG13 VAL 88 -3.920 -8.420 -6.914 663 HG21 VAL 88 HG21 VAL 88 -3.154 -6.703 -10.713 664 HG22 VAL 88 HG22 VAL 88 -3.516 -8.427 -10.619 665 HG23 VAL 88 HG23 VAL 88 -1.974 -7.811 -10.017 666 H THR 89 HN THR 89 -5.837 -9.093 -7.294 667 HA THR 89 HA THR 89 -6.996 -7.127 -5.423 668 HB THR 89 HB THR 89 -8.547 -8.921 -6.299 669 HG1 THR 89 HG1 THR 89 -9.671 -8.382 -4.564 670 HG21 THR 89 HG21 THR 89 -8.609 -11.047 -5.205 671 HG22 THR 89 HG22 THR 89 -7.198 -10.623 -4.245 672 HG23 THR 89 HG23 THR 89 -7.040 -10.843 -5.987 673 H HIS 90 HN HIS 90 -7.008 -8.007 -3.080 674 HA HIS 90 HA HIS 90 -4.241 -7.947 -2.421 675 HB2 HIS 90 HB2 HIS 90 -6.233 -6.954 -1.119 676 HB3 HIS 90 HB1 HIS 90 -6.402 -8.583 -0.458 677 HD1 HIS 90 HD1 HIS 90 -3.259 -9.107 -0.284 678 HD2 HIS 90 HD2 HIS 90 -5.283 -5.811 1.227 679 HE1 HIS 90 HE1 HIS 90 -1.792 -8.190 1.528 680 HE2 HIS 90 HE2 HIS 90 -3.140 -6.336 2.569 681 H ASP 91 HN ASP 91 -6.677 -10.446 -2.558 682 HA ASP 91 HA ASP 91 -5.109 -12.420 -1.166 683 HB2 ASP 91 HB2 ASP 91 -7.491 -12.781 -1.260 684 HB3 ASP 91 HB1 ASP 91 -7.485 -12.640 -3.020 685 H GLN 92 HN GLN 92 -5.975 -11.808 -4.469 686 HA GLN 92 HA GLN 92 -4.456 -13.301 -6.033 687 HB2 GLN 92 HB2 GLN 92 -6.067 -11.513 -6.616 688 HB3 GLN 92 HB1 GLN 92 -4.861 -10.319 -6.172 689 HG2 GLN 92 HG2 GLN 92 -5.032 -10.615 -8.556 690 HG3 GLN 92 HG1 GLN 92 -3.462 -11.038 -7.913 691 HE21 GLN 92 HE21 GLN 92 -6.253 -12.975 -7.574 692 HE22 GLN 92 HE22 GLN 92 -5.709 -14.235 -8.584 693 H ALA 93 HN ALA 93 -3.403 -10.202 -4.651 694 HA ALA 93 HA ALA 93 -0.733 -10.436 -5.563 695 HB1 ALA 93 HB1 ALA 93 -0.337 -8.436 -4.271 696 HB2 ALA 93 HB2 ALA 93 -1.868 -8.652 -3.418 697 HB3 ALA 93 HB3 ALA 93 -1.863 -8.293 -5.145 698 H ARG 94 HN ARG 94 -2.415 -11.305 -2.601 699 HA ARG 94 HA ARG 94 -0.078 -11.315 -1.000 700 HB2 ARG 94 HB2 ARG 94 -1.444 -11.773 0.785 701 HB3 ARG 94 HB1 ARG 94 -2.629 -11.131 -0.347 702 HG2 ARG 94 HG2 ARG 94 -3.208 -13.458 -0.972 703 HG3 ARG 94 HG1 ARG 94 -2.117 -14.010 0.314 704 HD2 ARG 94 HD2 ARG 94 -3.461 -13.153 1.999 705 HD3 ARG 94 HD1 ARG 94 -4.287 -12.040 0.906 706 HE ARG 94 HE ARG 94 -5.099 -14.356 -0.089 707 HH11 ARG 94 HH11 ARG 94 -4.841 -13.351 3.265 708 HH12 ARG 94 HH12 ARG 94 -6.190 -14.322 3.772 709 HH21 ARG 94 HH21 ARG 94 -6.863 -15.593 0.568 710 HH22 ARG 94 HH22 ARG 94 -7.343 -15.604 2.248 711 H LYS 95 HN LYS 95 -1.859 -13.835 -2.717 712 HA LYS 95 HA LYS 95 -0.175 -15.910 -1.671 713 HB2 LYS 95 HB2 LYS 95 -1.335 -17.387 -3.272 714 HB3 LYS 95 HB1 LYS 95 -2.445 -16.480 -2.260 715 HG2 LYS 95 HG2 LYS 95 -2.782 -14.893 -4.141 716 HG3 LYS 95 HG1 LYS 95 -1.771 -15.936 -5.139 717 HD2 LYS 95 HD2 LYS 95 -4.256 -16.278 -5.377 718 HD3 LYS 95 HD1 LYS 95 -3.329 -17.731 -4.992 719 HE2 LYS 95 HE2 LYS 95 -4.017 -17.657 -2.707 720 HE3 LYS 95 HE1 LYS 95 -4.686 -16.039 -2.903 721 HZ1 LYS 95 HZ1 LYS 95 -6.313 -17.953 -2.862 722 HZ2 LYS 95 HZ2 LYS 95 -5.754 -18.360 -4.409 723 HZ3 LYS 95 HZ3 LYS 95 -6.476 -16.848 -4.130 724 H ARG 96 HN ARG 96 -0.043 -13.713 -4.357 725 HA ARG 96 HA ARG 96 1.853 -15.428 -5.749 726 HB2 ARG 96 HB2 ARG 96 1.763 -13.863 -7.561 727 HB3 ARG 96 HB1 ARG 96 0.124 -14.186 -7.021 728 HG2 ARG 96 HG2 ARG 96 0.033 -11.927 -7.288 729 HG3 ARG 96 HG1 ARG 96 0.528 -12.015 -5.594 730 HD2 ARG 96 HD2 ARG 96 1.870 -10.399 -6.797 731 HD3 ARG 96 HD1 ARG 96 2.860 -11.766 -6.263 732 HE ARG 96 HE ARG 96 1.809 -11.623 -9.012 733 HH11 ARG 96 HH11 ARG 96 4.488 -12.062 -6.791 734 HH12 ARG 96 HH12 ARG 96 5.643 -12.338 -8.054 735 HH21 ARG 96 HH21 ARG 96 3.320 -12.010 -10.667 736 HH22 ARG 96 HH22 ARG 96 4.981 -12.331 -10.247 737 H LEU 97 HN LEU 97 1.866 -12.729 -3.570 738 HA LEU 97 HA LEU 97 4.580 -11.975 -4.090 739 HB2 LEU 97 HB2 LEU 97 4.421 -10.662 -2.057 740 HB3 LEU 97 HB1 LEU 97 3.070 -10.351 -3.123 741 HG LEU 97 HG LEU 97 1.815 -12.055 -1.598 742 HD11 LEU 97 HD11 LEU 97 2.604 -12.122 0.684 743 HD12 LEU 97 HD12 LEU 97 4.005 -11.138 0.260 744 HD13 LEU 97 HD13 LEU 97 3.839 -12.766 -0.397 745 HD21 LEU 97 HD21 LEU 97 1.279 -10.223 0.005 746 HD22 LEU 97 HD22 LEU 97 1.158 -9.765 -1.696 747 HD23 LEU 97 HD23 LEU 97 2.558 -9.260 -0.743 748 H THR 98 HN THR 98 2.975 -14.312 -2.110 749 HA THR 98 HA THR 98 5.544 -15.135 -0.963 750 HB THR 98 HB THR 98 4.022 -16.871 0.216 751 HG1 THR 98 HG1 THR 98 2.040 -14.925 -0.414 752 HG21 THR 98 HG21 THR 98 5.081 -15.018 1.383 753 HG22 THR 98 HG22 THR 98 3.432 -15.251 1.966 754 HG23 THR 98 HG23 THR 98 3.795 -13.931 0.855 755 H LYS 99 HN LYS 99 5.439 -15.492 -3.707 756 HA LYS 99 HA LYS 99 4.325 -18.005 -4.431 757 HB2 LYS 99 HB2 LYS 99 5.495 -17.729 -6.556 758 HB3 LYS 99 HB1 LYS 99 4.680 -16.233 -6.109 759 HG2 LYS 99 HG2 LYS 99 6.890 -15.485 -5.160 760 HG3 LYS 99 HG1 LYS 99 7.595 -16.899 -5.933 761 HD2 LYS 99 HD2 LYS 99 6.950 -16.105 -8.102 762 HD3 LYS 99 HD1 LYS 99 6.078 -14.746 -7.380 763 HE2 LYS 99 HE2 LYS 99 8.093 -13.778 -6.568 764 HE3 LYS 99 HE1 LYS 99 9.022 -15.219 -6.968 765 HZ1 LYS 99 HZ1 LYS 99 7.680 -13.539 -9.014 766 HZ2 LYS 99 HZ2 LYS 99 8.832 -14.762 -9.261 767 HZ3 LYS 99 HZ3 LYS 99 9.287 -13.305 -8.523 768 H ARG 100 HN ARG 100 6.941 -17.237 -2.684 769 HA ARG 100 HA ARG 100 8.637 -18.429 -1.734 770 HB2 ARG 100 HB2 ARG 100 6.669 -20.357 -2.357 771 HB3 ARG 100 HB1 ARG 100 8.212 -21.042 -2.844 772 HG2 ARG 100 HG2 ARG 100 7.624 -21.648 -0.552 773 HG3 ARG 100 HG1 ARG 100 9.108 -20.695 -0.626 774 HD2 ARG 100 HD2 ARG 100 7.629 -19.993 1.215 775 HD3 ARG 100 HD1 ARG 100 7.909 -18.705 0.046 776 HE ARG 100 HE ARG 100 5.687 -19.054 -0.797 777 HH11 ARG 100 HH11 ARG 100 6.426 -20.729 2.203 778 HH12 ARG 100 HH12 ARG 100 4.758 -20.914 2.651 779 HH21 ARG 100 HH21 ARG 100 3.499 -19.297 -0.198 780 HH22 ARG 100 HH22 ARG 100 3.092 -20.096 1.296 781 H SER 101 HN SER 101 8.536 -17.533 -4.672 782 HA SER 101 HA SER 101 10.966 -18.943 -5.527 783 HB2 SER 101 HB2 SER 101 8.753 -17.689 -7.154 784 HB3 SER 101 HB1 SER 101 10.258 -18.290 -7.841 785 HG SER 101 HG SER 101 8.910 -20.045 -6.174 786 H GLU 102 HN GLU 102 10.210 -16.255 -3.994 787 HA GLU 102 HA GLU 102 12.306 -14.720 -5.317 788 HB2 GLU 102 HB2 GLU 102 11.288 -12.677 -4.515 789 HB3 GLU 102 HB1 GLU 102 10.131 -13.564 -5.490 790 HG2 GLU 102 HG2 GLU 102 10.158 -13.668 -2.489 791 HG3 GLU 102 HG1 GLU 102 9.233 -12.485 -3.417 792 H GLU 103 HN GLU 103 12.978 -13.044 -3.524 793 HA GLU 103 HA GLU 103 13.240 -14.273 -0.909 794 HB2 GLU 103 HB2 GLU 103 15.650 -13.864 -0.849 795 HB3 GLU 103 HB1 GLU 103 15.235 -15.041 -2.081 796 HG2 GLU 103 HG2 GLU 103 15.307 -13.116 -3.733 797 HG3 GLU 103 HG1 GLU 103 16.065 -12.183 -2.441 798 H VAL 104 HN VAL 104 11.910 -12.225 -2.402 799 HA VAL 104 HA VAL 104 12.261 -9.896 -0.873 800 HB VAL 104 HB VAL 104 14.485 -10.089 -1.896 801 HG11 VAL 104 HG11 VAL 104 14.751 -9.589 -4.308 802 HG12 VAL 104 HG12 VAL 104 13.000 -9.713 -4.490 803 HG13 VAL 104 HG13 VAL 104 13.938 -11.122 -3.995 804 HG21 VAL 104 HG21 VAL 104 12.910 -7.732 -2.893 805 HG22 VAL 104 HG22 VAL 104 14.657 -7.789 -2.658 806 HG23 VAL 104 HG23 VAL 104 13.573 -7.906 -1.273 807 H VAL 105 HN VAL 105 10.773 -8.280 -1.489 808 HA VAL 105 HA VAL 105 9.274 -8.951 -3.956 809 HB VAL 105 HB VAL 105 7.274 -7.889 -2.919 810 HG11 VAL 105 HG11 VAL 105 7.486 -10.309 -2.994 811 HG12 VAL 105 HG12 VAL 105 6.681 -9.805 -1.510 812 HG13 VAL 105 HG13 VAL 105 8.374 -10.296 -1.471 813 HG21 VAL 105 HG21 VAL 105 8.365 -6.549 -1.218 814 HG22 VAL 105 HG22 VAL 105 8.920 -8.009 -0.398 815 HG23 VAL 105 HG23 VAL 105 7.195 -7.644 -0.480 816 H ARG 106 HN ARG 106 9.469 -7.486 -5.479 817 HA ARG 106 HA ARG 106 10.578 -4.919 -4.761 818 HB2 ARG 106 HB2 ARG 106 10.927 -6.560 -6.955 819 HB3 ARG 106 HB1 ARG 106 9.882 -5.262 -7.547 820 HG2 ARG 106 HG2 ARG 106 11.378 -3.622 -7.014 821 HG3 ARG 106 HG1 ARG 106 12.306 -4.668 -5.940 822 HD2 ARG 106 HD2 ARG 106 12.611 -6.005 -8.243 823 HD3 ARG 106 HD1 ARG 106 12.425 -4.369 -8.880 824 HE ARG 106 HE ARG 106 14.257 -4.314 -6.749 825 HH11 ARG 106 HH11 ARG 106 14.046 -5.390 -10.082 826 HH12 ARG 106 HH12 ARG 106 15.767 -5.387 -10.309 827 HH21 ARG 106 HH21 ARG 106 16.476 -4.299 -7.042 828 HH22 ARG 106 HH22 ARG 106 17.153 -4.783 -8.580 829 H LEU 107 HN LEU 107 9.511 -3.048 -4.855 830 HA LEU 107 HA LEU 107 6.651 -3.264 -5.476 831 HB2 LEU 107 HB2 LEU 107 7.725 -1.496 -3.321 832 HB3 LEU 107 HB1 LEU 107 6.079 -2.036 -3.578 833 HG LEU 107 HG LEU 107 8.379 -3.678 -2.536 834 HD11 LEU 107 HD11 LEU 107 7.077 -3.761 -0.529 835 HD12 LEU 107 HD12 LEU 107 5.778 -2.845 -1.319 836 HD13 LEU 107 HD13 LEU 107 7.338 -2.081 -1.017 837 HD21 LEU 107 HD21 LEU 107 6.833 -5.509 -2.304 838 HD22 LEU 107 HD22 LEU 107 6.935 -5.023 -4.002 839 HD23 LEU 107 HD23 LEU 107 5.540 -4.547 -3.031 840 H LEU 108 HN LEU 108 5.630 -1.487 -6.164 841 HA LEU 108 HA LEU 108 7.204 0.964 -6.658 842 HB2 LEU 108 HB2 LEU 108 6.120 -0.322 -8.696 843 HB3 LEU 108 HB1 LEU 108 4.636 0.321 -8.033 844 HG LEU 108 HG LEU 108 5.704 2.625 -8.239 845 HD11 LEU 108 HD11 LEU 108 8.001 1.880 -8.582 846 HD12 LEU 108 HD12 LEU 108 7.423 2.820 -9.959 847 HD13 LEU 108 HD13 LEU 108 7.513 1.058 -10.070 848 HD21 LEU 108 HD21 LEU 108 3.898 1.932 -9.645 849 HD22 LEU 108 HD22 LEU 108 4.980 0.949 -10.630 850 HD23 LEU 108 HD23 LEU 108 5.117 2.709 -10.657 851 H VAL 109 HN VAL 109 6.247 2.725 -5.649 852 HA VAL 109 HA VAL 109 3.612 2.389 -4.589 853 HB VAL 109 HB VAL 109 4.291 3.160 -2.399 854 HG11 VAL 109 HG11 VAL 109 5.323 1.111 -1.550 855 HG12 VAL 109 HG12 VAL 109 5.654 0.625 -3.214 856 HG13 VAL 109 HG13 VAL 109 3.987 0.810 -2.663 857 HG21 VAL 109 HG21 VAL 109 7.123 2.765 -3.319 858 HG22 VAL 109 HG22 VAL 109 6.618 3.161 -1.677 859 HG23 VAL 109 HG23 VAL 109 6.352 4.317 -2.979 860 H THR 110 HN THR 110 3.270 4.414 -3.233 861 HA THR 110 HA THR 110 4.309 6.796 -4.529 862 HB THR 110 HB THR 110 1.922 7.758 -4.283 863 HG1 THR 110 HG1 THR 110 1.448 4.951 -4.313 864 HG21 THR 110 HG21 THR 110 1.336 7.098 -6.556 865 HG22 THR 110 HG22 THR 110 2.483 5.761 -6.480 866 HG23 THR 110 HG23 THR 110 3.067 7.428 -6.434 867 H ARG 111 HN ARG 111 5.224 7.820 -2.875 868 HA ARG 111 HA ARG 111 4.300 7.286 -0.258 869 HB2 ARG 111 HB2 ARG 111 6.676 7.442 -1.013 870 HB3 ARG 111 HB1 ARG 111 6.420 9.177 -1.210 871 HG2 ARG 111 HG2 ARG 111 5.374 8.413 1.225 872 HG3 ARG 111 HG1 ARG 111 6.998 7.735 1.086 873 HD2 ARG 111 HD2 ARG 111 7.508 10.183 0.206 874 HD3 ARG 111 HD1 ARG 111 6.081 10.549 1.155 875 HE ARG 111 HE ARG 111 8.030 9.008 2.602 876 HH11 ARG 111 HH11 ARG 111 7.132 12.274 1.680 877 HH12 ARG 111 HH12 ARG 111 7.869 13.006 3.074 878 HH21 ARG 111 HH21 ARG 111 8.992 9.968 4.437 879 HH22 ARG 111 HH22 ARG 111 8.944 11.695 4.624 880 H GLN 112 HN GLN 112 3.636 8.830 1.191 881 HA GLN 112 HA GLN 112 2.004 10.240 1.869 882 HB2 GLN 112 HB2 GLN 112 2.985 12.070 -0.260 883 HB3 GLN 112 HB1 GLN 112 2.152 12.512 1.197 884 HG2 GLN 112 HG2 GLN 112 4.101 12.782 2.222 885 HG3 GLN 112 HG1 GLN 112 4.657 11.179 1.732 886 HE21 GLN 112 HE21 GLN 112 4.183 11.759 -1.060 887 HE22 GLN 112 HE22 GLN 112 5.466 12.816 -1.545 888 H SER 113 HN SER 113 2.311 11.268 -1.318 889 HA SER 113 HA SER 113 0.896 11.605 -3.080 890 HB2 SER 113 HB2 SER 113 1.411 9.256 -3.087 891 HB3 SER 113 HB1 SER 113 0.062 8.951 -1.998 892 HG SER 113 HG SER 113 -1.309 9.813 -3.722 893 H LEU 114 HN LEU 114 0.064 12.586 -0.539 894 HA LEU 114 HA LEU 114 -2.840 12.612 -0.841 895 HB2 LEU 114 HB2 LEU 114 -3.003 12.580 1.577 896 HB3 LEU 114 HB1 LEU 114 -2.111 11.195 0.978 897 HG LEU 114 HG LEU 114 -0.092 12.931 1.459 898 HD11 LEU 114 HD11 LEU 114 -0.461 13.859 3.705 899 HD12 LEU 114 HD12 LEU 114 -2.163 13.401 3.593 900 HD13 LEU 114 HD13 LEU 114 -1.490 14.592 2.475 901 HD21 LEU 114 HD21 LEU 114 -1.301 10.904 3.332 902 HD22 LEU 114 HD22 LEU 114 0.331 11.568 3.461 903 HD23 LEU 114 HD23 LEU 114 -0.122 10.598 2.049 904 H GLN 115 HN GLN 115 -0.289 14.121 -1.226 905 HA GLN 115 HA GLN 115 -0.863 16.689 0.012 906 HB2 GLN 115 HB2 GLN 115 1.422 15.534 -1.524 907 HB3 GLN 115 HB1 GLN 115 1.257 17.273 -1.424 908 HG2 GLN 115 HG2 GLN 115 1.393 15.442 0.954 909 HG3 GLN 115 HG1 GLN 115 2.770 16.311 0.278 910 HE21 GLN 115 HE21 GLN 115 1.547 16.490 2.931 911 HE22 GLN 115 HE22 GLN 115 1.104 18.147 3.133 912 H LYS 116 HN LYS 116 -0.245 18.564 -1.701 913 HA LYS 116 HA LYS 116 -2.403 18.693 -3.518 914 HB2 LYS 116 HB2 LYS 116 0.105 20.388 -3.410 915 HB3 LYS 116 HB1 LYS 116 -1.366 20.788 -4.290 916 HG2 LYS 116 HG2 LYS 116 -2.600 20.848 -2.169 917 HG3 LYS 116 HG1 LYS 116 -1.102 20.502 -1.304 918 HD2 LYS 116 HD2 LYS 116 -1.591 22.883 -1.249 919 HD3 LYS 116 HD1 LYS 116 -0.130 22.576 -2.189 920 HE2 LYS 116 HE2 LYS 116 -1.357 22.817 -4.255 921 HE3 LYS 116 HE1 LYS 116 -2.876 22.966 -3.371 922 HZ1 LYS 116 HZ1 LYS 116 -0.623 24.866 -3.035 923 HZ2 LYS 116 HZ2 LYS 116 -2.222 25.044 -2.499 924 HZ3 LYS 116 HZ3 LYS 116 -1.872 25.102 -4.157 925 H ALA 117 HN ALA 117 -2.564 18.028 -5.580 926 HA ALA 117 HA ALA 117 -0.113 17.164 -6.956 927 HB1 ALA 117 HB1 ALA 117 -1.063 15.189 -5.862 928 HB2 ALA 117 HB2 ALA 117 -1.188 15.069 -7.617 929 HB3 ALA 117 HB3 ALA 117 -2.603 15.494 -6.657 930 H VAL 118 HN VAL 118 -1.877 19.384 -7.112 931 HA VAL 118 HA VAL 118 -3.326 18.928 -9.592 932 HB VAL 118 HB VAL 118 -4.758 19.764 -7.868 933 HG11 VAL 118 HG11 VAL 118 -2.807 22.043 -7.548 934 HG12 VAL 118 HG12 VAL 118 -3.145 20.770 -6.374 935 HG13 VAL 118 HG13 VAL 118 -4.393 21.950 -6.782 936 HG21 VAL 118 HG21 VAL 118 -4.074 21.935 -9.825 937 HG22 VAL 118 HG22 VAL 118 -5.582 21.803 -8.918 938 HG23 VAL 118 HG23 VAL 118 -5.151 20.570 -10.106 939 H GLN 119 HN GLN 119 -1.435 18.932 -10.756 940 HA GLN 119 HA GLN 119 -0.161 21.555 -11.162 941 HB2 GLN 119 HB2 GLN 119 0.880 18.780 -11.751 942 HB3 GLN 119 HB1 GLN 119 1.714 20.261 -12.195 943 HG2 GLN 119 HG2 GLN 119 1.872 20.873 -9.833 944 HG3 GLN 119 HG1 GLN 119 1.049 19.376 -9.398 945 HE21 GLN 119 HE21 GLN 119 3.701 20.352 -8.696 946 HE22 GLN 119 HE22 GLN 119 4.822 19.116 -9.213 947 H GLN 120 HN GLN 120 -2.697 20.635 -12.287 948 HA GLN 120 HA GLN 120 -2.209 19.962 -15.035 949 HB2 GLN 120 HB2 GLN 120 -4.223 19.246 -13.701 950 HB3 GLN 120 HB1 GLN 120 -4.788 20.906 -13.791 951 HG2 GLN 120 HG2 GLN 120 -4.968 20.775 -16.182 952 HG3 GLN 120 HG1 GLN 120 -4.237 19.171 -16.186 953 HE21 GLN 120 HE21 GLN 120 -6.007 18.246 -17.186 954 HE22 GLN 120 HE22 GLN 120 -7.505 17.985 -16.365 955 H SER 121 HN SER 121 -0.710 21.956 -15.001 956 HA SER 121 HA SER 121 -2.200 24.286 -15.991 957 HB2 SER 121 HB2 SER 121 0.737 24.027 -15.283 958 HB3 SER 121 HB1 SER 121 -0.066 25.506 -15.804 959 HG SER 121 HG SER 121 -1.491 25.111 -13.908 960 H MET 122 HN MET 122 0.198 21.869 -16.824 961 HA MET 122 HA MET 122 -0.150 22.564 -19.654 962 HB2 MET 122 HB2 MET 122 2.034 23.405 -18.933 963 HB3 MET 122 HB1 MET 122 2.453 21.821 -18.297 964 HG2 MET 122 HG2 MET 122 3.529 22.235 -20.438 965 HG3 MET 122 HG1 MET 122 2.391 20.889 -20.543 966 HE1 MET 122 HE1 MET 122 2.338 21.007 -23.227 967 HE2 MET 122 HE2 MET 122 3.579 22.251 -23.073 968 HE3 MET 122 HE3 MET 122 2.171 22.532 -24.098 969 H LEU 123 HN LEU 123 -1.156 20.905 -20.556 970 HA LEU 123 HA LEU 123 -0.526 18.209 -19.608 971 HB2 LEU 123 HB2 LEU 123 -2.594 17.470 -20.734 972 HB3 LEU 123 HB1 LEU 123 -2.888 18.661 -19.487 973 HG LEU 123 HG LEU 123 -2.734 19.433 -22.394 974 HD11 LEU 123 HD11 LEU 123 -5.173 18.584 -20.833 975 HD12 LEU 123 HD12 LEU 123 -4.443 17.712 -22.180 976 HD13 LEU 123 HD13 LEU 123 -5.178 19.291 -22.451 977 HD21 LEU 123 HD21 LEU 123 -3.949 21.378 -21.679 978 HD22 LEU 123 HD22 LEU 123 -2.547 21.174 -20.623 979 HD23 LEU 123 HD23 LEU 123 -4.152 20.710 -20.059 980 H SER 124 HN SER 124 1.236 17.577 -20.725 981 HA SER 124 HA SER 124 1.809 18.194 -23.394 982 HB2 SER 124 HB2 SER 124 2.688 15.646 -22.051 983 HB3 SER 124 HB1 SER 124 3.583 16.663 -23.185 984 HG SER 124 HG SER 124 4.400 17.521 -21.445 985 H1 LYS 161 HN LYS 161 -13.749 -11.572 -3.166 986 HA LYS 161 HA LYS 161 -13.745 -9.296 -3.146 987 HB2 LYS 161 HB2 LYS 161 -16.344 -9.802 -1.709 988 HB3 LYS 161 HB1 LYS 161 -15.716 -8.174 -1.880 989 HG2 LYS 161 HG2 LYS 161 -15.789 -8.386 -4.319 990 HG3 LYS 161 HG1 LYS 161 -16.423 -10.037 -4.142 991 HD2 LYS 161 HD2 LYS 161 -17.747 -7.524 -3.114 992 HD3 LYS 161 HD1 LYS 161 -18.199 -8.381 -4.582 993 HE2 LYS 161 HE2 LYS 161 -18.181 -9.778 -1.932 994 HE3 LYS 161 HE1 LYS 161 -19.557 -8.789 -2.429 995 HZ1 LYS 161 HZ1 LYS 161 -19.888 -11.106 -3.010 996 HZ2 LYS 161 HZ2 LYS 161 -18.465 -11.112 -3.925 997 HZ3 LYS 161 HZ3 LYS 161 -19.775 -10.155 -4.408 998 H GLU 162 HN GLU 162 -14.710 -7.647 -0.980 999 HA GLU 162 HA GLU 162 -14.310 -6.863 1.087 1000 HB2 GLU 162 HB2 GLU 162 -12.987 -9.492 1.715 1001 HB3 GLU 162 HB1 GLU 162 -13.511 -8.256 2.845 1002 HG2 GLU 162 HG2 GLU 162 -15.836 -8.636 2.193 1003 HG3 GLU 162 HG1 GLU 162 -15.308 -9.896 1.077 1004 H ASN 163 HN ASN 163 -12.212 -7.052 2.789 1005 HA ASN 163 HA ASN 163 -9.991 -5.974 1.192 1006 HB2 ASN 163 HB2 ASN 163 -9.699 -4.246 2.898 1007 HB3 ASN 163 HB1 ASN 163 -11.313 -4.168 2.204 1008 HD21 ASN 163 HD21 ASN 163 -13.088 -4.786 3.461 1009 HD22 ASN 163 HD22 ASN 163 -12.978 -4.915 5.190 1010 H LEU 164 HN LEU 164 -7.887 -6.114 2.138 1011 HA LEU 164 HA LEU 164 -7.693 -7.711 4.586 1012 HB2 LEU 164 HB2 LEU 164 -6.037 -8.248 2.123 1013 HB3 LEU 164 HB1 LEU 164 -5.935 -9.099 3.649 1014 HG LEU 164 HG LEU 164 -8.459 -9.630 3.135 1015 HD11 LEU 164 HD11 LEU 164 -8.825 -10.012 0.737 1016 HD12 LEU 164 HD12 LEU 164 -7.291 -9.212 0.389 1017 HD13 LEU 164 HD13 LEU 164 -8.616 -8.302 1.112 1018 HD21 LEU 164 HD21 LEU 164 -6.703 -11.273 3.470 1019 HD22 LEU 164 HD22 LEU 164 -6.133 -11.020 1.819 1020 HD23 LEU 164 HD23 LEU 164 -7.724 -11.730 2.106 1021 H GLU 165 HN GLU 165 -5.647 -7.568 5.635 1022 HA GLU 165 HA GLU 165 -3.745 -5.646 4.514 1023 HB2 GLU 165 HB2 GLU 165 -3.973 -4.270 6.231 1024 HB3 GLU 165 HB1 GLU 165 -5.096 -5.360 7.039 1025 HG2 GLU 165 HG2 GLU 165 -3.235 -6.504 8.092 1026 HG3 GLU 165 HG1 GLU 165 -2.093 -5.488 7.214 1027 H SER 166 HN SER 166 -1.849 -6.536 4.160 1028 HA SER 166 HA SER 166 -0.966 -8.906 5.588 1029 HB2 SER 166 HB2 SER 166 -1.421 -9.185 2.648 1030 HB3 SER 166 HB1 SER 166 -1.299 -10.455 3.868 1031 HG SER 166 HG SER 166 -3.391 -10.365 4.108 1032 H MET 167 HN MET 167 1.211 -9.290 5.247 1033 HA MET 167 HA MET 167 2.303 -8.909 2.666 1034 HB2 MET 167 HB2 MET 167 3.154 -7.044 4.791 1035 HB3 MET 167 HB1 MET 167 4.442 -7.795 3.853 1036 HG2 MET 167 HG2 MET 167 2.179 -6.085 2.849 1037 HG3 MET 167 HG1 MET 167 3.902 -5.716 2.838 1038 HE1 MET 167 HE1 MET 167 3.734 -5.031 0.307 1039 HE2 MET 167 HE2 MET 167 2.020 -5.432 0.241 1040 HE3 MET 167 HE3 MET 167 3.122 -6.080 -0.974 1041 H VAL 168 HN VAL 168 2.815 -9.676 6.013 1042 HA VAL 168 HA VAL 168 2.848 -11.876 6.683 1043 HB VAL 168 HB VAL 168 3.568 -12.409 3.791 1044 HG11 VAL 168 HG11 VAL 168 4.653 -14.036 5.191 1045 HG12 VAL 168 HG12 VAL 168 3.291 -14.771 4.346 1046 HG13 VAL 168 HG13 VAL 168 3.145 -14.342 6.050 1047 HG21 VAL 168 HG21 VAL 168 1.356 -13.438 3.684 1048 HG22 VAL 168 HG22 VAL 168 1.241 -11.749 4.176 1049 HG23 VAL 168 HG23 VAL 168 1.071 -13.028 5.377 Start of MODEL 11 1 H1 MET 1 HT1 MET 1 -15.948 28.188 -3.359 2 H2 MET 1 HT2 MET 1 -16.487 27.875 -1.782 3 H3 MET 1 HT3 MET 1 -17.394 27.334 -3.105 4 HA MET 1 HA MET 1 -16.217 25.497 -2.156 5 HB2 MET 1 HB2 MET 1 -14.914 26.411 -4.731 6 HB3 MET 1 HB1 MET 1 -14.922 24.765 -4.118 7 HG2 MET 1 HG2 MET 1 -16.563 24.841 -5.799 8 HG3 MET 1 HG1 MET 1 -17.440 24.851 -4.272 9 HE1 MET 1 HE1 MET 1 -18.815 25.721 -7.080 10 HE2 MET 1 HE2 MET 1 -19.764 27.073 -6.454 11 HE3 MET 1 HE3 MET 1 -19.592 25.595 -5.503 12 H SER 2 HN SER 2 -14.517 24.793 -0.981 13 HA SER 2 HA SER 2 -12.247 26.666 -0.728 14 HB2 SER 2 HB2 SER 2 -13.837 26.464 1.249 15 HB3 SER 2 HB1 SER 2 -13.267 24.804 1.423 16 HG SER 2 HG SER 2 -11.174 25.607 1.755 17 H TYR 3 HN TYR 3 -13.135 23.635 -1.788 18 HA TYR 3 HA TYR 3 -10.415 22.592 -1.347 19 HB2 TYR 3 HB2 TYR 3 -12.315 21.381 -0.142 20 HB3 TYR 3 HB1 TYR 3 -12.874 20.881 -1.736 21 HD1 TYR 3 HD2 TYR 3 -10.099 20.592 0.691 22 HD2 TYR 3 HD1 TYR 3 -11.809 19.105 -2.910 23 HE1 TYR 3 HE2 TYR 3 -8.554 18.679 0.755 24 HE2 TYR 3 HE1 TYR 3 -10.271 17.185 -2.854 25 HH TYR 3 HH TYR 3 -8.424 16.376 -0.131 26 H ILE 4 HN ILE 4 -9.312 21.894 -3.108 27 HA ILE 4 HA ILE 4 -10.707 22.016 -5.702 28 HB ILE 4 HB ILE 4 -7.745 22.401 -5.225 29 HG12 ILE 4 HG12 ILE 4 -9.866 24.492 -5.783 30 HG13 ILE 4 HG11 ILE 4 -9.097 24.233 -4.220 31 HG21 ILE 4 HG21 ILE 4 -9.461 22.908 -7.657 32 HG22 ILE 4 HG22 ILE 4 -8.344 21.559 -7.449 33 HG23 ILE 4 HG23 ILE 4 -7.725 23.208 -7.530 34 HD11 ILE 4 HD11 ILE 4 -7.696 25.085 -6.743 35 HD12 ILE 4 HD12 ILE 4 -6.949 24.868 -5.159 36 HD13 ILE 4 HD13 ILE 4 -8.148 26.139 -5.404 37 HA PRO 5 HA PRO 5 -9.538 17.653 -5.325 38 HB2 PRO 5 HB2 PRO 5 -11.926 16.938 -6.687 39 HB3 PRO 5 HB1 PRO 5 -11.617 16.868 -4.956 40 HG2 PRO 5 HG2 PRO 5 -13.440 18.564 -6.185 41 HG3 PRO 5 HG1 PRO 5 -12.767 18.793 -4.559 42 HD2 PRO 5 HD2 PRO 5 -11.951 20.052 -7.146 43 HD3 PRO 5 HD1 PRO 5 -12.058 20.770 -5.523 44 H GLY 6 HN GLY 6 -9.024 19.584 -7.636 45 HA2 GLY 6 HA2 GLY 6 -9.021 17.580 -9.807 46 HA3 GLY 6 HA1 GLY 6 -9.161 19.321 -10.080 47 H GLN 7 HN GLN 7 -7.022 19.332 -7.732 48 HA GLN 7 HA GLN 7 -4.786 19.273 -9.600 49 HB2 GLN 7 HB2 GLN 7 -4.987 20.554 -6.870 50 HB3 GLN 7 HB1 GLN 7 -3.638 20.695 -7.984 51 HG2 GLN 7 HG2 GLN 7 -5.330 21.675 -9.630 52 HG3 GLN 7 HG1 GLN 7 -6.386 21.844 -8.230 53 HE21 GLN 7 HE21 GLN 7 -5.262 23.894 -9.927 54 HE22 GLN 7 HE22 GLN 7 -4.324 24.927 -8.891 55 HA PRO 8 HA PRO 8 -3.045 15.637 -7.957 56 HB2 PRO 8 HB2 PRO 8 -0.428 17.035 -8.018 57 HB3 PRO 8 HB1 PRO 8 -0.921 15.530 -8.804 58 HG2 PRO 8 HG2 PRO 8 -0.620 17.771 -10.215 59 HG3 PRO 8 HG1 PRO 8 -1.935 16.635 -10.574 60 HD2 PRO 8 HD2 PRO 8 -2.026 19.245 -9.107 61 HD3 PRO 8 HD1 PRO 8 -3.196 18.555 -10.263 62 H VAL 9 HN VAL 9 -2.605 14.764 -6.043 63 HA VAL 9 HA VAL 9 -2.223 16.509 -3.748 64 HB VAL 9 HB VAL 9 -3.899 14.588 -3.867 65 HG11 VAL 9 HG11 VAL 9 -2.564 12.898 -4.874 66 HG12 VAL 9 HG12 VAL 9 -2.973 12.347 -3.250 67 HG13 VAL 9 HG13 VAL 9 -1.363 12.991 -3.586 68 HG21 VAL 9 HG21 VAL 9 -3.462 15.634 -1.750 69 HG22 VAL 9 HG22 VAL 9 -1.966 14.719 -1.560 70 HG23 VAL 9 HG23 VAL 9 -3.521 13.888 -1.507 71 H THR 10 HN THR 10 -0.567 15.053 -5.894 72 HA THR 10 HA THR 10 1.583 14.713 -6.356 73 HB THR 10 HB THR 10 3.309 15.715 -5.118 74 HG1 THR 10 HG1 THR 10 1.588 15.380 -2.966 75 HG21 THR 10 HG21 THR 10 2.406 17.994 -4.881 76 HG22 THR 10 HG22 THR 10 0.766 17.317 -4.916 77 HG23 THR 10 HG23 THR 10 1.819 17.174 -6.333 78 H ALA 11 HN ALA 11 1.852 12.784 -6.588 79 HA ALA 11 HA ALA 11 2.349 10.991 -4.302 80 HB1 ALA 11 HB1 ALA 11 1.349 10.243 -7.051 81 HB2 ALA 11 HB2 ALA 11 0.351 10.367 -5.602 82 HB3 ALA 11 HB3 ALA 11 1.619 9.142 -5.699 83 H VAL 12 HN VAL 12 4.358 10.806 -4.041 84 HA VAL 12 HA VAL 12 6.329 10.975 -6.098 85 HB VAL 12 HB VAL 12 6.639 9.771 -3.383 86 HG11 VAL 12 HG11 VAL 12 8.963 10.527 -3.581 87 HG12 VAL 12 HG12 VAL 12 8.604 11.136 -5.198 88 HG13 VAL 12 HG13 VAL 12 8.501 9.407 -4.863 89 HG21 VAL 12 HG21 VAL 12 7.419 12.074 -2.666 90 HG22 VAL 12 HG22 VAL 12 5.680 11.842 -2.860 91 HG23 VAL 12 HG23 VAL 12 6.608 12.680 -4.113 92 H VAL 13 HN VAL 13 6.751 9.406 -7.435 93 HA VAL 13 HA VAL 13 6.079 6.646 -6.731 94 HB VAL 13 HB VAL 13 7.026 7.673 -9.402 95 HG11 VAL 13 HG11 VAL 13 5.706 5.085 -8.607 96 HG12 VAL 13 HG12 VAL 13 7.398 5.296 -9.053 97 HG13 VAL 13 HG13 VAL 13 6.132 5.557 -10.251 98 HG21 VAL 13 HG21 VAL 13 4.693 7.565 -10.131 99 HG22 VAL 13 HG22 VAL 13 4.908 8.733 -8.826 100 HG23 VAL 13 HG23 VAL 13 4.205 7.152 -8.487 101 H GLN 14 HN GLN 14 7.634 5.469 -5.884 102 HA GLN 14 HA GLN 14 10.305 5.667 -6.960 103 HB2 GLN 14 HB2 GLN 14 11.323 5.545 -4.748 104 HB3 GLN 14 HB1 GLN 14 10.421 7.032 -4.946 105 HG2 GLN 14 HG2 GLN 14 9.152 4.689 -3.602 106 HG3 GLN 14 HG1 GLN 14 10.313 5.683 -2.726 107 HE21 GLN 14 HE21 GLN 14 7.155 5.496 -4.074 108 HE22 GLN 14 HE22 GLN 14 6.580 7.009 -3.448 109 H ARG 15 HN ARG 15 11.610 3.801 -6.026 110 HA ARG 15 HA ARG 15 9.950 1.429 -6.125 111 HB2 ARG 15 HB2 ARG 15 12.761 1.859 -7.119 112 HB3 ARG 15 HB1 ARG 15 11.762 0.444 -7.347 113 HG2 ARG 15 HG2 ARG 15 10.127 2.201 -8.453 114 HG3 ARG 15 HG1 ARG 15 11.645 3.061 -8.694 115 HD2 ARG 15 HD2 ARG 15 12.611 1.197 -9.850 116 HD3 ARG 15 HD1 ARG 15 11.193 0.205 -9.496 117 HE ARG 15 HE ARG 15 10.651 2.626 -10.992 118 HH11 ARG 15 HH11 ARG 15 11.506 -0.777 -11.226 119 HH12 ARG 15 HH12 ARG 15 10.783 -0.965 -12.793 120 HH21 ARG 15 HH21 ARG 15 9.749 2.362 -13.072 121 HH22 ARG 15 HH22 ARG 15 9.802 0.798 -13.832 122 H VAL 16 HN VAL 16 10.503 -0.246 -4.739 123 HA VAL 16 HA VAL 16 12.663 0.329 -2.872 124 HB VAL 16 HB VAL 16 10.284 -1.027 -1.727 125 HG11 VAL 16 HG11 VAL 16 12.178 1.068 -0.696 126 HG12 VAL 16 HG12 VAL 16 12.260 -0.666 -0.403 127 HG13 VAL 16 HG13 VAL 16 10.920 0.273 0.253 128 HG21 VAL 16 HG21 VAL 16 9.158 1.035 -1.157 129 HG22 VAL 16 HG22 VAL 16 9.187 0.789 -2.905 130 HG23 VAL 16 HG23 VAL 16 10.292 1.941 -2.153 131 H GLU 17 HN GLU 17 13.628 -1.565 -2.097 132 HA GLU 17 HA GLU 17 12.805 -4.004 -3.468 133 HB2 GLU 17 HB2 GLU 17 15.483 -3.534 -2.152 134 HB3 GLU 17 HB1 GLU 17 15.031 -4.799 -3.302 135 HG2 GLU 17 HG2 GLU 17 14.782 -3.110 -5.053 136 HG3 GLU 17 HG1 GLU 17 15.244 -1.857 -3.906 137 H ILE 18 HN ILE 18 11.679 -5.272 -2.216 138 HA ILE 18 HA ILE 18 12.032 -5.525 0.614 139 HB ILE 18 HB ILE 18 9.431 -4.579 -0.562 140 HG12 ILE 18 HG12 ILE 18 11.200 -3.149 1.425 141 HG13 ILE 18 HG11 ILE 18 11.170 -2.782 -0.298 142 HG21 ILE 18 HG21 ILE 18 8.553 -4.764 1.639 143 HG22 ILE 18 HG22 ILE 18 10.154 -5.074 2.308 144 HG23 ILE 18 HG23 ILE 18 9.385 -6.287 1.272 145 HD11 ILE 18 HD11 ILE 18 8.786 -2.258 -0.106 146 HD12 ILE 18 HD12 ILE 18 9.809 -1.223 0.889 147 HD13 ILE 18 HD13 ILE 18 8.890 -2.532 1.634 148 H HIS 19 HN HIS 19 12.192 -7.676 0.516 149 HA HIS 19 HA HIS 19 9.571 -8.914 0.268 150 HB2 HIS 19 HB2 HIS 19 11.865 -9.514 -1.384 151 HB3 HIS 19 HB1 HIS 19 11.350 -10.932 -0.450 152 HD1 HIS 19 HD1 HIS 19 9.225 -12.131 -1.277 153 HD2 HIS 19 HD2 HIS 19 9.916 -8.446 -3.074 154 HE1 HIS 19 HE1 HIS 19 7.386 -11.861 -2.967 155 HE2 HIS 19 HE2 HIS 19 7.670 -9.527 -3.859 156 H LYS 20 HN LYS 20 9.503 -10.986 1.289 157 HA LYS 20 HA LYS 20 9.702 -11.229 3.861 158 HB2 LYS 20 HB2 LYS 20 10.435 -13.384 1.898 159 HB3 LYS 20 HB1 LYS 20 10.094 -13.683 3.599 160 HG2 LYS 20 HG2 LYS 20 7.856 -12.755 3.321 161 HG3 LYS 20 HG1 LYS 20 8.192 -12.448 1.616 162 HD2 LYS 20 HD2 LYS 20 8.402 -14.801 1.183 163 HD3 LYS 20 HD1 LYS 20 8.282 -15.170 2.905 164 HE2 LYS 20 HE2 LYS 20 6.116 -13.876 1.248 165 HE3 LYS 20 HE1 LYS 20 6.173 -15.581 1.686 166 HZ1 LYS 20 HZ1 LYS 20 4.739 -14.475 3.204 167 HZ2 LYS 20 HZ2 LYS 20 5.880 -13.271 3.546 168 HZ3 LYS 20 HZ3 LYS 20 6.146 -14.867 4.048 169 H LEU 21 HN LEU 21 11.029 -11.981 5.520 170 HA LEU 21 HA LEU 21 13.887 -11.498 5.003 171 HB2 LEU 21 HB2 LEU 21 12.937 -9.432 5.852 172 HB3 LEU 21 HB1 LEU 21 12.199 -10.298 7.201 173 HG LEU 21 HG LEU 21 14.425 -10.807 8.097 174 HD11 LEU 21 HD11 LEU 21 16.420 -9.757 7.111 175 HD12 LEU 21 HD12 LEU 21 15.435 -9.187 5.762 176 HD13 LEU 21 HD13 LEU 21 15.667 -10.918 6.013 177 HD21 LEU 21 HD21 LEU 21 13.299 -8.762 8.815 178 HD22 LEU 21 HD22 LEU 21 14.047 -7.878 7.484 179 HD23 LEU 21 HD23 LEU 21 15.050 -8.547 8.773 180 H ARG 22 HN ARG 22 15.181 -12.839 5.936 181 HA ARG 22 HA ARG 22 14.221 -15.265 6.905 182 HB2 ARG 22 HB2 ARG 22 16.700 -14.246 6.058 183 HB3 ARG 22 HB1 ARG 22 16.946 -14.917 7.645 184 HG2 ARG 22 HG2 ARG 22 17.394 -16.616 6.062 185 HG3 ARG 22 HG1 ARG 22 15.873 -17.015 6.879 186 HD2 ARG 22 HD2 ARG 22 15.356 -17.326 4.642 187 HD3 ARG 22 HD1 ARG 22 14.776 -15.699 5.002 188 HE ARG 22 HE ARG 22 17.432 -15.567 4.067 189 HH11 ARG 22 HH11 ARG 22 14.195 -16.177 2.869 190 HH12 ARG 22 HH12 ARG 22 14.542 -15.594 1.268 191 HH21 ARG 22 HH21 ARG 22 17.882 -14.782 2.008 192 HH22 ARG 22 HH22 ARG 22 16.648 -14.787 0.782 193 H GLN 23 HN GLN 23 13.456 -15.778 8.726 194 HA GLN 23 HA GLN 23 14.845 -15.028 11.155 195 HB2 GLN 23 HB2 GLN 23 12.192 -15.373 11.928 196 HB3 GLN 23 HB1 GLN 23 13.120 -13.883 11.917 197 HG2 GLN 23 HG2 GLN 23 12.447 -13.731 9.454 198 HG3 GLN 23 HG1 GLN 23 11.215 -14.914 9.884 199 HE21 GLN 23 HE21 GLN 23 11.066 -12.083 9.034 200 HE22 GLN 23 HE22 GLN 23 10.100 -11.301 10.253 201 H GLY 24 HN GLY 24 15.806 -16.991 10.517 202 HA2 GLY 24 HA2 GLY 24 16.290 -19.133 11.170 203 HA3 GLY 24 HA1 GLY 24 14.805 -19.132 12.116 204 H GLU 25 HN GLU 25 13.216 -20.306 11.456 205 HA GLU 25 HA GLU 25 13.383 -21.766 8.968 206 HB2 GLU 25 HB2 GLU 25 12.427 -22.345 11.405 207 HB3 GLU 25 HB1 GLU 25 10.939 -21.799 10.649 208 HG2 GLU 25 HG2 GLU 25 11.187 -23.449 8.897 209 HG3 GLU 25 HG1 GLU 25 12.712 -23.993 9.596 210 H ASN 26 HN ASN 26 12.539 -18.709 9.699 211 HA ASN 26 HA ASN 26 10.221 -18.659 7.957 212 HB2 ASN 26 HB2 ASN 26 10.979 -16.758 10.174 213 HB3 ASN 26 HB1 ASN 26 9.575 -16.646 9.148 214 HD21 ASN 26 HD21 ASN 26 11.134 -18.336 11.627 215 HD22 ASN 26 HD22 ASN 26 9.735 -19.138 12.307 216 H LEU 27 HN LEU 27 10.246 -17.154 6.542 217 HA LEU 27 HA LEU 27 11.939 -14.903 6.799 218 HB2 LEU 27 HB2 LEU 27 12.338 -14.945 4.258 219 HB3 LEU 27 HB1 LEU 27 13.370 -15.804 5.357 220 HG LEU 27 HG LEU 27 13.029 -17.080 3.338 221 HD11 LEU 27 HD11 LEU 27 11.912 -19.151 4.383 222 HD12 LEU 27 HD12 LEU 27 11.852 -18.162 5.856 223 HD13 LEU 27 HD13 LEU 27 13.401 -18.522 5.091 224 HD21 LEU 27 HD21 LEU 27 11.036 -16.339 2.484 225 HD22 LEU 27 HD22 LEU 27 10.159 -16.638 3.982 226 HD23 LEU 27 HD23 LEU 27 10.676 -17.997 2.969 227 H ILE 28 HN ILE 28 10.793 -13.369 6.869 228 HA ILE 28 HA ILE 28 8.412 -12.936 5.249 229 HB ILE 28 HB ILE 28 7.105 -12.562 7.487 230 HG12 ILE 28 HG12 ILE 28 9.250 -14.576 8.200 231 HG13 ILE 28 HG11 ILE 28 8.888 -13.061 9.029 232 HG21 ILE 28 HG21 ILE 28 7.662 -15.169 6.131 233 HG22 ILE 28 HG22 ILE 28 6.414 -13.990 5.728 234 HG23 ILE 28 HG23 ILE 28 6.308 -14.910 7.235 235 HD11 ILE 28 HD11 ILE 28 8.136 -15.097 10.233 236 HD12 ILE 28 HD12 ILE 28 7.011 -15.413 8.909 237 HD13 ILE 28 HD13 ILE 28 6.833 -13.952 9.880 238 H LEU 29 HN LEU 29 7.378 -10.917 5.541 239 HA LEU 29 HA LEU 29 9.270 -8.808 6.014 240 HB2 LEU 29 HB2 LEU 29 6.340 -8.834 5.302 241 HB3 LEU 29 HB1 LEU 29 7.233 -7.352 5.559 242 HG LEU 29 HG LEU 29 7.059 -7.675 3.233 243 HD11 LEU 29 HD11 LEU 29 9.410 -7.900 2.546 244 HD12 LEU 29 HD12 LEU 29 9.798 -8.475 4.168 245 HD13 LEU 29 HD13 LEU 29 9.187 -6.838 3.936 246 HD21 LEU 29 HD21 LEU 29 6.492 -10.019 3.169 247 HD22 LEU 29 HD22 LEU 29 8.131 -10.455 3.650 248 HD23 LEU 29 HD23 LEU 29 7.845 -9.697 2.082 249 H GLY 30 HN GLY 30 6.063 -9.574 7.327 250 HA2 GLY 30 HA2 GLY 30 5.432 -9.482 9.602 251 HA3 GLY 30 HA1 GLY 30 6.924 -8.625 9.967 252 H PHE 31 HN PHE 31 5.851 -7.047 7.334 253 HA PHE 31 HA PHE 31 4.532 -5.047 9.007 254 HB2 PHE 31 HB2 PHE 31 5.070 -3.408 7.427 255 HB3 PHE 31 HB1 PHE 31 6.482 -4.441 7.482 256 HD1 PHE 31 HD2 PHE 31 6.821 -6.102 5.620 257 HD2 PHE 31 HD1 PHE 31 3.937 -2.992 5.420 258 HE1 PHE 31 HE2 PHE 31 6.707 -6.373 3.191 259 HE2 PHE 31 HE1 PHE 31 3.814 -3.263 2.981 260 HZ PHE 31 HZ PHE 31 5.298 -4.789 1.841 261 H SER 32 HN SER 32 2.708 -3.748 7.754 262 HA SER 32 HA SER 32 0.942 -5.830 6.645 263 HB2 SER 32 HB2 SER 32 0.488 -5.603 9.079 264 HB3 SER 32 HB1 SER 32 0.100 -3.902 8.821 265 HG SER 32 HG SER 32 -1.753 -5.352 8.842 266 H ILE 33 HN ILE 33 -0.805 -5.082 5.397 267 HA ILE 33 HA ILE 33 -0.382 -2.378 4.333 268 HB ILE 33 HB ILE 33 -0.625 -3.235 2.056 269 HG12 ILE 33 HG12 ILE 33 -0.535 -6.003 3.284 270 HG13 ILE 33 HG11 ILE 33 -2.001 -5.237 2.685 271 HG21 ILE 33 HG21 ILE 33 1.614 -2.992 2.877 272 HG22 ILE 33 HG22 ILE 33 1.539 -4.464 1.907 273 HG23 ILE 33 HG23 ILE 33 1.549 -4.564 3.672 274 HD11 ILE 33 HD11 ILE 33 0.419 -5.930 1.041 275 HD12 ILE 33 HD12 ILE 33 -1.059 -5.176 0.442 276 HD13 ILE 33 HD13 ILE 33 -1.105 -6.820 1.084 277 H GLY 34 HN GLY 34 -2.217 -1.433 3.401 278 HA2 GLY 34 HA2 GLY 34 -4.701 -2.786 4.201 279 HA3 GLY 34 HA1 GLY 34 -4.498 -1.033 4.132 280 H GLY 35 HN GLY 35 -6.212 -3.205 2.720 281 HA2 GLY 35 HA2 GLY 35 -5.880 -2.022 0.037 282 HA3 GLY 35 HA1 GLY 35 -6.153 -3.754 0.238 283 H GLY 36 HN GLY 36 -7.682 -1.238 -0.847 284 HA2 GLY 36 HA2 GLY 36 -10.266 -2.034 0.365 285 HA3 GLY 36 HA1 GLY 36 -9.855 -0.333 0.146 286 H ILE 37 HN ILE 37 -8.662 -2.298 -2.268 287 HA ILE 37 HA ILE 37 -9.988 -1.159 -4.390 288 HB ILE 37 HB ILE 37 -9.269 -3.352 -5.582 289 HG12 ILE 37 HG12 ILE 37 -7.854 -3.657 -2.921 290 HG13 ILE 37 HG11 ILE 37 -9.191 -4.660 -3.458 291 HG21 ILE 37 HG21 ILE 37 -8.080 -1.225 -5.697 292 HG22 ILE 37 HG22 ILE 37 -6.953 -2.580 -5.607 293 HG23 ILE 37 HG23 ILE 37 -7.267 -1.594 -4.177 294 HD11 ILE 37 HD11 ILE 37 -7.842 -5.440 -5.313 295 HD12 ILE 37 HD12 ILE 37 -7.096 -5.770 -3.748 296 HD13 ILE 37 HD13 ILE 37 -6.501 -4.444 -4.745 297 H ASP 38 HN ASP 38 -10.521 -4.584 -3.499 298 HA ASP 38 HA ASP 38 -13.228 -4.341 -4.617 299 HB2 ASP 38 HB2 ASP 38 -12.818 -7.046 -4.162 300 HB3 ASP 38 HB1 ASP 38 -12.661 -6.227 -5.704 301 H GLN 39 HN GLN 39 -11.942 -3.838 -1.849 302 HA GLN 39 HA GLN 39 -13.319 -5.668 -0.126 303 HB2 GLN 39 HB2 GLN 39 -12.166 -3.099 0.852 304 HB3 GLN 39 HB1 GLN 39 -12.222 -4.670 1.642 305 HG2 GLN 39 HG2 GLN 39 -10.573 -3.900 -0.716 306 HG3 GLN 39 HG1 GLN 39 -9.986 -4.140 0.923 307 HE21 GLN 39 HE21 GLN 39 -9.338 -5.479 -1.639 308 HE22 GLN 39 HE22 GLN 39 -9.626 -7.153 -1.381 309 H ASP 40 HN ASP 40 -13.559 -2.302 0.762 310 HA ASP 40 HA ASP 40 -16.448 -2.738 0.848 311 HB2 ASP 40 HB2 ASP 40 -14.559 -2.376 3.027 312 HB3 ASP 40 HB1 ASP 40 -15.857 -1.190 3.066 313 HA PRO 41 HA PRO 41 -16.212 1.343 -1.195 314 HB2 PRO 41 HB2 PRO 41 -18.834 1.235 -1.919 315 HB3 PRO 41 HB1 PRO 41 -17.569 0.421 -2.852 316 HG2 PRO 41 HG2 PRO 41 -19.346 -0.718 -0.710 317 HG3 PRO 41 HG1 PRO 41 -19.036 -1.348 -2.329 318 HD2 PRO 41 HD2 PRO 41 -17.735 -2.363 -0.270 319 HD3 PRO 41 HD1 PRO 41 -16.858 -2.029 -1.782 320 H SER 42 HN SER 42 -17.811 -0.125 1.314 321 HA SER 42 HA SER 42 -19.582 1.671 2.405 322 HB2 SER 42 HB2 SER 42 -17.561 -0.027 3.902 323 HB3 SER 42 HB1 SER 42 -19.100 0.581 4.530 324 HG SER 42 HG SER 42 -18.703 -1.709 3.349 325 H GLN 43 HN GLN 43 -16.012 1.644 2.492 326 HA GLN 43 HA GLN 43 -16.064 3.697 4.557 327 HB2 GLN 43 HB2 GLN 43 -13.849 2.214 3.179 328 HB3 GLN 43 HB1 GLN 43 -13.689 3.198 4.640 329 HG2 GLN 43 HG2 GLN 43 -15.122 1.693 5.848 330 HG3 GLN 43 HG1 GLN 43 -15.438 0.771 4.379 331 HE21 GLN 43 HE21 GLN 43 -13.642 -0.271 3.361 332 HE22 GLN 43 HE22 GLN 43 -12.343 -0.857 4.365 333 H ASN 44 HN ASN 44 -15.910 3.464 1.202 334 HA ASN 44 HA ASN 44 -15.475 6.334 1.016 335 HB2 ASN 44 HB2 ASN 44 -13.255 4.955 0.786 336 HB3 ASN 44 HB1 ASN 44 -13.857 4.686 -0.854 337 HD21 ASN 44 HD21 ASN 44 -11.580 6.281 0.256 338 HD22 ASN 44 HD22 ASN 44 -11.774 7.859 -0.434 339 HA PRO 45 HA PRO 45 -18.496 5.220 -2.162 340 HB2 PRO 45 HB2 PRO 45 -20.224 7.193 -1.632 341 HB3 PRO 45 HB1 PRO 45 -20.160 5.737 -0.625 342 HG2 PRO 45 HG2 PRO 45 -19.056 8.461 -0.098 343 HG3 PRO 45 HG1 PRO 45 -19.824 7.325 1.026 344 HD2 PRO 45 HD2 PRO 45 -17.082 7.704 0.723 345 HD3 PRO 45 HD1 PRO 45 -17.843 6.295 1.481 346 H PHE 46 HN PHE 46 -16.478 7.858 -1.463 347 HA PHE 46 HA PHE 46 -17.271 9.434 -3.774 348 HB2 PHE 46 HB2 PHE 46 -15.256 9.885 -1.573 349 HB3 PHE 46 HB1 PHE 46 -15.381 10.944 -2.976 350 HD1 PHE 46 HD2 PHE 46 -17.326 12.388 -3.267 351 HD2 PHE 46 HD1 PHE 46 -16.934 9.878 0.149 352 HE1 PHE 46 HE2 PHE 46 -19.099 13.663 -2.130 353 HE2 PHE 46 HE1 PHE 46 -18.700 11.152 1.292 354 HZ PHE 46 HZ PHE 46 -19.772 13.081 0.137 355 H SER 47 HN SER 47 -14.436 7.556 -2.660 356 HA SER 47 HA SER 47 -13.485 7.642 -5.403 357 HB2 SER 47 HB2 SER 47 -11.164 7.892 -4.372 358 HB3 SER 47 HB1 SER 47 -12.194 9.322 -4.384 359 HG SER 47 HG SER 47 -12.771 8.215 -2.163 360 H GLU 48 HN GLU 48 -11.264 6.185 -5.185 361 HA GLU 48 HA GLU 48 -11.423 3.765 -3.832 362 HB2 GLU 48 HB2 GLU 48 -12.584 2.313 -5.334 363 HB3 GLU 48 HB1 GLU 48 -13.637 3.707 -5.087 364 HG2 GLU 48 HG2 GLU 48 -12.386 4.579 -7.246 365 HG3 GLU 48 HG1 GLU 48 -12.137 2.856 -7.509 366 H ASP 49 HN ASP 49 -10.671 5.491 -6.749 367 HA ASP 49 HA ASP 49 -7.996 4.737 -6.918 368 HB2 ASP 49 HB2 ASP 49 -8.763 2.534 -7.612 369 HB3 ASP 49 HB1 ASP 49 -9.781 3.248 -8.860 370 H LYS 50 HN LYS 50 -8.820 7.074 -6.939 371 HA LYS 50 HA LYS 50 -8.511 7.963 -9.713 372 HB2 LYS 50 HB2 LYS 50 -10.384 9.027 -7.615 373 HB3 LYS 50 HB1 LYS 50 -9.726 10.122 -8.819 374 HG2 LYS 50 HG2 LYS 50 -11.876 9.416 -9.556 375 HG3 LYS 50 HG1 LYS 50 -10.674 8.641 -10.585 376 HD2 LYS 50 HD2 LYS 50 -10.871 6.618 -9.105 377 HD3 LYS 50 HD1 LYS 50 -12.249 7.408 -8.336 378 HE2 LYS 50 HE2 LYS 50 -13.488 7.412 -10.372 379 HE3 LYS 50 HE1 LYS 50 -12.076 6.939 -11.309 380 HZ1 LYS 50 HZ1 LYS 50 -13.608 5.267 -9.383 381 HZ2 LYS 50 HZ2 LYS 50 -12.104 4.819 -10.018 382 HZ3 LYS 50 HZ3 LYS 50 -13.424 5.033 -11.056 383 H THR 51 HN THR 51 -8.306 8.964 -6.351 384 HA THR 51 HA THR 51 -5.685 10.177 -6.929 385 HB THR 51 HB THR 51 -6.119 11.482 -4.806 386 HG1 THR 51 HG1 THR 51 -7.909 11.080 -3.724 387 HG21 THR 51 HG21 THR 51 -6.442 12.511 -6.979 388 HG22 THR 51 HG22 THR 51 -7.721 13.037 -5.882 389 HG23 THR 51 HG23 THR 51 -8.053 11.804 -7.100 390 H ASP 52 HN ASP 52 -6.754 7.349 -6.008 391 HA ASP 52 HA ASP 52 -5.087 7.212 -3.577 392 HB2 ASP 52 HB2 ASP 52 -7.598 7.143 -3.156 393 HB3 ASP 52 HB1 ASP 52 -7.563 5.540 -3.887 394 H LYS 53 HN LYS 53 -6.701 4.982 -5.807 395 HA LYS 53 HA LYS 53 -5.864 3.284 -7.078 396 HB2 LYS 53 HB2 LYS 53 -3.345 4.048 -5.737 397 HB3 LYS 53 HB1 LYS 53 -3.465 2.381 -6.283 398 HG2 LYS 53 HG2 LYS 53 -2.419 3.782 -7.963 399 HG3 LYS 53 HG1 LYS 53 -3.960 3.148 -8.539 400 HD2 LYS 53 HD2 LYS 53 -4.986 5.347 -7.806 401 HD3 LYS 53 HD1 LYS 53 -3.339 5.938 -7.589 402 HE2 LYS 53 HE2 LYS 53 -4.273 6.562 -9.770 403 HE3 LYS 53 HE1 LYS 53 -2.852 5.531 -9.923 404 HZ1 LYS 53 HZ1 LYS 53 -4.105 3.753 -10.629 405 HZ2 LYS 53 HZ2 LYS 53 -4.953 5.045 -11.333 406 HZ3 LYS 53 HZ3 LYS 53 -5.539 4.317 -9.914 407 H GLY 54 HN GLY 54 -5.936 3.374 -3.649 408 HA2 GLY 54 HA2 GLY 54 -7.342 1.986 -2.424 409 HA3 GLY 54 HA1 GLY 54 -7.429 0.902 -3.800 410 H ILE 55 HN ILE 55 -4.216 1.288 -3.399 411 HA ILE 55 HA ILE 55 -4.010 -0.769 -1.300 412 HB ILE 55 HB ILE 55 -2.397 -0.712 -3.864 413 HG12 ILE 55 HG12 ILE 55 -4.737 -1.533 -4.138 414 HG13 ILE 55 HG11 ILE 55 -3.523 -2.765 -4.465 415 HG21 ILE 55 HG21 ILE 55 -1.034 -1.483 -2.036 416 HG22 ILE 55 HG22 ILE 55 -1.464 -2.867 -3.048 417 HG23 ILE 55 HG23 ILE 55 -2.296 -2.601 -1.512 418 HD11 ILE 55 HD11 ILE 55 -3.905 -3.716 -2.239 419 HD12 ILE 55 HD12 ILE 55 -5.378 -3.689 -3.210 420 HD13 ILE 55 HD13 ILE 55 -5.140 -2.489 -1.939 421 H TYR 56 HN TYR 56 -2.692 -0.183 0.311 422 HA TYR 56 HA TYR 56 -0.170 1.064 -0.192 423 HB2 TYR 56 HB2 TYR 56 -0.493 3.131 0.989 424 HB3 TYR 56 HB1 TYR 56 -1.704 3.030 -0.280 425 HD1 TYR 56 HD1 TYR 56 -4.035 2.042 0.503 426 HD2 TYR 56 HD2 TYR 56 -1.132 3.767 3.080 427 HE1 TYR 56 HE1 TYR 56 -5.796 2.504 2.164 428 HE2 TYR 56 HE2 TYR 56 -2.874 4.233 4.753 429 HH TYR 56 HH TYR 56 -5.898 2.829 4.696 430 H VAL 57 HN VAL 57 1.169 1.162 1.733 431 HA VAL 57 HA VAL 57 0.602 -0.888 3.588 432 HB VAL 57 HB VAL 57 2.848 0.003 2.682 433 HG11 VAL 57 HG11 VAL 57 2.222 2.015 4.704 434 HG12 VAL 57 HG12 VAL 57 3.159 2.137 3.209 435 HG13 VAL 57 HG13 VAL 57 3.870 1.401 4.636 436 HG21 VAL 57 HG21 VAL 57 2.560 -1.834 4.214 437 HG22 VAL 57 HG22 VAL 57 2.557 -0.690 5.557 438 HG23 VAL 57 HG23 VAL 57 4.006 -0.891 4.570 439 H THR 58 HN THR 58 -0.030 -0.754 5.657 440 HA THR 58 HA THR 58 -0.970 1.867 6.582 441 HB THR 58 HB THR 58 -2.715 0.140 6.190 442 HG1 THR 58 HG1 THR 58 -3.827 0.778 7.910 443 HG21 THR 58 HG21 THR 58 -1.408 -1.309 8.491 444 HG22 THR 58 HG22 THR 58 -1.385 -1.830 6.807 445 HG23 THR 58 HG23 THR 58 -2.912 -1.766 7.688 446 H ARG 59 HN ARG 59 1.216 -0.701 7.198 447 HA ARG 59 HA ARG 59 2.522 0.795 9.192 448 HB2 ARG 59 HB2 ARG 59 2.471 -1.080 10.858 449 HB3 ARG 59 HB1 ARG 59 1.072 -0.027 10.823 450 HG2 ARG 59 HG2 ARG 59 -0.152 -1.744 9.622 451 HG3 ARG 59 HG1 ARG 59 1.305 -2.747 9.571 452 HD2 ARG 59 HD2 ARG 59 1.309 -3.041 11.909 453 HD3 ARG 59 HD1 ARG 59 0.116 -1.770 12.149 454 HE ARG 59 HE ARG 59 -1.339 -3.459 10.756 455 HH11 ARG 59 HH11 ARG 59 0.901 -4.116 13.360 456 HH12 ARG 59 HH12 ARG 59 0.132 -5.598 13.833 457 HH21 ARG 59 HH21 ARG 59 -2.370 -5.416 11.357 458 HH22 ARG 59 HH22 ARG 59 -1.749 -6.327 12.711 459 H VAL 60 HN VAL 60 4.285 -0.674 10.236 460 HA VAL 60 HA VAL 60 5.436 -2.406 8.217 461 HB VAL 60 HB VAL 60 6.820 0.044 9.330 462 HG11 VAL 60 HG11 VAL 60 8.680 -0.596 7.898 463 HG12 VAL 60 HG12 VAL 60 7.799 -2.043 7.400 464 HG13 VAL 60 HG13 VAL 60 8.303 -1.851 9.077 465 HG21 VAL 60 HG21 VAL 60 6.839 0.887 7.063 466 HG22 VAL 60 HG22 VAL 60 5.178 0.565 7.568 467 HG23 VAL 60 HG23 VAL 60 6.009 -0.565 6.496 468 H SER 61 HN SER 61 6.714 -3.977 9.102 469 HA SER 61 HA SER 61 7.070 -4.183 11.916 470 HB2 SER 61 HB2 SER 61 8.839 -5.943 11.104 471 HB3 SER 61 HB1 SER 61 7.115 -6.251 10.911 472 HG SER 61 HG SER 61 8.378 -6.659 8.995 473 H GLU 62 HN GLU 62 8.316 -2.849 12.961 474 HA GLU 62 HA GLU 62 10.071 -1.115 11.702 475 HB2 GLU 62 HB2 GLU 62 9.459 -1.699 14.550 476 HB3 GLU 62 HB1 GLU 62 10.612 -0.503 14.069 477 HG2 GLU 62 HG2 GLU 62 9.004 0.798 12.980 478 HG3 GLU 62 HG1 GLU 62 7.808 -0.486 13.087 479 H GLY 63 HN GLY 63 11.984 -1.022 11.547 480 HA2 GLY 63 HA2 GLY 63 14.226 -1.579 11.411 481 HA3 GLY 63 HA1 GLY 63 14.016 -2.452 12.933 482 H GLY 64 HN GLY 64 12.198 -3.104 9.967 483 HA2 GLY 64 HA2 GLY 64 13.346 -5.802 10.077 484 HA3 GLY 64 HA1 GLY 64 11.746 -5.395 9.470 485 HA PRO 65 HA PRO 65 14.087 -5.487 5.673 486 HB2 PRO 65 HB2 PRO 65 12.071 -6.466 4.220 487 HB3 PRO 65 HB1 PRO 65 13.068 -7.464 5.269 488 HG2 PRO 65 HG2 PRO 65 10.266 -6.727 5.559 489 HG3 PRO 65 HG1 PRO 65 11.189 -7.948 6.449 490 HD2 PRO 65 HD2 PRO 65 10.486 -5.228 7.248 491 HD3 PRO 65 HD1 PRO 65 11.187 -6.545 8.221 492 H ALA 66 HN ALA 66 10.842 -4.103 5.968 493 HA ALA 66 HA ALA 66 10.823 -3.373 3.124 494 HB1 ALA 66 HB1 ALA 66 8.690 -3.973 4.024 495 HB2 ALA 66 HB2 ALA 66 8.644 -2.215 3.808 496 HB3 ALA 66 HB3 ALA 66 8.884 -2.907 5.414 497 H GLU 67 HN GLU 67 11.318 -1.926 6.277 498 HA GLU 67 HA GLU 67 10.834 0.728 5.274 499 HB2 GLU 67 HB2 GLU 67 11.472 1.304 7.649 500 HB3 GLU 67 HB1 GLU 67 10.021 0.324 7.437 501 HG2 GLU 67 HG2 GLU 67 10.954 -1.504 8.352 502 HG3 GLU 67 HG1 GLU 67 12.547 -1.106 7.715 503 H ILE 68 HN ILE 68 13.436 -1.469 5.881 504 HA ILE 68 HA ILE 68 15.404 0.570 6.004 505 HB ILE 68 HB ILE 68 16.949 -1.255 5.798 506 HG12 ILE 68 HG12 ILE 68 14.602 -3.092 6.005 507 HG13 ILE 68 HG11 ILE 68 15.424 -2.736 4.487 508 HG21 ILE 68 HG21 ILE 68 16.487 -2.229 8.019 509 HG22 ILE 68 HG22 ILE 68 14.868 -1.534 7.918 510 HG23 ILE 68 HG23 ILE 68 16.276 -0.476 7.969 511 HD11 ILE 68 HD11 ILE 68 16.158 -4.827 5.482 512 HD12 ILE 68 HD12 ILE 68 16.701 -3.941 6.910 513 HD13 ILE 68 HD13 ILE 68 17.466 -3.654 5.349 514 H ALA 69 HN ALA 69 13.844 -1.505 3.865 515 HA ALA 69 HA ALA 69 15.409 -1.119 1.560 516 HB1 ALA 69 HB1 ALA 69 13.486 -1.897 0.317 517 HB2 ALA 69 HB2 ALA 69 12.423 -1.569 1.680 518 HB3 ALA 69 HB3 ALA 69 13.618 -2.867 1.787 519 H GLY 70 HN GLY 70 13.135 0.737 3.331 520 HA2 GLY 70 HA2 GLY 70 13.198 3.181 2.978 521 HA3 GLY 70 HA1 GLY 70 13.255 2.861 1.244 522 H LEU 71 HN LEU 71 11.230 1.441 3.754 523 HA LEU 71 HA LEU 71 8.856 2.388 2.356 524 HB2 LEU 71 HB2 LEU 71 9.420 -0.064 2.138 525 HB3 LEU 71 HB1 LEU 71 9.264 -0.201 3.877 526 HG LEU 71 HG LEU 71 7.360 -0.994 2.329 527 HD11 LEU 71 HD11 LEU 71 7.297 -0.933 4.762 528 HD12 LEU 71 HD12 LEU 71 5.732 -0.548 4.047 529 HD13 LEU 71 HD13 LEU 71 6.749 0.738 4.700 530 HD21 LEU 71 HD21 LEU 71 5.632 0.754 1.948 531 HD22 LEU 71 HD22 LEU 71 7.079 0.932 0.953 532 HD23 LEU 71 HD23 LEU 71 6.841 1.973 2.353 533 H GLN 72 HN GLN 72 7.024 2.371 4.072 534 HA GLN 72 HA GLN 72 7.841 3.333 6.616 535 HB2 GLN 72 HB2 GLN 72 7.875 4.950 4.279 536 HB3 GLN 72 HB1 GLN 72 6.588 5.523 5.346 537 HG2 GLN 72 HG2 GLN 72 8.322 5.588 7.161 538 HG3 GLN 72 HG1 GLN 72 9.520 5.318 5.886 539 HE21 GLN 72 HE21 GLN 72 7.701 6.689 4.004 540 HE22 GLN 72 HE22 GLN 72 7.947 8.387 4.290 541 H ILE 73 HN ILE 73 5.753 4.774 7.340 542 HA ILE 73 HA ILE 73 3.534 2.955 6.992 543 HB ILE 73 HB ILE 73 3.421 5.443 8.658 544 HG12 ILE 73 HG12 ILE 73 5.545 4.546 9.333 545 HG13 ILE 73 HG11 ILE 73 4.370 4.088 10.561 546 HG21 ILE 73 HG21 ILE 73 1.436 4.148 8.451 547 HG22 ILE 73 HG22 ILE 73 2.080 3.943 10.082 548 HG23 ILE 73 HG23 ILE 73 2.308 2.677 8.876 549 HD11 ILE 73 HD11 ILE 73 4.235 1.849 9.564 550 HD12 ILE 73 HD12 ILE 73 5.871 2.256 10.082 551 HD13 ILE 73 HD13 ILE 73 5.447 2.322 8.363 552 H GLY 74 HN GLY 74 2.326 3.283 5.210 553 HA2 GLY 74 HA2 GLY 74 0.354 4.509 4.485 554 HA3 GLY 74 HA1 GLY 74 1.158 5.997 4.985 555 H ASP 75 HN ASP 75 1.784 3.222 2.883 556 HA ASP 75 HA ASP 75 2.965 5.064 0.894 557 HB2 ASP 75 HB2 ASP 75 4.451 3.503 2.682 558 HB3 ASP 75 HB1 ASP 75 4.463 2.579 1.184 559 H LYS 76 HN LYS 76 2.224 4.533 -1.159 560 HA LYS 76 HA LYS 76 0.260 2.398 -1.129 561 HB2 LYS 76 HB2 LYS 76 0.887 4.453 -3.240 562 HB3 LYS 76 HB1 LYS 76 -0.479 3.352 -3.254 563 HG2 LYS 76 HG2 LYS 76 -1.522 4.440 -1.466 564 HG3 LYS 76 HG1 LYS 76 -0.050 5.322 -1.038 565 HD2 LYS 76 HD2 LYS 76 -0.187 6.666 -2.984 566 HD3 LYS 76 HD1 LYS 76 -1.444 5.642 -3.682 567 HE2 LYS 76 HE2 LYS 76 -1.730 7.358 -1.209 568 HE3 LYS 76 HE1 LYS 76 -2.404 7.714 -2.802 569 HZ1 LYS 76 HZ1 LYS 76 -3.682 5.624 -2.630 570 HZ2 LYS 76 HZ2 LYS 76 -4.111 6.746 -1.436 571 HZ3 LYS 76 HZ3 LYS 76 -3.123 5.427 -1.047 572 H ILE 77 HN ILE 77 1.033 0.478 -1.517 573 HA ILE 77 HA ILE 77 3.187 -0.039 -3.327 574 HB ILE 77 HB ILE 77 1.265 -2.026 -2.112 575 HG12 ILE 77 HG12 ILE 77 3.983 -1.219 -1.066 576 HG13 ILE 77 HG11 ILE 77 2.485 -0.516 -0.464 577 HG21 ILE 77 HG21 ILE 77 3.096 -3.619 -2.471 578 HG22 ILE 77 HG22 ILE 77 4.048 -2.345 -3.234 579 HG23 ILE 77 HG23 ILE 77 2.552 -2.900 -3.986 580 HD11 ILE 77 HD11 ILE 77 3.170 -3.442 -0.390 581 HD12 ILE 77 HD12 ILE 77 1.735 -2.673 0.291 582 HD13 ILE 77 HD13 ILE 77 3.329 -2.317 0.958 583 H MET 78 HN MET 78 2.889 0.212 -5.434 584 HA MET 78 HA MET 78 0.256 -0.209 -6.610 585 HB2 MET 78 HB2 MET 78 2.783 0.692 -7.989 586 HB3 MET 78 HB1 MET 78 1.134 0.851 -8.577 587 HG2 MET 78 HG2 MET 78 2.101 2.192 -6.077 588 HG3 MET 78 HG1 MET 78 2.245 2.933 -7.666 589 HE1 MET 78 HE1 MET 78 -1.628 2.365 -5.226 590 HE2 MET 78 HE2 MET 78 0.026 2.160 -4.645 591 HE3 MET 78 HE3 MET 78 -0.696 0.947 -5.698 592 H GLN 79 HN GLN 79 3.353 -1.716 -6.397 593 HA GLN 79 HA GLN 79 2.409 -4.126 -7.498 594 HB2 GLN 79 HB2 GLN 79 4.511 -4.002 -9.140 595 HB3 GLN 79 HB1 GLN 79 2.847 -3.740 -9.621 596 HG2 GLN 79 HG2 GLN 79 3.294 -1.292 -9.214 597 HG3 GLN 79 HG1 GLN 79 4.988 -1.775 -9.128 598 HE21 GLN 79 HE21 GLN 79 5.993 -2.632 -10.887 599 HE22 GLN 79 HE22 GLN 79 5.414 -2.367 -12.506 600 H VAL 80 HN VAL 80 3.831 -5.772 -7.490 601 HA VAL 80 HA VAL 80 6.220 -5.291 -5.801 602 HB VAL 80 HB VAL 80 5.083 -6.374 -4.195 603 HG11 VAL 80 HG11 VAL 80 3.007 -6.170 -5.499 604 HG12 VAL 80 HG12 VAL 80 3.066 -7.651 -4.524 605 HG13 VAL 80 HG13 VAL 80 3.363 -7.727 -6.263 606 HG21 VAL 80 HG21 VAL 80 5.280 -8.878 -4.320 607 HG22 VAL 80 HG22 VAL 80 6.777 -8.023 -4.720 608 HG23 VAL 80 HG23 VAL 80 5.773 -8.706 -6.014 609 H ASN 81 HN ASN 81 8.052 -6.133 -6.567 610 HA ASN 81 HA ASN 81 9.538 -7.125 -7.959 611 HB2 ASN 81 HB2 ASN 81 7.609 -9.175 -7.285 612 HB3 ASN 81 HB1 ASN 81 8.292 -9.454 -8.890 613 HD21 ASN 81 HD21 ASN 81 9.004 -9.105 -5.498 614 HD22 ASN 81 HD22 ASN 81 10.581 -9.846 -5.552 615 H GLY 82 HN GLY 82 6.899 -5.739 -9.034 616 HA2 GLY 82 HA2 GLY 82 7.110 -4.625 -11.210 617 HA3 GLY 82 HA1 GLY 82 7.583 -6.195 -11.862 618 H TRP 83 HN TRP 83 5.193 -6.845 -9.674 619 HA TRP 83 HA TRP 83 3.301 -7.170 -11.846 620 HB2 TRP 83 HB2 TRP 83 3.152 -8.282 -9.070 621 HB3 TRP 83 HB1 TRP 83 2.230 -8.776 -10.470 622 HD1 TRP 83 HD1 TRP 83 5.824 -8.492 -9.448 623 HE1 TRP 83 HE1 TRP 83 7.067 -10.549 -10.190 624 HE3 TRP 83 HE3 TRP 83 2.076 -10.866 -11.947 625 HZ2 TRP 83 HZ2 TRP 83 6.630 -12.882 -11.677 626 HZ3 TRP 83 HZ3 TRP 83 2.594 -13.027 -13.032 627 HH2 TRP 83 HH2 TRP 83 4.839 -13.989 -12.882 628 H ASP 84 HN ASP 84 2.896 -4.862 -11.664 629 HA ASP 84 HA ASP 84 1.562 -3.343 -10.040 630 HB2 ASP 84 HB2 ASP 84 1.485 -3.017 -12.507 631 HB3 ASP 84 HB1 ASP 84 0.215 -4.232 -12.613 632 H MET 85 HN MET 85 0.634 -4.031 -8.244 633 HA MET 85 HA MET 85 -1.294 -6.198 -8.328 634 HB2 MET 85 HB2 MET 85 -1.313 -5.736 -5.781 635 HB3 MET 85 HB1 MET 85 0.084 -6.503 -6.521 636 HG2 MET 85 HG2 MET 85 1.435 -4.757 -6.106 637 HG3 MET 85 HG1 MET 85 0.162 -3.566 -6.343 638 HE1 MET 85 HE1 MET 85 0.146 -6.157 -2.553 639 HE2 MET 85 HE2 MET 85 1.519 -6.309 -3.649 640 HE3 MET 85 HE3 MET 85 -0.104 -6.706 -4.212 641 H THR 86 HN THR 86 -1.741 -3.176 -9.174 642 HA THR 86 HA THR 86 -4.161 -2.766 -7.572 643 HB THR 86 HB THR 86 -4.350 -0.580 -8.710 644 HG1 THR 86 HG1 THR 86 -2.372 -1.666 -10.304 645 HG21 THR 86 HG21 THR 86 -1.632 -1.084 -7.508 646 HG22 THR 86 HG22 THR 86 -3.117 -0.796 -6.598 647 HG23 THR 86 HG23 THR 86 -2.450 0.477 -7.623 648 H MET 87 HN MET 87 -3.137 -3.898 -10.638 649 HA MET 87 HA MET 87 -5.798 -3.746 -11.796 650 HB2 MET 87 HB2 MET 87 -4.805 -4.724 -13.778 651 HB3 MET 87 HB1 MET 87 -3.785 -3.418 -13.198 652 HG2 MET 87 HG2 MET 87 -2.241 -4.991 -12.225 653 HG3 MET 87 HG1 MET 87 -3.291 -6.335 -12.668 654 HE1 MET 87 HE1 MET 87 -0.220 -6.810 -15.052 655 HE2 MET 87 HE2 MET 87 -1.237 -7.556 -13.822 656 HE3 MET 87 HE3 MET 87 -0.177 -6.214 -13.394 657 H VAL 88 HN VAL 88 -4.247 -5.693 -9.655 658 HA VAL 88 HA VAL 88 -5.732 -8.110 -10.422 659 HB VAL 88 HB VAL 88 -3.989 -8.519 -8.178 660 HG11 VAL 88 HG11 VAL 88 -4.007 -9.569 -10.990 661 HG12 VAL 88 HG12 VAL 88 -4.767 -10.294 -9.565 662 HG13 VAL 88 HG13 VAL 88 -3.010 -10.204 -9.677 663 HG21 VAL 88 HG21 VAL 88 -2.633 -7.404 -10.626 664 HG22 VAL 88 HG22 VAL 88 -1.826 -8.161 -9.250 665 HG23 VAL 88 HG23 VAL 88 -2.698 -6.642 -9.036 666 H THR 89 HN THR 89 -6.064 -9.440 -8.111 667 HA THR 89 HA THR 89 -7.660 -7.609 -6.462 668 HB THR 89 HB THR 89 -7.910 -10.437 -7.310 669 HG1 THR 89 HG1 THR 89 -9.697 -8.284 -6.804 670 HG21 THR 89 HG21 THR 89 -9.422 -11.030 -5.483 671 HG22 THR 89 HG22 THR 89 -8.937 -9.562 -4.630 672 HG23 THR 89 HG23 THR 89 -7.750 -10.825 -4.964 673 H HIS 90 HN HIS 90 -7.626 -8.368 -4.028 674 HA HIS 90 HA HIS 90 -4.942 -7.867 -3.258 675 HB2 HIS 90 HB2 HIS 90 -7.117 -7.213 -2.032 676 HB3 HIS 90 HB1 HIS 90 -7.075 -8.844 -1.363 677 HD1 HIS 90 HD1 HIS 90 -4.032 -9.036 -0.778 678 HD2 HIS 90 HD2 HIS 90 -6.397 -5.752 0.182 679 HE1 HIS 90 HE1 HIS 90 -2.850 -7.875 1.107 680 HE2 HIS 90 HE2 HIS 90 -4.401 -6.028 1.804 681 H ASP 91 HN ASP 91 -6.873 -10.783 -3.350 682 HA ASP 91 HA ASP 91 -4.925 -12.395 -1.997 683 HB2 ASP 91 HB2 ASP 91 -7.345 -12.943 -2.007 684 HB3 ASP 91 HB1 ASP 91 -7.242 -13.250 -3.745 685 H GLN 92 HN GLN 92 -5.637 -11.565 -5.332 686 HA GLN 92 HA GLN 92 -3.830 -13.291 -6.595 687 HB2 GLN 92 HB2 GLN 92 -4.239 -10.512 -7.546 688 HB3 GLN 92 HB1 GLN 92 -4.104 -11.998 -8.472 689 HG2 GLN 92 HG2 GLN 92 -6.440 -11.085 -6.854 690 HG3 GLN 92 HG1 GLN 92 -6.338 -11.187 -8.606 691 HE21 GLN 92 HE21 GLN 92 -6.309 -13.152 -9.553 692 HE22 GLN 92 HE22 GLN 92 -6.887 -14.560 -8.738 693 H ALA 93 HN ALA 93 -3.530 -10.006 -5.401 694 HA ALA 93 HA ALA 93 -0.841 -9.527 -5.939 695 HB1 ALA 93 HB1 ALA 93 -1.929 -7.631 -5.246 696 HB2 ALA 93 HB2 ALA 93 -1.190 -8.106 -3.711 697 HB3 ALA 93 HB3 ALA 93 -2.877 -8.492 -4.034 698 H ARG 94 HN ARG 94 -2.523 -11.150 -3.352 699 HA ARG 94 HA ARG 94 -0.502 -11.633 -1.570 700 HB2 ARG 94 HB2 ARG 94 -3.027 -12.961 -2.291 701 HB3 ARG 94 HB1 ARG 94 -1.851 -13.986 -1.478 702 HG2 ARG 94 HG2 ARG 94 -1.791 -12.320 0.374 703 HG3 ARG 94 HG1 ARG 94 -3.104 -11.454 -0.438 704 HD2 ARG 94 HD2 ARG 94 -4.513 -13.417 -0.327 705 HD3 ARG 94 HD1 ARG 94 -3.203 -14.355 0.383 706 HE ARG 94 HE ARG 94 -3.507 -12.375 2.175 707 HH11 ARG 94 HH11 ARG 94 -5.808 -14.456 0.560 708 HH12 ARG 94 HH12 ARG 94 -6.902 -14.526 1.916 709 HH21 ARG 94 HH21 ARG 94 -4.969 -12.470 3.985 710 HH22 ARG 94 HH22 ARG 94 -6.421 -13.412 3.847 711 H LYS 95 HN LYS 95 -1.483 -13.545 -4.378 712 HA LYS 95 HA LYS 95 0.336 -15.646 -4.003 713 HB2 LYS 95 HB2 LYS 95 -0.809 -14.748 -6.651 714 HB3 LYS 95 HB1 LYS 95 -0.252 -16.361 -6.223 715 HG2 LYS 95 HG2 LYS 95 -2.088 -16.367 -4.463 716 HG3 LYS 95 HG1 LYS 95 -2.716 -14.929 -5.271 717 HD2 LYS 95 HD2 LYS 95 -3.885 -16.863 -6.086 718 HD3 LYS 95 HD1 LYS 95 -2.864 -16.221 -7.372 719 HE2 LYS 95 HE2 LYS 95 -1.207 -17.929 -6.963 720 HE3 LYS 95 HE1 LYS 95 -2.123 -18.521 -5.578 721 HZ1 LYS 95 HZ1 LYS 95 -2.396 -19.825 -7.668 722 HZ2 LYS 95 HZ2 LYS 95 -3.198 -18.485 -8.340 723 HZ3 LYS 95 HZ3 LYS 95 -3.845 -19.272 -6.988 724 H ARG 96 HN ARG 96 0.768 -12.484 -5.424 725 HA ARG 96 HA ARG 96 3.298 -13.142 -6.616 726 HB2 ARG 96 HB2 ARG 96 2.028 -10.492 -5.953 727 HB3 ARG 96 HB1 ARG 96 3.524 -10.684 -6.861 728 HG2 ARG 96 HG2 ARG 96 0.775 -11.608 -7.656 729 HG3 ARG 96 HG1 ARG 96 1.747 -10.335 -8.404 730 HD2 ARG 96 HD2 ARG 96 2.192 -12.040 -9.830 731 HD3 ARG 96 HD1 ARG 96 3.486 -12.288 -8.668 732 HE ARG 96 HE ARG 96 2.334 -14.169 -7.822 733 HH11 ARG 96 HH11 ARG 96 0.697 -12.686 -10.529 734 HH12 ARG 96 HH12 ARG 96 -0.243 -14.090 -10.913 735 HH21 ARG 96 HH21 ARG 96 1.147 -16.053 -8.346 736 HH22 ARG 96 HH22 ARG 96 0.036 -16.024 -9.684 737 H LEU 97 HN LEU 97 2.290 -11.527 -3.640 738 HA LEU 97 HA LEU 97 4.994 -10.945 -2.888 739 HB2 LEU 97 HB2 LEU 97 3.899 -10.129 -0.774 740 HB3 LEU 97 HB1 LEU 97 3.488 -9.294 -2.258 741 HG LEU 97 HG LEU 97 1.450 -10.956 -2.249 742 HD11 LEU 97 HD11 LEU 97 0.703 -11.554 -0.058 743 HD12 LEU 97 HD12 LEU 97 2.108 -10.773 0.672 744 HD13 LEU 97 HD13 LEU 97 2.321 -12.212 -0.327 745 HD21 LEU 97 HD21 LEU 97 1.662 -8.547 -0.458 746 HD22 LEU 97 HD22 LEU 97 0.157 -9.289 -1.006 747 HD23 LEU 97 HD23 LEU 97 1.255 -8.559 -2.176 748 H THR 98 HN THR 98 2.825 -13.555 -2.238 749 HA THR 98 HA THR 98 4.678 -14.517 -0.166 750 HB THR 98 HB THR 98 2.838 -16.193 0.370 751 HG1 THR 98 HG1 THR 98 1.475 -14.495 -1.423 752 HG21 THR 98 HG21 THR 98 3.347 -14.351 1.849 753 HG22 THR 98 HG22 THR 98 1.600 -14.570 1.772 754 HG23 THR 98 HG23 THR 98 2.364 -13.256 0.879 755 H LYS 99 HN LYS 99 5.327 -14.765 -2.974 756 HA LYS 99 HA LYS 99 4.917 -17.598 -3.376 757 HB2 LYS 99 HB2 LYS 99 5.586 -17.298 -5.629 758 HB3 LYS 99 HB1 LYS 99 4.511 -15.956 -5.276 759 HG2 LYS 99 HG2 LYS 99 6.683 -14.669 -4.751 760 HG3 LYS 99 HG1 LYS 99 7.471 -15.955 -5.658 761 HD2 LYS 99 HD2 LYS 99 5.220 -14.232 -6.692 762 HD3 LYS 99 HD1 LYS 99 6.926 -14.006 -7.071 763 HE2 LYS 99 HE2 LYS 99 5.623 -16.639 -7.595 764 HE3 LYS 99 HE1 LYS 99 5.378 -15.301 -8.717 765 HZ1 LYS 99 HZ1 LYS 99 7.970 -16.535 -7.956 766 HZ2 LYS 99 HZ2 LYS 99 7.835 -15.136 -8.893 767 HZ3 LYS 99 HZ3 LYS 99 7.215 -16.606 -9.469 768 H ARG 100 HN ARG 100 6.671 -18.930 -3.478 769 HA ARG 100 HA ARG 100 9.036 -17.986 -2.035 770 HB2 ARG 100 HB2 ARG 100 7.735 -20.060 -1.353 771 HB3 ARG 100 HB1 ARG 100 8.318 -20.806 -2.830 772 HG2 ARG 100 HG2 ARG 100 9.632 -21.468 -0.866 773 HG3 ARG 100 HG1 ARG 100 10.606 -20.621 -2.068 774 HD2 ARG 100 HD2 ARG 100 10.523 -18.589 -0.778 775 HD3 ARG 100 HD1 ARG 100 9.389 -19.314 0.360 776 HE ARG 100 HE ARG 100 11.218 -20.839 1.009 777 HH11 ARG 100 HH11 ARG 100 12.029 -17.825 -0.596 778 HH12 ARG 100 HH12 ARG 100 13.610 -17.737 0.106 779 HH21 ARG 100 HH21 ARG 100 13.288 -20.735 1.916 780 HH22 ARG 100 HH22 ARG 100 14.343 -19.403 1.532 781 H SER 101 HN SER 101 8.503 -17.211 -4.666 782 HA SER 101 HA SER 101 10.581 -18.598 -6.209 783 HB2 SER 101 HB2 SER 101 8.360 -19.536 -6.789 784 HB3 SER 101 HB1 SER 101 7.809 -17.925 -7.238 785 HG SER 101 HG SER 101 9.914 -19.409 -8.446 786 H GLU 102 HN GLU 102 9.811 -15.826 -4.853 787 HA GLU 102 HA GLU 102 10.395 -14.041 -7.032 788 HB2 GLU 102 HB2 GLU 102 10.332 -12.291 -5.479 789 HB3 GLU 102 HB1 GLU 102 9.137 -13.428 -4.873 790 HG2 GLU 102 HG2 GLU 102 11.930 -13.569 -3.873 791 HG3 GLU 102 HG1 GLU 102 10.857 -12.308 -3.270 792 H GLU 103 HN GLU 103 12.323 -12.941 -7.305 793 HA GLU 103 HA GLU 103 14.666 -14.429 -6.397 794 HB2 GLU 103 HB2 GLU 103 15.878 -13.310 -8.177 795 HB3 GLU 103 HB1 GLU 103 14.471 -14.155 -8.798 796 HG2 GLU 103 HG2 GLU 103 13.275 -12.129 -9.080 797 HG3 GLU 103 HG1 GLU 103 14.500 -11.214 -8.197 798 H VAL 104 HN VAL 104 12.924 -11.958 -5.393 799 HA VAL 104 HA VAL 104 14.997 -10.739 -3.905 800 HB VAL 104 HB VAL 104 15.472 -10.055 -6.304 801 HG11 VAL 104 HG11 VAL 104 13.069 -9.613 -6.833 802 HG12 VAL 104 HG12 VAL 104 14.135 -8.257 -7.230 803 HG13 VAL 104 HG13 VAL 104 13.140 -8.202 -5.766 804 HG21 VAL 104 HG21 VAL 104 14.959 -7.688 -4.502 805 HG22 VAL 104 HG22 VAL 104 16.316 -7.954 -5.615 806 HG23 VAL 104 HG23 VAL 104 16.206 -8.883 -4.117 807 H VAL 105 HN VAL 105 14.343 -8.526 -3.202 808 HA VAL 105 HA VAL 105 11.708 -8.344 -2.270 809 HB VAL 105 HB VAL 105 12.967 -6.698 -0.806 810 HG11 VAL 105 HG11 VAL 105 14.474 -8.247 0.305 811 HG12 VAL 105 HG12 VAL 105 14.536 -9.265 -1.131 812 HG13 VAL 105 HG13 VAL 105 13.035 -9.126 -0.216 813 HG21 VAL 105 HG21 VAL 105 15.362 -6.418 -1.023 814 HG22 VAL 105 HG22 VAL 105 14.585 -5.935 -2.531 815 HG23 VAL 105 HG23 VAL 105 15.393 -7.498 -2.415 816 H ARG 106 HN ARG 106 10.412 -7.306 -3.997 817 HA ARG 106 HA ARG 106 11.517 -4.738 -4.890 818 HB2 ARG 106 HB2 ARG 106 11.384 -6.931 -6.563 819 HB3 ARG 106 HB1 ARG 106 9.926 -6.016 -6.927 820 HG2 ARG 106 HG2 ARG 106 11.556 -5.256 -8.410 821 HG3 ARG 106 HG1 ARG 106 11.358 -3.997 -7.193 822 HD2 ARG 106 HD2 ARG 106 13.359 -4.762 -6.051 823 HD3 ARG 106 HD1 ARG 106 13.548 -6.072 -7.214 824 HE ARG 106 HE ARG 106 13.481 -3.639 -8.615 825 HH11 ARG 106 HH11 ARG 106 15.532 -5.413 -6.416 826 HH12 ARG 106 HH12 ARG 106 16.986 -4.626 -6.927 827 HH21 ARG 106 HH21 ARG 106 15.393 -2.601 -9.307 828 HH22 ARG 106 HH22 ARG 106 16.911 -3.022 -8.573 829 H LEU 107 HN LEU 107 10.126 -3.108 -4.853 830 HA LEU 107 HA LEU 107 7.238 -3.584 -5.127 831 HB2 LEU 107 HB2 LEU 107 8.713 -2.444 -2.931 832 HB3 LEU 107 HB1 LEU 107 7.571 -1.299 -3.593 833 HG LEU 107 HG LEU 107 5.745 -2.849 -3.188 834 HD11 LEU 107 HD11 LEU 107 6.194 -4.891 -1.862 835 HD12 LEU 107 HD12 LEU 107 7.923 -4.623 -2.109 836 HD13 LEU 107 HD13 LEU 107 6.874 -4.949 -3.489 837 HD21 LEU 107 HD21 LEU 107 6.269 -1.304 -1.489 838 HD22 LEU 107 HD22 LEU 107 7.632 -2.283 -0.947 839 HD23 LEU 107 HD23 LEU 107 5.978 -2.857 -0.698 840 H LEU 108 HN LEU 108 6.122 -1.985 -6.243 841 HA LEU 108 HA LEU 108 7.563 0.558 -6.721 842 HB2 LEU 108 HB2 LEU 108 5.338 -0.733 -8.278 843 HB3 LEU 108 HB1 LEU 108 5.594 0.997 -8.351 844 HG LEU 108 HG LEU 108 7.288 -1.209 -9.434 845 HD11 LEU 108 HD11 LEU 108 6.431 1.474 -10.518 846 HD12 LEU 108 HD12 LEU 108 5.655 -0.068 -10.871 847 HD13 LEU 108 HD13 LEU 108 7.311 0.224 -11.397 848 HD21 LEU 108 HD21 LEU 108 9.132 0.354 -9.733 849 HD22 LEU 108 HD22 LEU 108 8.799 0.073 -8.026 850 HD23 LEU 108 HD23 LEU 108 8.266 1.569 -8.791 851 H VAL 109 HN VAL 109 6.673 2.390 -5.757 852 HA VAL 109 HA VAL 109 4.202 2.050 -4.339 853 HB VAL 109 HB VAL 109 6.065 1.211 -2.933 854 HG11 VAL 109 HG11 VAL 109 7.846 2.694 -3.646 855 HG12 VAL 109 HG12 VAL 109 7.609 2.812 -1.900 856 HG13 VAL 109 HG13 VAL 109 6.984 4.074 -2.963 857 HG21 VAL 109 HG21 VAL 109 4.650 3.628 -1.917 858 HG22 VAL 109 HG22 VAL 109 5.415 2.390 -0.920 859 HG23 VAL 109 HG23 VAL 109 4.036 1.977 -1.938 860 H THR 110 HN THR 110 3.523 3.959 -3.403 861 HA THR 110 HA THR 110 4.567 6.449 -4.534 862 HB THR 110 HB THR 110 2.053 7.123 -4.741 863 HG1 THR 110 HG1 THR 110 1.474 4.609 -5.625 864 HG21 THR 110 HG21 THR 110 3.412 5.303 -6.704 865 HG22 THR 110 HG22 THR 110 3.575 7.058 -6.601 866 HG23 THR 110 HG23 THR 110 2.031 6.339 -7.063 867 H ARG 111 HN ARG 111 5.088 7.669 -2.847 868 HA ARG 111 HA ARG 111 3.035 7.918 -0.766 869 HB2 ARG 111 HB2 ARG 111 4.812 8.444 0.874 870 HB3 ARG 111 HB1 ARG 111 4.865 6.792 0.283 871 HG2 ARG 111 HG2 ARG 111 6.711 7.357 -1.184 872 HG3 ARG 111 HG1 ARG 111 6.635 9.039 -0.644 873 HD2 ARG 111 HD2 ARG 111 7.217 8.445 1.554 874 HD3 ARG 111 HD1 ARG 111 7.040 6.729 1.224 875 HE ARG 111 HE ARG 111 9.178 8.420 0.099 876 HH11 ARG 111 HH11 ARG 111 7.950 5.345 1.256 877 HH12 ARG 111 HH12 ARG 111 9.500 4.551 1.155 878 HH21 ARG 111 HH21 ARG 111 11.216 7.377 -0.033 879 HH22 ARG 111 HH22 ARG 111 11.353 5.711 0.419 880 H GLN 112 HN GLN 112 3.404 10.071 0.474 881 HA GLN 112 HA GLN 112 3.363 12.118 -1.565 882 HB2 GLN 112 HB2 GLN 112 2.655 12.363 1.334 883 HB3 GLN 112 HB1 GLN 112 2.111 13.351 0.006 884 HG2 GLN 112 HG2 GLN 112 1.340 10.490 0.476 885 HG3 GLN 112 HG1 GLN 112 0.331 11.896 0.802 886 HE21 GLN 112 HE21 GLN 112 1.683 9.833 -1.641 887 HE22 GLN 112 HE22 GLN 112 0.713 10.408 -2.960 888 H SER 113 HN SER 113 4.693 11.450 1.545 889 HA SER 113 HA SER 113 6.677 11.826 2.518 890 HB2 SER 113 HB2 SER 113 7.218 13.140 -0.102 891 HB3 SER 113 HB1 SER 113 8.409 13.162 1.198 892 HG SER 113 HG SER 113 8.885 11.152 0.766 893 H LEU 114 HN LEU 114 4.325 13.719 2.045 894 HA LEU 114 HA LEU 114 5.266 15.649 3.984 895 HB2 LEU 114 HB2 LEU 114 4.723 17.537 2.765 896 HB3 LEU 114 HB1 LEU 114 5.427 16.462 1.587 897 HG LEU 114 HG LEU 114 3.663 17.572 0.503 898 HD11 LEU 114 HD11 LEU 114 2.119 15.808 -0.121 899 HD12 LEU 114 HD12 LEU 114 2.648 14.848 1.262 900 HD13 LEU 114 HD13 LEU 114 3.780 15.223 -0.038 901 HD21 LEU 114 HD21 LEU 114 1.866 16.819 2.791 902 HD22 LEU 114 HD22 LEU 114 1.352 17.612 1.300 903 HD23 LEU 114 HD23 LEU 114 2.457 18.435 2.403 904 H GLN 115 HN GLN 115 3.575 13.383 3.269 905 HA GLN 115 HA GLN 115 0.848 13.878 3.636 906 HB2 GLN 115 HB2 GLN 115 0.762 11.422 4.069 907 HB3 GLN 115 HB1 GLN 115 1.564 11.869 2.574 908 HG2 GLN 115 HG2 GLN 115 3.739 11.690 3.856 909 HG3 GLN 115 HG1 GLN 115 2.805 10.934 5.145 910 HE21 GLN 115 HE21 GLN 115 1.996 8.873 4.852 911 HE22 GLN 115 HE22 GLN 115 2.498 7.854 3.545 912 H LYS 116 HN LYS 116 -0.455 12.948 5.384 913 HA LYS 116 HA LYS 116 0.690 13.580 8.017 914 HB2 LYS 116 HB2 LYS 116 -2.222 13.364 7.220 915 HB3 LYS 116 HB1 LYS 116 -1.575 14.063 8.699 916 HG2 LYS 116 HG2 LYS 116 -0.802 15.972 7.609 917 HG3 LYS 116 HG1 LYS 116 -0.855 15.198 6.026 918 HD2 LYS 116 HD2 LYS 116 -3.355 15.114 6.261 919 HD3 LYS 116 HD1 LYS 116 -3.182 16.117 7.702 920 HE2 LYS 116 HE2 LYS 116 -2.162 17.880 6.398 921 HE3 LYS 116 HE1 LYS 116 -2.174 16.863 4.959 922 HZ1 LYS 116 HZ1 LYS 116 -4.567 17.886 6.399 923 HZ2 LYS 116 HZ2 LYS 116 -4.606 16.865 5.041 924 HZ3 LYS 116 HZ3 LYS 116 -3.986 18.438 4.903 925 H ALA 117 HN ALA 117 0.732 12.008 9.601 926 HA ALA 117 HA ALA 117 -0.517 9.434 8.924 927 HB1 ALA 117 HB1 ALA 117 2.225 9.838 10.124 928 HB2 ALA 117 HB2 ALA 117 1.880 9.238 8.502 929 HB3 ALA 117 HB3 ALA 117 1.429 8.278 9.912 930 H VAL 118 HN VAL 118 -1.135 11.768 10.508 931 HA VAL 118 HA VAL 118 -1.609 10.497 13.080 932 HB VAL 118 HB VAL 118 0.326 11.902 13.384 933 HG11 VAL 118 HG11 VAL 118 -1.332 14.158 12.286 934 HG12 VAL 118 HG12 VAL 118 0.098 13.436 11.548 935 HG13 VAL 118 HG13 VAL 118 0.246 14.340 13.056 936 HG21 VAL 118 HG21 VAL 118 -1.272 11.771 15.198 937 HG22 VAL 118 HG22 VAL 118 -2.124 13.176 14.561 938 HG23 VAL 118 HG23 VAL 118 -0.477 13.343 15.168 939 H GLN 119 HN GLN 119 -3.733 10.151 12.432 940 HA GLN 119 HA GLN 119 -5.439 12.522 12.439 941 HB2 GLN 119 HB2 GLN 119 -5.589 10.384 10.299 942 HB3 GLN 119 HB1 GLN 119 -6.755 11.682 10.520 943 HG2 GLN 119 HG2 GLN 119 -4.925 13.307 10.104 944 HG3 GLN 119 HG1 GLN 119 -3.866 11.951 9.729 945 HE21 GLN 119 HE21 GLN 119 -7.263 12.120 8.932 946 HE22 GLN 119 HE22 GLN 119 -7.036 12.213 7.214 947 H GLN 120 HN GLN 120 -7.867 11.611 12.251 948 HA GLN 120 HA GLN 120 -8.015 9.392 14.173 949 HB2 GLN 120 HB2 GLN 120 -10.075 10.465 15.060 950 HB3 GLN 120 HB1 GLN 120 -8.607 11.388 15.335 951 HG2 GLN 120 HG2 GLN 120 -9.180 12.791 13.381 952 HG3 GLN 120 HG1 GLN 120 -10.707 11.916 13.255 953 HE21 GLN 120 HE21 GLN 120 -8.789 14.019 15.246 954 HE22 GLN 120 HE22 GLN 120 -10.096 14.670 16.181 955 H SER 121 HN SER 121 -9.259 7.724 13.650 956 HA SER 121 HA SER 121 -11.374 8.026 11.679 957 HB2 SER 121 HB2 SER 121 -10.516 5.975 10.463 958 HB3 SER 121 HB1 SER 121 -9.537 7.427 10.257 959 HG SER 121 HG SER 121 -9.005 5.430 12.202 960 H MET 122 HN MET 122 -13.009 7.432 12.978 961 HA MET 122 HA MET 122 -12.741 5.156 14.759 962 HB2 MET 122 HB2 MET 122 -15.093 6.949 14.133 963 HB3 MET 122 HB1 MET 122 -15.114 5.664 15.334 964 HG2 MET 122 HG2 MET 122 -13.302 8.072 15.386 965 HG3 MET 122 HG1 MET 122 -14.780 7.877 16.326 966 HE1 MET 122 HE1 MET 122 -11.808 8.541 17.577 967 HE2 MET 122 HE2 MET 122 -11.973 7.576 19.044 968 HE3 MET 122 HE3 MET 122 -13.341 8.513 18.449 969 H LEU 123 HN LEU 123 -13.462 3.140 14.396 970 HA LEU 123 HA LEU 123 -14.521 2.588 11.721 971 HB2 LEU 123 HB2 LEU 123 -13.203 0.761 13.735 972 HB3 LEU 123 HB1 LEU 123 -13.853 0.226 12.199 973 HG LEU 123 HG LEU 123 -12.203 1.935 11.161 974 HD11 LEU 123 HD11 LEU 123 -11.545 3.077 13.178 975 HD12 LEU 123 HD12 LEU 123 -10.153 2.234 12.499 976 HD13 LEU 123 HD13 LEU 123 -10.993 1.563 13.897 977 HD21 LEU 123 HD21 LEU 123 -12.056 -0.492 10.924 978 HD22 LEU 123 HD22 LEU 123 -11.210 -0.597 12.468 979 HD23 LEU 123 HD23 LEU 123 -10.458 0.234 11.106 980 H SER 124 HN SER 124 -16.176 0.980 11.460 981 HA SER 124 HA SER 124 -18.036 0.914 13.744 982 HB2 SER 124 HB2 SER 124 -18.617 0.614 10.786 983 HB3 SER 124 HB1 SER 124 -19.814 0.669 12.083 984 HG SER 124 HG SER 124 -18.157 2.787 12.242 985 H1 LYS 161 HN LYS 161 -11.053 3.541 2.902 986 HA LYS 161 HA LYS 161 -12.840 2.250 2.313 987 HB2 LYS 161 HB2 LYS 161 -12.725 3.397 0.236 988 HB3 LYS 161 HB1 LYS 161 -11.343 2.466 -0.300 989 HG2 LYS 161 HG2 LYS 161 -12.724 0.573 -0.739 990 HG3 LYS 161 HG1 LYS 161 -14.118 1.338 0.035 991 HD2 LYS 161 HD2 LYS 161 -14.262 2.987 -1.676 992 HD3 LYS 161 HD1 LYS 161 -12.701 2.522 -2.347 993 HE2 LYS 161 HE2 LYS 161 -15.014 0.608 -2.254 994 HE3 LYS 161 HE1 LYS 161 -14.807 1.756 -3.578 995 HZ1 LYS 161 HZ1 LYS 161 -12.748 -0.215 -2.741 996 HZ2 LYS 161 HZ2 LYS 161 -12.692 0.802 -4.092 997 HZ3 LYS 161 HZ3 LYS 161 -13.827 -0.448 -4.025 998 H GLU 162 HN GLU 162 -10.556 1.053 3.564 999 HA GLU 162 HA GLU 162 -10.094 -1.423 2.111 1000 HB2 GLU 162 HB2 GLU 162 -8.258 -1.702 3.796 1001 HB3 GLU 162 HB1 GLU 162 -8.056 -0.386 2.648 1002 HG2 GLU 162 HG2 GLU 162 -8.747 1.206 4.334 1003 HG3 GLU 162 HG1 GLU 162 -9.086 -0.102 5.467 1004 H ASN 163 HN ASN 163 -10.673 -3.366 2.743 1005 HA ASN 163 HA ASN 163 -11.646 -3.694 5.484 1006 HB2 ASN 163 HB2 ASN 163 -13.340 -4.117 3.701 1007 HB3 ASN 163 HB1 ASN 163 -12.306 -5.390 3.072 1008 HD21 ASN 163 HD21 ASN 163 -15.062 -5.410 4.097 1009 HD22 ASN 163 HD22 ASN 163 -15.066 -6.625 5.353 1010 H LEU 164 HN LEU 164 -9.482 -4.736 3.087 1011 HA LEU 164 HA LEU 164 -8.642 -7.049 4.651 1012 HB2 LEU 164 HB2 LEU 164 -8.744 -6.433 1.838 1013 HB3 LEU 164 HB1 LEU 164 -7.143 -6.984 2.309 1014 HG LEU 164 HG LEU 164 -9.689 -8.458 2.916 1015 HD11 LEU 164 HD11 LEU 164 -7.619 -8.971 0.775 1016 HD12 LEU 164 HD12 LEU 164 -9.264 -8.397 0.502 1017 HD13 LEU 164 HD13 LEU 164 -8.990 -10.014 1.149 1018 HD21 LEU 164 HD21 LEU 164 -6.795 -9.284 3.134 1019 HD22 LEU 164 HD22 LEU 164 -8.192 -10.308 3.473 1020 HD23 LEU 164 HD23 LEU 164 -7.865 -8.901 4.482 1021 H GLU 165 HN GLU 165 -6.991 -6.935 5.932 1022 HA GLU 165 HA GLU 165 -4.707 -5.236 5.150 1023 HB2 GLU 165 HB2 GLU 165 -4.343 -4.683 7.313 1024 HB3 GLU 165 HB1 GLU 165 -5.999 -5.208 7.579 1025 HG2 GLU 165 HG2 GLU 165 -5.260 -7.365 8.324 1026 HG3 GLU 165 HG1 GLU 165 -3.596 -6.999 7.862 1027 H SER 166 HN SER 166 -2.552 -6.285 5.569 1028 HA SER 166 HA SER 166 -2.627 -9.174 5.813 1029 HB2 SER 166 HB2 SER 166 -1.595 -7.897 3.268 1030 HB3 SER 166 HB1 SER 166 -1.545 -9.613 3.664 1031 HG SER 166 HG SER 166 -4.040 -8.882 3.983 1032 H MET 167 HN MET 167 -1.018 -9.674 7.127 1033 HA MET 167 HA MET 167 1.500 -8.209 6.990 1034 HB2 MET 167 HB2 MET 167 2.208 -9.649 8.887 1035 HB3 MET 167 HB1 MET 167 0.758 -8.717 9.239 1036 HG2 MET 167 HG2 MET 167 -0.610 -10.710 8.776 1037 HG3 MET 167 HG1 MET 167 0.867 -11.631 8.500 1038 HE1 MET 167 HE1 MET 167 -0.279 -9.787 12.580 1039 HE2 MET 167 HE2 MET 167 -1.249 -9.613 11.116 1040 HE3 MET 167 HE3 MET 167 0.324 -8.824 11.231 1041 H VAL 168 HN VAL 168 3.211 -8.939 5.897 1042 HA VAL 168 HA VAL 168 2.898 -11.581 4.619 1043 HB VAL 168 HB VAL 168 4.032 -10.626 2.625 1044 HG11 VAL 168 HG11 VAL 168 2.093 -9.352 1.828 1045 HG12 VAL 168 HG12 VAL 168 1.507 -9.212 3.484 1046 HG13 VAL 168 HG13 VAL 168 1.600 -10.796 2.714 1047 HG21 VAL 168 HG21 VAL 168 4.123 -8.165 2.406 1048 HG22 VAL 168 HG22 VAL 168 5.219 -8.781 3.645 1049 HG23 VAL 168 HG23 VAL 168 3.695 -8.023 4.113 Start of MODEL 12 1 H1 MET 1 HT1 MET 1 -13.239 28.453 -3.370 2 H2 MET 1 HT2 MET 1 -12.508 29.187 -2.020 3 H3 MET 1 HT3 MET 1 -13.750 28.058 -1.805 4 HA MET 1 HA MET 1 -11.442 27.231 -1.369 5 HB2 MET 1 HB2 MET 1 -12.981 25.818 -3.564 6 HB3 MET 1 HB1 MET 1 -11.830 25.078 -2.460 7 HG2 MET 1 HG2 MET 1 -14.483 26.290 -1.724 8 HG3 MET 1 HG1 MET 1 -14.108 24.573 -1.810 9 HE1 MET 1 HE1 MET 1 -12.626 23.282 -0.085 10 HE2 MET 1 HE2 MET 1 -11.696 24.058 1.196 11 HE3 MET 1 HE3 MET 1 -11.265 24.326 -0.493 12 H SER 2 HN SER 2 -10.146 29.039 -2.396 13 HA SER 2 HA SER 2 -9.202 28.244 -5.069 14 HB2 SER 2 HB2 SER 2 -8.674 30.746 -5.313 15 HB3 SER 2 HB1 SER 2 -10.369 30.268 -5.399 16 HG SER 2 HG SER 2 -10.692 31.583 -3.806 17 H TYR 3 HN TYR 3 -7.050 28.267 -5.480 18 HA TYR 3 HA TYR 3 -4.818 28.279 -5.188 19 HB2 TYR 3 HB2 TYR 3 -5.411 30.071 -2.832 20 HB3 TYR 3 HB1 TYR 3 -3.793 29.706 -3.421 21 HD1 TYR 3 HD2 TYR 3 -3.517 30.146 -6.063 22 HD2 TYR 3 HD1 TYR 3 -6.374 32.031 -3.537 23 HE1 TYR 3 HE2 TYR 3 -3.690 32.008 -7.657 24 HE2 TYR 3 HE1 TYR 3 -6.553 33.896 -5.126 25 HH TYR 3 HH TYR 3 -5.080 34.947 -6.914 26 H ILE 4 HN ILE 4 -3.253 27.032 -4.205 27 HA ILE 4 HA ILE 4 -4.213 25.400 -1.948 28 HB ILE 4 HB ILE 4 -2.505 24.419 -4.238 29 HG12 ILE 4 HG12 ILE 4 -4.806 24.947 -4.977 30 HG13 ILE 4 HG11 ILE 4 -4.463 23.225 -5.043 31 HG21 ILE 4 HG21 ILE 4 -3.819 22.987 -1.937 32 HG22 ILE 4 HG22 ILE 4 -2.089 23.206 -2.210 33 HG23 ILE 4 HG23 ILE 4 -3.033 22.190 -3.301 34 HD11 ILE 4 HD11 ILE 4 -5.676 22.929 -2.928 35 HD12 ILE 4 HD12 ILE 4 -6.683 23.600 -4.209 36 HD13 ILE 4 HD13 ILE 4 -6.063 24.651 -2.937 37 HA PRO 5 HA PRO 5 -0.201 27.023 -0.503 38 HB2 PRO 5 HB2 PRO 5 -1.405 26.849 2.138 39 HB3 PRO 5 HB1 PRO 5 -0.842 28.282 1.271 40 HG2 PRO 5 HG2 PRO 5 -3.466 27.813 1.766 41 HG3 PRO 5 HG1 PRO 5 -2.899 28.684 0.328 42 HD2 PRO 5 HD2 PRO 5 -3.729 25.809 0.588 43 HD3 PRO 5 HD1 PRO 5 -4.142 26.990 -0.678 44 H GLY 6 HN GLY 6 1.395 25.617 -0.182 45 HA2 GLY 6 HA2 GLY 6 2.571 23.791 0.614 46 HA3 GLY 6 HA1 GLY 6 1.253 23.513 1.758 47 H GLN 7 HN GLN 7 1.198 23.607 -1.777 48 HA GLN 7 HA GLN 7 -0.565 21.444 -2.001 49 HB2 GLN 7 HB2 GLN 7 0.012 21.540 -4.432 50 HB3 GLN 7 HB1 GLN 7 -0.501 23.069 -3.737 51 HG2 GLN 7 HG2 GLN 7 1.891 23.719 -3.554 52 HG3 GLN 7 HG1 GLN 7 2.315 22.233 -4.404 53 HE21 GLN 7 HE21 GLN 7 2.753 25.020 -5.167 54 HE22 GLN 7 HE22 GLN 7 1.959 25.230 -6.700 55 HA PRO 8 HA PRO 8 2.254 18.041 -1.467 56 HB2 PRO 8 HB2 PRO 8 0.040 16.419 -2.509 57 HB3 PRO 8 HB1 PRO 8 0.824 16.368 -0.926 58 HG2 PRO 8 HG2 PRO 8 -1.675 17.313 -1.244 59 HG3 PRO 8 HG1 PRO 8 -0.558 17.981 -0.040 60 HD2 PRO 8 HD2 PRO 8 -1.305 19.066 -2.731 61 HD3 PRO 8 HD1 PRO 8 -1.079 19.926 -1.190 62 H VAL 9 HN VAL 9 3.044 16.195 -2.771 63 HA VAL 9 HA VAL 9 3.293 17.013 -5.564 64 HB VAL 9 HB VAL 9 5.252 16.596 -4.002 65 HG11 VAL 9 HG11 VAL 9 6.061 14.272 -3.872 66 HG12 VAL 9 HG12 VAL 9 4.531 13.740 -4.570 67 HG13 VAL 9 HG13 VAL 9 4.554 14.544 -3.001 68 HG21 VAL 9 HG21 VAL 9 6.659 15.667 -5.807 69 HG22 VAL 9 HG22 VAL 9 5.566 16.927 -6.379 70 HG23 VAL 9 HG23 VAL 9 5.192 15.233 -6.687 71 H THR 10 HN THR 10 1.423 15.279 -3.910 72 HA THR 10 HA THR 10 -0.283 13.884 -4.419 73 HB THR 10 HB THR 10 -0.848 13.249 -6.625 74 HG1 THR 10 HG1 THR 10 1.828 13.888 -7.381 75 HG21 THR 10 HG21 THR 10 -0.604 15.365 -7.892 76 HG22 THR 10 HG22 THR 10 0.565 15.916 -6.683 77 HG23 THR 10 HG23 THR 10 -1.114 15.620 -6.222 78 H ALA 11 HN ALA 11 2.572 12.692 -5.965 79 HA ALA 11 HA ALA 11 2.827 10.481 -4.150 80 HB1 ALA 11 HB1 ALA 11 1.133 9.539 -5.621 81 HB2 ALA 11 HB2 ALA 11 2.680 8.719 -5.856 82 HB3 ALA 11 HB3 ALA 11 2.129 9.912 -7.031 83 H VAL 12 HN VAL 12 4.850 10.478 -3.765 84 HA VAL 12 HA VAL 12 6.833 10.930 -5.814 85 HB VAL 12 HB VAL 12 7.238 9.690 -3.145 86 HG11 VAL 12 HG11 VAL 12 9.125 9.466 -4.522 87 HG12 VAL 12 HG12 VAL 12 9.494 10.704 -3.322 88 HG13 VAL 12 HG13 VAL 12 9.080 11.172 -4.973 89 HG21 VAL 12 HG21 VAL 12 7.073 12.625 -3.744 90 HG22 VAL 12 HG22 VAL 12 7.853 11.983 -2.301 91 HG23 VAL 12 HG23 VAL 12 6.131 11.701 -2.566 92 H VAL 13 HN VAL 13 7.846 9.340 -6.851 93 HA VAL 13 HA VAL 13 6.697 6.655 -6.597 94 HB VAL 13 HB VAL 13 8.179 7.785 -8.964 95 HG11 VAL 13 HG11 VAL 13 7.168 5.888 -10.170 96 HG12 VAL 13 HG12 VAL 13 6.513 5.301 -8.642 97 HG13 VAL 13 HG13 VAL 13 8.257 5.382 -8.882 98 HG21 VAL 13 HG21 VAL 13 5.207 7.560 -8.525 99 HG22 VAL 13 HG22 VAL 13 5.983 8.010 -10.044 100 HG23 VAL 13 HG23 VAL 13 6.139 9.053 -8.629 101 H GLN 14 HN GLN 14 7.924 5.183 -5.682 102 HA GLN 14 HA GLN 14 10.812 5.267 -6.129 103 HB2 GLN 14 HB2 GLN 14 9.412 4.925 -3.489 104 HB3 GLN 14 HB1 GLN 14 11.022 4.274 -3.760 105 HG2 GLN 14 HG2 GLN 14 11.744 6.248 -3.041 106 HG3 GLN 14 HG1 GLN 14 11.286 6.840 -4.637 107 HE21 GLN 14 HE21 GLN 14 8.423 6.391 -3.986 108 HE22 GLN 14 HE22 GLN 14 7.987 7.739 -2.978 109 H ARG 15 HN ARG 15 11.784 3.385 -6.370 110 HA ARG 15 HA ARG 15 10.137 1.012 -6.612 111 HB2 ARG 15 HB2 ARG 15 12.868 1.696 -7.709 112 HB3 ARG 15 HB1 ARG 15 11.969 0.234 -8.029 113 HG2 ARG 15 HG2 ARG 15 10.215 2.278 -8.687 114 HG3 ARG 15 HG1 ARG 15 11.789 2.792 -9.305 115 HD2 ARG 15 HD2 ARG 15 12.045 0.602 -10.405 116 HD3 ARG 15 HD1 ARG 15 10.425 0.170 -9.842 117 HE ARG 15 HE ARG 15 10.017 2.503 -11.168 118 HH11 ARG 15 HH11 ARG 15 11.656 -0.451 -12.073 119 HH12 ARG 15 HH12 ARG 15 11.257 -0.312 -13.750 120 HH21 ARG 15 HH21 ARG 15 9.483 2.695 -13.356 121 HH22 ARG 15 HH22 ARG 15 10.007 1.492 -14.487 122 H VAL 16 HN VAL 16 10.239 -0.204 -4.823 123 HA VAL 16 HA VAL 16 12.796 -0.276 -3.424 124 HB VAL 16 HB VAL 16 11.578 1.366 -2.194 125 HG11 VAL 16 HG11 VAL 16 9.388 0.937 -1.202 126 HG12 VAL 16 HG12 VAL 16 9.308 -0.589 -2.078 127 HG13 VAL 16 HG13 VAL 16 9.346 0.935 -2.967 128 HG21 VAL 16 HG21 VAL 16 12.802 -0.228 -0.816 129 HG22 VAL 16 HG22 VAL 16 11.368 -1.248 -0.711 130 HG23 VAL 16 HG23 VAL 16 11.363 0.362 0.025 131 H GLU 17 HN GLU 17 13.204 -2.185 -2.363 132 HA GLU 17 HA GLU 17 11.445 -4.415 -3.074 133 HB2 GLU 17 HB2 GLU 17 14.468 -4.334 -3.024 134 HB3 GLU 17 HB1 GLU 17 13.493 -5.755 -3.390 135 HG2 GLU 17 HG2 GLU 17 12.715 -4.830 -5.412 136 HG3 GLU 17 HG1 GLU 17 13.251 -3.213 -4.966 137 H ILE 18 HN ILE 18 10.625 -5.272 -1.381 138 HA ILE 18 HA ILE 18 11.774 -4.869 1.245 139 HB ILE 18 HB ILE 18 8.960 -5.721 0.535 140 HG12 ILE 18 HG12 ILE 18 9.224 -3.560 -0.455 141 HG13 ILE 18 HG11 ILE 18 8.332 -3.348 1.049 142 HG21 ILE 18 HG21 ILE 18 10.171 -4.557 3.025 143 HG22 ILE 18 HG22 ILE 18 9.695 -6.239 2.779 144 HG23 ILE 18 HG23 ILE 18 8.470 -4.969 2.807 145 HD11 ILE 18 HD11 ILE 18 10.333 -2.591 2.160 146 HD12 ILE 18 HD12 ILE 18 10.031 -1.627 0.713 147 HD13 ILE 18 HD13 ILE 18 11.273 -2.882 0.698 148 H HIS 19 HN HIS 19 12.745 -6.555 2.043 149 HA HIS 19 HA HIS 19 12.017 -9.080 0.864 150 HB2 HIS 19 HB2 HIS 19 14.148 -9.865 1.935 151 HB3 HIS 19 HB1 HIS 19 14.230 -8.682 0.642 152 HD1 HIS 19 HD1 HIS 19 15.244 -9.217 4.150 153 HD2 HIS 19 HD2 HIS 19 15.054 -6.132 1.369 154 HE1 HIS 19 HE1 HIS 19 16.696 -7.377 5.080 155 HE2 HIS 19 HE2 HIS 19 16.709 -5.592 3.282 156 H LYS 20 HN LYS 20 10.105 -9.294 1.793 157 HA LYS 20 HA LYS 20 10.118 -10.440 4.505 158 HB2 LYS 20 HB2 LYS 20 7.905 -8.853 3.172 159 HB3 LYS 20 HB1 LYS 20 7.785 -9.643 4.735 160 HG2 LYS 20 HG2 LYS 20 9.746 -7.460 4.103 161 HG3 LYS 20 HG1 LYS 20 8.163 -7.191 4.834 162 HD2 LYS 20 HD2 LYS 20 10.179 -9.064 6.030 163 HD3 LYS 20 HD1 LYS 20 10.187 -7.337 6.385 164 HE2 LYS 20 HE2 LYS 20 8.992 -8.463 8.124 165 HE3 LYS 20 HE1 LYS 20 7.832 -7.553 7.158 166 HZ1 LYS 20 HZ1 LYS 20 8.354 -10.386 6.572 167 HZ2 LYS 20 HZ2 LYS 20 6.970 -9.466 6.231 168 HZ3 LYS 20 HZ3 LYS 20 7.308 -9.957 7.825 169 H LEU 21 HN LEU 21 9.923 -12.613 4.133 170 HA LEU 21 HA LEU 21 8.223 -13.672 2.130 171 HB2 LEU 21 HB2 LEU 21 10.030 -12.747 0.731 172 HB3 LEU 21 HB1 LEU 21 11.211 -13.685 1.639 173 HG LEU 21 HG LEU 21 10.090 -15.765 0.850 174 HD11 LEU 21 HD11 LEU 21 7.882 -14.824 0.416 175 HD12 LEU 21 HD12 LEU 21 8.530 -15.633 -1.014 176 HD13 LEU 21 HD13 LEU 21 8.544 -13.872 -0.913 177 HD21 LEU 21 HD21 LEU 21 11.036 -13.931 -1.344 178 HD22 LEU 21 HD22 LEU 21 11.013 -15.693 -1.387 179 HD23 LEU 21 HD23 LEU 21 12.080 -14.852 -0.260 180 H ARG 22 HN ARG 22 8.093 -15.960 2.340 181 HA ARG 22 HA ARG 22 9.640 -17.253 4.333 182 HB2 ARG 22 HB2 ARG 22 7.438 -17.991 2.543 183 HB3 ARG 22 HB1 ARG 22 8.598 -19.264 2.832 184 HG2 ARG 22 HG2 ARG 22 6.805 -19.361 4.452 185 HG3 ARG 22 HG1 ARG 22 8.361 -18.975 5.219 186 HD2 ARG 22 HD2 ARG 22 7.232 -17.271 6.125 187 HD3 ARG 22 HD1 ARG 22 7.533 -16.546 4.550 188 HE ARG 22 HE ARG 22 5.031 -18.024 5.025 189 HH11 ARG 22 HH11 ARG 22 6.662 -15.000 4.317 190 HH12 ARG 22 HH12 ARG 22 5.240 -14.234 3.696 191 HH21 ARG 22 HH21 ARG 22 3.170 -17.030 4.230 192 HH22 ARG 22 HH22 ARG 22 3.235 -15.397 3.643 193 H GLN 23 HN GLN 23 11.615 -17.613 4.094 194 HA GLN 23 HA GLN 23 12.670 -18.578 1.559 195 HB2 GLN 23 HB2 GLN 23 14.685 -16.932 2.253 196 HB3 GLN 23 HB1 GLN 23 13.408 -16.504 1.119 197 HG2 GLN 23 HG2 GLN 23 12.178 -15.388 2.838 198 HG3 GLN 23 HG1 GLN 23 13.319 -15.938 4.061 199 HE21 GLN 23 HE21 GLN 23 12.477 -13.265 3.322 200 HE22 GLN 23 HE22 GLN 23 13.927 -12.392 2.923 201 H GLY 24 HN GLY 24 12.414 -20.416 3.026 202 HA2 GLY 24 HA2 GLY 24 13.628 -22.216 3.751 203 HA3 GLY 24 HA1 GLY 24 15.072 -21.236 3.562 204 H GLU 25 HN GLU 25 16.008 -20.376 5.249 205 HA GLU 25 HA GLU 25 15.200 -21.217 7.870 206 HB2 GLU 25 HB2 GLU 25 17.585 -20.836 6.958 207 HB3 GLU 25 HB1 GLU 25 17.281 -19.135 7.241 208 HG2 GLU 25 HG2 GLU 25 16.650 -19.885 9.630 209 HG3 GLU 25 HG1 GLU 25 17.542 -21.352 9.227 210 H ASN 26 HN ASN 26 14.327 -18.784 5.784 211 HA ASN 26 HA ASN 26 13.945 -16.835 7.928 212 HB2 ASN 26 HB2 ASN 26 14.043 -16.456 4.975 213 HB3 ASN 26 HB1 ASN 26 13.755 -15.207 6.142 214 HD21 ASN 26 HD21 ASN 26 15.969 -17.470 4.947 215 HD22 ASN 26 HD22 ASN 26 17.421 -16.639 5.433 216 H LEU 27 HN LEU 27 12.135 -16.762 8.541 217 HA LEU 27 HA LEU 27 9.803 -16.879 6.733 218 HB2 LEU 27 HB2 LEU 27 10.268 -17.690 9.584 219 HB3 LEU 27 HB1 LEU 27 8.714 -17.022 9.166 220 HG LEU 27 HG LEU 27 9.179 -19.640 9.167 221 HD11 LEU 27 HD11 LEU 27 7.029 -18.633 8.801 222 HD12 LEU 27 HD12 LEU 27 7.314 -19.861 7.567 223 HD13 LEU 27 HD13 LEU 27 7.497 -18.152 7.170 224 HD21 LEU 27 HD21 LEU 27 9.641 -20.534 6.992 225 HD22 LEU 27 HD22 LEU 27 10.964 -19.435 7.403 226 HD23 LEU 27 HD23 LEU 27 9.697 -18.920 6.285 227 H ILE 28 HN ILE 28 9.571 -14.813 6.200 228 HA ILE 28 HA ILE 28 9.133 -12.912 8.398 229 HB ILE 28 HB ILE 28 9.710 -11.337 6.179 230 HG12 ILE 28 HG12 ILE 28 10.853 -13.542 5.302 231 HG13 ILE 28 HG11 ILE 28 11.713 -12.010 5.177 232 HG21 ILE 28 HG21 ILE 28 11.614 -10.607 7.520 233 HG22 ILE 28 HG22 ILE 28 11.462 -12.055 8.516 234 HG23 ILE 28 HG23 ILE 28 10.175 -10.852 8.513 235 HD11 ILE 28 HD11 ILE 28 12.140 -14.087 7.322 236 HD12 ILE 28 HD12 ILE 28 13.035 -12.581 7.139 237 HD13 ILE 28 HD13 ILE 28 13.175 -13.844 5.909 238 H LEU 29 HN LEU 29 7.281 -12.203 8.528 239 HA LEU 29 HA LEU 29 5.424 -11.789 6.396 240 HB2 LEU 29 HB2 LEU 29 5.387 -14.281 6.692 241 HB3 LEU 29 HB1 LEU 29 4.920 -14.037 8.363 242 HG LEU 29 HG LEU 29 2.861 -12.864 7.519 243 HD11 LEU 29 HD11 LEU 29 3.689 -12.304 5.302 244 HD12 LEU 29 HD12 LEU 29 2.216 -13.272 5.199 245 HD13 LEU 29 HD13 LEU 29 3.784 -14.019 4.895 246 HD21 LEU 29 HD21 LEU 29 1.695 -14.933 6.976 247 HD22 LEU 29 HD22 LEU 29 2.825 -15.181 8.308 248 HD23 LEU 29 HD23 LEU 29 3.237 -15.736 6.685 249 H GLY 30 HN GLY 30 5.675 -9.737 7.526 250 HA2 GLY 30 HA2 GLY 30 4.490 -9.709 10.232 251 HA3 GLY 30 HA1 GLY 30 6.038 -8.953 9.936 252 H PHE 31 HN PHE 31 5.708 -7.319 7.787 253 HA PHE 31 HA PHE 31 4.241 -5.249 9.101 254 HB2 PHE 31 HB2 PHE 31 5.090 -3.734 7.539 255 HB3 PHE 31 HB1 PHE 31 6.366 -4.910 7.758 256 HD1 PHE 31 HD1 PHE 31 3.908 -3.542 5.445 257 HD2 PHE 31 HD2 PHE 31 6.999 -6.409 5.971 258 HE1 PHE 31 HE1 PHE 31 3.984 -3.906 3.018 259 HE2 PHE 31 HE2 PHE 31 7.095 -6.770 3.550 260 HZ PHE 31 HZ PHE 31 5.667 -5.357 2.042 261 H SER 32 HN SER 32 2.580 -3.856 7.896 262 HA SER 32 HA SER 32 0.712 -5.858 6.746 263 HB2 SER 32 HB2 SER 32 -0.189 -3.577 8.503 264 HB3 SER 32 HB1 SER 32 -1.124 -4.956 7.947 265 HG SER 32 HG SER 32 -0.582 -5.519 9.947 266 H ILE 33 HN ILE 33 -0.692 -5.203 5.186 267 HA ILE 33 HA ILE 33 -0.366 -2.474 4.165 268 HB ILE 33 HB ILE 33 -0.329 -3.275 1.888 269 HG12 ILE 33 HG12 ILE 33 -0.322 -6.092 3.002 270 HG13 ILE 33 HG11 ILE 33 -1.752 -5.304 2.350 271 HG21 ILE 33 HG21 ILE 33 1.685 -4.638 3.672 272 HG22 ILE 33 HG22 ILE 33 1.822 -3.059 2.895 273 HG23 ILE 33 HG23 ILE 33 1.839 -4.527 1.915 274 HD11 ILE 33 HD11 ILE 33 0.762 -5.973 0.844 275 HD12 ILE 33 HD12 ILE 33 -0.625 -5.111 0.177 276 HD13 ILE 33 HD13 ILE 33 -0.802 -6.783 0.714 277 H GLY 34 HN GLY 34 -2.209 -1.676 3.035 278 HA2 GLY 34 HA2 GLY 34 -4.638 -3.149 3.824 279 HA3 GLY 34 HA1 GLY 34 -4.538 -1.392 3.724 280 H GLY 35 HN GLY 35 -6.126 -3.675 2.351 281 HA2 GLY 35 HA2 GLY 35 -5.955 -2.451 -0.321 282 HA3 GLY 35 HA1 GLY 35 -5.992 -4.205 -0.163 283 H GLY 36 HN GLY 36 -7.897 -1.906 -1.164 284 HA2 GLY 36 HA2 GLY 36 -10.316 -3.140 -0.070 285 HA3 GLY 36 HA1 GLY 36 -10.099 -1.418 0.228 286 H ILE 37 HN ILE 37 -9.684 -3.586 -2.582 287 HA ILE 37 HA ILE 37 -11.449 -1.785 -4.088 288 HB ILE 37 HB ILE 37 -10.122 -2.361 -6.133 289 HG12 ILE 37 HG12 ILE 37 -8.910 -4.305 -4.954 290 HG13 ILE 37 HG11 ILE 37 -7.975 -3.285 -6.034 291 HG21 ILE 37 HG21 ILE 37 -8.794 -0.794 -3.949 292 HG22 ILE 37 HG22 ILE 37 -9.989 -0.205 -5.105 293 HG23 ILE 37 HG23 ILE 37 -8.384 -0.686 -5.661 294 HD11 ILE 37 HD11 ILE 37 -6.742 -3.834 -4.019 295 HD12 ILE 37 HD12 ILE 37 -8.006 -3.098 -3.034 296 HD13 ILE 37 HD13 ILE 37 -7.047 -2.100 -4.124 297 H ASP 38 HN ASP 38 -10.153 -5.080 -3.798 298 HA ASP 38 HA ASP 38 -12.373 -6.046 -5.465 299 HB2 ASP 38 HB2 ASP 38 -11.192 -8.134 -5.676 300 HB3 ASP 38 HB1 ASP 38 -10.051 -6.839 -5.999 301 H GLN 39 HN GLN 39 -12.082 -5.149 -2.507 302 HA GLN 39 HA GLN 39 -13.314 -7.522 -1.313 303 HB2 GLN 39 HB2 GLN 39 -12.603 -6.076 0.861 304 HB3 GLN 39 HB1 GLN 39 -11.629 -7.354 0.157 305 HG2 GLN 39 HG2 GLN 39 -11.330 -4.476 -0.636 306 HG3 GLN 39 HG1 GLN 39 -10.457 -5.187 0.708 307 HE21 GLN 39 HE21 GLN 39 -10.190 -7.767 -0.656 308 HE22 GLN 39 HE22 GLN 39 -8.993 -7.526 -1.877 309 H ASP 40 HN ASP 40 -13.355 -4.028 -0.666 310 HA ASP 40 HA ASP 40 -16.264 -4.246 -0.404 311 HB2 ASP 40 HB2 ASP 40 -15.329 -4.190 1.832 312 HB3 ASP 40 HB1 ASP 40 -14.340 -2.795 1.420 313 HA PRO 41 HA PRO 41 -15.954 -0.904 -3.314 314 HB2 PRO 41 HB2 PRO 41 -18.562 -0.531 -3.724 315 HB3 PRO 41 HB1 PRO 41 -17.798 -2.051 -4.222 316 HG2 PRO 41 HG2 PRO 41 -19.334 -1.448 -1.707 317 HG3 PRO 41 HG1 PRO 41 -19.546 -2.794 -2.829 318 HD2 PRO 41 HD2 PRO 41 -18.122 -3.037 -0.550 319 HD3 PRO 41 HD1 PRO 41 -17.706 -3.935 -2.025 320 H SER 42 HN SER 42 -17.338 -0.755 -0.199 321 HA SER 42 HA SER 42 -18.158 2.000 -0.431 322 HB2 SER 42 HB2 SER 42 -19.444 0.328 0.924 323 HB3 SER 42 HB1 SER 42 -18.082 0.253 2.043 324 HG SER 42 HG SER 42 -18.443 2.707 2.015 325 H GLN 43 HN GLN 43 -15.230 0.319 0.227 326 HA GLN 43 HA GLN 43 -13.910 1.985 1.997 327 HB2 GLN 43 HB2 GLN 43 -12.859 0.822 -0.593 328 HB3 GLN 43 HB1 GLN 43 -11.880 1.412 0.741 329 HG2 GLN 43 HG2 GLN 43 -13.685 -0.971 0.743 330 HG3 GLN 43 HG1 GLN 43 -11.931 -0.965 0.781 331 HE21 GLN 43 HE21 GLN 43 -14.823 -0.581 2.529 332 HE22 GLN 43 HE22 GLN 43 -14.101 -0.565 4.133 333 H ASN 44 HN ASN 44 -15.025 2.456 -1.198 334 HA ASN 44 HA ASN 44 -13.788 5.114 -1.311 335 HB2 ASN 44 HB2 ASN 44 -12.681 3.041 -2.598 336 HB3 ASN 44 HB1 ASN 44 -13.856 3.539 -3.821 337 HD21 ASN 44 HD21 ASN 44 -10.910 3.690 -3.775 338 HD22 ASN 44 HD22 ASN 44 -10.510 5.353 -4.063 339 HA PRO 45 HA PRO 45 -18.075 5.615 -2.813 340 HB2 PRO 45 HB2 PRO 45 -18.748 7.675 -1.236 341 HB3 PRO 45 HB1 PRO 45 -18.769 6.006 -0.635 342 HG2 PRO 45 HG2 PRO 45 -16.767 8.168 -0.173 343 HG3 PRO 45 HG1 PRO 45 -17.341 6.910 0.934 344 HD2 PRO 45 HD2 PRO 45 -14.960 6.846 -0.529 345 HD3 PRO 45 HD1 PRO 45 -15.732 5.456 0.255 346 H PHE 46 HN PHE 46 -15.209 7.045 -3.196 347 HA PHE 46 HA PHE 46 -16.290 9.347 -4.684 348 HB2 PHE 46 HB2 PHE 46 -13.640 9.030 -3.269 349 HB3 PHE 46 HB1 PHE 46 -14.000 10.351 -4.380 350 HD1 PHE 46 HD2 PHE 46 -15.539 12.116 -3.750 351 HD2 PHE 46 HD1 PHE 46 -14.644 8.925 -1.084 352 HE1 PHE 46 HE2 PHE 46 -16.519 13.396 -1.896 353 HE2 PHE 46 HE1 PHE 46 -15.619 10.203 0.782 354 HZ PHE 46 HZ PHE 46 -16.570 12.439 0.372 355 H SER 47 HN SER 47 -14.462 6.447 -4.822 356 HA SER 47 HA SER 47 -14.000 6.769 -7.650 357 HB2 SER 47 HB2 SER 47 -11.955 7.705 -6.512 358 HB3 SER 47 HB1 SER 47 -11.696 6.127 -5.770 359 HG SER 47 HG SER 47 -10.474 6.444 -7.701 360 H GLU 48 HN GLU 48 -12.138 4.495 -7.548 361 HA GLU 48 HA GLU 48 -13.266 2.229 -6.368 362 HB2 GLU 48 HB2 GLU 48 -15.266 2.715 -7.602 363 HB3 GLU 48 HB1 GLU 48 -14.356 2.988 -9.081 364 HG2 GLU 48 HG2 GLU 48 -13.651 0.434 -8.548 365 HG3 GLU 48 HG1 GLU 48 -15.287 0.473 -7.887 366 H ASP 49 HN ASP 49 -11.787 3.670 -9.175 367 HA ASP 49 HA ASP 49 -9.611 1.883 -9.370 368 HB2 ASP 49 HB2 ASP 49 -11.296 0.261 -10.070 369 HB3 ASP 49 HB1 ASP 49 -11.979 1.408 -11.209 370 H LYS 50 HN LYS 50 -8.778 2.175 -11.862 371 HA LYS 50 HA LYS 50 -7.999 3.575 -13.451 372 HB2 LYS 50 HB2 LYS 50 -10.392 5.311 -12.804 373 HB3 LYS 50 HB1 LYS 50 -9.325 5.542 -14.175 374 HG2 LYS 50 HG2 LYS 50 -11.181 4.488 -15.093 375 HG3 LYS 50 HG1 LYS 50 -10.034 3.166 -14.876 376 HD2 LYS 50 HD2 LYS 50 -11.161 2.506 -12.820 377 HD3 LYS 50 HD1 LYS 50 -12.272 3.867 -12.976 378 HE2 LYS 50 HE2 LYS 50 -13.327 2.927 -14.851 379 HE3 LYS 50 HE1 LYS 50 -12.021 1.767 -15.108 380 HZ1 LYS 50 HZ1 LYS 50 -13.770 1.749 -12.703 381 HZ2 LYS 50 HZ2 LYS 50 -12.678 0.553 -13.194 382 HZ3 LYS 50 HZ3 LYS 50 -14.089 0.832 -14.093 383 H THR 51 HN THR 51 -9.370 6.052 -11.335 384 HA THR 51 HA THR 51 -6.816 7.404 -11.299 385 HB THR 51 HB THR 51 -8.927 8.677 -11.589 386 HG1 THR 51 HG1 THR 51 -6.918 9.492 -10.425 387 HG21 THR 51 HG21 THR 51 -9.459 7.858 -8.731 388 HG22 THR 51 HG22 THR 51 -10.394 7.390 -10.153 389 HG23 THR 51 HG23 THR 51 -10.368 9.075 -9.630 390 H ASP 52 HN ASP 52 -8.250 4.976 -9.501 391 HA ASP 52 HA ASP 52 -6.573 5.634 -7.201 392 HB2 ASP 52 HB2 ASP 52 -9.253 5.464 -6.950 393 HB3 ASP 52 HB1 ASP 52 -8.851 3.750 -6.798 394 H LYS 53 HN LYS 53 -6.113 3.596 -6.010 395 HA LYS 53 HA LYS 53 -5.627 1.317 -7.779 396 HB2 LYS 53 HB2 LYS 53 -3.517 2.715 -6.117 397 HB3 LYS 53 HB1 LYS 53 -3.308 1.116 -6.809 398 HG2 LYS 53 HG2 LYS 53 -2.197 2.532 -8.291 399 HG3 LYS 53 HG1 LYS 53 -3.750 2.234 -9.069 400 HD2 LYS 53 HD2 LYS 53 -4.581 4.385 -8.258 401 HD3 LYS 53 HD1 LYS 53 -3.048 4.675 -7.435 402 HE2 LYS 53 HE2 LYS 53 -3.147 5.890 -9.536 403 HE3 LYS 53 HE1 LYS 53 -1.887 4.662 -9.583 404 HZ1 LYS 53 HZ1 LYS 53 -3.270 3.260 -10.916 405 HZ2 LYS 53 HZ2 LYS 53 -3.242 4.794 -11.635 406 HZ3 LYS 53 HZ3 LYS 53 -4.600 4.298 -10.745 407 H GLY 54 HN GLY 54 -6.248 2.722 -4.741 408 HA2 GLY 54 HA2 GLY 54 -6.998 1.897 -2.762 409 HA3 GLY 54 HA1 GLY 54 -7.533 0.508 -3.696 410 H ILE 55 HN ILE 55 -4.100 1.164 -3.524 411 HA ILE 55 HA ILE 55 -3.787 -0.961 -1.497 412 HB ILE 55 HB ILE 55 -2.171 -0.695 -4.049 413 HG12 ILE 55 HG12 ILE 55 -4.452 -1.669 -4.323 414 HG13 ILE 55 HG11 ILE 55 -3.142 -2.762 -4.757 415 HG21 ILE 55 HG21 ILE 55 -1.177 -2.903 -3.297 416 HG22 ILE 55 HG22 ILE 55 -1.868 -2.557 -1.706 417 HG23 ILE 55 HG23 ILE 55 -0.672 -1.463 -2.403 418 HD11 ILE 55 HD11 ILE 55 -3.394 -3.915 -2.622 419 HD12 ILE 55 HD12 ILE 55 -4.901 -3.914 -3.538 420 HD13 ILE 55 HD13 ILE 55 -4.697 -2.812 -2.176 421 H TYR 56 HN TYR 56 -2.534 -0.344 0.175 422 HA TYR 56 HA TYR 56 -0.060 1.026 -0.227 423 HB2 TYR 56 HB2 TYR 56 -0.578 2.953 1.310 424 HB3 TYR 56 HB1 TYR 56 -1.325 3.040 -0.278 425 HD1 TYR 56 HD1 TYR 56 -1.976 2.350 3.305 426 HD2 TYR 56 HD2 TYR 56 -3.673 3.153 -0.513 427 HE1 TYR 56 HE1 TYR 56 -4.166 2.738 4.366 428 HE2 TYR 56 HE2 TYR 56 -5.868 3.530 0.533 429 HH TYR 56 HH TYR 56 -6.249 3.821 3.952 430 H VAL 57 HN VAL 57 1.132 1.382 1.942 431 HA VAL 57 HA VAL 57 0.666 -0.984 3.497 432 HB VAL 57 HB VAL 57 2.886 -0.103 2.545 433 HG11 VAL 57 HG11 VAL 57 4.120 1.162 4.413 434 HG12 VAL 57 HG12 VAL 57 2.502 1.741 4.813 435 HG13 VAL 57 HG13 VAL 57 3.180 2.031 3.210 436 HG21 VAL 57 HG21 VAL 57 4.125 -1.096 4.373 437 HG22 VAL 57 HG22 VAL 57 2.692 -2.028 3.938 438 HG23 VAL 57 HG23 VAL 57 2.676 -0.999 5.370 439 H THR 58 HN THR 58 0.276 -1.007 5.681 440 HA THR 58 HA THR 58 -0.665 1.559 6.773 441 HB THR 58 HB THR 58 -2.539 0.068 6.209 442 HG1 THR 58 HG1 THR 58 -2.719 -0.133 8.935 443 HG21 THR 58 HG21 THR 58 -1.379 -1.819 8.256 444 HG22 THR 58 HG22 THR 58 -1.383 -2.084 6.514 445 HG23 THR 58 HG23 THR 58 -2.908 -2.016 7.396 446 H ARG 59 HN ARG 59 1.595 -0.899 7.119 447 HA ARG 59 HA ARG 59 2.715 0.371 9.360 448 HB2 ARG 59 HB2 ARG 59 2.449 -1.080 11.152 449 HB3 ARG 59 HB1 ARG 59 0.862 -1.017 10.450 450 HG2 ARG 59 HG2 ARG 59 0.900 -3.144 9.724 451 HG3 ARG 59 HG1 ARG 59 2.649 -3.163 9.541 452 HD2 ARG 59 HD2 ARG 59 1.937 -4.601 11.383 453 HD3 ARG 59 HD1 ARG 59 2.882 -3.236 11.985 454 HE ARG 59 HE ARG 59 0.285 -2.393 12.151 455 HH11 ARG 59 HH11 ARG 59 1.986 -5.216 13.326 456 HH12 ARG 59 HH12 ARG 59 1.058 -5.317 14.797 457 HH21 ARG 59 HH21 ARG 59 -0.962 -2.547 14.052 458 HH22 ARG 59 HH22 ARG 59 -0.637 -3.809 15.195 459 H VAL 60 HN VAL 60 4.521 -0.992 10.297 460 HA VAL 60 HA VAL 60 5.662 -2.827 8.358 461 HB VAL 60 HB VAL 60 7.040 -0.325 9.345 462 HG11 VAL 60 HG11 VAL 60 8.931 -1.150 7.949 463 HG12 VAL 60 HG12 VAL 60 8.058 -2.686 7.806 464 HG13 VAL 60 HG13 VAL 60 8.582 -2.113 9.387 465 HG21 VAL 60 HG21 VAL 60 5.576 0.126 7.479 466 HG22 VAL 60 HG22 VAL 60 6.267 -1.223 6.578 467 HG23 VAL 60 HG23 VAL 60 7.257 0.188 6.948 468 H SER 61 HN SER 61 6.682 -4.489 9.382 469 HA SER 61 HA SER 61 7.295 -4.648 12.112 470 HB2 SER 61 HB2 SER 61 9.092 -5.836 10.026 471 HB3 SER 61 HB1 SER 61 8.654 -6.494 11.598 472 HG SER 61 HG SER 61 6.764 -7.176 10.833 473 H GLU 62 HN GLU 62 8.413 -3.113 13.102 474 HA GLU 62 HA GLU 62 9.860 -1.199 11.730 475 HB2 GLU 62 HB2 GLU 62 9.981 -0.099 13.791 476 HB3 GLU 62 HB1 GLU 62 8.416 -0.844 13.714 477 HG2 GLU 62 HG2 GLU 62 9.623 -2.774 14.980 478 HG3 GLU 62 HG1 GLU 62 10.752 -1.496 15.413 479 H GLY 63 HN GLY 63 11.799 -0.644 11.833 480 HA2 GLY 63 HA2 GLY 63 14.098 -0.740 11.931 481 HA3 GLY 63 HA1 GLY 63 13.912 -1.740 13.377 482 H GLY 64 HN GLY 64 12.487 -2.609 10.281 483 HA2 GLY 64 HA2 GLY 64 14.221 -4.979 10.386 484 HA3 GLY 64 HA1 GLY 64 12.532 -4.989 9.903 485 HA PRO 65 HA PRO 65 14.678 -4.955 5.980 486 HB2 PRO 65 HB2 PRO 65 12.482 -6.304 4.871 487 HB3 PRO 65 HB1 PRO 65 13.992 -7.008 5.416 488 HG2 PRO 65 HG2 PRO 65 11.511 -7.469 6.558 489 HG3 PRO 65 HG1 PRO 65 13.069 -7.763 7.347 490 HD2 PRO 65 HD2 PRO 65 11.212 -5.424 7.628 491 HD3 PRO 65 HD1 PRO 65 12.209 -6.253 8.852 492 H ALA 66 HN ALA 66 11.285 -4.106 6.450 493 HA ALA 66 HA ALA 66 10.797 -3.487 3.687 494 HB1 ALA 66 HB1 ALA 66 8.781 -2.232 4.606 495 HB2 ALA 66 HB2 ALA 66 9.293 -2.782 6.208 496 HB3 ALA 66 HB3 ALA 66 8.853 -3.964 4.975 497 H GLU 67 HN GLU 67 11.625 -1.685 6.564 498 HA GLU 67 HA GLU 67 10.977 0.778 5.267 499 HB2 GLU 67 HB2 GLU 67 12.021 1.558 7.545 500 HB3 GLU 67 HB1 GLU 67 10.394 0.877 7.457 501 HG2 GLU 67 HG2 GLU 67 11.060 -1.143 8.299 502 HG3 GLU 67 HG1 GLU 67 12.730 -0.889 7.817 503 H ILE 68 HN ILE 68 13.740 -1.198 5.932 504 HA ILE 68 HA ILE 68 15.607 0.908 5.682 505 HB ILE 68 HB ILE 68 17.226 -0.864 5.491 506 HG12 ILE 68 HG12 ILE 68 14.942 -2.713 6.052 507 HG13 ILE 68 HG11 ILE 68 15.773 -2.577 4.506 508 HG21 ILE 68 HG21 ILE 68 16.801 0.120 7.614 509 HG22 ILE 68 HG22 ILE 68 16.984 -1.619 7.853 510 HG23 ILE 68 HG23 ILE 68 15.376 -0.892 7.830 511 HD11 ILE 68 HD11 ILE 68 16.997 -3.441 7.097 512 HD12 ILE 68 HD12 ILE 68 17.843 -3.281 5.559 513 HD13 ILE 68 HD13 ILE 68 16.565 -4.487 5.745 514 H ALA 69 HN ALA 69 14.053 -1.475 3.809 515 HA ALA 69 HA ALA 69 15.500 -1.107 1.425 516 HB1 ALA 69 HB1 ALA 69 12.686 -2.017 1.977 517 HB2 ALA 69 HB2 ALA 69 14.079 -2.997 1.505 518 HB3 ALA 69 HB3 ALA 69 13.330 -1.897 0.339 519 H GLY 70 HN GLY 70 13.114 0.640 3.172 520 HA2 GLY 70 HA2 GLY 70 12.862 3.043 2.657 521 HA3 GLY 70 HA1 GLY 70 12.951 2.620 0.942 522 H LEU 71 HN LEU 71 11.106 1.475 3.730 523 HA LEU 71 HA LEU 71 8.606 1.951 2.331 524 HB2 LEU 71 HB2 LEU 71 9.432 -0.432 2.072 525 HB3 LEU 71 HB1 LEU 71 9.277 -0.566 3.809 526 HG LEU 71 HG LEU 71 7.463 -1.563 2.407 527 HD11 LEU 71 HD11 LEU 71 7.299 -1.201 4.799 528 HD12 LEU 71 HD12 LEU 71 5.737 -0.985 4.007 529 HD13 LEU 71 HD13 LEU 71 6.682 0.422 4.508 530 HD21 LEU 71 HD21 LEU 71 6.695 1.332 2.087 531 HD22 LEU 71 HD22 LEU 71 5.656 -0.041 1.705 532 HD23 LEU 71 HD23 LEU 71 7.147 0.217 0.798 533 H GLN 72 HN GLN 72 6.956 2.290 3.780 534 HA GLN 72 HA GLN 72 7.248 2.408 6.502 535 HB2 GLN 72 HB2 GLN 72 7.693 4.744 6.949 536 HB3 GLN 72 HB1 GLN 72 9.018 3.997 6.084 537 HG2 GLN 72 HG2 GLN 72 7.106 6.079 5.147 538 HG3 GLN 72 HG1 GLN 72 8.862 6.084 5.168 539 HE21 GLN 72 HE21 GLN 72 6.036 5.062 3.486 540 HE22 GLN 72 HE22 GLN 72 6.834 4.592 2.013 541 H ILE 73 HN ILE 73 5.607 3.947 7.472 542 HA ILE 73 HA ILE 73 3.286 2.629 6.602 543 HB ILE 73 HB ILE 73 3.076 4.869 8.552 544 HG12 ILE 73 HG12 ILE 73 5.259 4.098 9.192 545 HG13 ILE 73 HG11 ILE 73 4.108 3.434 10.338 546 HG21 ILE 73 HG21 ILE 73 1.846 3.150 9.803 547 HG22 ILE 73 HG22 ILE 73 2.214 2.005 8.513 548 HG23 ILE 73 HG23 ILE 73 1.214 3.418 8.179 549 HD11 ILE 73 HD11 ILE 73 5.780 1.791 9.754 550 HD12 ILE 73 HD12 ILE 73 5.384 1.960 8.037 551 HD13 ILE 73 HD13 ILE 73 4.199 1.283 9.162 552 H GLY 74 HN GLY 74 2.174 3.155 4.961 553 HA2 GLY 74 HA2 GLY 74 0.229 4.522 4.377 554 HA3 GLY 74 HA1 GLY 74 1.156 5.942 4.865 555 H ASP 75 HN ASP 75 1.827 3.124 2.820 556 HA ASP 75 HA ASP 75 2.759 5.063 0.780 557 HB2 ASP 75 HB2 ASP 75 4.556 3.823 2.274 558 HB3 ASP 75 HB1 ASP 75 4.228 2.499 1.153 559 H LYS 76 HN LYS 76 2.148 4.595 -1.277 560 HA LYS 76 HA LYS 76 0.113 2.526 -1.392 561 HB2 LYS 76 HB2 LYS 76 0.787 4.648 -3.427 562 HB3 LYS 76 HB1 LYS 76 -0.673 3.669 -3.368 563 HG2 LYS 76 HG2 LYS 76 -1.614 4.923 -1.729 564 HG3 LYS 76 HG1 LYS 76 -0.061 5.334 -0.996 565 HD2 LYS 76 HD2 LYS 76 0.415 6.886 -2.805 566 HD3 LYS 76 HD1 LYS 76 -1.095 6.440 -3.610 567 HE2 LYS 76 HE2 LYS 76 -2.392 7.333 -1.784 568 HE3 LYS 76 HE1 LYS 76 -0.934 7.657 -0.852 569 HZ1 LYS 76 HZ1 LYS 76 -1.604 8.949 -3.446 570 HZ2 LYS 76 HZ2 LYS 76 -0.292 9.314 -2.450 571 HZ3 LYS 76 HZ3 LYS 76 -1.869 9.651 -1.924 572 H ILE 77 HN ILE 77 0.893 0.624 -1.885 573 HA ILE 77 HA ILE 77 3.078 0.181 -3.680 574 HB ILE 77 HB ILE 77 1.093 -1.768 -2.496 575 HG12 ILE 77 HG12 ILE 77 3.921 -1.202 -1.600 576 HG13 ILE 77 HG11 ILE 77 2.517 -0.417 -0.891 577 HG21 ILE 77 HG21 ILE 77 2.771 -3.483 -3.019 578 HG22 ILE 77 HG22 ILE 77 3.756 -2.261 -3.822 579 HG23 ILE 77 HG23 ILE 77 2.173 -2.686 -4.474 580 HD11 ILE 77 HD11 ILE 77 3.268 -2.292 0.452 581 HD12 ILE 77 HD12 ILE 77 3.033 -3.374 -0.921 582 HD13 ILE 77 HD13 ILE 77 1.647 -2.567 -0.186 583 H MET 78 HN MET 78 2.780 0.577 -5.778 584 HA MET 78 HA MET 78 0.146 0.263 -6.959 585 HB2 MET 78 HB2 MET 78 2.688 1.168 -8.310 586 HB3 MET 78 HB1 MET 78 1.038 1.414 -8.864 587 HG2 MET 78 HG2 MET 78 2.101 2.566 -6.310 588 HG3 MET 78 HG1 MET 78 2.198 3.405 -7.853 589 HE1 MET 78 HE1 MET 78 0.077 2.082 -4.989 590 HE2 MET 78 HE2 MET 78 -1.019 1.336 -6.162 591 HE3 MET 78 HE3 MET 78 -1.531 2.754 -5.247 592 H GLN 79 HN GLN 79 3.274 -1.283 -7.010 593 HA GLN 79 HA GLN 79 2.113 -3.625 -8.155 594 HB2 GLN 79 HB2 GLN 79 4.236 -3.536 -9.787 595 HB3 GLN 79 HB1 GLN 79 2.588 -3.152 -10.259 596 HG2 GLN 79 HG2 GLN 79 3.207 -0.765 -9.588 597 HG3 GLN 79 HG1 GLN 79 4.863 -1.373 -9.681 598 HE21 GLN 79 HE21 GLN 79 5.683 -2.090 -11.588 599 HE22 GLN 79 HE22 GLN 79 4.996 -1.632 -13.130 600 H VAL 80 HN VAL 80 3.291 -5.364 -8.235 601 HA VAL 80 HA VAL 80 5.417 -5.381 -6.182 602 HB VAL 80 HB VAL 80 3.539 -6.421 -5.276 603 HG11 VAL 80 HG11 VAL 80 2.173 -6.488 -7.281 604 HG12 VAL 80 HG12 VAL 80 2.137 -8.053 -6.462 605 HG13 VAL 80 HG13 VAL 80 3.127 -7.835 -7.907 606 HG21 VAL 80 HG21 VAL 80 4.123 -8.830 -5.165 607 HG22 VAL 80 HG22 VAL 80 5.571 -7.821 -5.070 608 HG23 VAL 80 HG23 VAL 80 5.158 -8.633 -6.588 609 H ASN 81 HN ASN 81 7.372 -6.100 -6.889 610 HA ASN 81 HA ASN 81 8.974 -7.070 -8.164 611 HB2 ASN 81 HB2 ASN 81 6.744 -9.052 -8.653 612 HB3 ASN 81 HB1 ASN 81 8.406 -9.301 -9.186 613 HD21 ASN 81 HD21 ASN 81 9.789 -8.359 -6.943 614 HD22 ASN 81 HD22 ASN 81 9.466 -9.429 -5.618 615 H GLY 82 HN GLY 82 6.568 -5.441 -9.433 616 HA2 GLY 82 HA2 GLY 82 6.968 -4.254 -11.528 617 HA3 GLY 82 HA1 GLY 82 7.489 -5.796 -12.209 618 H TRP 83 HN TRP 83 4.847 -6.388 -10.250 619 HA TRP 83 HA TRP 83 3.134 -6.601 -12.591 620 HB2 TRP 83 HB2 TRP 83 2.671 -7.825 -9.899 621 HB3 TRP 83 HB1 TRP 83 1.907 -8.233 -11.403 622 HD1 TRP 83 HD1 TRP 83 5.501 -8.019 -10.323 623 HE1 TRP 83 HE1 TRP 83 6.619 -10.236 -10.710 624 HE3 TRP 83 HE3 TRP 83 1.608 -10.575 -12.392 625 HZ2 TRP 83 HZ2 TRP 83 6.065 -12.734 -11.822 626 HZ3 TRP 83 HZ3 TRP 83 2.010 -12.897 -13.123 627 HH2 TRP 83 HH2 TRP 83 4.210 -13.932 -12.832 628 H ASP 84 HN ASP 84 2.693 -4.284 -12.315 629 HA ASP 84 HA ASP 84 1.295 -2.783 -10.760 630 HB2 ASP 84 HB2 ASP 84 1.257 -2.562 -13.239 631 HB3 ASP 84 HB1 ASP 84 -0.015 -3.773 -13.305 632 H MET 85 HN MET 85 0.268 -3.352 -8.957 633 HA MET 85 HA MET 85 -1.834 -5.405 -9.102 634 HB2 MET 85 HB2 MET 85 -1.636 -5.419 -6.579 635 HB3 MET 85 HB1 MET 85 -0.271 -6.069 -7.470 636 HG2 MET 85 HG2 MET 85 1.120 -4.375 -6.846 637 HG3 MET 85 HG1 MET 85 -0.187 -3.207 -6.686 638 HE1 MET 85 HE1 MET 85 1.507 -6.403 -4.421 639 HE2 MET 85 HE2 MET 85 0.155 -6.725 -5.499 640 HE3 MET 85 HE3 MET 85 -0.109 -6.664 -3.757 641 H THR 86 HN THR 86 -2.947 -3.407 -10.152 642 HA THR 86 HA THR 86 -4.229 -1.799 -8.055 643 HB THR 86 HB THR 86 -4.987 -0.335 -9.909 644 HG1 THR 86 HG1 THR 86 -3.165 -1.676 -11.619 645 HG21 THR 86 HG21 THR 86 -2.895 0.137 -8.697 646 HG22 THR 86 HG22 THR 86 -2.785 0.624 -10.391 647 HG23 THR 86 HG23 THR 86 -2.012 -0.866 -9.849 648 H MET 87 HN MET 87 -5.337 -2.975 -11.208 649 HA MET 87 HA MET 87 -7.971 -3.623 -10.184 650 HB2 MET 87 HB2 MET 87 -8.366 -4.455 -12.506 651 HB3 MET 87 HB1 MET 87 -7.838 -2.781 -12.437 652 HG2 MET 87 HG2 MET 87 -5.547 -3.524 -12.977 653 HG3 MET 87 HG1 MET 87 -6.146 -5.173 -13.129 654 HE1 MET 87 HE1 MET 87 -5.333 -3.940 -16.802 655 HE2 MET 87 HE2 MET 87 -4.937 -5.126 -15.563 656 HE3 MET 87 HE3 MET 87 -4.514 -3.431 -15.323 657 H VAL 88 HN VAL 88 -5.248 -4.940 -9.679 658 HA VAL 88 HA VAL 88 -5.727 -7.762 -10.156 659 HB VAL 88 HB VAL 88 -3.482 -6.061 -9.062 660 HG11 VAL 88 HG11 VAL 88 -2.136 -7.984 -8.719 661 HG12 VAL 88 HG12 VAL 88 -3.414 -9.042 -9.314 662 HG13 VAL 88 HG13 VAL 88 -3.624 -8.182 -7.788 663 HG21 VAL 88 HG21 VAL 88 -3.730 -6.079 -11.468 664 HG22 VAL 88 HG22 VAL 88 -3.699 -7.845 -11.478 665 HG23 VAL 88 HG23 VAL 88 -2.263 -6.940 -10.999 666 H THR 89 HN THR 89 -5.817 -9.290 -8.251 667 HA THR 89 HA THR 89 -7.453 -7.997 -6.257 668 HB THR 89 HB THR 89 -6.981 -10.763 -7.200 669 HG1 THR 89 HG1 THR 89 -8.989 -8.943 -7.307 670 HG21 THR 89 HG21 THR 89 -8.244 -11.693 -5.385 671 HG22 THR 89 HG22 THR 89 -8.300 -10.105 -4.616 672 HG23 THR 89 HG23 THR 89 -6.754 -10.925 -4.850 673 H HIS 90 HN HIS 90 -6.934 -7.942 -4.202 674 HA HIS 90 HA HIS 90 -4.232 -7.701 -3.498 675 HB2 HIS 90 HB2 HIS 90 -5.892 -6.481 -2.278 676 HB3 HIS 90 HB1 HIS 90 -6.764 -7.950 -1.871 677 HD1 HIS 90 HD1 HIS 90 -6.108 -9.189 0.168 678 HD2 HIS 90 HD2 HIS 90 -3.498 -6.062 -0.698 679 HE1 HIS 90 HE1 HIS 90 -4.597 -8.988 2.168 680 HE2 HIS 90 HE2 HIS 90 -2.938 -7.198 1.559 681 H ASP 91 HN ASP 91 -6.510 -10.254 -3.102 682 HA ASP 91 HA ASP 91 -4.980 -11.929 -1.404 683 HB2 ASP 91 HB2 ASP 91 -7.412 -12.180 -1.734 684 HB3 ASP 91 HB1 ASP 91 -7.102 -12.674 -3.401 685 H GLN 92 HN GLN 92 -5.241 -11.691 -4.930 686 HA GLN 92 HA GLN 92 -3.605 -14.032 -5.233 687 HB2 GLN 92 HB2 GLN 92 -3.987 -13.659 -7.660 688 HB3 GLN 92 HB1 GLN 92 -5.461 -13.861 -6.736 689 HG2 GLN 92 HG2 GLN 92 -6.088 -12.123 -7.970 690 HG3 GLN 92 HG1 GLN 92 -5.272 -11.216 -6.701 691 HE21 GLN 92 HE21 GLN 92 -3.118 -10.737 -7.013 692 HE22 GLN 92 HE22 GLN 92 -2.549 -10.421 -8.593 693 H ALA 93 HN ALA 93 -3.342 -10.669 -4.975 694 HA ALA 93 HA ALA 93 -0.836 -10.401 -6.343 695 HB1 ALA 93 HB1 ALA 93 -2.450 -8.551 -6.171 696 HB2 ALA 93 HB2 ALA 93 -0.880 -8.147 -5.494 697 HB3 ALA 93 HB3 ALA 93 -2.218 -8.533 -4.423 698 H ARG 94 HN ARG 94 -2.014 -10.949 -3.064 699 HA ARG 94 HA ARG 94 0.616 -10.575 -2.004 700 HB2 ARG 94 HB2 ARG 94 -0.271 -11.322 0.147 701 HB3 ARG 94 HB1 ARG 94 -1.180 -9.999 -0.557 702 HG2 ARG 94 HG2 ARG 94 -2.791 -11.328 0.288 703 HG3 ARG 94 HG1 ARG 94 -2.771 -11.834 -1.393 704 HD2 ARG 94 HD2 ARG 94 -1.375 -13.772 -0.748 705 HD3 ARG 94 HD1 ARG 94 -1.483 -13.262 0.939 706 HE ARG 94 HE ARG 94 -3.836 -14.049 -0.672 707 HH11 ARG 94 HH11 ARG 94 -2.023 -14.084 2.326 708 HH12 ARG 94 HH12 ARG 94 -3.251 -14.940 3.210 709 HH21 ARG 94 HH21 ARG 94 -5.444 -15.171 0.459 710 HH22 ARG 94 HH22 ARG 94 -5.185 -15.602 2.134 711 H LYS 95 HN LYS 95 -1.211 -13.197 -3.266 712 HA LYS 95 HA LYS 95 0.433 -15.233 -2.164 713 HB2 LYS 95 HB2 LYS 95 -0.730 -16.771 -3.492 714 HB3 LYS 95 HB1 LYS 95 -1.919 -15.523 -3.150 715 HG2 LYS 95 HG2 LYS 95 -1.489 -14.548 -5.365 716 HG3 LYS 95 HG1 LYS 95 -0.363 -15.871 -5.702 717 HD2 LYS 95 HD2 LYS 95 -2.291 -17.446 -5.244 718 HD3 LYS 95 HD1 LYS 95 -3.337 -16.022 -5.260 719 HE2 LYS 95 HE2 LYS 95 -3.381 -17.005 -7.435 720 HE3 LYS 95 HE1 LYS 95 -2.482 -15.492 -7.530 721 HZ1 LYS 95 HZ1 LYS 95 -0.429 -16.844 -7.342 722 HZ2 LYS 95 HZ2 LYS 95 -1.310 -17.133 -8.757 723 HZ3 LYS 95 HZ3 LYS 95 -1.370 -18.242 -7.478 724 H ARG 96 HN ARG 96 0.715 -13.149 -5.057 725 HA ARG 96 HA ARG 96 2.847 -14.834 -6.054 726 HB2 ARG 96 HB2 ARG 96 2.944 -13.341 -7.905 727 HB3 ARG 96 HB1 ARG 96 1.285 -13.823 -7.590 728 HG2 ARG 96 HG2 ARG 96 0.748 -11.721 -6.679 729 HG3 ARG 96 HG1 ARG 96 2.453 -11.238 -6.620 730 HD2 ARG 96 HD2 ARG 96 1.841 -10.248 -8.573 731 HD3 ARG 96 HD1 ARG 96 2.371 -11.840 -9.114 732 HE ARG 96 HE ARG 96 -0.173 -12.369 -8.856 733 HH11 ARG 96 HH11 ARG 96 1.187 -9.404 -10.088 734 HH12 ARG 96 HH12 ARG 96 -0.048 -9.169 -11.285 735 HH21 ARG 96 HH21 ARG 96 -1.834 -12.061 -10.392 736 HH22 ARG 96 HH22 ARG 96 -1.780 -10.682 -11.459 737 H LEU 97 HN LEU 97 2.550 -11.854 -4.185 738 HA LEU 97 HA LEU 97 5.277 -11.141 -4.468 739 HB2 LEU 97 HB2 LEU 97 4.916 -9.767 -2.444 740 HB3 LEU 97 HB1 LEU 97 3.806 -9.448 -3.758 741 HG LEU 97 HG LEU 97 2.249 -11.081 -2.421 742 HD11 LEU 97 HD11 LEU 97 4.066 -11.644 -0.819 743 HD12 LEU 97 HD12 LEU 97 2.591 -11.041 -0.057 744 HD13 LEU 97 HD13 LEU 97 3.995 -9.984 -0.226 745 HD21 LEU 97 HD21 LEU 97 1.311 -9.160 -1.264 746 HD22 LEU 97 HD22 LEU 97 1.811 -8.720 -2.898 747 HD23 LEU 97 HD23 LEU 97 2.805 -8.257 -1.515 748 H THR 98 HN THR 98 3.647 -13.432 -2.439 749 HA THR 98 HA THR 98 6.287 -14.148 -1.340 750 HB THR 98 HB THR 98 4.897 -15.555 0.304 751 HG1 THR 98 HG1 THR 98 2.896 -13.767 -0.679 752 HG21 THR 98 HG21 THR 98 4.586 -13.640 1.809 753 HG22 THR 98 HG22 THR 98 4.800 -12.537 0.450 754 HG23 THR 98 HG23 THR 98 6.134 -13.565 0.971 755 H LYS 99 HN LYS 99 5.885 -14.925 -3.909 756 HA LYS 99 HA LYS 99 4.639 -17.486 -4.106 757 HB2 LYS 99 HB2 LYS 99 5.646 -17.510 -6.390 758 HB3 LYS 99 HB1 LYS 99 4.631 -16.107 -6.059 759 HG2 LYS 99 HG2 LYS 99 6.707 -14.856 -5.495 760 HG3 LYS 99 HG1 LYS 99 7.633 -16.252 -6.046 761 HD2 LYS 99 HD2 LYS 99 6.747 -16.034 -8.264 762 HD3 LYS 99 HD1 LYS 99 5.644 -14.758 -7.734 763 HE2 LYS 99 HE2 LYS 99 8.638 -14.571 -7.543 764 HE3 LYS 99 HE1 LYS 99 7.699 -13.932 -8.899 765 HZ1 LYS 99 HZ1 LYS 99 6.443 -12.614 -7.206 766 HZ2 LYS 99 HZ2 LYS 99 8.061 -12.166 -7.381 767 HZ3 LYS 99 HZ3 LYS 99 7.583 -13.099 -6.050 768 H ARG 100 HN ARG 100 7.591 -16.534 -3.030 769 HA ARG 100 HA ARG 100 9.244 -17.786 -1.996 770 HB2 ARG 100 HB2 ARG 100 7.332 -19.718 -2.392 771 HB3 ARG 100 HB1 ARG 100 8.692 -20.357 -3.304 772 HG2 ARG 100 HG2 ARG 100 9.006 -21.293 -1.226 773 HG3 ARG 100 HG1 ARG 100 10.039 -19.860 -1.141 774 HD2 ARG 100 HD2 ARG 100 8.683 -20.134 0.883 775 HD3 ARG 100 HD1 ARG 100 8.294 -18.644 0.018 776 HE ARG 100 HE ARG 100 6.291 -19.741 -0.813 777 HH11 ARG 100 HH11 ARG 100 7.920 -21.339 1.853 778 HH12 ARG 100 HH12 ARG 100 6.490 -22.165 2.397 779 HH21 ARG 100 HH21 ARG 100 4.428 -20.834 -0.105 780 HH22 ARG 100 HH22 ARG 100 4.518 -21.881 1.279 781 H SER 101 HN SER 101 8.885 -16.940 -5.010 782 HA SER 101 HA SER 101 11.101 -18.482 -6.148 783 HB2 SER 101 HB2 SER 101 8.966 -18.276 -7.428 784 HB3 SER 101 HB1 SER 101 9.245 -16.539 -7.537 785 HG SER 101 HG SER 101 11.291 -18.262 -8.361 786 H GLU 102 HN GLU 102 10.615 -15.590 -4.537 787 HA GLU 102 HA GLU 102 12.804 -14.268 -5.926 788 HB2 GLU 102 HB2 GLU 102 11.969 -12.184 -4.954 789 HB3 GLU 102 HB1 GLU 102 10.751 -12.968 -5.949 790 HG2 GLU 102 HG2 GLU 102 10.842 -13.257 -2.957 791 HG3 GLU 102 HG1 GLU 102 9.977 -11.946 -3.769 792 H GLU 103 HN GLU 103 13.640 -12.583 -4.225 793 HA GLU 103 HA GLU 103 14.518 -14.034 -1.828 794 HB2 GLU 103 HB2 GLU 103 16.146 -11.863 -3.102 795 HB3 GLU 103 HB1 GLU 103 16.680 -13.122 -2.003 796 HG2 GLU 103 HG2 GLU 103 15.872 -13.564 -4.869 797 HG3 GLU 103 HG1 GLU 103 17.529 -13.390 -4.295 798 H VAL 104 HN VAL 104 12.522 -11.926 -2.952 799 HA VAL 104 HA VAL 104 12.307 -10.157 -0.800 800 HB VAL 104 HB VAL 104 14.590 -9.591 -1.452 801 HG11 VAL 104 HG11 VAL 104 13.385 -8.738 -4.075 802 HG12 VAL 104 HG12 VAL 104 14.533 -10.053 -3.816 803 HG13 VAL 104 HG13 VAL 104 15.030 -8.380 -3.551 804 HG21 VAL 104 HG21 VAL 104 13.087 -7.884 -0.485 805 HG22 VAL 104 HG22 VAL 104 12.701 -7.349 -2.119 806 HG23 VAL 104 HG23 VAL 104 14.349 -7.200 -1.506 807 H VAL 105 HN VAL 105 10.604 -8.656 -1.130 808 HA VAL 105 HA VAL 105 9.235 -9.145 -3.681 809 HB VAL 105 HB VAL 105 7.806 -9.924 -1.925 810 HG11 VAL 105 HG11 VAL 105 8.710 -8.727 -0.009 811 HG12 VAL 105 HG12 VAL 105 6.966 -8.482 -0.119 812 HG13 VAL 105 HG13 VAL 105 8.069 -7.209 -0.639 813 HG21 VAL 105 HG21 VAL 105 6.853 -7.239 -2.886 814 HG22 VAL 105 HG22 VAL 105 5.831 -8.540 -2.278 815 HG23 VAL 105 HG23 VAL 105 6.742 -8.756 -3.773 816 H ARG 106 HN ARG 106 9.264 -7.616 -5.042 817 HA ARG 106 HA ARG 106 10.281 -5.021 -4.297 818 HB2 ARG 106 HB2 ARG 106 11.295 -6.039 -6.183 819 HB3 ARG 106 HB1 ARG 106 9.746 -6.526 -6.829 820 HG2 ARG 106 HG2 ARG 106 9.265 -4.452 -7.635 821 HG3 ARG 106 HG1 ARG 106 10.458 -3.644 -6.614 822 HD2 ARG 106 HD2 ARG 106 12.244 -4.391 -7.903 823 HD3 ARG 106 HD1 ARG 106 11.303 -5.696 -8.618 824 HE ARG 106 HE ARG 106 10.055 -3.716 -9.722 825 HH11 ARG 106 HH11 ARG 106 13.481 -3.805 -9.021 826 HH12 ARG 106 HH12 ARG 106 13.926 -2.887 -10.423 827 HH21 ARG 106 HH21 ARG 106 10.632 -2.537 -11.596 828 HH22 ARG 106 HH22 ARG 106 12.316 -2.212 -11.913 829 H LEU 107 HN LEU 107 9.023 -3.223 -4.276 830 HA LEU 107 HA LEU 107 6.579 -3.377 -5.807 831 HB2 LEU 107 HB2 LEU 107 5.839 -1.598 -3.872 832 HB3 LEU 107 HB1 LEU 107 5.265 -3.230 -4.079 833 HG LEU 107 HG LEU 107 5.815 -2.658 -1.756 834 HD11 LEU 107 HD11 LEU 107 7.201 -4.669 -1.318 835 HD12 LEU 107 HD12 LEU 107 7.431 -4.818 -3.064 836 HD13 LEU 107 HD13 LEU 107 5.816 -4.956 -2.372 837 HD21 LEU 107 HD21 LEU 107 8.437 -2.761 -1.432 838 HD22 LEU 107 HD22 LEU 107 7.564 -1.248 -1.706 839 HD23 LEU 107 HD23 LEU 107 8.382 -2.044 -3.053 840 H LEU 108 HN LEU 108 5.970 -1.768 -6.803 841 HA LEU 108 HA LEU 108 7.594 0.643 -6.881 842 HB2 LEU 108 HB2 LEU 108 5.754 -0.727 -8.731 843 HB3 LEU 108 HB1 LEU 108 5.657 1.032 -8.714 844 HG LEU 108 HG LEU 108 8.371 -0.161 -8.914 845 HD11 LEU 108 HD11 LEU 108 6.435 -0.024 -11.219 846 HD12 LEU 108 HD12 LEU 108 7.116 -1.495 -10.522 847 HD13 LEU 108 HD13 LEU 108 8.164 -0.339 -11.342 848 HD21 LEU 108 HD21 LEU 108 7.910 2.244 -8.718 849 HD22 LEU 108 HD22 LEU 108 7.000 2.155 -10.231 850 HD23 LEU 108 HD23 LEU 108 8.732 1.816 -10.220 851 H VAL 109 HN VAL 109 6.991 2.201 -5.557 852 HA VAL 109 HA VAL 109 4.286 2.085 -4.509 853 HB VAL 109 HB VAL 109 6.287 1.130 -3.173 854 HG11 VAL 109 HG11 VAL 109 7.752 3.057 -3.385 855 HG12 VAL 109 HG12 VAL 109 7.408 2.678 -1.697 856 HG13 VAL 109 HG13 VAL 109 6.591 4.031 -2.484 857 HG21 VAL 109 HG21 VAL 109 4.306 2.954 -1.897 858 HG22 VAL 109 HG22 VAL 109 5.203 1.666 -1.089 859 HG23 VAL 109 HG23 VAL 109 4.041 1.273 -2.355 860 H THR 110 HN THR 110 3.836 4.020 -3.254 861 HA THR 110 HA THR 110 4.923 6.454 -4.442 862 HB THR 110 HB THR 110 2.470 7.236 -4.756 863 HG1 THR 110 HG1 THR 110 2.225 4.461 -4.469 864 HG21 THR 110 HG21 THR 110 2.448 6.392 -7.046 865 HG22 THR 110 HG22 THR 110 3.736 5.260 -6.633 866 HG23 THR 110 HG23 THR 110 4.038 6.998 -6.578 867 H ARG 111 HN ARG 111 5.480 7.624 -2.772 868 HA ARG 111 HA ARG 111 3.579 7.794 -0.528 869 HB2 ARG 111 HB2 ARG 111 5.619 8.212 0.938 870 HB3 ARG 111 HB1 ARG 111 5.331 6.563 0.409 871 HG2 ARG 111 HG2 ARG 111 7.069 6.707 -1.216 872 HG3 ARG 111 HG1 ARG 111 7.269 8.437 -0.921 873 HD2 ARG 111 HD2 ARG 111 8.077 8.042 1.278 874 HD3 ARG 111 HD1 ARG 111 7.654 6.333 1.190 875 HE ARG 111 HE ARG 111 9.398 6.438 -0.761 876 HH11 ARG 111 HH11 ARG 111 9.537 8.049 2.327 877 HH12 ARG 111 HH12 ARG 111 11.266 7.992 2.445 878 HH21 ARG 111 HH21 ARG 111 11.684 6.361 -0.639 879 HH22 ARG 111 HH22 ARG 111 12.495 7.046 0.728 880 H GLN 112 HN GLN 112 4.081 9.768 0.848 881 HA GLN 112 HA GLN 112 4.237 12.061 -0.951 882 HB2 GLN 112 HB2 GLN 112 3.331 12.006 1.911 883 HB3 GLN 112 HB1 GLN 112 3.051 13.269 0.726 884 HG2 GLN 112 HG2 GLN 112 1.901 10.495 0.684 885 HG3 GLN 112 HG1 GLN 112 1.059 11.972 1.119 886 HE21 GLN 112 HE21 GLN 112 2.444 10.110 -1.455 887 HE22 GLN 112 HE22 GLN 112 1.696 10.960 -2.771 888 H SER 113 HN SER 113 5.335 10.722 1.886 889 HA SER 113 HA SER 113 7.581 10.564 2.569 890 HB2 SER 113 HB2 SER 113 7.694 13.305 1.406 891 HB3 SER 113 HB1 SER 113 8.969 12.677 2.451 892 HG SER 113 HG SER 113 9.742 11.723 0.743 893 H LEU 114 HN LEU 114 5.008 11.479 3.527 894 HA LEU 114 HA LEU 114 4.009 12.089 5.437 895 HB2 LEU 114 HB2 LEU 114 6.744 11.431 6.373 896 HB3 LEU 114 HB1 LEU 114 5.430 11.798 7.470 897 HG LEU 114 HG LEU 114 5.473 9.462 7.434 898 HD11 LEU 114 HD11 LEU 114 3.486 8.775 6.090 899 HD12 LEU 114 HD12 LEU 114 3.483 10.395 5.381 900 HD13 LEU 114 HD13 LEU 114 3.230 10.187 7.116 901 HD21 LEU 114 HD21 LEU 114 5.675 8.133 5.359 902 HD22 LEU 114 HD22 LEU 114 7.079 9.162 5.646 903 HD23 LEU 114 HD23 LEU 114 5.877 9.633 4.447 904 H GLN 115 HN GLN 115 4.026 14.176 4.397 905 HA GLN 115 HA GLN 115 5.549 16.306 5.476 906 HB2 GLN 115 HB2 GLN 115 3.580 17.698 4.624 907 HB3 GLN 115 HB1 GLN 115 4.508 16.806 3.438 908 HG2 GLN 115 HG2 GLN 115 2.772 15.059 3.445 909 HG3 GLN 115 HG1 GLN 115 1.838 16.026 4.584 910 HE21 GLN 115 HE21 GLN 115 2.572 18.545 3.343 911 HE22 GLN 115 HE22 GLN 115 1.674 18.643 1.870 912 H LYS 116 HN LYS 116 5.488 17.078 7.434 913 HA LYS 116 HA LYS 116 5.005 17.342 9.620 914 HB2 LYS 116 HB2 LYS 116 2.134 16.965 8.750 915 HB3 LYS 116 HB1 LYS 116 2.641 17.494 10.348 916 HG2 LYS 116 HG2 LYS 116 3.741 19.453 9.286 917 HG3 LYS 116 HG1 LYS 116 3.050 18.945 7.743 918 HD2 LYS 116 HD2 LYS 116 0.792 19.114 8.747 919 HD3 LYS 116 HD1 LYS 116 1.529 19.721 10.234 920 HE2 LYS 116 HE2 LYS 116 2.526 21.573 8.888 921 HE3 LYS 116 HE1 LYS 116 1.586 21.009 7.507 922 HZ1 LYS 116 HZ1 LYS 116 0.431 22.790 8.568 923 HZ2 LYS 116 HZ2 LYS 116 0.528 22.037 10.082 924 HZ3 LYS 116 HZ3 LYS 116 -0.437 21.359 8.862 925 H ALA 117 HN ALA 117 5.259 15.972 11.311 926 HA ALA 117 HA ALA 117 4.547 13.159 10.833 927 HB1 ALA 117 HB1 ALA 117 7.318 14.164 11.471 928 HB2 ALA 117 HB2 ALA 117 6.799 13.474 9.931 929 HB3 ALA 117 HB3 ALA 117 6.845 12.470 11.383 930 H VAL 118 HN VAL 118 3.629 15.235 12.529 931 HA VAL 118 HA VAL 118 4.714 14.957 15.131 932 HB VAL 118 HB VAL 118 2.878 16.520 15.655 933 HG11 VAL 118 HG11 VAL 118 5.048 17.361 14.996 934 HG12 VAL 118 HG12 VAL 118 3.763 18.403 14.386 935 HG13 VAL 118 HG13 VAL 118 4.566 17.269 13.300 936 HG21 VAL 118 HG21 VAL 118 1.240 15.720 14.029 937 HG22 VAL 118 HG22 VAL 118 2.258 16.336 12.727 938 HG23 VAL 118 HG23 VAL 118 1.514 17.455 13.868 939 H GLN 119 HN GLN 119 3.521 12.584 13.875 940 HA GLN 119 HA GLN 119 1.278 12.048 15.710 941 HB2 GLN 119 HB2 GLN 119 1.954 10.675 13.095 942 HB3 GLN 119 HB1 GLN 119 0.601 10.272 14.141 943 HG2 GLN 119 HG2 GLN 119 -0.327 12.514 13.771 944 HG3 GLN 119 HG1 GLN 119 1.017 12.873 12.686 945 HE21 GLN 119 HE21 GLN 119 -1.879 12.757 12.214 946 HE22 GLN 119 HE22 GLN 119 -2.097 11.640 10.898 947 H GLN 120 HN GLN 120 2.432 11.330 17.486 948 HA GLN 120 HA GLN 120 4.443 9.266 17.121 949 HB2 GLN 120 HB2 GLN 120 4.916 11.087 18.689 950 HB3 GLN 120 HB1 GLN 120 3.495 10.667 19.632 951 HG2 GLN 120 HG2 GLN 120 5.508 9.855 20.697 952 HG3 GLN 120 HG1 GLN 120 4.496 8.509 20.181 953 HE21 GLN 120 HE21 GLN 120 7.494 10.182 19.731 954 HE22 GLN 120 HE22 GLN 120 8.231 9.005 18.688 955 H SER 121 HN SER 121 2.423 9.193 19.968 956 HA SER 121 HA SER 121 0.762 7.025 19.078 957 HB2 SER 121 HB2 SER 121 3.004 6.462 21.037 958 HB3 SER 121 HB1 SER 121 1.689 5.354 20.661 959 HG SER 121 HG SER 121 2.865 6.166 18.390 960 H MET 122 HN MET 122 -1.017 6.902 20.309 961 HA MET 122 HA MET 122 -2.498 7.118 22.009 962 HB2 MET 122 HB2 MET 122 -0.003 7.438 23.668 963 HB3 MET 122 HB1 MET 122 -1.618 7.409 24.353 964 HG2 MET 122 HG2 MET 122 -1.962 5.162 23.490 965 HG3 MET 122 HG1 MET 122 -0.353 5.190 22.769 966 HE1 MET 122 HE1 MET 122 -0.071 2.665 25.804 967 HE2 MET 122 HE2 MET 122 0.118 2.853 24.061 968 HE3 MET 122 HE3 MET 122 -1.486 2.937 24.786 969 H LEU 123 HN LEU 123 -0.139 9.397 23.323 970 HA LEU 123 HA LEU 123 -2.014 11.587 22.795 971 HB2 LEU 123 HB2 LEU 123 -2.407 10.648 25.083 972 HB3 LEU 123 HB1 LEU 123 -0.747 11.037 25.485 973 HG LEU 123 HG LEU 123 -1.263 13.446 25.105 974 HD11 LEU 123 HD11 LEU 123 -3.592 14.144 24.960 975 HD12 LEU 123 HD12 LEU 123 -4.104 12.460 24.878 976 HD13 LEU 123 HD13 LEU 123 -3.148 13.155 23.570 977 HD21 LEU 123 HD21 LEU 123 -1.312 12.470 27.346 978 HD22 LEU 123 HD22 LEU 123 -3.013 12.056 27.126 979 HD23 LEU 123 HD23 LEU 123 -2.516 13.748 27.169 980 H SER 124 HN SER 124 -0.970 13.733 23.262 981 HA SER 124 HA SER 124 1.421 14.065 21.904 982 HB2 SER 124 HB2 SER 124 0.535 15.949 24.076 983 HB3 SER 124 HB1 SER 124 1.256 16.326 22.512 984 HG SER 124 HG SER 124 -0.660 15.775 21.500 985 H1 LYS 161 HN LYS 161 -18.920 -1.461 4.105 986 HA LYS 161 HA LYS 161 -16.934 -0.729 3.346 987 HB2 LYS 161 HB2 LYS 161 -17.814 1.491 3.570 988 HB3 LYS 161 HB1 LYS 161 -17.448 1.525 5.293 989 HG2 LYS 161 HG2 LYS 161 -15.002 1.198 4.522 990 HG3 LYS 161 HG1 LYS 161 -15.611 1.709 2.938 991 HD2 LYS 161 HD2 LYS 161 -14.678 3.591 4.242 992 HD3 LYS 161 HD1 LYS 161 -16.395 3.808 3.898 993 HE2 LYS 161 HE2 LYS 161 -15.738 4.412 6.225 994 HE3 LYS 161 HE1 LYS 161 -16.989 3.177 6.130 995 HZ1 LYS 161 HZ1 LYS 161 -15.322 2.623 7.796 996 HZ2 LYS 161 HZ2 LYS 161 -14.095 2.666 6.628 997 HZ3 LYS 161 HZ3 LYS 161 -15.306 1.485 6.540 998 H GLU 162 HN GLU 162 -15.812 -2.525 4.091 999 HA GLU 162 HA GLU 162 -13.736 -1.797 5.964 1000 HB2 GLU 162 HB2 GLU 162 -15.369 -2.731 7.424 1001 HB3 GLU 162 HB1 GLU 162 -15.543 -4.163 6.426 1002 HG2 GLU 162 HG2 GLU 162 -13.258 -4.822 6.970 1003 HG3 GLU 162 HG1 GLU 162 -13.074 -3.372 7.954 1004 H ASN 163 HN ASN 163 -11.839 -2.515 5.311 1005 HA ASN 163 HA ASN 163 -11.753 -4.289 2.978 1006 HB2 ASN 163 HB2 ASN 163 -9.532 -3.354 2.568 1007 HB3 ASN 163 HB1 ASN 163 -10.717 -2.063 2.738 1008 HD21 ASN 163 HD21 ASN 163 -10.580 -0.661 4.438 1009 HD22 ASN 163 HD22 ASN 163 -9.211 -0.612 5.517 1010 H LEU 164 HN LEU 164 -9.128 -5.152 3.071 1011 HA LEU 164 HA LEU 164 -8.926 -6.490 5.682 1012 HB2 LEU 164 HB2 LEU 164 -8.595 -8.575 4.823 1013 HB3 LEU 164 HB1 LEU 164 -9.719 -7.941 3.642 1014 HG LEU 164 HG LEU 164 -6.775 -7.743 3.121 1015 HD11 LEU 164 HD11 LEU 164 -7.118 -10.047 3.793 1016 HD12 LEU 164 HD12 LEU 164 -6.829 -9.946 2.057 1017 HD13 LEU 164 HD13 LEU 164 -8.465 -10.193 2.665 1018 HD21 LEU 164 HD21 LEU 164 -7.555 -8.063 0.766 1019 HD22 LEU 164 HD22 LEU 164 -8.191 -6.608 1.548 1020 HD23 LEU 164 HD23 LEU 164 -9.218 -8.031 1.370 1021 H GLU 165 HN GLU 165 -6.957 -6.481 6.596 1022 HA GLU 165 HA GLU 165 -4.799 -5.209 5.097 1023 HB2 GLU 165 HB2 GLU 165 -3.879 -4.567 7.098 1024 HB3 GLU 165 HB1 GLU 165 -5.548 -4.731 7.618 1025 HG2 GLU 165 HG2 GLU 165 -5.064 -6.977 8.450 1026 HG3 GLU 165 HG1 GLU 165 -3.383 -6.793 7.949 1027 H SER 166 HN SER 166 -2.660 -6.206 5.126 1028 HA SER 166 HA SER 166 -2.708 -9.112 5.527 1029 HB2 SER 166 HB2 SER 166 -3.120 -8.321 3.082 1030 HB3 SER 166 HB1 SER 166 -1.410 -7.911 3.090 1031 HG SER 166 HG SER 166 -2.513 -10.475 3.643 1032 H MET 167 HN MET 167 -1.118 -9.581 6.871 1033 HA MET 167 HA MET 167 1.238 -7.877 7.025 1034 HB2 MET 167 HB2 MET 167 0.434 -10.285 8.657 1035 HB3 MET 167 HB1 MET 167 1.847 -9.290 8.963 1036 HG2 MET 167 HG2 MET 167 0.411 -7.378 9.407 1037 HG3 MET 167 HG1 MET 167 -1.013 -8.359 9.065 1038 HE1 MET 167 HE1 MET 167 -2.087 -7.676 11.411 1039 HE2 MET 167 HE2 MET 167 -0.674 -6.662 11.711 1040 HE3 MET 167 HE3 MET 167 -1.218 -7.802 12.940 1041 H VAL 168 HN VAL 168 2.945 -8.307 5.816 1042 HA VAL 168 HA VAL 168 3.448 -11.081 4.997 1043 HB VAL 168 HB VAL 168 4.229 -10.243 2.788 1044 HG11 VAL 168 HG11 VAL 168 1.995 -11.215 3.025 1045 HG12 VAL 168 HG12 VAL 168 2.003 -9.929 1.818 1046 HG13 VAL 168 HG13 VAL 168 1.341 -9.627 3.425 1047 HG21 VAL 168 HG21 VAL 168 3.546 -8.010 2.057 1048 HG22 VAL 168 HG22 VAL 168 4.676 -7.935 3.411 1049 HG23 VAL 168 HG23 VAL 168 2.955 -7.661 3.683 Start of MODEL 13 1 H1 MET 1 HT1 MET 1 -12.092 31.290 -2.708 2 H2 MET 1 HT2 MET 1 -12.705 32.866 -2.780 3 H3 MET 1 HT3 MET 1 -11.246 32.487 -3.553 4 HA MET 1 HA MET 1 -13.905 31.406 -4.258 5 HB2 MET 1 HB2 MET 1 -13.579 32.690 -6.381 6 HB3 MET 1 HB1 MET 1 -13.797 33.696 -4.958 7 HG2 MET 1 HG2 MET 1 -11.086 33.035 -6.055 8 HG3 MET 1 HG1 MET 1 -12.034 34.400 -6.632 9 HE1 MET 1 HE1 MET 1 -12.646 36.491 -5.243 10 HE2 MET 1 HE2 MET 1 -12.262 36.712 -3.537 11 HE3 MET 1 HE3 MET 1 -13.451 35.503 -4.024 12 H SER 2 HN SER 2 -12.638 31.452 -7.092 13 HA SER 2 HA SER 2 -12.061 28.666 -7.007 14 HB2 SER 2 HB2 SER 2 -11.797 30.581 -9.330 15 HB3 SER 2 HB1 SER 2 -11.905 28.822 -9.423 16 HG SER 2 HG SER 2 -13.904 30.148 -9.745 17 H TYR 3 HN TYR 3 -10.186 28.833 -5.556 18 HA TYR 3 HA TYR 3 -7.746 28.856 -7.205 19 HB2 TYR 3 HB2 TYR 3 -8.033 29.840 -4.355 20 HB3 TYR 3 HB1 TYR 3 -6.484 29.514 -5.119 21 HD1 TYR 3 HD1 TYR 3 -9.418 31.731 -5.112 22 HD2 TYR 3 HD2 TYR 3 -5.546 31.037 -6.716 23 HE1 TYR 3 HE1 TYR 3 -9.397 34.017 -6.021 24 HE2 TYR 3 HE2 TYR 3 -5.512 33.317 -7.634 25 HH TYR 3 HH TYR 3 -6.936 35.095 -8.226 26 H ILE 4 HN ILE 4 -9.886 27.037 -5.841 27 HA ILE 4 HA ILE 4 -10.087 24.985 -4.927 28 HB ILE 4 HB ILE 4 -7.266 24.576 -5.911 29 HG12 ILE 4 HG12 ILE 4 -9.903 24.050 -7.302 30 HG13 ILE 4 HG11 ILE 4 -8.800 25.367 -7.689 31 HG21 ILE 4 HG21 ILE 4 -7.889 22.198 -5.980 32 HG22 ILE 4 HG22 ILE 4 -9.456 22.596 -5.276 33 HG23 ILE 4 HG23 ILE 4 -7.980 22.854 -4.346 34 HD11 ILE 4 HD11 ILE 4 -8.183 22.434 -7.943 35 HD12 ILE 4 HD12 ILE 4 -7.105 23.766 -8.363 36 HD13 ILE 4 HD13 ILE 4 -8.601 23.526 -9.264 37 HA PRO 5 HA PRO 5 -7.886 26.058 -1.026 38 HB2 PRO 5 HB2 PRO 5 -10.504 25.726 0.205 39 HB3 PRO 5 HB1 PRO 5 -9.465 27.154 0.186 40 HG2 PRO 5 HG2 PRO 5 -11.814 27.031 -1.160 41 HG3 PRO 5 HG1 PRO 5 -10.433 27.995 -1.720 42 HD2 PRO 5 HD2 PRO 5 -11.354 25.288 -2.638 43 HD3 PRO 5 HD1 PRO 5 -10.784 26.672 -3.601 44 H GLY 6 HN GLY 6 -6.804 24.177 -0.689 45 HA2 GLY 6 HA2 GLY 6 -6.574 22.201 0.597 46 HA3 GLY 6 HA1 GLY 6 -8.322 21.967 0.506 47 H GLN 7 HN GLN 7 -5.918 22.555 -2.035 48 HA GLN 7 HA GLN 7 -6.982 20.670 -3.817 49 HB2 GLN 7 HB2 GLN 7 -4.789 20.951 -5.022 50 HB3 GLN 7 HB1 GLN 7 -5.655 22.444 -4.698 51 HG2 GLN 7 HG2 GLN 7 -4.181 23.008 -2.915 52 HG3 GLN 7 HG1 GLN 7 -3.424 21.418 -2.963 53 HE21 GLN 7 HE21 GLN 7 -1.986 20.933 -4.587 54 HE22 GLN 7 HE22 GLN 7 -1.253 22.156 -5.577 55 HA PRO 8 HA PRO 8 -5.370 16.862 -2.067 56 HB2 PRO 8 HB2 PRO 8 -6.058 15.832 -4.755 57 HB3 PRO 8 HB1 PRO 8 -6.609 15.282 -3.168 58 HG2 PRO 8 HG2 PRO 8 -8.246 16.617 -4.809 59 HG3 PRO 8 HG1 PRO 8 -8.289 16.867 -3.053 60 HD2 PRO 8 HD2 PRO 8 -7.052 18.579 -5.179 61 HD3 PRO 8 HD1 PRO 8 -7.974 19.058 -3.736 62 H VAL 9 HN VAL 9 -3.338 16.041 -2.128 63 HA VAL 9 HA VAL 9 -1.533 17.038 -4.174 64 HB VAL 9 HB VAL 9 -1.116 16.627 -1.560 65 HG11 VAL 9 HG11 VAL 9 -1.381 14.186 -1.686 66 HG12 VAL 9 HG12 VAL 9 0.230 14.651 -1.145 67 HG13 VAL 9 HG13 VAL 9 -0.014 14.105 -2.808 68 HG21 VAL 9 HG21 VAL 9 1.303 16.691 -2.038 69 HG22 VAL 9 HG22 VAL 9 0.375 17.839 -3.002 70 HG23 VAL 9 HG23 VAL 9 0.948 16.340 -3.731 71 H THR 10 HN THR 10 0.190 15.365 -4.824 72 HA THR 10 HA THR 10 -1.278 13.371 -6.321 73 HB THR 10 HB THR 10 0.667 13.392 -7.824 74 HG1 THR 10 HG1 THR 10 2.247 15.096 -7.427 75 HG21 THR 10 HG21 THR 10 0.365 15.777 -8.574 76 HG22 THR 10 HG22 THR 10 -0.588 16.048 -7.104 77 HG23 THR 10 HG23 THR 10 -1.137 14.889 -8.323 78 H ALA 11 HN ALA 11 1.923 12.848 -6.299 79 HA ALA 11 HA ALA 11 2.287 11.071 -4.137 80 HB1 ALA 11 HB1 ALA 11 0.644 9.691 -5.328 81 HB2 ALA 11 HB2 ALA 11 2.247 8.947 -5.335 82 HB3 ALA 11 HB3 ALA 11 1.649 9.762 -6.778 83 H VAL 12 HN VAL 12 4.267 10.490 -3.937 84 HA VAL 12 HA VAL 12 6.214 11.070 -6.036 85 HB VAL 12 HB VAL 12 6.706 9.961 -3.318 86 HG11 VAL 12 HG11 VAL 12 8.561 9.728 -4.798 87 HG12 VAL 12 HG12 VAL 12 8.946 10.944 -3.582 88 HG13 VAL 12 HG13 VAL 12 8.493 11.440 -5.214 89 HG21 VAL 12 HG21 VAL 12 6.327 12.826 -4.076 90 HG22 VAL 12 HG22 VAL 12 7.316 12.372 -2.691 91 HG23 VAL 12 HG23 VAL 12 5.607 11.924 -2.732 92 H VAL 13 HN VAL 13 7.320 9.449 -6.975 93 HA VAL 13 HA VAL 13 6.305 6.729 -6.582 94 HB VAL 13 HB VAL 13 7.818 7.840 -8.952 95 HG11 VAL 13 HG11 VAL 13 7.122 5.768 -10.078 96 HG12 VAL 13 HG12 VAL 13 6.420 5.197 -8.565 97 HG13 VAL 13 HG13 VAL 13 8.160 5.453 -8.687 98 HG21 VAL 13 HG21 VAL 13 5.667 7.724 -10.137 99 HG22 VAL 13 HG22 VAL 13 5.620 8.862 -8.791 100 HG23 VAL 13 HG23 VAL 13 4.873 7.273 -8.628 101 H GLN 14 HN GLN 14 7.578 5.255 -5.699 102 HA GLN 14 HA GLN 14 10.477 5.566 -5.878 103 HB2 GLN 14 HB2 GLN 14 8.876 5.083 -3.373 104 HB3 GLN 14 HB1 GLN 14 10.551 4.571 -3.500 105 HG2 GLN 14 HG2 GLN 14 11.016 6.585 -2.673 106 HG3 GLN 14 HG1 GLN 14 10.709 7.159 -4.311 107 HE21 GLN 14 HE21 GLN 14 7.831 6.550 -4.041 108 HE22 GLN 14 HE22 GLN 14 7.189 7.843 -3.077 109 H ARG 15 HN ARG 15 11.602 3.733 -6.022 110 HA ARG 15 HA ARG 15 10.169 1.235 -6.380 111 HB2 ARG 15 HB2 ARG 15 12.830 2.277 -7.358 112 HB3 ARG 15 HB1 ARG 15 12.277 0.640 -7.592 113 HG2 ARG 15 HG2 ARG 15 10.229 2.366 -8.497 114 HG3 ARG 15 HG1 ARG 15 11.767 2.910 -9.182 115 HD2 ARG 15 HD2 ARG 15 10.513 0.193 -9.390 116 HD3 ARG 15 HD1 ARG 15 10.913 1.307 -10.699 117 HE ARG 15 HE ARG 15 13.049 0.141 -9.034 118 HH11 ARG 15 HH11 ARG 15 11.567 0.579 -12.200 119 HH12 ARG 15 HH12 ARG 15 12.886 -0.184 -13.043 120 HH21 ARG 15 HH21 ARG 15 14.737 -0.872 -10.134 121 HH22 ARG 15 HH22 ARG 15 14.696 -1.006 -11.870 122 H VAL 16 HN VAL 16 10.432 -0.183 -4.749 123 HA VAL 16 HA VAL 16 12.928 -0.060 -3.286 124 HB VAL 16 HB VAL 16 11.656 1.325 -1.898 125 HG11 VAL 16 HG11 VAL 16 9.427 0.816 -1.066 126 HG12 VAL 16 HG12 VAL 16 9.417 -0.669 -2.016 127 HG13 VAL 16 HG13 VAL 16 9.453 0.897 -2.829 128 HG21 VAL 16 HG21 VAL 16 11.437 -1.428 -0.710 129 HG22 VAL 16 HG22 VAL 16 11.394 0.093 0.191 130 HG23 VAL 16 HG23 VAL 16 12.862 -0.393 -0.663 131 H GLU 17 HN GLU 17 13.713 -2.010 -2.896 132 HA GLU 17 HA GLU 17 11.963 -4.335 -3.193 133 HB2 GLU 17 HB2 GLU 17 14.972 -4.086 -3.373 134 HB3 GLU 17 HB1 GLU 17 14.135 -5.632 -3.322 135 HG2 GLU 17 HG2 GLU 17 14.572 -5.254 -5.577 136 HG3 GLU 17 HG1 GLU 17 12.869 -4.844 -5.374 137 H ILE 18 HN ILE 18 11.183 -4.927 -1.354 138 HA ILE 18 HA ILE 18 12.589 -4.726 1.149 139 HB ILE 18 HB ILE 18 9.812 -5.686 0.426 140 HG12 ILE 18 HG12 ILE 18 10.467 -3.132 1.850 141 HG13 ILE 18 HG11 ILE 18 10.353 -3.223 0.090 142 HG21 ILE 18 HG21 ILE 18 10.981 -5.102 3.142 143 HG22 ILE 18 HG22 ILE 18 10.630 -6.701 2.487 144 HG23 ILE 18 HG23 ILE 18 9.315 -5.570 2.800 145 HD11 ILE 18 HD11 ILE 18 8.237 -2.538 0.896 146 HD12 ILE 18 HD12 ILE 18 8.221 -3.831 2.099 147 HD13 ILE 18 HD13 ILE 18 8.101 -4.227 0.382 148 H HIS 19 HN HIS 19 12.955 -6.648 2.342 149 HA HIS 19 HA HIS 19 12.806 -9.114 0.865 150 HB2 HIS 19 HB2 HIS 19 14.875 -8.148 0.123 151 HB3 HIS 19 HB1 HIS 19 15.358 -7.830 1.768 152 HD1 HIS 19 HD1 HIS 19 17.559 -9.278 0.995 153 HD2 HIS 19 HD2 HIS 19 13.955 -11.287 1.408 154 HE1 HIS 19 HE1 HIS 19 18.156 -11.720 1.089 155 HE2 HIS 19 HE2 HIS 19 15.946 -12.923 1.126 156 H LYS 20 HN LYS 20 11.673 -10.260 2.266 157 HA LYS 20 HA LYS 20 13.204 -11.134 4.617 158 HB2 LYS 20 HB2 LYS 20 10.270 -10.631 4.390 159 HB3 LYS 20 HB1 LYS 20 10.820 -11.972 5.387 160 HG2 LYS 20 HG2 LYS 20 11.608 -9.080 5.716 161 HG3 LYS 20 HG1 LYS 20 10.452 -9.968 6.710 162 HD2 LYS 20 HD2 LYS 20 12.266 -11.528 7.353 163 HD3 LYS 20 HD1 LYS 20 13.400 -10.535 6.435 164 HE2 LYS 20 HE2 LYS 20 13.591 -9.890 8.712 165 HE3 LYS 20 HE1 LYS 20 12.733 -8.599 7.875 166 HZ1 LYS 20 HZ1 LYS 20 11.577 -8.943 9.872 167 HZ2 LYS 20 HZ2 LYS 20 11.634 -10.630 9.732 168 HZ3 LYS 20 HZ3 LYS 20 10.636 -9.728 8.703 169 H LEU 21 HN LEU 21 11.379 -13.539 4.878 170 HA LEU 21 HA LEU 21 11.910 -14.845 2.359 171 HB2 LEU 21 HB2 LEU 21 14.127 -14.871 3.261 172 HB3 LEU 21 HB1 LEU 21 13.549 -15.452 4.816 173 HG LEU 21 HG LEU 21 13.028 -17.616 3.877 174 HD11 LEU 21 HD11 LEU 21 13.603 -18.151 1.535 175 HD12 LEU 21 HD12 LEU 21 13.869 -16.432 1.240 176 HD13 LEU 21 HD13 LEU 21 12.260 -17.016 1.684 177 HD21 LEU 21 HD21 LEU 21 15.313 -17.235 4.623 178 HD22 LEU 21 HD22 LEU 21 15.753 -16.682 3.008 179 HD23 LEU 21 HD23 LEU 21 15.268 -18.358 3.264 180 H ARG 22 HN ARG 22 10.546 -16.477 2.040 181 HA ARG 22 HA ARG 22 8.867 -17.467 4.099 182 HB2 ARG 22 HB2 ARG 22 7.695 -18.274 2.376 183 HB3 ARG 22 HB1 ARG 22 8.831 -17.457 1.325 184 HG2 ARG 22 HG2 ARG 22 8.891 -19.548 0.431 185 HG3 ARG 22 HG1 ARG 22 10.168 -19.698 1.648 186 HD2 ARG 22 HD2 ARG 22 8.716 -20.741 3.171 187 HD3 ARG 22 HD1 ARG 22 7.303 -20.430 2.159 188 HE ARG 22 HE ARG 22 9.479 -22.175 1.197 189 HH11 ARG 22 HH11 ARG 22 6.131 -21.735 2.154 190 HH12 ARG 22 HH12 ARG 22 5.605 -23.243 1.472 191 HH21 ARG 22 HH21 ARG 22 8.808 -24.153 0.347 192 HH22 ARG 22 HH22 ARG 22 7.138 -24.628 0.440 193 H GLN 23 HN GLN 23 9.076 -19.325 5.261 194 HA GLN 23 HA GLN 23 11.539 -20.839 4.981 195 HB2 GLN 23 HB2 GLN 23 10.572 -20.374 7.725 196 HB3 GLN 23 HB1 GLN 23 12.207 -20.411 7.093 197 HG2 GLN 23 HG2 GLN 23 11.844 -18.165 6.134 198 HG3 GLN 23 HG1 GLN 23 10.269 -18.134 6.924 199 HE21 GLN 23 HE21 GLN 23 12.562 -16.387 7.238 200 HE22 GLN 23 HE22 GLN 23 12.986 -16.442 8.922 201 H GLY 24 HN GLY 24 9.552 -21.864 3.869 202 HA2 GLY 24 HA2 GLY 24 8.571 -23.951 3.733 203 HA3 GLY 24 HA1 GLY 24 9.187 -24.275 5.349 204 H GLU 25 HN GLU 25 7.938 -23.984 7.082 205 HA GLU 25 HA GLU 25 5.110 -23.804 6.779 206 HB2 GLU 25 HB2 GLU 25 6.993 -23.809 9.123 207 HB3 GLU 25 HB1 GLU 25 5.274 -23.535 9.333 208 HG2 GLU 25 HG2 GLU 25 4.778 -25.713 8.408 209 HG3 GLU 25 HG1 GLU 25 6.486 -25.967 8.049 210 H ASN 26 HN ASN 26 7.511 -21.540 6.669 211 HA ASN 26 HA ASN 26 5.907 -19.491 7.923 212 HB2 ASN 26 HB2 ASN 26 8.881 -19.706 7.594 213 HB3 ASN 26 HB1 ASN 26 8.047 -18.276 8.150 214 HD21 ASN 26 HD21 ASN 26 8.958 -21.441 8.804 215 HD22 ASN 26 HD22 ASN 26 8.707 -21.429 10.526 216 H LEU 27 HN LEU 27 5.577 -17.853 6.941 217 HA LEU 27 HA LEU 27 6.886 -17.137 4.435 218 HB2 LEU 27 HB2 LEU 27 3.993 -17.063 5.218 219 HB3 LEU 27 HB1 LEU 27 4.621 -15.818 4.173 220 HG LEU 27 HG LEU 27 3.521 -17.582 2.896 221 HD11 LEU 27 HD11 LEU 27 6.500 -17.601 2.466 222 HD12 LEU 27 HD12 LEU 27 5.390 -16.347 1.910 223 HD13 LEU 27 HD13 LEU 27 5.255 -17.987 1.277 224 HD21 LEU 27 HD21 LEU 27 3.827 -19.477 4.318 225 HD22 LEU 27 HD22 LEU 27 5.583 -19.382 4.170 226 HD23 LEU 27 HD23 LEU 27 4.598 -19.833 2.771 227 H ILE 28 HN ILE 28 8.245 -15.585 5.099 228 HA ILE 28 HA ILE 28 7.334 -13.784 7.214 229 HB ILE 28 HB ILE 28 10.160 -14.278 6.344 230 HG12 ILE 28 HG12 ILE 28 9.103 -16.399 7.049 231 HG13 ILE 28 HG11 ILE 28 10.410 -15.897 8.103 232 HG21 ILE 28 HG21 ILE 28 8.946 -13.077 8.802 233 HG22 ILE 28 HG22 ILE 28 9.898 -12.270 7.553 234 HG23 ILE 28 HG23 ILE 28 10.659 -13.450 8.619 235 HD11 ILE 28 HD11 ILE 28 8.518 -16.842 9.327 236 HD12 ILE 28 HD12 ILE 28 7.471 -15.575 8.676 237 HD13 ILE 28 HD13 ILE 28 8.797 -15.152 9.761 238 H LEU 29 HN LEU 29 6.757 -11.857 6.475 239 HA LEU 29 HA LEU 29 8.833 -10.396 5.047 240 HB2 LEU 29 HB2 LEU 29 7.102 -10.999 3.397 241 HB3 LEU 29 HB1 LEU 29 5.891 -10.215 4.390 242 HG LEU 29 HG LEU 29 7.037 -8.056 4.040 243 HD11 LEU 29 HD11 LEU 29 8.785 -9.663 2.178 244 HD12 LEU 29 HD12 LEU 29 9.298 -8.887 3.677 245 HD13 LEU 29 HD13 LEU 29 8.772 -7.904 2.309 246 HD21 LEU 29 HD21 LEU 29 5.189 -8.760 2.629 247 HD22 LEU 29 HD22 LEU 29 6.315 -9.573 1.539 248 HD23 LEU 29 HD23 LEU 29 6.360 -7.817 1.702 249 H GLY 30 HN GLY 30 5.586 -9.926 6.551 250 HA2 GLY 30 HA2 GLY 30 5.576 -9.630 8.932 251 HA3 GLY 30 HA1 GLY 30 7.102 -8.782 8.804 252 H PHE 31 HN PHE 31 5.577 -7.350 6.354 253 HA PHE 31 HA PHE 31 4.755 -5.273 8.244 254 HB2 PHE 31 HB2 PHE 31 5.150 -3.619 6.614 255 HB3 PHE 31 HB1 PHE 31 6.530 -4.694 6.633 256 HD1 PHE 31 HD1 PHE 31 3.622 -3.559 4.745 257 HD2 PHE 31 HD2 PHE 31 7.156 -5.908 4.697 258 HE1 PHE 31 HE1 PHE 31 3.505 -3.629 2.319 259 HE2 PHE 31 HE2 PHE 31 7.064 -6.007 2.251 260 HZ PHE 31 HZ PHE 31 5.230 -4.868 1.035 261 H SER 32 HN SER 32 2.923 -3.763 7.357 262 HA SER 32 HA SER 32 0.732 -5.695 6.933 263 HB2 SER 32 HB2 SER 32 1.077 -4.731 9.283 264 HB3 SER 32 HB1 SER 32 0.539 -3.192 8.612 265 HG SER 32 HG SER 32 -1.037 -5.449 8.139 266 H ILE 33 HN ILE 33 -0.889 -5.144 5.492 267 HA ILE 33 HA ILE 33 -0.491 -2.578 4.123 268 HB ILE 33 HB ILE 33 -0.745 -3.577 1.969 269 HG12 ILE 33 HG12 ILE 33 -0.776 -6.321 3.227 270 HG13 ILE 33 HG11 ILE 33 -2.256 -5.445 2.860 271 HG21 ILE 33 HG21 ILE 33 1.312 -5.058 3.594 272 HG22 ILE 33 HG22 ILE 33 1.518 -3.499 2.793 273 HG23 ILE 33 HG23 ILE 33 1.294 -4.962 1.831 274 HD11 ILE 33 HD11 ILE 33 -1.613 -5.382 0.492 275 HD12 ILE 33 HD12 ILE 33 -1.752 -7.031 1.107 276 HD13 ILE 33 HD13 ILE 33 -0.160 -6.305 0.880 277 H GLY 34 HN GLY 34 -2.310 -1.819 3.009 278 HA2 GLY 34 HA2 GLY 34 -4.797 -3.029 4.008 279 HA3 GLY 34 HA1 GLY 34 -4.622 -1.338 3.519 280 H GLY 35 HN GLY 35 -5.973 -4.154 2.604 281 HA2 GLY 35 HA2 GLY 35 -5.548 -3.639 -0.273 282 HA3 GLY 35 HA1 GLY 35 -6.173 -5.146 0.397 283 H GLY 36 HN GLY 36 -6.983 -2.149 -0.948 284 HA2 GLY 36 HA2 GLY 36 -9.794 -2.639 -0.476 285 HA3 GLY 36 HA1 GLY 36 -9.156 -1.220 0.341 286 H ILE 37 HN ILE 37 -9.150 -2.742 -2.830 287 HA ILE 37 HA ILE 37 -9.323 -0.109 -4.070 288 HB ILE 37 HB ILE 37 -9.094 -1.607 -6.203 289 HG12 ILE 37 HG12 ILE 37 -8.112 -3.436 -3.998 290 HG13 ILE 37 HG11 ILE 37 -9.424 -3.754 -5.122 291 HG21 ILE 37 HG21 ILE 37 -6.808 -1.204 -4.281 292 HG22 ILE 37 HG22 ILE 37 -7.413 -0.020 -5.439 293 HG23 ILE 37 HG23 ILE 37 -6.655 -1.507 -6.010 294 HD11 ILE 37 HD11 ILE 37 -7.461 -4.988 -5.726 295 HD12 ILE 37 HD12 ILE 37 -6.517 -3.501 -5.786 296 HD13 ILE 37 HD13 ILE 37 -7.809 -3.770 -6.956 297 H ASP 38 HN ASP 38 -10.674 -3.234 -5.010 298 HA ASP 38 HA ASP 38 -13.268 -1.891 -5.427 299 HB2 ASP 38 HB2 ASP 38 -12.028 -2.616 -7.499 300 HB3 ASP 38 HB1 ASP 38 -12.166 -4.275 -6.936 301 H GLN 39 HN GLN 39 -11.863 -3.461 -3.250 302 HA GLN 39 HA GLN 39 -13.173 -5.941 -2.895 303 HB2 GLN 39 HB2 GLN 39 -12.157 -4.249 -0.639 304 HB3 GLN 39 HB1 GLN 39 -12.192 -6.001 -0.760 305 HG2 GLN 39 HG2 GLN 39 -10.458 -4.208 -2.426 306 HG3 GLN 39 HG1 GLN 39 -9.933 -5.029 -0.965 307 HE21 GLN 39 HE21 GLN 39 -8.845 -5.318 -3.615 308 HE22 GLN 39 HE22 GLN 39 -9.038 -6.980 -4.053 309 H ASP 40 HN ASP 40 -13.506 -3.086 -0.931 310 HA ASP 40 HA ASP 40 -16.336 -3.423 -0.630 311 HB2 ASP 40 HB2 ASP 40 -14.351 -3.574 1.622 312 HB3 ASP 40 HB1 ASP 40 -16.028 -3.178 1.841 313 HA PRO 41 HA PRO 41 -14.295 1.027 0.787 314 HB2 PRO 41 HB2 PRO 41 -12.185 1.253 -1.023 315 HB3 PRO 41 HB1 PRO 41 -12.012 0.974 0.716 316 HG2 PRO 41 HG2 PRO 41 -12.157 -1.039 -1.506 317 HG3 PRO 41 HG1 PRO 41 -10.986 -0.934 -0.195 318 HD2 PRO 41 HD2 PRO 41 -12.874 -2.661 0.081 319 HD3 PRO 41 HD1 PRO 41 -12.643 -1.516 1.434 320 H SER 42 HN SER 42 -14.704 -0.841 -1.958 321 HA SER 42 HA SER 42 -15.504 0.789 -3.992 322 HB2 SER 42 HB2 SER 42 -15.653 -1.646 -4.030 323 HB3 SER 42 HB1 SER 42 -16.895 -1.608 -2.782 324 HG SER 42 HG SER 42 -17.464 -0.116 -5.051 325 H GLN 43 HN GLN 43 -16.912 0.490 -0.753 326 HA GLN 43 HA GLN 43 -19.384 1.772 -1.434 327 HB2 GLN 43 HB2 GLN 43 -19.891 1.414 0.776 328 HB3 GLN 43 HB1 GLN 43 -18.695 0.174 0.497 329 HG2 GLN 43 HG2 GLN 43 -18.113 2.827 1.755 330 HG3 GLN 43 HG1 GLN 43 -18.491 1.367 2.636 331 HE21 GLN 43 HE21 GLN 43 -17.034 -0.369 2.576 332 HE22 GLN 43 HE22 GLN 43 -15.371 -0.088 2.197 333 H ASN 44 HN ASN 44 -16.243 2.818 -0.787 334 HA ASN 44 HA ASN 44 -16.871 5.495 0.083 335 HB2 ASN 44 HB2 ASN 44 -14.811 4.094 0.769 336 HB3 ASN 44 HB1 ASN 44 -14.155 4.585 -0.798 337 HD21 ASN 44 HD21 ASN 44 -16.227 6.492 1.329 338 HD22 ASN 44 HD22 ASN 44 -15.042 7.712 1.678 339 HA PRO 45 HA PRO 45 -17.194 6.950 -4.149 340 HB2 PRO 45 HB2 PRO 45 -18.217 9.360 -3.405 341 HB3 PRO 45 HB1 PRO 45 -19.204 7.895 -3.552 342 HG2 PRO 45 HG2 PRO 45 -18.044 9.161 -1.095 343 HG3 PRO 45 HG1 PRO 45 -19.652 8.455 -1.341 344 HD2 PRO 45 HD2 PRO 45 -17.645 7.121 -0.085 345 HD3 PRO 45 HD1 PRO 45 -18.886 6.293 -1.042 346 H PHE 46 HN PHE 46 -15.368 7.881 -1.455 347 HA PHE 46 HA PHE 46 -13.957 10.032 -2.767 348 HB2 PHE 46 HB2 PHE 46 -13.619 8.659 -0.103 349 HB3 PHE 46 HB1 PHE 46 -12.455 9.841 -0.706 350 HD1 PHE 46 HD1 PHE 46 -15.903 9.334 0.449 351 HD2 PHE 46 HD2 PHE 46 -12.975 12.179 -0.744 352 HE1 PHE 46 HE1 PHE 46 -17.311 11.149 1.337 353 HE2 PHE 46 HE2 PHE 46 -14.369 14.000 0.142 354 HZ PHE 46 HZ PHE 46 -16.552 13.499 1.137 355 H SER 47 HN SER 47 -13.683 6.578 -2.400 356 HA SER 47 HA SER 47 -11.143 6.705 -3.836 357 HB2 SER 47 HB2 SER 47 -11.260 4.183 -3.600 358 HB3 SER 47 HB1 SER 47 -11.069 5.089 -2.099 359 HG SER 47 HG SER 47 -13.213 3.587 -3.011 360 H GLU 48 HN GLU 48 -11.510 4.343 -5.356 361 HA GLU 48 HA GLU 48 -11.982 3.897 -7.537 362 HB2 GLU 48 HB2 GLU 48 -14.484 4.290 -6.198 363 HB3 GLU 48 HB1 GLU 48 -14.624 4.941 -7.822 364 HG2 GLU 48 HG2 GLU 48 -13.567 2.186 -7.285 365 HG3 GLU 48 HG1 GLU 48 -15.284 2.521 -7.483 366 H ASP 49 HN ASP 49 -11.310 6.723 -6.523 367 HA ASP 49 HA ASP 49 -11.589 8.099 -9.088 368 HB2 ASP 49 HB2 ASP 49 -13.360 9.101 -7.849 369 HB3 ASP 49 HB1 ASP 49 -12.392 9.160 -6.380 370 H LYS 50 HN LYS 50 -9.683 8.642 -9.739 371 HA LYS 50 HA LYS 50 -7.478 9.086 -9.850 372 HB2 LYS 50 HB2 LYS 50 -7.849 10.631 -7.306 373 HB3 LYS 50 HB1 LYS 50 -6.605 10.845 -8.526 374 HG2 LYS 50 HG2 LYS 50 -9.546 11.442 -8.815 375 HG3 LYS 50 HG1 LYS 50 -8.226 12.611 -8.738 376 HD2 LYS 50 HD2 LYS 50 -7.334 11.753 -10.843 377 HD3 LYS 50 HD1 LYS 50 -8.627 10.549 -10.908 378 HE2 LYS 50 HE2 LYS 50 -9.005 13.547 -10.926 379 HE3 LYS 50 HE1 LYS 50 -9.089 12.500 -12.339 380 HZ1 LYS 50 HZ1 LYS 50 -11.257 13.174 -11.206 381 HZ2 LYS 50 HZ2 LYS 50 -10.849 12.045 -10.006 382 HZ3 LYS 50 HZ3 LYS 50 -11.060 11.543 -11.612 383 H THR 51 HN THR 51 -6.845 7.023 -9.494 384 HA THR 51 HA THR 51 -5.201 5.701 -8.819 385 HB THR 51 HB THR 51 -3.610 6.181 -7.075 386 HG1 THR 51 HG1 THR 51 -5.471 8.167 -6.289 387 HG21 THR 51 HG21 THR 51 -2.817 8.402 -7.816 388 HG22 THR 51 HG22 THR 51 -4.353 8.633 -8.654 389 HG23 THR 51 HG23 THR 51 -3.263 7.341 -9.152 390 H ASP 52 HN ASP 52 -7.828 6.520 -6.897 391 HA ASP 52 HA ASP 52 -9.257 5.330 -5.646 392 HB2 ASP 52 HB2 ASP 52 -8.845 3.583 -7.287 393 HB3 ASP 52 HB1 ASP 52 -7.478 3.035 -6.345 394 H LYS 53 HN LYS 53 -5.885 4.818 -5.034 395 HA LYS 53 HA LYS 53 -4.613 4.859 -3.160 396 HB2 LYS 53 HB2 LYS 53 -7.083 5.626 -1.586 397 HB3 LYS 53 HB1 LYS 53 -5.408 5.854 -1.112 398 HG2 LYS 53 HG2 LYS 53 -5.808 7.972 -1.783 399 HG3 LYS 53 HG1 LYS 53 -5.452 7.313 -3.380 400 HD2 LYS 53 HD2 LYS 53 -7.851 6.933 -3.752 401 HD3 LYS 53 HD1 LYS 53 -8.197 7.603 -2.161 402 HE2 LYS 53 HE2 LYS 53 -7.232 9.753 -2.880 403 HE3 LYS 53 HE1 LYS 53 -6.958 9.073 -4.485 404 HZ1 LYS 53 HZ1 LYS 53 -9.289 8.848 -4.824 405 HZ2 LYS 53 HZ2 LYS 53 -9.031 10.422 -4.258 406 HZ3 LYS 53 HZ3 LYS 53 -9.637 9.236 -3.213 407 H GLY 54 HN GLY 54 -6.555 2.684 -4.038 408 HA2 GLY 54 HA2 GLY 54 -7.512 1.262 -1.849 409 HA3 GLY 54 HA1 GLY 54 -7.234 0.602 -3.452 410 H ILE 55 HN ILE 55 -4.543 0.568 -3.730 411 HA ILE 55 HA ILE 55 -3.822 -1.425 -1.708 412 HB ILE 55 HB ILE 55 -2.491 -0.820 -4.357 413 HG12 ILE 55 HG12 ILE 55 -4.741 -1.767 -4.633 414 HG13 ILE 55 HG11 ILE 55 -3.506 -2.920 -5.128 415 HG21 ILE 55 HG21 ILE 55 -2.005 -3.048 -2.375 416 HG22 ILE 55 HG22 ILE 55 -0.892 -1.748 -2.808 417 HG23 ILE 55 HG23 ILE 55 -1.318 -2.977 -3.999 418 HD11 ILE 55 HD11 ILE 55 -4.983 -2.937 -2.503 419 HD12 ILE 55 HD12 ILE 55 -3.742 -4.091 -2.995 420 HD13 ILE 55 HD13 ILE 55 -5.274 -4.012 -3.867 421 H TYR 56 HN TYR 56 -2.765 -0.617 -0.014 422 HA TYR 56 HA TYR 56 -0.356 0.945 -0.442 423 HB2 TYR 56 HB2 TYR 56 -1.005 2.831 0.902 424 HB3 TYR 56 HB1 TYR 56 -2.218 2.634 -0.360 425 HD1 TYR 56 HD2 TYR 56 -4.313 1.242 0.298 426 HD2 TYR 56 HD1 TYR 56 -1.687 3.054 3.103 427 HE1 TYR 56 HE2 TYR 56 -6.101 1.188 1.989 428 HE2 TYR 56 HE1 TYR 56 -3.463 3.009 4.810 429 HH TYR 56 HH TYR 56 -5.863 2.898 4.955 430 H VAL 57 HN VAL 57 0.969 1.067 1.470 431 HA VAL 57 HA VAL 57 0.580 -1.036 3.353 432 HB VAL 57 HB VAL 57 2.750 0.072 2.312 433 HG11 VAL 57 HG11 VAL 57 3.886 1.338 4.206 434 HG12 VAL 57 HG12 VAL 57 2.243 1.688 4.747 435 HG13 VAL 57 HG13 VAL 57 2.776 2.203 3.149 436 HG21 VAL 57 HG21 VAL 57 2.748 -0.868 5.133 437 HG22 VAL 57 HG22 VAL 57 4.039 -1.029 3.941 438 HG23 VAL 57 HG23 VAL 57 2.539 -1.936 3.741 439 H THR 58 HN THR 58 0.061 -0.839 5.508 440 HA THR 58 HA THR 58 -0.837 1.853 6.316 441 HB THR 58 HB THR 58 -2.729 0.274 6.061 442 HG1 THR 58 HG1 THR 58 -3.519 1.416 7.645 443 HG21 THR 58 HG21 THR 58 -1.544 -1.807 6.601 444 HG22 THR 58 HG22 THR 58 -2.995 -1.609 7.584 445 HG23 THR 58 HG23 THR 58 -1.405 -1.282 8.277 446 H ARG 59 HN ARG 59 1.365 -0.599 6.728 447 HA ARG 59 HA ARG 59 2.814 0.717 8.713 448 HB2 ARG 59 HB2 ARG 59 1.509 0.071 10.491 449 HB3 ARG 59 HB1 ARG 59 0.880 -1.298 9.612 450 HG2 ARG 59 HG2 ARG 59 2.895 -2.511 9.957 451 HG3 ARG 59 HG1 ARG 59 3.557 -1.169 10.906 452 HD2 ARG 59 HD2 ARG 59 2.653 -2.876 12.391 453 HD3 ARG 59 HD1 ARG 59 1.697 -1.399 12.495 454 HE ARG 59 HE ARG 59 0.708 -3.374 10.636 455 HH11 ARG 59 HH11 ARG 59 0.528 -2.069 13.883 456 HH12 ARG 59 HH12 ARG 59 -1.040 -2.759 14.202 457 HH21 ARG 59 HH21 ARG 59 -1.357 -4.248 11.049 458 HH22 ARG 59 HH22 ARG 59 -2.106 -3.996 12.598 459 H VAL 60 HN VAL 60 4.697 -0.693 9.346 460 HA VAL 60 HA VAL 60 5.123 -2.826 7.438 461 HB VAL 60 HB VAL 60 7.080 -2.072 6.658 462 HG11 VAL 60 HG11 VAL 60 7.104 0.326 6.219 463 HG12 VAL 60 HG12 VAL 60 5.848 0.537 7.438 464 HG13 VAL 60 HG13 VAL 60 5.515 -0.399 5.983 465 HG21 VAL 60 HG21 VAL 60 8.144 -2.031 8.882 466 HG22 VAL 60 HG22 VAL 60 7.633 -0.347 9.047 467 HG23 VAL 60 HG23 VAL 60 8.762 -0.813 7.766 468 H SER 61 HN SER 61 6.934 -4.230 8.110 469 HA SER 61 HA SER 61 6.969 -4.745 10.910 470 HB2 SER 61 HB2 SER 61 9.089 -6.139 9.980 471 HB3 SER 61 HB1 SER 61 7.428 -6.715 9.909 472 HG SER 61 HG SER 61 7.966 -6.865 7.832 473 H GLU 62 HN GLU 62 7.833 -3.283 12.126 474 HA GLU 62 HA GLU 62 9.663 -1.413 11.106 475 HB2 GLU 62 HB2 GLU 62 8.208 -1.760 13.677 476 HB3 GLU 62 HB1 GLU 62 9.382 -0.510 13.443 477 HG2 GLU 62 HG2 GLU 62 8.113 0.645 11.952 478 HG3 GLU 62 HG1 GLU 62 7.228 -0.791 11.444 479 H GLY 63 HN GLY 63 11.553 -1.021 11.740 480 HA2 GLY 63 HA2 GLY 63 13.760 -1.570 12.155 481 HA3 GLY 63 HA1 GLY 63 13.170 -2.525 13.525 482 H GLY 64 HN GLY 64 12.138 -2.992 10.192 483 HA2 GLY 64 HA2 GLY 64 13.373 -5.656 10.353 484 HA3 GLY 64 HA1 GLY 64 11.729 -5.388 9.783 485 HA PRO 65 HA PRO 65 13.918 -5.389 5.925 486 HB2 PRO 65 HB2 PRO 65 11.906 -6.384 4.527 487 HB3 PRO 65 HB1 PRO 65 12.833 -7.379 5.645 488 HG2 PRO 65 HG2 PRO 65 10.078 -6.369 5.875 489 HG3 PRO 65 HG1 PRO 65 10.834 -7.756 6.671 490 HD2 PRO 65 HD2 PRO 65 10.393 -5.125 7.738 491 HD3 PRO 65 HD1 PRO 65 11.152 -6.526 8.533 492 H ALA 66 HN ALA 66 10.671 -4.032 6.364 493 HA ALA 66 HA ALA 66 10.421 -3.268 3.619 494 HB1 ALA 66 HB1 ALA 66 8.503 -1.863 4.566 495 HB2 ALA 66 HB2 ALA 66 8.872 -2.635 6.110 496 HB3 ALA 66 HB3 ALA 66 8.392 -3.615 4.724 497 H GLU 67 HN GLU 67 11.553 -1.768 6.527 498 HA GLU 67 HA GLU 67 11.134 0.885 5.424 499 HB2 GLU 67 HB2 GLU 67 12.043 1.448 7.750 500 HB3 GLU 67 HB1 GLU 67 10.433 0.733 7.632 501 HG2 GLU 67 HG2 GLU 67 11.086 -1.219 8.548 502 HG3 GLU 67 HG1 GLU 67 12.672 -1.119 7.803 503 H ILE 68 HN ILE 68 13.557 -1.491 6.016 504 HA ILE 68 HA ILE 68 15.680 0.360 5.920 505 HB ILE 68 HB ILE 68 17.074 -1.574 5.775 506 HG12 ILE 68 HG12 ILE 68 14.600 -3.212 6.130 507 HG13 ILE 68 HG11 ILE 68 15.452 -3.027 4.597 508 HG21 ILE 68 HG21 ILE 68 15.062 -1.544 7.983 509 HG22 ILE 68 HG22 ILE 68 16.580 -0.649 7.922 510 HG23 ILE 68 HG23 ILE 68 16.599 -2.407 8.069 511 HD11 ILE 68 HD11 ILE 68 17.450 -3.983 5.623 512 HD12 ILE 68 HD12 ILE 68 16.078 -5.093 5.657 513 HD13 ILE 68 HD13 ILE 68 16.553 -4.220 7.117 514 H ALA 69 HN ALA 69 13.893 -1.705 3.964 515 HA ALA 69 HA ALA 69 15.419 -1.523 1.595 516 HB1 ALA 69 HB1 ALA 69 12.455 -1.944 1.949 517 HB2 ALA 69 HB2 ALA 69 13.678 -3.209 1.835 518 HB3 ALA 69 HB3 ALA 69 13.339 -2.180 0.442 519 H GLY 70 HN GLY 70 13.196 0.412 3.317 520 HA2 GLY 70 HA2 GLY 70 13.412 2.847 3.022 521 HA3 GLY 70 HA1 GLY 70 13.518 2.558 1.283 522 H LEU 71 HN LEU 71 11.274 1.256 3.715 523 HA LEU 71 HA LEU 71 9.059 2.506 2.279 524 HB2 LEU 71 HB2 LEU 71 9.339 -0.031 2.065 525 HB3 LEU 71 HB1 LEU 71 9.042 -0.104 3.793 526 HG LEU 71 HG LEU 71 6.858 1.216 3.160 527 HD11 LEU 71 HD11 LEU 71 7.414 1.436 0.781 528 HD12 LEU 71 HD12 LEU 71 5.941 0.497 1.025 529 HD13 LEU 71 HD13 LEU 71 7.455 -0.322 0.631 530 HD21 LEU 71 HD21 LEU 71 5.755 -1.015 2.926 531 HD22 LEU 71 HD22 LEU 71 6.857 -0.855 4.295 532 HD23 LEU 71 HD23 LEU 71 7.373 -1.716 2.847 533 H GLN 72 HN GLN 72 7.182 2.649 3.835 534 HA GLN 72 HA GLN 72 7.666 2.772 6.559 535 HB2 GLN 72 HB2 GLN 72 7.505 5.278 6.799 536 HB3 GLN 72 HB1 GLN 72 8.999 4.618 6.197 537 HG2 GLN 72 HG2 GLN 72 8.424 6.683 5.098 538 HG3 GLN 72 HG1 GLN 72 8.539 5.324 3.980 539 HE21 GLN 72 HE21 GLN 72 6.849 4.776 2.811 540 HE22 GLN 72 HE22 GLN 72 5.308 5.538 2.909 541 H ILE 73 HN ILE 73 5.765 4.428 7.436 542 HA ILE 73 HA ILE 73 3.547 2.772 6.764 543 HB ILE 73 HB ILE 73 3.408 5.155 8.580 544 HG12 ILE 73 HG12 ILE 73 5.475 4.271 9.336 545 HG13 ILE 73 HG11 ILE 73 4.271 3.587 10.418 546 HG21 ILE 73 HG21 ILE 73 2.241 2.403 8.618 547 HG22 ILE 73 HG22 ILE 73 1.411 3.920 8.284 548 HG23 ILE 73 HG23 ILE 73 2.031 3.590 9.901 549 HD11 ILE 73 HD11 ILE 73 5.949 1.942 9.771 550 HD12 ILE 73 HD12 ILE 73 5.530 2.182 8.067 551 HD13 ILE 73 HD13 ILE 73 4.347 1.486 9.186 552 H GLY 74 HN GLY 74 2.441 3.230 4.952 553 HA2 GLY 74 HA2 GLY 74 0.456 4.524 4.311 554 HA3 GLY 74 HA1 GLY 74 1.344 5.983 4.770 555 H ASP 75 HN ASP 75 1.447 3.211 2.566 556 HA ASP 75 HA ASP 75 2.844 4.889 0.580 557 HB2 ASP 75 HB2 ASP 75 4.086 3.006 2.268 558 HB3 ASP 75 HB1 ASP 75 3.933 2.221 0.698 559 H LYS 76 HN LYS 76 1.745 4.612 -1.350 560 HA LYS 76 HA LYS 76 -0.166 2.438 -1.527 561 HB2 LYS 76 HB2 LYS 76 0.458 4.406 -3.710 562 HB3 LYS 76 HB1 LYS 76 -1.022 3.504 -3.455 563 HG2 LYS 76 HG2 LYS 76 -1.684 4.895 -1.678 564 HG3 LYS 76 HG1 LYS 76 -0.080 5.631 -1.557 565 HD2 LYS 76 HD2 LYS 76 -0.345 6.570 -3.796 566 HD3 LYS 76 HD1 LYS 76 -1.951 5.850 -3.912 567 HE2 LYS 76 HE2 LYS 76 -2.671 7.202 -1.983 568 HE3 LYS 76 HE1 LYS 76 -1.072 7.947 -1.930 569 HZ1 LYS 76 HZ1 LYS 76 -1.474 8.755 -4.216 570 HZ2 LYS 76 HZ2 LYS 76 -2.579 9.386 -3.089 571 HZ3 LYS 76 HZ3 LYS 76 -3.049 8.140 -4.138 572 H ILE 77 HN ILE 77 0.643 0.546 -2.056 573 HA ILE 77 HA ILE 77 2.927 0.163 -3.732 574 HB ILE 77 HB ILE 77 0.878 -1.876 -2.841 575 HG12 ILE 77 HG12 ILE 77 3.553 -1.256 -1.576 576 HG13 ILE 77 HG11 ILE 77 2.038 -0.556 -1.009 577 HG21 ILE 77 HG21 ILE 77 2.649 -3.513 -3.249 578 HG22 ILE 77 HG22 ILE 77 3.709 -2.228 -3.823 579 HG23 ILE 77 HG23 ILE 77 2.243 -2.627 -4.719 580 HD11 ILE 77 HD11 ILE 77 2.722 -2.483 0.320 581 HD12 ILE 77 HD12 ILE 77 2.667 -3.499 -1.122 582 HD13 ILE 77 HD13 ILE 77 1.188 -2.761 -0.507 583 H MET 78 HN MET 78 2.927 0.299 -5.887 584 HA MET 78 HA MET 78 0.328 0.118 -7.267 585 HB2 MET 78 HB2 MET 78 2.873 1.435 -8.218 586 HB3 MET 78 HB1 MET 78 1.299 1.520 -8.990 587 HG2 MET 78 HG2 MET 78 1.736 2.510 -6.208 588 HG3 MET 78 HG1 MET 78 2.090 3.512 -7.610 589 HE1 MET 78 HE1 MET 78 -2.052 2.356 -5.998 590 HE2 MET 78 HE2 MET 78 -0.484 2.056 -5.247 591 HE3 MET 78 HE3 MET 78 -1.024 1.058 -6.594 592 H GLN 79 HN GLN 79 3.353 -1.318 -6.913 593 HA GLN 79 HA GLN 79 2.743 -3.399 -8.774 594 HB2 GLN 79 HB2 GLN 79 3.890 -2.573 -10.512 595 HB3 GLN 79 HB1 GLN 79 4.397 -1.193 -9.572 596 HG2 GLN 79 HG2 GLN 79 6.216 -2.561 -8.631 597 HG3 GLN 79 HG1 GLN 79 5.770 -3.849 -9.752 598 HE21 GLN 79 HE21 GLN 79 5.185 -2.066 -11.903 599 HE22 GLN 79 HE22 GLN 79 6.678 -1.449 -12.499 600 H VAL 80 HN VAL 80 4.139 -5.085 -8.731 601 HA VAL 80 HA VAL 80 6.012 -5.137 -6.465 602 HB VAL 80 HB VAL 80 3.925 -5.930 -5.581 603 HG11 VAL 80 HG11 VAL 80 3.910 -7.914 -7.841 604 HG12 VAL 80 HG12 VAL 80 2.846 -6.516 -7.663 605 HG13 VAL 80 HG13 VAL 80 2.748 -7.853 -6.511 606 HG21 VAL 80 HG21 VAL 80 4.589 -8.214 -4.871 607 HG22 VAL 80 HG22 VAL 80 5.952 -7.093 -4.816 608 HG23 VAL 80 HG23 VAL 80 5.808 -8.240 -6.154 609 H ASN 81 HN ASN 81 7.875 -6.200 -6.986 610 HA ASN 81 HA ASN 81 9.419 -7.370 -8.145 611 HB2 ASN 81 HB2 ASN 81 7.005 -9.088 -8.230 612 HB3 ASN 81 HB1 ASN 81 8.332 -9.526 -9.298 613 HD21 ASN 81 HD21 ASN 81 7.209 -9.386 -6.052 614 HD22 ASN 81 HD22 ASN 81 8.573 -10.181 -5.322 615 H GLY 82 HN GLY 82 7.170 -5.680 -9.697 616 HA2 GLY 82 HA2 GLY 82 7.952 -4.547 -11.741 617 HA3 GLY 82 HA1 GLY 82 8.380 -6.146 -12.343 618 H TRP 83 HN TRP 83 5.536 -6.309 -10.582 619 HA TRP 83 HA TRP 83 3.928 -6.258 -13.005 620 HB2 TRP 83 HB2 TRP 83 3.043 -7.442 -10.410 621 HB3 TRP 83 HB1 TRP 83 2.614 -7.884 -12.042 622 HD1 TRP 83 HD1 TRP 83 4.569 -8.943 -9.253 623 HE1 TRP 83 HE1 TRP 83 6.336 -10.640 -9.884 624 HE3 TRP 83 HE3 TRP 83 4.372 -8.515 -14.334 625 HZ2 TRP 83 HZ2 TRP 83 7.481 -11.746 -12.163 626 HZ3 TRP 83 HZ3 TRP 83 5.860 -9.955 -15.672 627 HH2 TRP 83 HH2 TRP 83 7.378 -11.533 -14.577 628 H ASP 84 HN ASP 84 3.157 -4.217 -13.103 629 HA ASP 84 HA ASP 84 2.256 -2.570 -11.089 630 HB2 ASP 84 HB2 ASP 84 2.351 -1.952 -13.506 631 HB3 ASP 84 HB1 ASP 84 0.906 -2.924 -13.777 632 H MET 85 HN MET 85 1.070 -3.169 -9.445 633 HA MET 85 HA MET 85 -0.833 -5.238 -9.367 634 HB2 MET 85 HB2 MET 85 -0.466 -2.831 -7.580 635 HB3 MET 85 HB1 MET 85 -1.529 -4.185 -7.217 636 HG2 MET 85 HG2 MET 85 1.413 -4.479 -7.704 637 HG3 MET 85 HG1 MET 85 0.707 -4.243 -6.107 638 HE1 MET 85 HE1 MET 85 1.660 -6.366 -5.093 639 HE2 MET 85 HE2 MET 85 0.526 -7.715 -5.017 640 HE3 MET 85 HE3 MET 85 -0.019 -6.072 -4.638 641 H THR 86 HN THR 86 -1.989 -2.241 -8.221 642 HA THR 86 HA THR 86 -3.734 -0.899 -8.521 643 HB THR 86 HB THR 86 -4.395 -0.250 -10.827 644 HG1 THR 86 HG1 THR 86 -2.224 -1.548 -11.962 645 HG21 THR 86 HG21 THR 86 -1.435 -0.271 -10.252 646 HG22 THR 86 HG22 THR 86 -2.604 0.885 -9.615 647 HG23 THR 86 HG23 THR 86 -2.277 0.833 -11.346 648 H MET 87 HN MET 87 -4.148 -3.845 -10.338 649 HA MET 87 HA MET 87 -7.029 -3.775 -9.709 650 HB2 MET 87 HB2 MET 87 -7.387 -5.115 -11.753 651 HB3 MET 87 HB1 MET 87 -6.688 -3.540 -12.101 652 HG2 MET 87 HG2 MET 87 -4.472 -4.600 -12.281 653 HG3 MET 87 HG1 MET 87 -5.227 -6.170 -12.011 654 HE1 MET 87 HE1 MET 87 -6.579 -3.103 -14.111 655 HE2 MET 87 HE2 MET 87 -5.964 -3.511 -15.712 656 HE3 MET 87 HE3 MET 87 -4.842 -3.116 -14.409 657 H VAL 88 HN VAL 88 -4.219 -5.178 -8.927 658 HA VAL 88 HA VAL 88 -4.939 -7.926 -8.731 659 HB VAL 88 HB VAL 88 -2.718 -6.281 -7.522 660 HG11 VAL 88 HG11 VAL 88 -2.939 -9.278 -7.460 661 HG12 VAL 88 HG12 VAL 88 -3.447 -8.246 -6.122 662 HG13 VAL 88 HG13 VAL 88 -1.753 -8.251 -6.641 663 HG21 VAL 88 HG21 VAL 88 -2.742 -8.360 -9.706 664 HG22 VAL 88 HG22 VAL 88 -1.324 -7.493 -9.115 665 HG23 VAL 88 HG23 VAL 88 -2.616 -6.619 -9.940 666 H THR 89 HN THR 89 -5.736 -9.043 -6.932 667 HA THR 89 HA THR 89 -7.041 -7.280 -5.043 668 HB THR 89 HB THR 89 -7.989 -9.422 -6.311 669 HG1 THR 89 HG1 THR 89 -9.494 -9.414 -4.257 670 HG21 THR 89 HG21 THR 89 -6.965 -11.209 -5.347 671 HG22 THR 89 HG22 THR 89 -8.438 -11.086 -4.380 672 HG23 THR 89 HG23 THR 89 -6.916 -10.446 -3.763 673 H HIS 90 HN HIS 90 -7.256 -8.472 -2.716 674 HA HIS 90 HA HIS 90 -4.666 -8.053 -1.647 675 HB2 HIS 90 HB2 HIS 90 -6.860 -7.571 -0.494 676 HB3 HIS 90 HB1 HIS 90 -7.041 -9.303 -0.251 677 HD1 HIS 90 HD1 HIS 90 -5.322 -6.310 1.081 678 HD2 HIS 90 HD2 HIS 90 -5.268 -10.420 1.663 679 HE1 HIS 90 HE1 HIS 90 -4.110 -6.660 3.246 680 HE2 HIS 90 HE2 HIS 90 -4.349 -9.126 3.703 681 H ASP 91 HN ASP 91 -6.608 -10.947 -2.207 682 HA ASP 91 HA ASP 91 -4.779 -12.799 -1.057 683 HB2 ASP 91 HB2 ASP 91 -6.877 -13.254 -3.182 684 HB3 ASP 91 HB1 ASP 91 -6.221 -14.434 -2.063 685 H GLN 92 HN GLN 92 -5.727 -11.990 -4.308 686 HA GLN 92 HA GLN 92 -3.987 -13.059 -5.969 687 HB2 GLN 92 HB2 GLN 92 -5.873 -11.635 -6.522 688 HB3 GLN 92 HB1 GLN 92 -5.079 -10.253 -5.792 689 HG2 GLN 92 HG2 GLN 92 -5.084 -10.300 -8.261 690 HG3 GLN 92 HG1 GLN 92 -3.510 -10.154 -7.492 691 HE21 GLN 92 HE21 GLN 92 -5.341 -13.016 -7.549 692 HE22 GLN 92 HE22 GLN 92 -4.272 -13.889 -8.562 693 H ALA 93 HN ALA 93 -3.417 -10.049 -4.112 694 HA ALA 93 HA ALA 93 -0.771 -9.653 -5.065 695 HB1 ALA 93 HB1 ALA 93 -0.603 -8.039 -3.216 696 HB2 ALA 93 HB2 ALA 93 -2.128 -8.635 -2.558 697 HB3 ALA 93 HB3 ALA 93 -2.097 -7.829 -4.127 698 H ARG 94 HN ARG 94 -2.214 -11.045 -2.182 699 HA ARG 94 HA ARG 94 0.002 -11.419 -0.639 700 HB2 ARG 94 HB2 ARG 94 -2.626 -12.803 -0.842 701 HB3 ARG 94 HB1 ARG 94 -1.373 -13.578 0.125 702 HG2 ARG 94 HG2 ARG 94 -1.164 -11.415 1.390 703 HG3 ARG 94 HG1 ARG 94 -2.607 -10.866 0.529 704 HD2 ARG 94 HD2 ARG 94 -3.124 -11.792 2.756 705 HD3 ARG 94 HD1 ARG 94 -3.893 -12.702 1.448 706 HE ARG 94 HE ARG 94 -1.864 -14.242 1.736 707 HH11 ARG 94 HH11 ARG 94 -3.405 -12.492 4.350 708 HH12 ARG 94 HH12 ARG 94 -2.947 -13.644 5.564 709 HH21 ARG 94 HH21 ARG 94 -1.274 -15.768 3.315 710 HH22 ARG 94 HH22 ARG 94 -1.744 -15.510 4.970 711 H LYS 95 HN LYS 95 -1.370 -13.711 -2.977 712 HA LYS 95 HA LYS 95 0.662 -15.636 -2.386 713 HB2 LYS 95 HB2 LYS 95 -0.382 -17.025 -4.060 714 HB3 LYS 95 HB1 LYS 95 -1.603 -16.308 -3.020 715 HG2 LYS 95 HG2 LYS 95 -2.190 -14.713 -4.729 716 HG3 LYS 95 HG1 LYS 95 -0.884 -15.296 -5.767 717 HD2 LYS 95 HD2 LYS 95 -3.273 -16.895 -4.832 718 HD3 LYS 95 HD1 LYS 95 -3.027 -16.242 -6.455 719 HE2 LYS 95 HE2 LYS 95 -1.205 -17.676 -6.868 720 HE3 LYS 95 HE1 LYS 95 -1.075 -18.132 -5.171 721 HZ1 LYS 95 HZ1 LYS 95 -2.082 -19.915 -6.324 722 HZ2 LYS 95 HZ2 LYS 95 -3.207 -18.909 -7.094 723 HZ3 LYS 95 HZ3 LYS 95 -3.309 -19.181 -5.418 724 H ARG 96 HN ARG 96 0.421 -13.030 -4.744 725 HA ARG 96 HA ARG 96 2.334 -14.378 -6.456 726 HB2 ARG 96 HB2 ARG 96 1.954 -12.618 -8.020 727 HB3 ARG 96 HB1 ARG 96 0.396 -13.131 -7.388 728 HG2 ARG 96 HG2 ARG 96 -0.044 -11.028 -6.885 729 HG3 ARG 96 HG1 ARG 96 1.295 -11.044 -5.732 730 HD2 ARG 96 HD2 ARG 96 2.266 -9.526 -7.023 731 HD3 ARG 96 HD1 ARG 96 2.528 -10.842 -8.164 732 HE ARG 96 HE ARG 96 0.341 -8.879 -8.289 733 HH11 ARG 96 HH11 ARG 96 2.339 -11.330 -9.793 734 HH12 ARG 96 HH12 ARG 96 1.640 -11.122 -11.363 735 HH21 ARG 96 HH21 ARG 96 -0.572 -8.594 -10.372 736 HH22 ARG 96 HH22 ARG 96 -0.037 -9.585 -11.696 737 H LEU 97 HN LEU 97 2.332 -12.087 -3.884 738 HA LEU 97 HA LEU 97 4.983 -11.130 -4.592 739 HB2 LEU 97 HB2 LEU 97 4.824 -9.750 -2.563 740 HB3 LEU 97 HB1 LEU 97 3.568 -9.441 -3.740 741 HG LEU 97 HG LEU 97 2.173 -11.068 -2.221 742 HD11 LEU 97 HD11 LEU 97 2.760 -10.959 0.112 743 HD12 LEU 97 HD12 LEU 97 4.180 -9.982 -0.259 744 HD13 LEU 97 HD13 LEU 97 4.102 -11.657 -0.802 745 HD21 LEU 97 HD21 LEU 97 2.838 -8.215 -1.504 746 HD22 LEU 97 HD22 LEU 97 1.453 -9.112 -0.884 747 HD23 LEU 97 HD23 LEU 97 1.578 -8.769 -2.609 748 H THR 98 HN THR 98 3.556 -13.370 -2.302 749 HA THR 98 HA THR 98 6.290 -13.987 -1.409 750 HB THR 98 HB THR 98 5.016 -15.195 0.529 751 HG1 THR 98 HG1 THR 98 2.958 -14.274 -0.696 752 HG21 THR 98 HG21 THR 98 6.551 -13.321 0.841 753 HG22 THR 98 HG22 THR 98 5.144 -13.163 1.892 754 HG23 THR 98 HG23 THR 98 5.263 -12.188 0.427 755 H LYS 99 HN LYS 99 5.706 -15.056 -3.755 756 HA LYS 99 HA LYS 99 4.732 -17.753 -3.293 757 HB2 LYS 99 HB2 LYS 99 5.010 -18.019 -5.746 758 HB3 LYS 99 HB1 LYS 99 3.927 -16.711 -5.299 759 HG2 LYS 99 HG2 LYS 99 5.902 -15.163 -5.615 760 HG3 LYS 99 HG1 LYS 99 6.722 -16.533 -6.368 761 HD2 LYS 99 HD2 LYS 99 4.811 -16.718 -7.950 762 HD3 LYS 99 HD1 LYS 99 4.148 -15.243 -7.243 763 HE2 LYS 99 HE2 LYS 99 6.828 -15.494 -8.610 764 HE3 LYS 99 HE1 LYS 99 5.378 -14.779 -9.312 765 HZ1 LYS 99 HZ1 LYS 99 5.417 -13.102 -7.564 766 HZ2 LYS 99 HZ2 LYS 99 6.853 -13.082 -8.462 767 HZ3 LYS 99 HZ3 LYS 99 6.827 -13.781 -6.913 768 H ARG 100 HN ARG 100 6.484 -18.858 -5.409 769 HA ARG 100 HA ARG 100 8.919 -19.092 -3.757 770 HB2 ARG 100 HB2 ARG 100 7.608 -21.128 -5.543 771 HB3 ARG 100 HB1 ARG 100 9.158 -21.356 -4.746 772 HG2 ARG 100 HG2 ARG 100 6.476 -21.013 -3.430 773 HG3 ARG 100 HG1 ARG 100 7.477 -22.465 -3.460 774 HD2 ARG 100 HD2 ARG 100 8.237 -19.849 -2.167 775 HD3 ARG 100 HD1 ARG 100 7.613 -21.255 -1.308 776 HE ARG 100 HE ARG 100 9.654 -22.437 -2.065 777 HH11 ARG 100 HH11 ARG 100 9.644 -18.920 -2.036 778 HH12 ARG 100 HH12 ARG 100 11.356 -18.795 -1.782 779 HH21 ARG 100 HH21 ARG 100 11.917 -22.251 -1.747 780 HH22 ARG 100 HH22 ARG 100 12.644 -20.671 -1.612 781 H SER 101 HN SER 101 8.351 -17.223 -6.012 782 HA SER 101 HA SER 101 10.295 -18.190 -7.983 783 HB2 SER 101 HB2 SER 101 8.348 -15.885 -8.210 784 HB3 SER 101 HB1 SER 101 9.381 -16.509 -9.490 785 HG SER 101 HG SER 101 8.183 -18.346 -9.592 786 H GLU 102 HN GLU 102 9.897 -15.940 -5.439 787 HA GLU 102 HA GLU 102 12.291 -14.491 -6.240 788 HB2 GLU 102 HB2 GLU 102 11.426 -12.569 -4.990 789 HB3 GLU 102 HB1 GLU 102 10.365 -13.018 -6.315 790 HG2 GLU 102 HG2 GLU 102 9.883 -13.915 -3.488 791 HG3 GLU 102 HG1 GLU 102 9.259 -12.395 -4.127 792 H GLU 103 HN GLU 103 12.984 -13.277 -4.164 793 HA GLU 103 HA GLU 103 13.158 -15.103 -1.875 794 HB2 GLU 103 HB2 GLU 103 15.457 -13.391 -2.753 795 HB3 GLU 103 HB1 GLU 103 15.481 -14.745 -1.638 796 HG2 GLU 103 HG2 GLU 103 15.416 -16.314 -3.364 797 HG3 GLU 103 HG1 GLU 103 14.881 -15.116 -4.545 798 H VAL 104 HN VAL 104 11.853 -12.553 -2.984 799 HA VAL 104 HA VAL 104 12.382 -10.679 -0.887 800 HB VAL 104 HB VAL 104 14.550 -10.866 -1.987 801 HG11 VAL 104 HG11 VAL 104 13.878 -11.523 -4.193 802 HG12 VAL 104 HG12 VAL 104 14.851 -10.056 -4.299 803 HG13 VAL 104 HG13 VAL 104 13.098 -9.963 -4.464 804 HG21 VAL 104 HG21 VAL 104 13.718 -8.670 -1.092 805 HG22 VAL 104 HG22 VAL 104 13.345 -8.226 -2.756 806 HG23 VAL 104 HG23 VAL 104 15.010 -8.562 -2.282 807 H VAL 105 HN VAL 105 11.196 -8.609 -1.247 808 HA VAL 105 HA VAL 105 9.320 -9.025 -3.498 809 HB VAL 105 HB VAL 105 7.669 -7.637 -2.201 810 HG11 VAL 105 HG11 VAL 105 6.968 -9.501 -0.753 811 HG12 VAL 105 HG12 VAL 105 8.540 -10.263 -0.996 812 HG13 VAL 105 HG13 VAL 105 7.440 -10.051 -2.359 813 HG21 VAL 105 HG21 VAL 105 9.580 -8.164 0.064 814 HG22 VAL 105 HG22 VAL 105 7.945 -7.527 0.233 815 HG23 VAL 105 HG23 VAL 105 9.175 -6.589 -0.616 816 H ARG 106 HN ARG 106 9.823 -7.760 -5.090 817 HA ARG 106 HA ARG 106 10.932 -5.136 -4.641 818 HB2 ARG 106 HB2 ARG 106 11.829 -6.297 -6.540 819 HB3 ARG 106 HB1 ARG 106 10.231 -6.763 -7.071 820 HG2 ARG 106 HG2 ARG 106 9.693 -4.517 -7.619 821 HG3 ARG 106 HG1 ARG 106 11.261 -3.957 -7.054 822 HD2 ARG 106 HD2 ARG 106 12.315 -5.414 -8.780 823 HD3 ARG 106 HD1 ARG 106 10.698 -5.788 -9.381 824 HE ARG 106 HE ARG 106 11.470 -2.978 -9.220 825 HH11 ARG 106 HH11 ARG 106 11.046 -5.802 -11.253 826 HH12 ARG 106 HH12 ARG 106 10.877 -4.875 -12.709 827 HH21 ARG 106 HH21 ARG 106 11.251 -1.771 -11.132 828 HH22 ARG 106 HH22 ARG 106 10.928 -2.576 -12.632 829 H LEU 107 HN LEU 107 9.707 -3.286 -5.029 830 HA LEU 107 HA LEU 107 7.126 -3.597 -6.192 831 HB2 LEU 107 HB2 LEU 107 6.358 -2.198 -3.993 832 HB3 LEU 107 HB1 LEU 107 6.067 -3.891 -4.319 833 HG LEU 107 HG LEU 107 8.515 -3.991 -3.140 834 HD11 LEU 107 HD11 LEU 107 8.411 -1.606 -2.623 835 HD12 LEU 107 HD12 LEU 107 8.425 -2.608 -1.164 836 HD13 LEU 107 HD13 LEU 107 6.916 -1.874 -1.725 837 HD21 LEU 107 HD21 LEU 107 6.614 -5.434 -2.709 838 HD22 LEU 107 HD22 LEU 107 5.801 -4.131 -1.847 839 HD23 LEU 107 HD23 LEU 107 7.290 -4.825 -1.193 840 H LEU 108 HN LEU 108 5.914 -1.697 -6.259 841 HA LEU 108 HA LEU 108 7.544 0.727 -6.667 842 HB2 LEU 108 HB2 LEU 108 6.374 -0.629 -8.668 843 HB3 LEU 108 HB1 LEU 108 4.983 0.272 -8.114 844 HG LEU 108 HG LEU 108 6.340 2.377 -8.454 845 HD11 LEU 108 HD11 LEU 108 8.102 0.448 -9.958 846 HD12 LEU 108 HD12 LEU 108 8.554 1.326 -8.488 847 HD13 LEU 108 HD13 LEU 108 8.236 2.208 -9.981 848 HD21 LEU 108 HD21 LEU 108 5.974 2.348 -10.894 849 HD22 LEU 108 HD22 LEU 108 4.597 1.707 -9.995 850 HD23 LEU 108 HD23 LEU 108 5.710 0.606 -10.811 851 H VAL 109 HN VAL 109 6.517 2.608 -5.825 852 HA VAL 109 HA VAL 109 4.046 2.260 -4.486 853 HB VAL 109 HB VAL 109 5.843 1.241 -3.069 854 HG11 VAL 109 HG11 VAL 109 6.638 4.112 -2.678 855 HG12 VAL 109 HG12 VAL 109 7.627 2.840 -3.398 856 HG13 VAL 109 HG13 VAL 109 7.196 2.759 -1.690 857 HG21 VAL 109 HG21 VAL 109 3.681 1.818 -2.264 858 HG22 VAL 109 HG22 VAL 109 4.219 3.468 -1.960 859 HG23 VAL 109 HG23 VAL 109 4.899 2.131 -1.030 860 H THR 110 HN THR 110 3.370 4.104 -3.510 861 HA THR 110 HA THR 110 4.570 6.572 -4.529 862 HB THR 110 HB THR 110 2.182 7.389 -4.930 863 HG1 THR 110 HG1 THR 110 1.775 4.577 -4.792 864 HG21 THR 110 HG21 THR 110 3.796 6.859 -6.706 865 HG22 THR 110 HG22 THR 110 2.131 6.483 -7.167 866 HG23 THR 110 HG23 THR 110 3.229 5.189 -6.686 867 H ARG 111 HN ARG 111 5.098 7.754 -2.864 868 HA ARG 111 HA ARG 111 3.159 7.914 -0.654 869 HB2 ARG 111 HB2 ARG 111 4.985 8.173 0.931 870 HB3 ARG 111 HB1 ARG 111 5.137 6.652 0.062 871 HG2 ARG 111 HG2 ARG 111 6.804 7.720 -1.422 872 HG3 ARG 111 HG1 ARG 111 6.704 9.172 -0.424 873 HD2 ARG 111 HD2 ARG 111 8.589 7.915 0.325 874 HD3 ARG 111 HD1 ARG 111 7.319 7.770 1.531 875 HE ARG 111 HE ARG 111 6.819 5.557 0.444 876 HH11 ARG 111 HH11 ARG 111 10.017 6.982 0.232 877 HH12 ARG 111 HH12 ARG 111 10.827 5.450 0.191 878 HH21 ARG 111 HH21 ARG 111 7.865 3.570 0.430 879 HH22 ARG 111 HH22 ARG 111 9.609 3.498 0.334 880 H GLN 112 HN GLN 112 3.486 9.927 0.658 881 HA GLN 112 HA GLN 112 3.672 12.244 -1.033 882 HB2 GLN 112 HB2 GLN 112 3.139 11.921 1.911 883 HB3 GLN 112 HB1 GLN 112 3.077 13.450 1.056 884 HG2 GLN 112 HG2 GLN 112 0.894 12.505 1.506 885 HG3 GLN 112 HG1 GLN 112 1.183 12.708 -0.215 886 HE21 GLN 112 HE21 GLN 112 1.302 10.902 -1.518 887 HE22 GLN 112 HE22 GLN 112 0.838 9.321 -0.970 888 H SER 113 HN SER 113 5.149 10.878 1.699 889 HA SER 113 HA SER 113 7.318 10.807 2.440 890 HB2 SER 113 HB2 SER 113 7.697 12.961 0.400 891 HB3 SER 113 HB1 SER 113 8.994 12.419 1.465 892 HG SER 113 HG SER 113 8.222 11.366 -0.840 893 H LEU 114 HN LEU 114 4.994 12.612 2.945 894 HA LEU 114 HA LEU 114 6.295 14.440 4.831 895 HB2 LEU 114 HB2 LEU 114 4.017 14.759 2.978 896 HB3 LEU 114 HB1 LEU 114 3.964 15.631 4.500 897 HG LEU 114 HG LEU 114 4.927 17.207 3.127 898 HD11 LEU 114 HD11 LEU 114 6.409 16.976 4.958 899 HD12 LEU 114 HD12 LEU 114 7.426 17.117 3.520 900 HD13 LEU 114 HD13 LEU 114 7.151 15.534 4.265 901 HD21 LEU 114 HD21 LEU 114 6.354 14.942 1.731 902 HD22 LEU 114 HD22 LEU 114 6.594 16.651 1.364 903 HD23 LEU 114 HD23 LEU 114 5.017 15.908 1.102 904 H GLN 115 HN GLN 115 5.687 11.838 5.105 905 HA GLN 115 HA GLN 115 3.216 11.431 6.492 906 HB2 GLN 115 HB2 GLN 115 5.605 9.686 5.936 907 HB3 GLN 115 HB1 GLN 115 4.273 9.157 6.942 908 HG2 GLN 115 HG2 GLN 115 3.994 10.064 4.094 909 HG3 GLN 115 HG1 GLN 115 4.133 8.384 4.602 910 HE21 GLN 115 HE21 GLN 115 2.134 7.849 3.748 911 HE22 GLN 115 HE22 GLN 115 0.652 8.365 4.471 912 H LYS 116 HN LYS 116 3.718 9.890 8.624 913 HA LYS 116 HA LYS 116 5.040 11.825 10.402 914 HB2 LYS 116 HB2 LYS 116 3.395 11.087 12.128 915 HB3 LYS 116 HB1 LYS 116 2.674 11.915 10.754 916 HG2 LYS 116 HG2 LYS 116 2.327 9.500 9.839 917 HG3 LYS 116 HG1 LYS 116 2.526 9.039 11.531 918 HD2 LYS 116 HD2 LYS 116 0.168 9.343 11.001 919 HD3 LYS 116 HD1 LYS 116 0.705 10.570 12.152 920 HE2 LYS 116 HE2 LYS 116 -0.721 11.527 10.408 921 HE3 LYS 116 HE1 LYS 116 0.909 12.193 10.356 922 HZ1 LYS 116 HZ1 LYS 116 0.228 11.723 8.140 923 HZ2 LYS 116 HZ2 LYS 116 -0.249 10.146 8.545 924 HZ3 LYS 116 HZ3 LYS 116 1.388 10.562 8.559 925 H ALA 117 HN ALA 117 6.606 11.140 11.668 926 HA ALA 117 HA ALA 117 6.778 8.313 12.399 927 HB1 ALA 117 HB1 ALA 117 9.226 8.354 12.016 928 HB2 ALA 117 HB2 ALA 117 9.058 9.960 11.307 929 HB3 ALA 117 HB3 ALA 117 8.313 8.568 10.520 930 H VAL 118 HN VAL 118 5.905 10.768 13.554 931 HA VAL 118 HA VAL 118 7.861 11.211 15.664 932 HB VAL 118 HB VAL 118 7.592 13.227 14.408 933 HG11 VAL 118 HG11 VAL 118 5.493 12.867 13.306 934 HG12 VAL 118 HG12 VAL 118 5.406 14.378 14.211 935 HG13 VAL 118 HG13 VAL 118 4.624 12.927 14.840 936 HG21 VAL 118 HG21 VAL 118 6.893 14.758 16.127 937 HG22 VAL 118 HG22 VAL 118 7.775 13.408 16.844 938 HG23 VAL 118 HG23 VAL 118 6.017 13.471 16.955 939 H GLN 119 HN GLN 119 7.123 9.483 16.778 940 HA GLN 119 HA GLN 119 4.500 9.812 18.072 941 HB2 GLN 119 HB2 GLN 119 6.036 7.274 17.470 942 HB3 GLN 119 HB1 GLN 119 4.594 7.338 18.470 943 HG2 GLN 119 HG2 GLN 119 4.662 8.249 15.607 944 HG3 GLN 119 HG1 GLN 119 4.230 6.615 16.107 945 HE21 GLN 119 HE21 GLN 119 3.279 9.975 16.137 946 HE22 GLN 119 HE22 GLN 119 1.622 9.698 16.603 947 H GLN 120 HN GLN 120 4.396 9.112 20.321 948 HA GLN 120 HA GLN 120 6.840 9.794 21.740 949 HB2 GLN 120 HB2 GLN 120 4.126 9.075 22.871 950 HB3 GLN 120 HB1 GLN 120 5.476 9.769 23.756 951 HG2 GLN 120 HG2 GLN 120 3.911 11.102 21.557 952 HG3 GLN 120 HG1 GLN 120 3.802 11.447 23.281 953 HE21 GLN 120 HE21 GLN 120 4.460 13.212 21.077 954 HE22 GLN 120 HE22 GLN 120 6.027 13.860 21.426 955 H SER 121 HN SER 121 8.034 7.937 21.069 956 HA SER 121 HA SER 121 7.165 5.319 21.833 957 HB2 SER 121 HB2 SER 121 9.607 4.753 21.225 958 HB3 SER 121 HB1 SER 121 8.562 5.346 19.937 959 HG SER 121 HG SER 121 9.970 6.867 19.662 960 H MET 122 HN MET 122 6.921 4.974 23.927 961 HA MET 122 HA MET 122 8.563 6.235 25.923 962 HB2 MET 122 HB2 MET 122 7.149 4.956 27.519 963 HB3 MET 122 HB1 MET 122 6.213 5.900 26.367 964 HG2 MET 122 HG2 MET 122 5.812 3.880 25.049 965 HG3 MET 122 HG1 MET 122 6.734 2.934 26.214 966 HE1 MET 122 HE1 MET 122 3.717 2.275 25.267 967 HE2 MET 122 HE2 MET 122 3.025 1.786 26.815 968 HE3 MET 122 HE3 MET 122 4.658 1.281 26.375 969 H LEU 123 HN LEU 123 10.239 4.831 24.351 970 HA LEU 123 HA LEU 123 11.639 3.189 26.164 971 HB2 LEU 123 HB2 LEU 123 9.665 1.722 25.210 972 HB3 LEU 123 HB1 LEU 123 10.685 1.614 23.792 973 HG LEU 123 HG LEU 123 10.914 -0.339 25.276 974 HD11 LEU 123 HD11 LEU 123 13.353 -0.391 25.387 975 HD12 LEU 123 HD12 LEU 123 13.396 1.350 25.104 976 HD13 LEU 123 HD13 LEU 123 12.780 0.271 23.854 977 HD21 LEU 123 HD21 LEU 123 10.506 0.775 27.410 978 HD22 LEU 123 HD22 LEU 123 12.041 1.631 27.260 979 HD23 LEU 123 HD23 LEU 123 12.024 -0.124 27.437 980 H SER 124 HN SER 124 11.003 3.621 22.704 981 HA SER 124 HA SER 124 12.265 4.360 20.979 982 HB2 SER 124 HB2 SER 124 13.129 6.042 22.667 983 HB3 SER 124 HB1 SER 124 14.490 4.954 22.929 984 HG SER 124 HG SER 124 15.356 5.847 21.250 985 H1 LYS 161 HN LYS 161 -19.834 -2.676 4.980 986 HA LYS 161 HA LYS 161 -17.956 -3.749 3.040 987 HB2 LYS 161 HB2 LYS 161 -20.123 -2.185 2.733 988 HB3 LYS 161 HB1 LYS 161 -18.920 -0.920 2.929 989 HG2 LYS 161 HG2 LYS 161 -19.297 -1.351 0.588 990 HG3 LYS 161 HG1 LYS 161 -17.658 -1.827 1.030 991 HD2 LYS 161 HD2 LYS 161 -18.373 -4.168 1.186 992 HD3 LYS 161 HD1 LYS 161 -20.017 -3.698 0.760 993 HE2 LYS 161 HE2 LYS 161 -19.408 -3.135 -1.435 994 HE3 LYS 161 HE1 LYS 161 -17.691 -3.081 -1.035 995 HZ1 LYS 161 HZ1 LYS 161 -19.403 -5.507 -1.175 996 HZ2 LYS 161 HZ2 LYS 161 -17.790 -5.496 -0.641 997 HZ3 LYS 161 HZ3 LYS 161 -18.154 -5.079 -2.240 998 H GLU 162 HN GLU 162 -15.860 -3.721 3.842 999 HA GLU 162 HA GLU 162 -14.590 -1.173 3.863 1000 HB2 GLU 162 HB2 GLU 162 -15.459 -1.161 6.147 1001 HB3 GLU 162 HB1 GLU 162 -14.639 -2.679 6.488 1002 HG2 GLU 162 HG2 GLU 162 -12.492 -1.623 6.209 1003 HG3 GLU 162 HG1 GLU 162 -13.261 -0.109 5.746 1004 H ASN 163 HN ASN 163 -12.252 -1.330 4.056 1005 HA ASN 163 HA ASN 163 -11.295 -3.432 2.422 1006 HB2 ASN 163 HB2 ASN 163 -9.047 -2.265 2.910 1007 HB3 ASN 163 HB1 ASN 163 -10.296 -1.338 2.077 1008 HD21 ASN 163 HD21 ASN 163 -8.372 -1.634 4.932 1009 HD22 ASN 163 HD22 ASN 163 -8.960 -0.187 5.708 1010 H LEU 164 HN LEU 164 -9.419 -4.769 2.842 1011 HA LEU 164 HA LEU 164 -9.435 -5.818 5.591 1012 HB2 LEU 164 HB2 LEU 164 -9.004 -8.001 4.751 1013 HB3 LEU 164 HB1 LEU 164 -10.407 -7.352 3.926 1014 HG LEU 164 HG LEU 164 -7.681 -7.229 2.675 1015 HD11 LEU 164 HD11 LEU 164 -8.093 -9.542 3.324 1016 HD12 LEU 164 HD12 LEU 164 -8.160 -9.349 1.567 1017 HD13 LEU 164 HD13 LEU 164 -9.653 -9.499 2.504 1018 HD21 LEU 164 HD21 LEU 164 -10.482 -7.305 1.553 1019 HD22 LEU 164 HD22 LEU 164 -8.998 -7.242 0.603 1020 HD23 LEU 164 HD23 LEU 164 -9.433 -5.891 1.648 1021 H GLU 165 HN GLU 165 -7.622 -5.714 6.676 1022 HA GLU 165 HA GLU 165 -5.112 -5.208 5.242 1023 HB2 GLU 165 HB2 GLU 165 -6.022 -4.561 8.031 1024 HB3 GLU 165 HB1 GLU 165 -4.308 -4.645 7.645 1025 HG2 GLU 165 HG2 GLU 165 -5.031 -2.371 7.534 1026 HG3 GLU 165 HG1 GLU 165 -4.640 -2.938 5.908 1027 H SER 166 HN SER 166 -3.163 -6.170 6.140 1028 HA SER 166 HA SER 166 -3.388 -8.547 7.766 1029 HB2 SER 166 HB2 SER 166 -2.481 -8.807 4.889 1030 HB3 SER 166 HB1 SER 166 -2.545 -10.101 6.085 1031 HG SER 166 HG SER 166 -4.949 -9.198 6.085 1032 H MET 167 HN MET 167 -1.260 -9.405 8.312 1033 HA MET 167 HA MET 167 0.971 -7.754 7.326 1034 HB2 MET 167 HB2 MET 167 2.340 -8.824 9.149 1035 HB3 MET 167 HB1 MET 167 1.076 -7.720 9.704 1036 HG2 MET 167 HG2 MET 167 -0.331 -9.580 10.328 1037 HG3 MET 167 HG1 MET 167 0.823 -10.727 9.654 1038 HE1 MET 167 HE1 MET 167 1.762 -8.092 13.337 1039 HE2 MET 167 HE2 MET 167 0.190 -8.077 12.534 1040 HE3 MET 167 HE3 MET 167 1.615 -7.476 11.690 1041 H VAL 168 HN VAL 168 1.785 -8.594 5.596 1042 HA VAL 168 HA VAL 168 2.143 -11.495 5.440 1043 HB VAL 168 HB VAL 168 2.807 -11.018 3.038 1044 HG11 VAL 168 HG11 VAL 168 0.603 -11.885 3.643 1045 HG12 VAL 168 HG12 VAL 168 0.509 -10.799 2.256 1046 HG13 VAL 168 HG13 VAL 168 0.010 -10.240 3.853 1047 HG21 VAL 168 HG21 VAL 168 3.331 -8.644 3.266 1048 HG22 VAL 168 HG22 VAL 168 1.648 -8.298 3.670 1049 HG23 VAL 168 HG23 VAL 168 2.068 -8.890 2.062 Start of MODEL 14 1 H1 MET 1 HT1 MET 1 6.431 21.308 10.941 2 H2 MET 1 HT2 MET 1 7.020 20.317 9.702 3 H3 MET 1 HT3 MET 1 5.691 21.332 9.413 4 HA MET 1 HA MET 1 7.089 23.273 9.797 5 HB2 MET 1 HB2 MET 1 9.491 23.042 9.911 6 HB3 MET 1 HB1 MET 1 8.767 22.103 11.207 7 HG2 MET 1 HG2 MET 1 9.074 20.060 9.907 8 HG3 MET 1 HG1 MET 1 9.800 20.996 8.604 9 HE1 MET 1 HE1 MET 1 12.075 22.395 8.921 10 HE2 MET 1 HE2 MET 1 13.066 22.338 10.377 11 HE3 MET 1 HE3 MET 1 11.496 23.145 10.407 12 H SER 2 HN SER 2 6.870 20.516 7.815 13 HA SER 2 HA SER 2 8.026 21.966 5.532 14 HB2 SER 2 HB2 SER 2 7.465 19.000 5.831 15 HB3 SER 2 HB1 SER 2 8.276 19.776 4.468 16 HG SER 2 HG SER 2 9.420 18.834 6.595 17 H TYR 3 HN TYR 3 6.350 23.160 4.745 18 HA TYR 3 HA TYR 3 4.079 21.675 3.683 19 HB2 TYR 3 HB2 TYR 3 2.415 23.126 4.638 20 HB3 TYR 3 HB1 TYR 3 3.409 22.507 5.953 21 HD1 TYR 3 HD2 TYR 3 5.398 24.049 6.672 22 HD2 TYR 3 HD1 TYR 3 1.980 25.402 4.530 23 HE1 TYR 3 HE2 TYR 3 5.825 26.336 7.453 24 HE2 TYR 3 HE1 TYR 3 2.398 27.698 5.312 25 HH TYR 3 HH TYR 3 3.534 28.821 7.190 26 H ILE 4 HN ILE 4 3.252 22.509 1.833 27 HA ILE 4 HA ILE 4 4.069 25.189 0.981 28 HB ILE 4 HB ILE 4 4.177 22.740 -0.798 29 HG12 ILE 4 HG12 ILE 4 6.417 24.508 0.213 30 HG13 ILE 4 HG11 ILE 4 6.095 22.866 0.751 31 HG21 ILE 4 HG21 ILE 4 4.753 25.639 -1.393 32 HG22 ILE 4 HG22 ILE 4 3.424 24.674 -2.032 33 HG23 ILE 4 HG23 ILE 4 5.084 24.298 -2.489 34 HD11 ILE 4 HD11 ILE 4 7.948 22.973 -0.839 35 HD12 ILE 4 HD12 ILE 4 6.862 23.658 -2.048 36 HD13 ILE 4 HD13 ILE 4 6.602 22.016 -1.462 37 HA PRO 5 HA PRO 5 -0.437 24.766 0.624 38 HB2 PRO 5 HB2 PRO 5 -0.343 27.698 0.579 39 HB3 PRO 5 HB1 PRO 5 -1.169 26.626 1.710 40 HG2 PRO 5 HG2 PRO 5 1.000 28.047 2.432 41 HG3 PRO 5 HG1 PRO 5 0.679 26.424 3.080 42 HD2 PRO 5 HD2 PRO 5 2.560 27.256 0.894 43 HD3 PRO 5 HD1 PRO 5 2.816 26.101 2.221 44 H GLY 6 HN GLY 6 -0.771 24.076 -1.409 45 HA2 GLY 6 HA2 GLY 6 -1.836 25.362 -3.416 46 HA3 GLY 6 HA1 GLY 6 -0.163 25.873 -3.643 47 H GLN 7 HN GLN 7 1.227 23.579 -3.080 48 HA GLN 7 HA GLN 7 0.184 21.637 -5.011 49 HB2 GLN 7 HB2 GLN 7 2.982 22.745 -4.823 50 HB3 GLN 7 HB1 GLN 7 2.561 21.321 -5.746 51 HG2 GLN 7 HG2 GLN 7 0.975 22.715 -7.063 52 HG3 GLN 7 HG1 GLN 7 1.593 24.122 -6.201 53 HE21 GLN 7 HE21 GLN 7 2.370 25.084 -8.059 54 HE22 GLN 7 HE22 GLN 7 3.771 24.490 -8.897 55 HA PRO 8 HA PRO 8 1.481 19.280 -1.303 56 HB2 PRO 8 HB2 PRO 8 -1.053 17.980 -1.272 57 HB3 PRO 8 HB1 PRO 8 -0.456 19.193 -0.141 58 HG2 PRO 8 HG2 PRO 8 -2.562 19.549 -1.911 59 HG3 PRO 8 HG1 PRO 8 -1.647 20.856 -1.136 60 HD2 PRO 8 HD2 PRO 8 -1.372 19.710 -3.887 61 HD3 PRO 8 HD1 PRO 8 -1.227 21.400 -3.348 62 H VAL 9 HN VAL 9 2.609 17.450 -1.684 63 HA VAL 9 HA VAL 9 2.193 15.960 -4.065 64 HB VAL 9 HB VAL 9 3.895 14.445 -2.556 65 HG11 VAL 9 HG11 VAL 9 5.666 15.528 -3.886 66 HG12 VAL 9 HG12 VAL 9 4.519 16.803 -4.307 67 HG13 VAL 9 HG13 VAL 9 4.234 15.145 -4.845 68 HG21 VAL 9 HG21 VAL 9 3.914 15.974 -0.701 69 HG22 VAL 9 HG22 VAL 9 4.302 17.316 -1.777 70 HG23 VAL 9 HG23 VAL 9 5.480 16.028 -1.515 71 H THR 10 HN THR 10 1.102 14.240 -4.397 72 HA THR 10 HA THR 10 -0.586 13.258 -2.275 73 HB THR 10 HB THR 10 -1.913 12.315 -4.099 74 HG1 THR 10 HG1 THR 10 -1.192 12.572 -6.232 75 HG21 THR 10 HG21 THR 10 -2.382 14.464 -5.303 76 HG22 THR 10 HG22 THR 10 -0.940 15.141 -4.521 77 HG23 THR 10 HG23 THR 10 -2.325 14.630 -3.545 78 H ALA 11 HN ALA 11 1.552 12.068 -4.702 79 HA ALA 11 HA ALA 11 2.378 9.835 -3.080 80 HB1 ALA 11 HB1 ALA 11 0.315 8.982 -4.092 81 HB2 ALA 11 HB2 ALA 11 1.740 8.114 -4.664 82 HB3 ALA 11 HB3 ALA 11 0.971 9.320 -5.694 83 H VAL 12 HN VAL 12 4.354 9.400 -3.399 84 HA VAL 12 HA VAL 12 5.797 10.504 -5.702 85 HB VAL 12 HB VAL 12 6.883 9.190 -3.241 86 HG11 VAL 12 HG11 VAL 12 8.251 10.996 -5.224 87 HG12 VAL 12 HG12 VAL 12 8.409 9.241 -5.160 88 HG13 VAL 12 HG13 VAL 12 8.997 10.228 -3.820 89 HG21 VAL 12 HG21 VAL 12 7.438 11.559 -2.533 90 HG22 VAL 12 HG22 VAL 12 5.754 11.040 -2.394 91 HG23 VAL 12 HG23 VAL 12 6.257 12.071 -3.746 92 H VAL 13 HN VAL 13 6.226 9.152 -7.321 93 HA VAL 13 HA VAL 13 5.901 6.322 -7.106 94 HB VAL 13 HB VAL 13 7.257 7.827 -9.339 95 HG11 VAL 13 HG11 VAL 13 5.951 5.112 -9.248 96 HG12 VAL 13 HG12 VAL 13 7.683 5.430 -9.342 97 HG13 VAL 13 HG13 VAL 13 6.631 5.875 -10.685 98 HG21 VAL 13 HG21 VAL 13 5.023 8.722 -8.994 99 HG22 VAL 13 HG22 VAL 13 4.350 7.092 -9.009 100 HG23 VAL 13 HG23 VAL 13 5.072 7.760 -10.471 101 H GLN 14 HN GLN 14 7.302 5.069 -6.145 102 HA GLN 14 HA GLN 14 10.145 5.627 -6.339 103 HB2 GLN 14 HB2 GLN 14 9.554 6.572 -4.266 104 HB3 GLN 14 HB1 GLN 14 8.447 5.263 -3.888 105 HG2 GLN 14 HG2 GLN 14 10.227 3.780 -3.490 106 HG3 GLN 14 HG1 GLN 14 11.421 4.935 -4.075 107 HE21 GLN 14 HE21 GLN 14 10.014 7.156 -2.789 108 HE22 GLN 14 HE22 GLN 14 10.382 7.022 -1.104 109 H ARG 15 HN ARG 15 11.448 3.813 -6.156 110 HA ARG 15 HA ARG 15 10.185 1.244 -6.568 111 HB2 ARG 15 HB2 ARG 15 12.810 2.417 -7.491 112 HB3 ARG 15 HB1 ARG 15 12.318 0.764 -7.751 113 HG2 ARG 15 HG2 ARG 15 10.222 2.393 -8.687 114 HG3 ARG 15 HG1 ARG 15 11.737 3.054 -9.313 115 HD2 ARG 15 HD2 ARG 15 10.984 0.152 -9.461 116 HD3 ARG 15 HD1 ARG 15 10.681 1.309 -10.760 117 HE ARG 15 HE ARG 15 13.401 1.394 -10.044 118 HH11 ARG 15 HH11 ARG 15 11.092 -0.689 -11.643 119 HH12 ARG 15 HH12 ARG 15 12.279 -1.477 -12.632 120 HH21 ARG 15 HH21 ARG 15 14.977 0.368 -11.356 121 HH22 ARG 15 HH22 ARG 15 14.484 -0.845 -12.502 122 H VAL 16 HN VAL 16 10.380 0.002 -4.790 123 HA VAL 16 HA VAL 16 12.982 -0.032 -3.527 124 HB VAL 16 HB VAL 16 11.755 1.450 -2.067 125 HG11 VAL 16 HG11 VAL 16 9.692 -0.719 -1.820 126 HG12 VAL 16 HG12 VAL 16 9.504 0.794 -2.718 127 HG13 VAL 16 HG13 VAL 16 9.696 0.823 -0.960 128 HG21 VAL 16 HG21 VAL 16 11.946 -1.282 -0.795 129 HG22 VAL 16 HG22 VAL 16 11.876 0.252 0.081 130 HG23 VAL 16 HG23 VAL 16 13.262 -0.122 -0.953 131 H GLU 17 HN GLU 17 13.535 -2.028 -2.756 132 HA GLU 17 HA GLU 17 11.698 -4.203 -3.370 133 HB2 GLU 17 HB2 GLU 17 13.980 -5.506 -3.557 134 HB3 GLU 17 HB1 GLU 17 13.338 -4.590 -4.906 135 HG2 GLU 17 HG2 GLU 17 14.804 -2.666 -3.919 136 HG3 GLU 17 HG1 GLU 17 15.666 -3.999 -3.149 137 H ILE 18 HN ILE 18 10.946 -5.076 -1.688 138 HA ILE 18 HA ILE 18 12.083 -4.707 0.928 139 HB ILE 18 HB ILE 18 9.374 -5.734 0.045 140 HG12 ILE 18 HG12 ILE 18 9.508 -3.472 -0.632 141 HG13 ILE 18 HG11 ILE 18 8.587 -3.479 0.868 142 HG21 ILE 18 HG21 ILE 18 9.998 -6.529 2.255 143 HG22 ILE 18 HG22 ILE 18 8.686 -5.353 2.356 144 HG23 ILE 18 HG23 ILE 18 10.334 -4.874 2.767 145 HD11 ILE 18 HD11 ILE 18 11.519 -2.907 0.702 146 HD12 ILE 18 HD12 ILE 18 10.455 -2.696 2.094 147 HD13 ILE 18 HD13 ILE 18 10.263 -1.663 0.679 148 H HIS 19 HN HIS 19 13.522 -6.243 1.327 149 HA HIS 19 HA HIS 19 12.975 -8.915 0.434 150 HB2 HIS 19 HB2 HIS 19 15.342 -9.307 0.874 151 HB3 HIS 19 HB1 HIS 19 15.030 -7.980 -0.228 152 HD1 HIS 19 HD1 HIS 19 16.313 -8.656 3.261 153 HD2 HIS 19 HD2 HIS 19 16.088 -5.606 0.443 154 HE1 HIS 19 HE1 HIS 19 17.786 -6.812 4.140 155 HE2 HIS 19 HE2 HIS 19 17.835 -5.099 2.284 156 H LYS 20 HN LYS 20 11.614 -9.800 1.757 157 HA LYS 20 HA LYS 20 11.471 -9.625 4.549 158 HB2 LYS 20 HB2 LYS 20 9.961 -11.493 4.382 159 HB3 LYS 20 HB1 LYS 20 9.690 -10.428 3.007 160 HG2 LYS 20 HG2 LYS 20 11.648 -12.439 2.365 161 HG3 LYS 20 HG1 LYS 20 10.157 -13.176 2.955 162 HD2 LYS 20 HD2 LYS 20 10.326 -11.121 0.753 163 HD3 LYS 20 HD1 LYS 20 10.183 -12.862 0.500 164 HE2 LYS 20 HE2 LYS 20 8.069 -12.767 1.864 165 HE3 LYS 20 HE1 LYS 20 8.193 -11.008 1.784 166 HZ1 LYS 20 HZ1 LYS 20 8.119 -12.770 -0.604 167 HZ2 LYS 20 HZ2 LYS 20 8.002 -11.078 -0.572 168 HZ3 LYS 20 HZ3 LYS 20 6.751 -12.017 0.051 169 H LEU 21 HN LEU 21 11.585 -11.850 5.879 170 HA LEU 21 HA LEU 21 13.929 -13.393 5.125 171 HB2 LEU 21 HB2 LEU 21 14.741 -11.356 6.378 172 HB3 LEU 21 HB1 LEU 21 13.888 -11.973 7.783 173 HG LEU 21 HG LEU 21 16.507 -12.433 7.283 174 HD11 LEU 21 HD11 LEU 21 15.392 -12.860 9.380 175 HD12 LEU 21 HD12 LEU 21 16.377 -14.243 8.905 176 HD13 LEU 21 HD13 LEU 21 14.625 -14.295 8.700 177 HD21 LEU 21 HD21 LEU 21 15.991 -13.775 5.269 178 HD22 LEU 21 HD22 LEU 21 15.095 -14.915 6.280 179 HD23 LEU 21 HD23 LEU 21 16.833 -14.700 6.507 180 H ARG 22 HN ARG 22 13.247 -15.378 5.329 181 HA ARG 22 HA ARG 22 11.477 -16.379 7.266 182 HB2 ARG 22 HB2 ARG 22 11.912 -17.570 5.238 183 HB3 ARG 22 HB1 ARG 22 13.614 -17.704 5.662 184 HG2 ARG 22 HG2 ARG 22 13.061 -19.105 7.560 185 HG3 ARG 22 HG1 ARG 22 11.335 -18.969 7.156 186 HD2 ARG 22 HD2 ARG 22 11.515 -20.422 5.508 187 HD3 ARG 22 HD1 ARG 22 12.913 -19.531 4.914 188 HE ARG 22 HE ARG 22 14.120 -20.879 6.781 189 HH11 ARG 22 HH11 ARG 22 11.568 -22.044 4.682 190 HH12 ARG 22 HH12 ARG 22 12.127 -23.687 4.699 191 HH21 ARG 22 HH21 ARG 22 14.861 -23.036 6.791 192 HH22 ARG 22 HH22 ARG 22 13.985 -24.258 5.923 193 H GLN 23 HN GLN 23 11.919 -17.519 9.116 194 HA GLN 23 HA GLN 23 14.594 -17.303 10.214 195 HB2 GLN 23 HB2 GLN 23 12.312 -16.467 11.934 196 HB3 GLN 23 HB1 GLN 23 13.999 -16.016 12.013 197 HG2 GLN 23 HG2 GLN 23 13.648 -14.756 9.860 198 HG3 GLN 23 HG1 GLN 23 11.922 -15.009 10.128 199 HE21 GLN 23 HE21 GLN 23 13.326 -12.555 9.936 200 HE22 GLN 23 HE22 GLN 23 13.125 -11.712 11.451 201 H GLY 24 HN GLY 24 13.964 -19.524 9.441 202 HA2 GLY 24 HA2 GLY 24 13.803 -21.723 10.053 203 HA3 GLY 24 HA1 GLY 24 13.828 -21.168 11.725 204 H GLU 25 HN GLU 25 12.051 -21.012 12.837 205 HA GLU 25 HA GLU 25 9.689 -22.324 11.859 206 HB2 GLU 25 HB2 GLU 25 10.621 -21.199 14.473 207 HB3 GLU 25 HB1 GLU 25 8.921 -21.560 14.228 208 HG2 GLU 25 HG2 GLU 25 9.343 -23.861 13.930 209 HG3 GLU 25 HG1 GLU 25 11.069 -23.586 13.701 210 H ASN 26 HN ASN 26 10.870 -19.370 11.389 211 HA ASN 26 HA ASN 26 8.280 -18.076 11.442 212 HB2 ASN 26 HB2 ASN 26 11.040 -16.908 11.618 213 HB3 ASN 26 HB1 ASN 26 9.588 -15.974 11.377 214 HD21 ASN 26 HD21 ASN 26 11.471 -17.785 13.437 215 HD22 ASN 26 HD22 ASN 26 10.708 -17.340 14.940 216 H LEU 27 HN LEU 27 7.732 -17.078 9.807 217 HA LEU 27 HA LEU 27 9.390 -16.758 7.415 218 HB2 LEU 27 HB2 LEU 27 6.680 -17.981 7.714 219 HB3 LEU 27 HB1 LEU 27 6.939 -16.936 6.348 220 HG LEU 27 HG LEU 27 7.233 -19.261 5.707 221 HD11 LEU 27 HD11 LEU 27 8.574 -17.622 4.541 222 HD12 LEU 27 HD12 LEU 27 9.475 -19.127 4.729 223 HD13 LEU 27 HD13 LEU 27 9.833 -17.748 5.769 224 HD21 LEU 27 HD21 LEU 27 9.136 -20.562 6.637 225 HD22 LEU 27 HD22 LEU 27 7.862 -20.237 7.811 226 HD23 LEU 27 HD23 LEU 27 9.356 -19.298 7.852 227 H ILE 28 HN ILE 28 9.673 -14.620 7.441 228 HA ILE 28 HA ILE 28 7.420 -12.889 8.193 229 HB ILE 28 HB ILE 28 10.211 -11.921 7.797 230 HG12 ILE 28 HG12 ILE 28 10.464 -13.872 9.281 231 HG13 ILE 28 HG11 ILE 28 10.812 -12.363 10.107 232 HG21 ILE 28 HG21 ILE 28 8.647 -10.242 8.094 233 HG22 ILE 28 HG22 ILE 28 9.491 -10.387 9.637 234 HG23 ILE 28 HG23 ILE 28 7.879 -11.076 9.444 235 HD11 ILE 28 HD11 ILE 28 8.700 -12.465 11.265 236 HD12 ILE 28 HD12 ILE 28 9.560 -13.999 11.485 237 HD13 ILE 28 HD13 ILE 28 8.223 -13.882 10.334 238 H LEU 29 HN LEU 29 6.463 -11.774 6.566 239 HA LEU 29 HA LEU 29 7.817 -11.772 3.967 240 HB2 LEU 29 HB2 LEU 29 5.068 -10.661 4.304 241 HB3 LEU 29 HB1 LEU 29 5.762 -11.526 2.948 242 HG LEU 29 HG LEU 29 4.678 -12.680 5.510 243 HD11 LEU 29 HD11 LEU 29 3.958 -13.120 2.622 244 HD12 LEU 29 HD12 LEU 29 3.022 -12.210 3.809 245 HD13 LEU 29 HD13 LEU 29 3.242 -13.950 4.002 246 HD21 LEU 29 HD21 LEU 29 6.213 -14.117 3.360 247 HD22 LEU 29 HD22 LEU 29 5.398 -14.859 4.741 248 HD23 LEU 29 HD23 LEU 29 6.771 -13.776 4.999 249 H GLY 30 HN GLY 30 6.433 -9.649 6.409 250 HA2 GLY 30 HA2 GLY 30 8.526 -7.933 6.527 251 HA3 GLY 30 HA1 GLY 30 7.654 -7.334 5.135 252 H PHE 31 HN PHE 31 5.046 -7.252 5.844 253 HA PHE 31 HA PHE 31 4.799 -5.627 8.231 254 HB2 PHE 31 HB2 PHE 31 4.495 -3.495 6.915 255 HB3 PHE 31 HB1 PHE 31 6.148 -4.083 7.061 256 HD1 PHE 31 HD1 PHE 31 3.321 -3.614 4.819 257 HD2 PHE 31 HD2 PHE 31 7.349 -4.879 5.160 258 HE1 PHE 31 HE1 PHE 31 3.534 -3.563 2.391 259 HE2 PHE 31 HE2 PHE 31 7.580 -4.842 2.729 260 HZ PHE 31 HZ PHE 31 5.711 -4.161 1.321 261 H SER 32 HN SER 32 2.742 -3.964 7.626 262 HA SER 32 HA SER 32 0.712 -5.915 6.739 263 HB2 SER 32 HB2 SER 32 0.549 -5.409 9.173 264 HB3 SER 32 HB1 SER 32 0.307 -3.706 8.776 265 HG SER 32 HG SER 32 -1.739 -4.270 8.733 266 H ILE 33 HN ILE 33 -0.920 -5.205 5.373 267 HA ILE 33 HA ILE 33 -0.458 -2.536 4.246 268 HB ILE 33 HB ILE 33 -0.720 -3.371 1.982 269 HG12 ILE 33 HG12 ILE 33 -0.658 -6.182 3.109 270 HG13 ILE 33 HG11 ILE 33 -2.143 -5.365 2.628 271 HG21 ILE 33 HG21 ILE 33 1.396 -4.735 1.842 272 HG22 ILE 33 HG22 ILE 33 1.416 -4.733 3.609 273 HG23 ILE 33 HG23 ILE 33 1.529 -3.214 2.725 274 HD11 ILE 33 HD11 ILE 33 -1.284 -6.892 0.901 275 HD12 ILE 33 HD12 ILE 33 0.182 -5.919 0.797 276 HD13 ILE 33 HD13 ILE 33 -1.373 -5.221 0.343 277 H GLY 34 HN GLY 34 -2.261 -1.553 3.355 278 HA2 GLY 34 HA2 GLY 34 -4.761 -2.781 4.294 279 HA3 GLY 34 HA1 GLY 34 -4.455 -1.045 4.294 280 H GLY 35 HN GLY 35 -6.249 -3.224 2.871 281 HA2 GLY 35 HA2 GLY 35 -6.062 -2.033 0.192 282 HA3 GLY 35 HA1 GLY 35 -6.792 -3.600 0.555 283 H GLY 36 HN GLY 36 -7.662 -0.911 -0.615 284 HA2 GLY 36 HA2 GLY 36 -10.271 -0.851 0.721 285 HA3 GLY 36 HA1 GLY 36 -9.371 0.658 0.579 286 H ILE 37 HN ILE 37 -10.273 -2.095 -1.445 287 HA ILE 37 HA ILE 37 -10.744 -0.256 -3.675 288 HB ILE 37 HB ILE 37 -9.865 -1.968 -5.194 289 HG12 ILE 37 HG12 ILE 37 -10.311 -3.903 -3.512 290 HG13 ILE 37 HG11 ILE 37 -8.894 -3.990 -4.540 291 HG21 ILE 37 HG21 ILE 37 -8.382 -0.245 -4.470 292 HG22 ILE 37 HG22 ILE 37 -7.479 -1.760 -4.542 293 HG23 ILE 37 HG23 ILE 37 -8.019 -1.124 -2.986 294 HD11 ILE 37 HD11 ILE 37 -7.539 -3.120 -2.642 295 HD12 ILE 37 HD12 ILE 37 -8.265 -4.701 -2.366 296 HD13 ILE 37 HD13 ILE 37 -8.972 -3.269 -1.627 297 H ASP 38 HN ASP 38 -11.512 -3.311 -2.145 298 HA ASP 38 HA ASP 38 -14.103 -3.300 -3.528 299 HB2 ASP 38 HB2 ASP 38 -14.008 -5.839 -2.872 300 HB3 ASP 38 HB1 ASP 38 -13.141 -5.274 -4.286 301 H GLN 39 HN GLN 39 -13.242 -1.955 -1.059 302 HA GLN 39 HA GLN 39 -14.477 -3.525 1.063 303 HB2 GLN 39 HB2 GLN 39 -13.300 -0.768 1.334 304 HB3 GLN 39 HB1 GLN 39 -13.577 -1.959 2.602 305 HG2 GLN 39 HG2 GLN 39 -11.662 -2.211 0.329 306 HG3 GLN 39 HG1 GLN 39 -11.238 -1.824 1.996 307 HE21 GLN 39 HE21 GLN 39 -10.821 -4.171 0.043 308 HE22 GLN 39 HE22 GLN 39 -11.184 -5.555 0.996 309 H ASP 40 HN ASP 40 -14.667 -0.088 0.547 310 HA ASP 40 HA ASP 40 -17.531 -0.151 0.867 311 HB2 ASP 40 HB2 ASP 40 -17.131 -0.322 3.095 312 HB3 ASP 40 HB1 ASP 40 -15.532 0.383 2.983 313 HA PRO 41 HA PRO 41 -17.074 3.627 -1.429 314 HB2 PRO 41 HB2 PRO 41 -19.576 4.524 -1.292 315 HB3 PRO 41 HB1 PRO 41 -19.220 3.004 -2.132 316 HG2 PRO 41 HG2 PRO 41 -20.191 3.412 0.686 317 HG3 PRO 41 HG1 PRO 41 -20.845 2.348 -0.559 318 HD2 PRO 41 HD2 PRO 41 -19.174 1.445 1.347 319 HD3 PRO 41 HD1 PRO 41 -19.162 0.781 -0.301 320 H SER 42 HN SER 42 -17.805 3.480 1.874 321 HA SER 42 HA SER 42 -18.310 6.242 2.367 322 HB2 SER 42 HB2 SER 42 -18.943 4.176 3.786 323 HB3 SER 42 HB1 SER 42 -17.296 4.273 4.413 324 HG SER 42 HG SER 42 -19.043 5.415 5.604 325 H GLN 43 HN GLN 43 -15.407 4.372 1.899 326 HA GLN 43 HA GLN 43 -13.727 6.198 3.364 327 HB2 GLN 43 HB2 GLN 43 -11.934 4.784 2.584 328 HB3 GLN 43 HB1 GLN 43 -13.232 3.817 3.257 329 HG2 GLN 43 HG2 GLN 43 -13.937 3.823 0.671 330 HG3 GLN 43 HG1 GLN 43 -12.191 3.958 0.523 331 HE21 GLN 43 HE21 GLN 43 -14.121 2.343 2.956 332 HE22 GLN 43 HE22 GLN 43 -13.490 0.746 2.691 333 H ASN 44 HN ASN 44 -15.213 6.114 0.419 334 HA ASN 44 HA ASN 44 -14.220 8.607 -0.442 335 HB2 ASN 44 HB2 ASN 44 -12.578 6.458 -1.083 336 HB3 ASN 44 HB1 ASN 44 -13.498 6.794 -2.539 337 HD21 ASN 44 HD21 ASN 44 -11.380 8.183 -0.121 338 HD22 ASN 44 HD22 ASN 44 -10.788 9.472 -1.115 339 HA PRO 45 HA PRO 45 -18.411 7.871 -1.908 340 HB2 PRO 45 HB2 PRO 45 -18.523 10.411 -3.075 341 HB3 PRO 45 HB1 PRO 45 -19.040 9.997 -1.433 342 HG2 PRO 45 HG2 PRO 45 -16.480 11.213 -2.371 343 HG3 PRO 45 HG1 PRO 45 -17.408 11.538 -0.896 344 HD2 PRO 45 HD2 PRO 45 -15.175 10.065 -0.835 345 HD3 PRO 45 HD1 PRO 45 -16.568 9.667 0.192 346 H PHE 46 HN PHE 46 -15.568 8.635 -3.676 347 HA PHE 46 HA PHE 46 -16.451 7.172 -5.943 348 HB2 PHE 46 HB2 PHE 46 -17.522 9.458 -6.249 349 HB3 PHE 46 HB1 PHE 46 -15.889 10.100 -6.425 350 HD1 PHE 46 HD1 PHE 46 -18.356 7.768 -7.900 351 HD2 PHE 46 HD2 PHE 46 -14.743 9.942 -8.469 352 HE1 PHE 46 HE1 PHE 46 -18.412 7.227 -10.299 353 HE2 PHE 46 HE2 PHE 46 -14.791 9.406 -10.867 354 HZ PHE 46 HZ PHE 46 -16.630 8.045 -11.787 355 H SER 47 HN SER 47 -14.005 9.324 -4.483 356 HA SER 47 HA SER 47 -11.681 8.466 -5.369 357 HB2 SER 47 HB2 SER 47 -12.427 8.134 -7.610 358 HB3 SER 47 HB1 SER 47 -13.128 9.747 -7.691 359 HG SER 47 HG SER 47 -10.699 8.980 -8.392 360 H GLU 48 HN GLU 48 -10.078 9.992 -5.156 361 HA GLU 48 HA GLU 48 -10.919 12.773 -4.914 362 HB2 GLU 48 HB2 GLU 48 -9.964 11.023 -2.765 363 HB3 GLU 48 HB1 GLU 48 -9.157 12.591 -2.839 364 HG2 GLU 48 HG2 GLU 48 -12.127 12.118 -2.631 365 HG3 GLU 48 HG1 GLU 48 -11.066 12.622 -1.319 366 H ASP 49 HN ASP 49 -8.980 10.633 -6.391 367 HA ASP 49 HA ASP 49 -7.287 12.813 -7.264 368 HB2 ASP 49 HB2 ASP 49 -6.179 11.341 -5.296 369 HB3 ASP 49 HB1 ASP 49 -5.713 10.370 -6.693 370 H LYS 50 HN LYS 50 -9.399 10.891 -8.119 371 HA LYS 50 HA LYS 50 -10.087 10.284 -10.165 372 HB2 LYS 50 HB2 LYS 50 -7.510 11.533 -10.782 373 HB3 LYS 50 HB1 LYS 50 -8.091 10.389 -11.984 374 HG2 LYS 50 HG2 LYS 50 -9.598 12.792 -10.961 375 HG3 LYS 50 HG1 LYS 50 -8.783 12.661 -12.525 376 HD2 LYS 50 HD2 LYS 50 -10.226 10.724 -13.056 377 HD3 LYS 50 HD1 LYS 50 -11.084 10.996 -11.541 378 HE2 LYS 50 HE2 LYS 50 -10.898 12.934 -13.851 379 HE3 LYS 50 HE1 LYS 50 -12.305 11.963 -13.420 380 HZ1 LYS 50 HZ1 LYS 50 -12.839 13.894 -12.392 381 HZ2 LYS 50 HZ2 LYS 50 -11.231 14.362 -12.125 382 HZ3 LYS 50 HZ3 LYS 50 -11.950 13.193 -11.133 383 H THR 51 HN THR 51 -6.792 9.231 -10.657 384 HA THR 51 HA THR 51 -7.984 6.699 -11.521 385 HB THR 51 HB THR 51 -5.829 6.432 -12.787 386 HG1 THR 51 HG1 THR 51 -4.741 8.079 -11.389 387 HG21 THR 51 HG21 THR 51 -6.477 8.061 -14.516 388 HG22 THR 51 HG22 THR 51 -7.507 8.875 -13.335 389 HG23 THR 51 HG23 THR 51 -7.875 7.227 -13.835 390 H ASP 52 HN ASP 52 -7.459 7.149 -8.757 391 HA ASP 52 HA ASP 52 -5.074 5.744 -8.112 392 HB2 ASP 52 HB2 ASP 52 -6.161 7.339 -6.539 393 HB3 ASP 52 HB1 ASP 52 -7.493 6.194 -6.354 394 H LYS 53 HN LYS 53 -4.966 3.825 -7.170 395 HA LYS 53 HA LYS 53 -6.767 1.745 -8.166 396 HB2 LYS 53 HB2 LYS 53 -4.160 1.378 -6.693 397 HB3 LYS 53 HB1 LYS 53 -5.006 0.202 -7.686 398 HG2 LYS 53 HG2 LYS 53 -3.691 2.717 -8.689 399 HG3 LYS 53 HG1 LYS 53 -3.021 1.089 -8.795 400 HD2 LYS 53 HD2 LYS 53 -5.024 0.426 -10.113 401 HD3 LYS 53 HD1 LYS 53 -5.519 2.121 -10.112 402 HE2 LYS 53 HE2 LYS 53 -4.312 1.461 -12.174 403 HE3 LYS 53 HE1 LYS 53 -3.509 2.756 -11.285 404 HZ1 LYS 53 HZ1 LYS 53 -2.053 1.028 -10.296 405 HZ2 LYS 53 HZ2 LYS 53 -1.868 1.179 -11.968 406 HZ3 LYS 53 HZ3 LYS 53 -2.748 -0.119 -11.328 407 H GLY 54 HN GLY 54 -5.451 3.184 -5.289 408 HA2 GLY 54 HA2 GLY 54 -6.363 3.264 -3.155 409 HA3 GLY 54 HA1 GLY 54 -7.603 2.131 -3.671 410 H ILE 55 HN ILE 55 -4.158 1.452 -3.991 411 HA ILE 55 HA ILE 55 -4.309 -0.482 -1.756 412 HB ILE 55 HB ILE 55 -2.665 -0.578 -4.294 413 HG12 ILE 55 HG12 ILE 55 -5.049 -1.377 -4.371 414 HG13 ILE 55 HG11 ILE 55 -3.846 -2.592 -4.800 415 HG21 ILE 55 HG21 ILE 55 -2.473 -2.354 -1.867 416 HG22 ILE 55 HG22 ILE 55 -1.220 -1.290 -2.509 417 HG23 ILE 55 HG23 ILE 55 -1.730 -2.710 -3.428 418 HD11 ILE 55 HD11 ILE 55 -4.026 -3.542 -2.537 419 HD12 ILE 55 HD12 ILE 55 -5.570 -3.560 -3.392 420 HD13 ILE 55 HD13 ILE 55 -5.266 -2.347 -2.146 421 H TYR 56 HN TYR 56 -2.896 -0.163 -0.043 422 HA TYR 56 HA TYR 56 -0.304 0.992 -0.498 423 HB2 TYR 56 HB2 TYR 56 -0.570 2.975 0.906 424 HB3 TYR 56 HB1 TYR 56 -1.634 3.042 -0.493 425 HD1 TYR 56 HD1 TYR 56 -4.060 2.518 -0.188 426 HD2 TYR 56 HD2 TYR 56 -1.426 3.096 3.093 427 HE1 TYR 56 HE1 TYR 56 -5.995 2.903 1.279 428 HE2 TYR 56 HE2 TYR 56 -3.353 3.485 4.581 429 HH TYR 56 HH TYR 56 -5.698 4.195 4.406 430 H VAL 57 HN VAL 57 1.030 1.108 1.464 431 HA VAL 57 HA VAL 57 0.467 -0.983 3.304 432 HB VAL 57 HB VAL 57 2.747 -0.118 2.331 433 HG11 VAL 57 HG11 VAL 57 3.108 1.988 3.016 434 HG12 VAL 57 HG12 VAL 57 3.850 1.119 4.362 435 HG13 VAL 57 HG13 VAL 57 2.216 1.769 4.519 436 HG21 VAL 57 HG21 VAL 57 3.868 -1.241 4.065 437 HG22 VAL 57 HG22 VAL 57 2.288 -2.003 3.863 438 HG23 VAL 57 HG23 VAL 57 2.569 -0.885 5.200 439 H THR 58 HN THR 58 -0.008 -0.805 5.448 440 HA THR 58 HA THR 58 -0.745 1.878 6.390 441 HB THR 58 HB THR 58 -2.692 0.389 6.012 442 HG1 THR 58 HG1 THR 58 -3.493 0.571 8.272 443 HG21 THR 58 HG21 THR 58 -1.633 -1.756 6.455 444 HG22 THR 58 HG22 THR 58 -3.036 -1.537 7.502 445 HG23 THR 58 HG23 THR 58 -1.411 -1.317 8.148 446 H ARG 59 HN ARG 59 1.356 -0.724 6.775 447 HA ARG 59 HA ARG 59 2.549 0.486 9.053 448 HB2 ARG 59 HB2 ARG 59 1.709 -0.659 10.773 449 HB3 ARG 59 HB1 ARG 59 0.545 -1.337 9.667 450 HG2 ARG 59 HG2 ARG 59 1.944 -3.245 9.255 451 HG3 ARG 59 HG1 ARG 59 3.204 -2.562 10.285 452 HD2 ARG 59 HD2 ARG 59 0.451 -3.426 11.139 453 HD3 ARG 59 HD1 ARG 59 1.965 -4.248 11.500 454 HE ARG 59 HE ARG 59 1.326 -1.549 12.506 455 HH11 ARG 59 HH11 ARG 59 2.664 -4.756 12.936 456 HH12 ARG 59 HH12 ARG 59 3.000 -4.528 14.625 457 HH21 ARG 59 HH21 ARG 59 1.818 -1.235 14.720 458 HH22 ARG 59 HH22 ARG 59 2.548 -2.518 15.621 459 H VAL 60 HN VAL 60 4.254 -1.020 9.951 460 HA VAL 60 HA VAL 60 5.511 -2.710 7.999 461 HB VAL 60 HB VAL 60 6.855 -0.276 9.199 462 HG11 VAL 60 HG11 VAL 60 8.293 -2.265 9.099 463 HG12 VAL 60 HG12 VAL 60 8.868 -0.979 8.042 464 HG13 VAL 60 HG13 VAL 60 8.023 -2.370 7.361 465 HG21 VAL 60 HG21 VAL 60 5.415 0.314 7.331 466 HG22 VAL 60 HG22 VAL 60 6.194 -0.911 6.328 467 HG23 VAL 60 HG23 VAL 60 7.111 0.489 6.885 468 H SER 61 HN SER 61 6.663 -4.306 9.096 469 HA SER 61 HA SER 61 6.535 -4.205 11.992 470 HB2 SER 61 HB2 SER 61 8.106 -6.152 10.328 471 HB3 SER 61 HB1 SER 61 7.520 -6.369 11.979 472 HG SER 61 HG SER 61 6.248 -6.837 9.622 473 H GLU 62 HN GLU 62 7.884 -2.845 12.949 474 HA GLU 62 HA GLU 62 10.009 -1.672 11.641 475 HB2 GLU 62 HB2 GLU 62 8.826 -0.304 13.101 476 HB3 GLU 62 HB1 GLU 62 8.854 -1.511 14.369 477 HG2 GLU 62 HG2 GLU 62 10.971 -1.061 14.967 478 HG3 GLU 62 HG1 GLU 62 11.368 -0.361 13.407 479 H GLY 63 HN GLY 63 12.023 -1.846 11.950 480 HA2 GLY 63 HA2 GLY 63 14.040 -2.982 12.286 481 HA3 GLY 63 HA1 GLY 63 13.236 -3.950 13.529 482 H GLY 64 HN GLY 64 12.045 -3.441 10.272 483 HA2 GLY 64 HA2 GLY 64 12.493 -6.267 9.710 484 HA3 GLY 64 HA1 GLY 64 10.870 -5.588 9.588 485 HA PRO 65 HA PRO 65 14.706 -5.034 6.114 486 HB2 PRO 65 HB2 PRO 65 12.630 -7.016 5.372 487 HB3 PRO 65 HB1 PRO 65 14.253 -6.848 4.708 488 HG2 PRO 65 HG2 PRO 65 13.763 -8.507 6.773 489 HG3 PRO 65 HG1 PRO 65 15.278 -7.588 6.659 490 HD2 PRO 65 HD2 PRO 65 13.164 -7.304 8.605 491 HD3 PRO 65 HD1 PRO 65 14.679 -6.385 8.511 492 H ALA 66 HN ALA 66 11.358 -4.452 6.268 493 HA ALA 66 HA ALA 66 11.052 -3.586 3.503 494 HB1 ALA 66 HB1 ALA 66 8.949 -2.537 4.424 495 HB2 ALA 66 HB2 ALA 66 9.392 -3.228 5.997 496 HB3 ALA 66 HB3 ALA 66 9.074 -4.295 4.625 497 H GLU 67 HN GLU 67 11.880 -2.246 6.629 498 HA GLU 67 HA GLU 67 11.498 0.487 5.769 499 HB2 GLU 67 HB2 GLU 67 12.646 0.777 8.119 500 HB3 GLU 67 HB1 GLU 67 10.958 0.282 7.985 501 HG2 GLU 67 HG2 GLU 67 11.384 -1.846 8.608 502 HG3 GLU 67 HG1 GLU 67 13.020 -1.835 7.974 503 H ILE 68 HN ILE 68 14.030 -1.841 6.164 504 HA ILE 68 HA ILE 68 16.066 0.131 6.000 505 HB ILE 68 HB ILE 68 17.515 -1.781 5.707 506 HG12 ILE 68 HG12 ILE 68 15.085 -3.377 6.383 507 HG13 ILE 68 HG11 ILE 68 15.838 -3.332 4.791 508 HG21 ILE 68 HG21 ILE 68 17.319 -2.469 8.075 509 HG22 ILE 68 HG22 ILE 68 15.729 -1.702 8.099 510 HG23 ILE 68 HG23 ILE 68 17.175 -0.724 7.849 511 HD11 ILE 68 HD11 ILE 68 16.507 -5.314 5.983 512 HD12 ILE 68 HD12 ILE 68 17.082 -4.328 7.329 513 HD13 ILE 68 HD13 ILE 68 17.888 -4.233 5.767 514 H ALA 69 HN ALA 69 14.259 -1.904 4.022 515 HA ALA 69 HA ALA 69 15.745 -1.542 1.647 516 HB1 ALA 69 HB1 ALA 69 14.142 -3.315 1.646 517 HB2 ALA 69 HB2 ALA 69 13.555 -2.100 0.505 518 HB3 ALA 69 HB3 ALA 69 12.847 -2.216 2.115 519 H GLY 70 HN GLY 70 13.433 0.179 3.526 520 HA2 GLY 70 HA2 GLY 70 13.572 2.611 3.474 521 HA3 GLY 70 HA1 GLY 70 13.860 2.512 1.739 522 H LEU 71 HN LEU 71 11.350 1.004 3.770 523 HA LEU 71 HA LEU 71 9.379 2.354 2.181 524 HB2 LEU 71 HB2 LEU 71 8.036 0.502 2.389 525 HB3 LEU 71 HB1 LEU 71 9.609 -0.213 2.201 526 HG LEU 71 HG LEU 71 9.302 -1.462 3.954 527 HD11 LEU 71 HD11 LEU 71 8.889 -0.804 6.191 528 HD12 LEU 71 HD12 LEU 71 8.311 0.781 5.681 529 HD13 LEU 71 HD13 LEU 71 10.008 0.351 5.470 530 HD21 LEU 71 HD21 LEU 71 7.123 -1.647 3.115 531 HD22 LEU 71 HD22 LEU 71 6.595 -0.206 3.978 532 HD23 LEU 71 HD23 LEU 71 7.028 -1.663 4.875 533 H GLN 72 HN GLN 72 7.281 2.224 3.854 534 HA GLN 72 HA GLN 72 7.888 3.109 6.412 535 HB2 GLN 72 HB2 GLN 72 7.429 5.555 6.031 536 HB3 GLN 72 HB1 GLN 72 8.949 4.940 5.384 537 HG2 GLN 72 HG2 GLN 72 8.385 5.972 3.539 538 HG3 GLN 72 HG1 GLN 72 7.322 4.588 3.289 539 HE21 GLN 72 HE21 GLN 72 5.805 5.705 2.151 540 HE22 GLN 72 HE22 GLN 72 4.780 6.893 2.912 541 H ILE 73 HN ILE 73 5.868 4.455 7.206 542 HA ILE 73 HA ILE 73 3.662 2.711 6.646 543 HB ILE 73 HB ILE 73 3.450 5.112 8.421 544 HG12 ILE 73 HG12 ILE 73 5.666 4.333 9.010 545 HG13 ILE 73 HG11 ILE 73 4.548 3.833 10.272 546 HG21 ILE 73 HG21 ILE 73 2.569 2.262 8.646 547 HG22 ILE 73 HG22 ILE 73 1.573 3.635 8.171 548 HG23 ILE 73 HG23 ILE 73 2.210 3.532 9.813 549 HD11 ILE 73 HD11 ILE 73 5.654 2.098 8.071 550 HD12 ILE 73 HD12 ILE 73 4.482 1.581 9.293 551 HD13 ILE 73 HD13 ILE 73 6.109 2.061 9.781 552 H GLY 74 HN GLY 74 2.492 3.132 4.892 553 HA2 GLY 74 HA2 GLY 74 0.568 4.459 4.144 554 HA3 GLY 74 HA1 GLY 74 1.484 5.910 4.584 555 H ASP 75 HN ASP 75 1.712 3.022 2.552 556 HA ASP 75 HA ASP 75 3.223 4.611 0.586 557 HB2 ASP 75 HB2 ASP 75 4.453 2.890 2.390 558 HB3 ASP 75 HB1 ASP 75 4.291 1.920 0.926 559 H LYS 76 HN LYS 76 2.321 4.330 -1.329 560 HA LYS 76 HA LYS 76 0.165 2.448 -1.587 561 HB2 LYS 76 HB2 LYS 76 1.031 4.947 -2.647 562 HB3 LYS 76 HB1 LYS 76 0.649 3.857 -3.962 563 HG2 LYS 76 HG2 LYS 76 -1.572 3.601 -3.188 564 HG3 LYS 76 HG1 LYS 76 -1.201 4.496 -1.702 565 HD2 LYS 76 HD2 LYS 76 -1.172 6.493 -2.752 566 HD3 LYS 76 HD1 LYS 76 -0.510 5.810 -4.242 567 HE2 LYS 76 HE2 LYS 76 -2.797 6.660 -4.524 568 HE3 LYS 76 HE1 LYS 76 -2.673 4.932 -4.833 569 HZ1 LYS 76 HZ1 LYS 76 -3.509 4.567 -2.554 570 HZ2 LYS 76 HZ2 LYS 76 -4.623 5.344 -3.567 571 HZ3 LYS 76 HZ3 LYS 76 -3.765 6.234 -2.406 572 H ILE 77 HN ILE 77 0.775 0.430 -2.116 573 HA ILE 77 HA ILE 77 2.926 -0.062 -3.978 574 HB ILE 77 HB ILE 77 0.952 -2.078 -2.910 575 HG12 ILE 77 HG12 ILE 77 3.632 -1.368 -1.706 576 HG13 ILE 77 HG11 ILE 77 2.110 -0.700 -1.122 577 HG21 ILE 77 HG21 ILE 77 2.849 -3.637 -3.281 578 HG22 ILE 77 HG22 ILE 77 3.749 -2.311 -4.014 579 HG23 ILE 77 HG23 ILE 77 2.264 -2.892 -4.768 580 HD11 ILE 77 HD11 ILE 77 1.331 -2.957 -0.613 581 HD12 ILE 77 HD12 ILE 77 2.820 -2.560 0.248 582 HD13 ILE 77 HD13 ILE 77 2.873 -3.609 -1.173 583 H MET 78 HN MET 78 2.573 0.377 -6.058 584 HA MET 78 HA MET 78 -0.080 0.013 -7.206 585 HB2 MET 78 HB2 MET 78 2.456 1.018 -8.511 586 HB3 MET 78 HB1 MET 78 0.855 1.040 -9.225 587 HG2 MET 78 HG2 MET 78 1.607 2.534 -6.736 588 HG3 MET 78 HG1 MET 78 1.637 3.227 -8.352 589 HE1 MET 78 HE1 MET 78 -0.798 1.120 -6.015 590 HE2 MET 78 HE2 MET 78 -2.032 2.348 -5.751 591 HE3 MET 78 HE3 MET 78 -0.372 2.632 -5.214 592 H GLN 79 HN GLN 79 3.196 -1.209 -7.582 593 HA GLN 79 HA GLN 79 2.158 -3.686 -8.684 594 HB2 GLN 79 HB2 GLN 79 4.452 -3.192 -10.153 595 HB3 GLN 79 HB1 GLN 79 2.801 -3.294 -10.740 596 HG2 GLN 79 HG2 GLN 79 2.782 -0.766 -9.997 597 HG3 GLN 79 HG1 GLN 79 4.519 -0.991 -10.254 598 HE21 GLN 79 HE21 GLN 79 5.286 -1.570 -12.191 599 HE22 GLN 79 HE22 GLN 79 4.430 -1.310 -13.686 600 H VAL 80 HN VAL 80 3.559 -5.347 -8.781 601 HA VAL 80 HA VAL 80 5.746 -5.048 -6.833 602 HB VAL 80 HB VAL 80 3.927 -6.189 -5.798 603 HG11 VAL 80 HG11 VAL 80 2.962 -8.247 -6.673 604 HG12 VAL 80 HG12 VAL 80 3.963 -8.101 -8.119 605 HG13 VAL 80 HG13 VAL 80 2.728 -6.888 -7.773 606 HG21 VAL 80 HG21 VAL 80 5.005 -8.421 -5.334 607 HG22 VAL 80 HG22 VAL 80 6.101 -7.047 -5.190 608 HG23 VAL 80 HG23 VAL 80 6.153 -8.068 -6.629 609 H ASN 81 HN ASN 81 7.661 -5.805 -7.432 610 HA ASN 81 HA ASN 81 9.317 -6.468 -8.815 611 HB2 ASN 81 HB2 ASN 81 7.288 -8.636 -8.950 612 HB3 ASN 81 HB1 ASN 81 8.631 -8.706 -10.079 613 HD21 ASN 81 HD21 ASN 81 7.650 -9.046 -6.785 614 HD22 ASN 81 HD22 ASN 81 9.181 -9.590 -6.170 615 H GLY 82 HN GLY 82 7.126 -4.688 -9.842 616 HA2 GLY 82 HA2 GLY 82 7.321 -3.360 -11.775 617 HA3 GLY 82 HA1 GLY 82 8.104 -4.701 -12.597 618 H TRP 83 HN TRP 83 5.283 -5.867 -11.093 619 HA TRP 83 HA TRP 83 3.737 -5.234 -13.472 620 HB2 TRP 83 HB2 TRP 83 2.578 -7.430 -12.925 621 HB3 TRP 83 HB1 TRP 83 4.108 -7.490 -13.768 622 HD1 TRP 83 HD1 TRP 83 2.620 -7.905 -10.268 623 HE1 TRP 83 HE1 TRP 83 3.986 -9.691 -9.046 624 HE3 TRP 83 HE3 TRP 83 6.204 -8.837 -13.781 625 HZ2 TRP 83 HZ2 TRP 83 6.197 -11.291 -9.447 626 HZ3 TRP 83 HZ3 TRP 83 7.914 -10.533 -13.269 627 HH2 TRP 83 HH2 TRP 83 7.890 -11.727 -11.129 628 H ASP 84 HN ASP 84 2.302 -3.844 -12.924 629 HA ASP 84 HA ASP 84 1.008 -2.982 -10.886 630 HB2 ASP 84 HB2 ASP 84 0.259 -2.594 -13.229 631 HB3 ASP 84 HB1 ASP 84 -0.596 -4.132 -13.184 632 H MET 85 HN MET 85 0.314 -3.746 -9.076 633 HA MET 85 HA MET 85 -0.737 -6.496 -8.976 634 HB2 MET 85 HB2 MET 85 -0.164 -6.407 -6.582 635 HB3 MET 85 HB1 MET 85 1.235 -6.167 -7.621 636 HG2 MET 85 HG2 MET 85 1.682 -4.383 -6.382 637 HG3 MET 85 HG1 MET 85 0.315 -3.607 -7.179 638 HE1 MET 85 HE1 MET 85 0.433 -6.581 -4.809 639 HE2 MET 85 HE2 MET 85 -0.069 -5.920 -3.244 640 HE3 MET 85 HE3 MET 85 1.518 -5.514 -3.915 641 H THR 86 HN THR 86 -1.989 -3.662 -9.420 642 HA THR 86 HA THR 86 -3.859 -3.642 -7.178 643 HB THR 86 HB THR 86 -4.506 -1.393 -8.050 644 HG1 THR 86 HG1 THR 86 -2.965 -2.216 -10.137 645 HG21 THR 86 HG21 THR 86 -2.885 -1.639 -6.251 646 HG22 THR 86 HG22 THR 86 -2.435 -0.297 -7.304 647 HG23 THR 86 HG23 THR 86 -1.591 -1.840 -7.430 648 H MET 87 HN MET 87 -3.712 -4.286 -10.561 649 HA MET 87 HA MET 87 -6.559 -4.229 -10.987 650 HB2 MET 87 HB2 MET 87 -6.045 -5.311 -13.142 651 HB3 MET 87 HB1 MET 87 -5.053 -3.885 -12.873 652 HG2 MET 87 HG2 MET 87 -3.169 -5.271 -12.277 653 HG3 MET 87 HG1 MET 87 -4.158 -6.724 -12.410 654 HE1 MET 87 HE1 MET 87 -3.104 -4.032 -16.004 655 HE2 MET 87 HE2 MET 87 -2.552 -3.710 -14.360 656 HE3 MET 87 HE3 MET 87 -4.263 -3.581 -14.758 657 H VAL 88 HN VAL 88 -4.546 -6.256 -9.338 658 HA VAL 88 HA VAL 88 -6.130 -8.677 -9.774 659 HB VAL 88 HB VAL 88 -4.045 -8.892 -7.760 660 HG11 VAL 88 HG11 VAL 88 -4.575 -10.226 -10.399 661 HG12 VAL 88 HG12 VAL 88 -4.994 -10.817 -8.783 662 HG13 VAL 88 HG13 VAL 88 -3.303 -10.711 -9.276 663 HG21 VAL 88 HG21 VAL 88 -2.949 -7.117 -9.015 664 HG22 VAL 88 HG22 VAL 88 -3.175 -8.020 -10.513 665 HG23 VAL 88 HG23 VAL 88 -2.118 -8.655 -9.253 666 H THR 89 HN THR 89 -6.213 -9.910 -7.339 667 HA THR 89 HA THR 89 -7.712 -7.988 -5.707 668 HB THR 89 HB THR 89 -7.840 -10.893 -6.228 669 HG1 THR 89 HG1 THR 89 -9.457 -8.762 -6.370 670 HG21 THR 89 HG21 THR 89 -9.105 -11.363 -4.177 671 HG22 THR 89 HG22 THR 89 -8.566 -9.808 -3.540 672 HG23 THR 89 HG23 THR 89 -7.385 -11.065 -3.928 673 H HIS 90 HN HIS 90 -7.359 -8.320 -3.277 674 HA HIS 90 HA HIS 90 -4.668 -7.749 -2.724 675 HB2 HIS 90 HB2 HIS 90 -6.427 -6.938 -1.290 676 HB3 HIS 90 HB1 HIS 90 -6.929 -8.580 -0.905 677 HD1 HIS 90 HD1 HIS 90 -5.572 -9.878 0.828 678 HD2 HIS 90 HD2 HIS 90 -4.183 -6.007 0.169 679 HE1 HIS 90 HE1 HIS 90 -3.946 -9.412 2.676 680 HE2 HIS 90 HE2 HIS 90 -3.336 -6.997 2.411 681 H ASP 91 HN ASP 91 -6.528 -10.689 -2.282 682 HA ASP 91 HA ASP 91 -4.439 -12.231 -1.138 683 HB2 ASP 91 HB2 ASP 91 -6.762 -12.935 -0.953 684 HB3 ASP 91 HB1 ASP 91 -6.870 -13.111 -2.708 685 H GLN 92 HN GLN 92 -5.343 -11.532 -4.429 686 HA GLN 92 HA GLN 92 -3.636 -13.421 -5.685 687 HB2 GLN 92 HB2 GLN 92 -4.341 -10.878 -7.030 688 HB3 GLN 92 HB1 GLN 92 -4.305 -12.510 -7.679 689 HG2 GLN 92 HG2 GLN 92 -6.386 -11.427 -5.815 690 HG3 GLN 92 HG1 GLN 92 -6.563 -11.565 -7.553 691 HE21 GLN 92 HE21 GLN 92 -5.218 -14.052 -7.689 692 HE22 GLN 92 HE22 GLN 92 -6.317 -15.204 -7.062 693 H ALA 93 HN ALA 93 -3.466 -9.992 -4.928 694 HA ALA 93 HA ALA 93 -0.878 -9.510 -5.902 695 HB1 ALA 93 HB1 ALA 93 -2.298 -7.658 -5.508 696 HB2 ALA 93 HB2 ALA 93 -1.030 -7.548 -4.290 697 HB3 ALA 93 HB3 ALA 93 -2.620 -8.160 -3.851 698 H ARG 94 HN ARG 94 -2.197 -10.818 -2.975 699 HA ARG 94 HA ARG 94 -0.029 -10.682 -1.281 700 HB2 ARG 94 HB2 ARG 94 -2.443 -12.327 -1.492 701 HB3 ARG 94 HB1 ARG 94 -1.104 -13.147 -0.702 702 HG2 ARG 94 HG2 ARG 94 -0.954 -11.300 0.915 703 HG3 ARG 94 HG1 ARG 94 -2.339 -10.531 0.127 704 HD2 ARG 94 HD2 ARG 94 -2.892 -11.871 2.186 705 HD3 ARG 94 HD1 ARG 94 -3.788 -12.313 0.732 706 HE ARG 94 HE ARG 94 -1.847 -14.085 0.599 707 HH11 ARG 94 HH11 ARG 94 -3.678 -13.073 3.410 708 HH12 ARG 94 HH12 ARG 94 -3.539 -14.604 4.215 709 HH21 ARG 94 HH21 ARG 94 -1.637 -16.082 1.653 710 HH22 ARG 94 HH22 ARG 94 -2.354 -16.320 3.222 711 H LYS 95 HN LYS 95 -0.934 -13.350 -3.441 712 HA LYS 95 HA LYS 95 1.452 -14.800 -2.934 713 HB2 LYS 95 HB2 LYS 95 0.742 -16.264 -4.773 714 HB3 LYS 95 HB1 LYS 95 -0.549 -15.966 -3.621 715 HG2 LYS 95 HG2 LYS 95 -1.574 -14.375 -5.148 716 HG3 LYS 95 HG1 LYS 95 -0.246 -14.608 -6.293 717 HD2 LYS 95 HD2 LYS 95 -0.841 -17.008 -6.422 718 HD3 LYS 95 HD1 LYS 95 -2.225 -16.693 -5.378 719 HE2 LYS 95 HE2 LYS 95 -3.118 -15.133 -7.035 720 HE3 LYS 95 HE1 LYS 95 -1.730 -15.441 -8.075 721 HZ1 LYS 95 HZ1 LYS 95 -3.610 -16.724 -8.793 722 HZ2 LYS 95 HZ2 LYS 95 -3.784 -17.428 -7.263 723 HZ3 LYS 95 HZ3 LYS 95 -2.421 -17.772 -8.205 724 H ARG 96 HN ARG 96 0.756 -12.160 -5.009 725 HA ARG 96 HA ARG 96 2.837 -12.703 -6.916 726 HB2 ARG 96 HB2 ARG 96 1.211 -10.246 -6.296 727 HB3 ARG 96 HB1 ARG 96 2.492 -10.245 -7.498 728 HG2 ARG 96 HG2 ARG 96 0.054 -12.010 -7.563 729 HG3 ARG 96 HG1 ARG 96 0.258 -10.515 -8.477 730 HD2 ARG 96 HD2 ARG 96 2.518 -11.871 -9.139 731 HD3 ARG 96 HD1 ARG 96 1.363 -13.194 -8.952 732 HE ARG 96 HE ARG 96 0.610 -10.915 -10.619 733 HH11 ARG 96 HH11 ARG 96 1.527 -14.280 -10.377 734 HH12 ARG 96 HH12 ARG 96 1.105 -14.649 -12.025 735 HH21 ARG 96 HH21 ARG 96 0.058 -11.394 -12.790 736 HH22 ARG 96 HH22 ARG 96 0.269 -13.001 -13.393 737 H LEU 97 HN LEU 97 2.550 -11.065 -3.861 738 HA LEU 97 HA LEU 97 5.171 -9.845 -4.112 739 HB2 LEU 97 HB2 LEU 97 4.659 -8.754 -1.990 740 HB3 LEU 97 HB1 LEU 97 3.436 -8.442 -3.199 741 HG LEU 97 HG LEU 97 2.223 -10.466 -2.004 742 HD11 LEU 97 HD11 LEU 97 2.656 -10.487 0.387 743 HD12 LEU 97 HD12 LEU 97 3.938 -9.292 0.186 744 HD13 LEU 97 HD13 LEU 97 4.120 -10.902 -0.508 745 HD21 LEU 97 HD21 LEU 97 1.284 -8.246 -2.201 746 HD22 LEU 97 HD22 LEU 97 2.349 -7.644 -0.931 747 HD23 LEU 97 HD23 LEU 97 1.092 -8.819 -0.543 748 H THR 98 HN THR 98 3.561 -12.422 -2.416 749 HA THR 98 HA THR 98 6.207 -13.253 -1.451 750 HB THR 98 HB THR 98 4.949 -12.500 0.481 751 HG1 THR 98 HG1 THR 98 4.918 -15.327 0.633 752 HG21 THR 98 HG21 THR 98 2.900 -13.633 1.226 753 HG22 THR 98 HG22 THR 98 2.876 -14.566 -0.270 754 HG23 THR 98 HG23 THR 98 2.666 -12.817 -0.320 755 H LYS 99 HN LYS 99 5.985 -14.228 -3.684 756 HA LYS 99 HA LYS 99 4.436 -16.610 -3.912 757 HB2 LYS 99 HB2 LYS 99 5.797 -17.026 -5.938 758 HB3 LYS 99 HB1 LYS 99 5.117 -15.400 -5.916 759 HG2 LYS 99 HG2 LYS 99 7.309 -14.604 -5.010 760 HG3 LYS 99 HG1 LYS 99 7.936 -16.223 -5.279 761 HD2 LYS 99 HD2 LYS 99 7.379 -15.988 -7.680 762 HD3 LYS 99 HD1 LYS 99 6.916 -14.313 -7.361 763 HE2 LYS 99 HE2 LYS 99 9.148 -13.812 -6.567 764 HE3 LYS 99 HE1 LYS 99 9.625 -15.495 -6.774 765 HZ1 LYS 99 HZ1 LYS 99 10.421 -14.201 -8.603 766 HZ2 LYS 99 HZ2 LYS 99 8.883 -13.590 -8.926 767 HZ3 LYS 99 HZ3 LYS 99 9.211 -15.234 -9.176 768 H ARG 100 HN ARG 100 7.028 -15.841 -2.166 769 HA ARG 100 HA ARG 100 8.447 -16.951 -0.789 770 HB2 ARG 100 HB2 ARG 100 6.453 -18.356 -0.311 771 HB3 ARG 100 HB1 ARG 100 6.927 -19.431 -1.616 772 HG2 ARG 100 HG2 ARG 100 7.488 -20.120 0.779 773 HG3 ARG 100 HG1 ARG 100 8.755 -20.257 -0.437 774 HD2 ARG 100 HD2 ARG 100 9.537 -19.290 1.714 775 HD3 ARG 100 HD1 ARG 100 9.799 -18.242 0.322 776 HE ARG 100 HE ARG 100 7.488 -17.850 2.119 777 HH11 ARG 100 HH11 ARG 100 10.351 -16.637 0.495 778 HH12 ARG 100 HH12 ARG 100 10.095 -14.999 0.985 779 HH21 ARG 100 HH21 ARG 100 7.164 -15.720 2.800 780 HH22 ARG 100 HH22 ARG 100 8.285 -14.479 2.341 781 H SER 101 HN SER 101 8.621 -16.885 -3.868 782 HA SER 101 HA SER 101 10.882 -18.740 -4.144 783 HB2 SER 101 HB2 SER 101 9.288 -17.394 -6.332 784 HB3 SER 101 HB1 SER 101 10.470 -18.682 -6.509 785 HG SER 101 HG SER 101 8.317 -19.164 -4.810 786 H GLU 102 HN GLU 102 10.600 -15.895 -3.029 787 HA GLU 102 HA GLU 102 12.771 -14.720 -4.549 788 HB2 GLU 102 HB2 GLU 102 11.772 -12.596 -4.610 789 HB3 GLU 102 HB1 GLU 102 10.472 -13.687 -5.059 790 HG2 GLU 102 HG2 GLU 102 10.895 -12.445 -2.348 791 HG3 GLU 102 HG1 GLU 102 9.700 -11.944 -3.546 792 H GLU 103 HN GLU 103 14.043 -13.328 -3.338 793 HA GLU 103 HA GLU 103 13.989 -13.786 -0.444 794 HB2 GLU 103 HB2 GLU 103 16.240 -12.720 -2.147 795 HB3 GLU 103 HB1 GLU 103 16.334 -13.109 -0.436 796 HG2 GLU 103 HG2 GLU 103 15.931 -15.464 -0.963 797 HG3 GLU 103 HG1 GLU 103 15.880 -15.053 -2.679 798 H VAL 104 HN VAL 104 13.008 -11.704 -2.668 799 HA VAL 104 HA VAL 104 12.859 -9.494 -0.843 800 HB VAL 104 HB VAL 104 15.118 -9.209 -1.691 801 HG11 VAL 104 HG11 VAL 104 15.513 -8.705 -4.062 802 HG12 VAL 104 HG12 VAL 104 13.839 -9.148 -4.406 803 HG13 VAL 104 HG13 VAL 104 14.963 -10.361 -3.792 804 HG21 VAL 104 HG21 VAL 104 13.745 -7.217 -1.243 805 HG22 VAL 104 HG22 VAL 104 13.264 -7.196 -2.936 806 HG23 VAL 104 HG23 VAL 104 14.952 -6.941 -2.499 807 H VAL 105 HN VAL 105 11.270 -8.042 -1.392 808 HA VAL 105 HA VAL 105 9.598 -8.916 -3.654 809 HB VAL 105 HB VAL 105 8.724 -7.017 -1.501 810 HG11 VAL 105 HG11 VAL 105 6.511 -7.907 -2.000 811 HG12 VAL 105 HG12 VAL 105 7.219 -9.001 -3.188 812 HG13 VAL 105 HG13 VAL 105 7.292 -7.257 -3.442 813 HG21 VAL 105 HG21 VAL 105 9.606 -8.871 -0.269 814 HG22 VAL 105 HG22 VAL 105 8.712 -10.016 -1.280 815 HG23 VAL 105 HG23 VAL 105 7.840 -8.915 -0.209 816 H ARG 106 HN ARG 106 10.060 -7.662 -5.406 817 HA ARG 106 HA ARG 106 10.946 -4.955 -4.972 818 HB2 ARG 106 HB2 ARG 106 11.400 -6.812 -6.993 819 HB3 ARG 106 HB1 ARG 106 10.275 -5.659 -7.712 820 HG2 ARG 106 HG2 ARG 106 11.696 -3.858 -7.348 821 HG3 ARG 106 HG1 ARG 106 12.729 -4.799 -6.260 822 HD2 ARG 106 HD2 ARG 106 13.132 -6.296 -8.334 823 HD3 ARG 106 HD1 ARG 106 12.525 -4.911 -9.246 824 HE ARG 106 HE ARG 106 14.547 -4.126 -7.398 825 HH11 ARG 106 HH11 ARG 106 14.062 -5.589 -10.552 826 HH12 ARG 106 HH12 ARG 106 15.685 -5.251 -11.091 827 HH21 ARG 106 HH21 ARG 106 16.643 -3.681 -8.082 828 HH22 ARG 106 HH22 ARG 106 17.155 -4.140 -9.676 829 H LEU 107 HN LEU 107 9.687 -3.182 -5.405 830 HA LEU 107 HA LEU 107 7.187 -3.587 -6.731 831 HB2 LEU 107 HB2 LEU 107 6.306 -2.145 -4.581 832 HB3 LEU 107 HB1 LEU 107 6.012 -3.835 -4.918 833 HG LEU 107 HG LEU 107 8.354 -4.035 -3.625 834 HD11 LEU 107 HD11 LEU 107 8.366 -2.563 -1.730 835 HD12 LEU 107 HD12 LEU 107 6.908 -1.746 -2.321 836 HD13 LEU 107 HD13 LEU 107 8.416 -1.615 -3.227 837 HD21 LEU 107 HD21 LEU 107 6.236 -5.233 -3.243 838 HD22 LEU 107 HD22 LEU 107 5.657 -3.854 -2.308 839 HD23 LEU 107 HD23 LEU 107 7.059 -4.777 -1.751 840 H LEU 108 HN LEU 108 5.957 -1.742 -6.978 841 HA LEU 108 HA LEU 108 7.534 0.715 -7.250 842 HB2 LEU 108 HB2 LEU 108 5.572 -0.596 -9.093 843 HB3 LEU 108 HB1 LEU 108 5.742 1.155 -9.096 844 HG LEU 108 HG LEU 108 8.192 -0.538 -9.371 845 HD11 LEU 108 HD11 LEU 108 7.921 -0.469 -11.815 846 HD12 LEU 108 HD12 LEU 108 6.284 0.158 -11.603 847 HD13 LEU 108 HD13 LEU 108 6.693 -1.462 -11.029 848 HD21 LEU 108 HD21 LEU 108 8.897 1.425 -10.668 849 HD22 LEU 108 HD22 LEU 108 8.422 1.840 -9.019 850 HD23 LEU 108 HD23 LEU 108 7.326 2.162 -10.369 851 H VAL 109 HN VAL 109 6.856 2.162 -5.879 852 HA VAL 109 HA VAL 109 4.182 1.890 -4.802 853 HB VAL 109 HB VAL 109 5.980 0.965 -3.367 854 HG11 VAL 109 HG11 VAL 109 7.450 2.526 -2.152 855 HG12 VAL 109 HG12 VAL 109 6.930 3.811 -3.241 856 HG13 VAL 109 HG13 VAL 109 7.814 2.422 -3.874 857 HG21 VAL 109 HG21 VAL 109 3.932 1.666 -2.379 858 HG22 VAL 109 HG22 VAL 109 4.513 3.326 -2.276 859 HG23 VAL 109 HG23 VAL 109 5.272 2.065 -1.303 860 H THR 110 HN THR 110 3.662 3.822 -3.559 861 HA THR 110 HA THR 110 4.736 6.294 -4.606 862 HB THR 110 HB THR 110 2.134 6.975 -4.644 863 HG1 THR 110 HG1 THR 110 2.265 4.201 -4.947 864 HG21 THR 110 HG21 THR 110 3.549 5.606 -6.919 865 HG22 THR 110 HG22 THR 110 3.789 7.287 -6.441 866 HG23 THR 110 HG23 THR 110 2.220 6.755 -7.053 867 H ARG 111 HN ARG 111 5.313 7.366 -2.887 868 HA ARG 111 HA ARG 111 4.191 6.567 -0.326 869 HB2 ARG 111 HB2 ARG 111 6.113 7.468 0.671 870 HB3 ARG 111 HB1 ARG 111 6.685 6.750 -0.830 871 HG2 ARG 111 HG2 ARG 111 7.737 8.713 -1.030 872 HG3 ARG 111 HG1 ARG 111 6.164 9.211 -1.680 873 HD2 ARG 111 HD2 ARG 111 5.535 10.274 0.270 874 HD3 ARG 111 HD1 ARG 111 6.660 9.373 1.256 875 HE ARG 111 HE ARG 111 7.237 11.740 -0.364 876 HH11 ARG 111 HH11 ARG 111 8.446 9.218 1.740 877 HH12 ARG 111 HH12 ARG 111 9.900 10.069 2.168 878 HH21 ARG 111 HH21 ARG 111 9.163 12.881 0.183 879 HH22 ARG 111 HH22 ARG 111 10.303 12.167 1.283 880 H GLN 112 HN GLN 112 4.343 8.779 1.256 881 HA GLN 112 HA GLN 112 2.746 10.147 2.079 882 HB2 GLN 112 HB2 GLN 112 2.558 10.785 -0.818 883 HB3 GLN 112 HB1 GLN 112 1.459 11.508 0.347 884 HG2 GLN 112 HG2 GLN 112 2.949 13.033 0.748 885 HG3 GLN 112 HG1 GLN 112 4.076 11.831 1.336 886 HE21 GLN 112 HE21 GLN 112 3.001 11.673 -1.913 887 HE22 GLN 112 HE22 GLN 112 4.435 12.315 -2.648 888 H SER 113 HN SER 113 1.568 9.103 -0.943 889 HA SER 113 HA SER 113 -0.024 7.541 -1.587 890 HB2 SER 113 HB2 SER 113 1.069 6.187 0.169 891 HB3 SER 113 HB1 SER 113 -0.042 6.902 1.339 892 HG SER 113 HG SER 113 -1.749 5.890 0.304 893 H LEU 114 HN LEU 114 -0.637 10.205 -0.512 894 HA LEU 114 HA LEU 114 -3.049 9.839 1.034 895 HB2 LEU 114 HB2 LEU 114 -1.051 11.869 0.621 896 HB3 LEU 114 HB1 LEU 114 -2.673 12.525 0.765 897 HG LEU 114 HG LEU 114 -2.474 12.393 2.990 898 HD11 LEU 114 HD11 LEU 114 -2.290 9.473 2.331 899 HD12 LEU 114 HD12 LEU 114 -3.654 10.381 2.989 900 HD13 LEU 114 HD13 LEU 114 -2.248 10.047 4.005 901 HD21 LEU 114 HD21 LEU 114 -0.427 11.513 4.044 902 HD22 LEU 114 HD22 LEU 114 -0.082 12.619 2.713 903 HD23 LEU 114 HD23 LEU 114 0.084 10.877 2.479 904 H GLN 115 HN GLN 115 -2.836 9.316 -1.753 905 HA GLN 115 HA GLN 115 -5.146 10.869 -2.666 906 HB2 GLN 115 HB2 GLN 115 -4.583 10.012 -4.915 907 HB3 GLN 115 HB1 GLN 115 -3.334 11.032 -4.240 908 HG2 GLN 115 HG2 GLN 115 -1.859 9.302 -4.031 909 HG3 GLN 115 HG1 GLN 115 -3.132 8.089 -3.900 910 HE21 GLN 115 HE21 GLN 115 -0.765 8.153 -5.626 911 HE22 GLN 115 HE22 GLN 115 -1.355 8.031 -7.242 912 H LYS 116 HN LYS 116 -7.023 9.756 -3.290 913 HA LYS 116 HA LYS 116 -6.987 6.845 -3.167 914 HB2 LYS 116 HB2 LYS 116 -8.642 8.664 -1.466 915 HB3 LYS 116 HB1 LYS 116 -9.262 7.094 -1.934 916 HG2 LYS 116 HG2 LYS 116 -7.292 6.032 -0.900 917 HG3 LYS 116 HG1 LYS 116 -6.737 7.626 -0.385 918 HD2 LYS 116 HD2 LYS 116 -7.870 6.509 1.443 919 HD3 LYS 116 HD1 LYS 116 -8.810 7.903 0.912 920 HE2 LYS 116 HE2 LYS 116 -10.396 6.200 1.200 921 HE3 LYS 116 HE1 LYS 116 -10.118 6.265 -0.539 922 HZ1 LYS 116 HZ1 LYS 116 -10.091 4.011 0.014 923 HZ2 LYS 116 HZ2 LYS 116 -9.160 4.254 1.405 924 HZ3 LYS 116 HZ3 LYS 116 -8.453 4.413 -0.127 925 H ALA 117 HN ALA 117 -8.990 5.878 -4.015 926 HA ALA 117 HA ALA 117 -10.990 6.985 -5.446 927 HB1 ALA 117 HB1 ALA 117 -10.203 7.005 -7.765 928 HB2 ALA 117 HB2 ALA 117 -8.559 6.677 -7.216 929 HB3 ALA 117 HB3 ALA 117 -9.343 8.201 -6.794 930 H VAL 118 HN VAL 118 -12.051 5.163 -5.044 931 HA VAL 118 HA VAL 118 -11.033 2.544 -5.512 932 HB VAL 118 HB VAL 118 -12.648 3.136 -3.745 933 HG11 VAL 118 HG11 VAL 118 -14.495 3.685 -6.048 934 HG12 VAL 118 HG12 VAL 118 -13.883 4.843 -4.866 935 HG13 VAL 118 HG13 VAL 118 -15.003 3.571 -4.362 936 HG21 VAL 118 HG21 VAL 118 -12.577 0.839 -4.486 937 HG22 VAL 118 HG22 VAL 118 -13.755 1.193 -5.747 938 HG23 VAL 118 HG23 VAL 118 -14.222 1.300 -4.050 939 H GLN 119 HN GLN 119 -10.874 4.205 -7.801 940 HA GLN 119 HA GLN 119 -13.030 3.291 -9.572 941 HB2 GLN 119 HB2 GLN 119 -11.194 5.673 -9.862 942 HB3 GLN 119 HB1 GLN 119 -12.488 5.234 -10.969 943 HG2 GLN 119 HG2 GLN 119 -12.867 5.964 -8.075 944 HG3 GLN 119 HG1 GLN 119 -13.101 7.050 -9.446 945 HE21 GLN 119 HE21 GLN 119 -14.230 5.046 -11.161 946 HE22 GLN 119 HE22 GLN 119 -15.833 4.748 -10.570 947 H GLN 120 HN GLN 120 -12.070 1.305 -10.100 948 HA GLN 120 HA GLN 120 -9.886 1.631 -12.030 949 HB2 GLN 120 HB2 GLN 120 -10.489 -0.645 -10.197 950 HB3 GLN 120 HB1 GLN 120 -9.629 -0.924 -11.708 951 HG2 GLN 120 HG2 GLN 120 -8.014 0.862 -10.989 952 HG3 GLN 120 HG1 GLN 120 -8.803 0.825 -9.410 953 HE21 GLN 120 HE21 GLN 120 -8.601 -0.958 -8.139 954 HE22 GLN 120 HE22 GLN 120 -7.373 -2.159 -8.381 955 H SER 121 HN SER 121 -10.003 -0.036 -13.839 956 HA SER 121 HA SER 121 -12.667 0.150 -14.947 957 HB2 SER 121 HB2 SER 121 -10.536 0.689 -16.237 958 HB3 SER 121 HB1 SER 121 -10.229 -1.045 -16.267 959 HG SER 121 HG SER 121 -12.377 0.382 -17.437 960 H MET 122 HN MET 122 -13.945 -1.576 -15.545 961 HA MET 122 HA MET 122 -13.350 -4.058 -14.110 962 HB2 MET 122 HB2 MET 122 -15.482 -3.015 -13.557 963 HB3 MET 122 HB1 MET 122 -15.943 -2.997 -15.255 964 HG2 MET 122 HG2 MET 122 -17.067 -4.794 -14.092 965 HG3 MET 122 HG1 MET 122 -15.944 -5.441 -15.284 966 HE1 MET 122 HE1 MET 122 -16.029 -7.853 -14.175 967 HE2 MET 122 HE2 MET 122 -17.222 -7.215 -13.047 968 HE3 MET 122 HE3 MET 122 -15.840 -8.127 -12.443 969 H LEU 123 HN LEU 123 -12.563 -5.695 -15.221 970 HA LEU 123 HA LEU 123 -12.956 -5.843 -18.094 971 HB2 LEU 123 HB2 LEU 123 -11.325 -7.731 -17.962 972 HB3 LEU 123 HB1 LEU 123 -10.702 -6.184 -17.431 973 HG LEU 123 HG LEU 123 -11.200 -6.994 -15.050 974 HD11 LEU 123 HD11 LEU 123 -11.399 -9.340 -14.696 975 HD12 LEU 123 HD12 LEU 123 -11.195 -9.670 -16.416 976 HD13 LEU 123 HD13 LEU 123 -12.653 -8.859 -15.843 977 HD21 LEU 123 HD21 LEU 123 -9.084 -8.192 -14.937 978 HD22 LEU 123 HD22 LEU 123 -8.954 -6.795 -16.005 979 HD23 LEU 123 HD23 LEU 123 -9.104 -8.416 -16.686 980 H SER 124 HN SER 124 -13.415 -8.070 -19.013 981 HA SER 124 HA SER 124 -15.553 -9.312 -17.418 982 HB2 SER 124 HB2 SER 124 -16.297 -10.062 -19.827 983 HB3 SER 124 HB1 SER 124 -16.653 -8.428 -19.265 984 HG SER 124 HG SER 124 -15.106 -7.611 -20.539 985 H1 LYS 161 HN LYS 161 -15.767 1.548 6.770 986 HA LYS 161 HA LYS 161 -14.844 2.147 4.821 987 HB2 LYS 161 HB2 LYS 161 -12.867 3.442 6.672 988 HB3 LYS 161 HB1 LYS 161 -12.609 3.448 4.934 989 HG2 LYS 161 HG2 LYS 161 -13.651 5.507 5.544 990 HG3 LYS 161 HG1 LYS 161 -14.834 4.541 4.652 991 HD2 LYS 161 HD2 LYS 161 -15.907 3.899 6.732 992 HD3 LYS 161 HD1 LYS 161 -14.681 4.747 7.674 993 HE2 LYS 161 HE2 LYS 161 -15.388 6.862 6.784 994 HE3 LYS 161 HE1 LYS 161 -16.504 6.070 5.674 995 HZ1 LYS 161 HZ1 LYS 161 -17.682 5.208 7.677 996 HZ2 LYS 161 HZ2 LYS 161 -17.760 6.883 7.474 997 HZ3 LYS 161 HZ3 LYS 161 -16.710 6.221 8.630 998 H GLU 162 HN GLU 162 -11.582 2.142 4.891 999 HA GLU 162 HA GLU 162 -11.659 -0.453 3.652 1000 HB2 GLU 162 HB2 GLU 162 -9.235 -0.096 3.158 1001 HB3 GLU 162 HB1 GLU 162 -10.314 1.123 2.512 1002 HG2 GLU 162 HG2 GLU 162 -8.967 1.596 5.127 1003 HG3 GLU 162 HG1 GLU 162 -8.070 1.805 3.624 1004 H ASN 163 HN ASN 163 -11.572 -2.214 4.701 1005 HA ASN 163 HA ASN 163 -9.829 -2.390 7.076 1006 HB2 ASN 163 HB2 ASN 163 -12.616 -3.457 6.700 1007 HB3 ASN 163 HB1 ASN 163 -11.535 -4.093 7.937 1008 HD21 ASN 163 HD21 ASN 163 -10.928 -2.773 9.666 1009 HD22 ASN 163 HD22 ASN 163 -11.834 -1.340 10.068 1010 H LEU 164 HN LEU 164 -9.272 -3.305 4.220 1011 HA LEU 164 HA LEU 164 -9.108 -6.169 4.774 1012 HB2 LEU 164 HB2 LEU 164 -9.983 -6.026 2.676 1013 HB3 LEU 164 HB1 LEU 164 -9.212 -4.494 2.333 1014 HG LEU 164 HG LEU 164 -7.065 -5.814 2.155 1015 HD11 LEU 164 HD11 LEU 164 -7.699 -7.933 3.086 1016 HD12 LEU 164 HD12 LEU 164 -7.410 -8.183 1.357 1017 HD13 LEU 164 HD13 LEU 164 -9.062 -8.073 1.973 1018 HD21 LEU 164 HD21 LEU 164 -9.254 -6.180 0.120 1019 HD22 LEU 164 HD22 LEU 164 -7.526 -6.360 -0.194 1020 HD23 LEU 164 HD23 LEU 164 -8.180 -4.787 0.270 1021 H GLU 165 HN GLU 165 -7.458 -6.023 6.327 1022 HA GLU 165 HA GLU 165 -4.832 -5.150 5.317 1023 HB2 GLU 165 HB2 GLU 165 -5.964 -5.342 8.078 1024 HB3 GLU 165 HB1 GLU 165 -4.228 -5.464 7.832 1025 HG2 GLU 165 HG2 GLU 165 -4.314 -3.267 6.669 1026 HG3 GLU 165 HG1 GLU 165 -6.003 -3.138 7.173 1027 H SER 166 HN SER 166 -2.990 -6.365 5.912 1028 HA SER 166 HA SER 166 -3.316 -8.978 7.111 1029 HB2 SER 166 HB2 SER 166 -2.163 -8.739 4.321 1030 HB3 SER 166 HB1 SER 166 -2.237 -10.210 5.291 1031 HG SER 166 HG SER 166 -4.684 -9.249 5.208 1032 H MET 167 HN MET 167 -1.647 -9.160 8.515 1033 HA MET 167 HA MET 167 0.742 -7.618 8.085 1034 HB2 MET 167 HB2 MET 167 1.607 -8.735 10.126 1035 HB3 MET 167 HB1 MET 167 0.088 -7.886 10.383 1036 HG2 MET 167 HG2 MET 167 -1.127 -9.966 10.375 1037 HG3 MET 167 HG1 MET 167 0.336 -10.858 9.953 1038 HE1 MET 167 HE1 MET 167 -0.214 -8.678 13.985 1039 HE2 MET 167 HE2 MET 167 -1.432 -8.673 12.709 1040 HE3 MET 167 HE3 MET 167 0.106 -7.846 12.463 1041 H VAL 168 HN VAL 168 1.588 -8.306 6.225 1042 HA VAL 168 HA VAL 168 2.385 -11.110 6.026 1043 HB VAL 168 HB VAL 168 2.930 -10.486 3.616 1044 HG11 VAL 168 HG11 VAL 168 0.073 -10.210 4.552 1045 HG12 VAL 168 HG12 VAL 168 0.915 -11.717 4.192 1046 HG13 VAL 168 HG13 VAL 168 0.575 -10.568 2.898 1047 HG21 VAL 168 HG21 VAL 168 1.311 -8.029 4.292 1048 HG22 VAL 168 HG22 VAL 168 1.890 -8.492 2.690 1049 HG23 VAL 168 HG23 VAL 168 3.041 -8.049 3.954 Start of MODEL 15 1 H1 MET 1 HT1 MET 1 7.116 27.809 -3.312 2 H2 MET 1 HT2 MET 1 8.613 28.603 -3.394 3 H3 MET 1 HT3 MET 1 7.218 29.454 -2.928 4 HA MET 1 HA MET 1 8.462 27.225 -1.426 5 HB2 MET 1 HB2 MET 1 9.141 28.885 0.196 6 HB3 MET 1 HB1 MET 1 9.751 29.369 -1.382 7 HG2 MET 1 HG2 MET 1 8.000 31.003 -1.602 8 HG3 MET 1 HG1 MET 1 7.256 30.453 -0.101 9 HE1 MET 1 HE1 MET 1 8.535 33.928 0.996 10 HE2 MET 1 HE2 MET 1 7.168 32.816 0.920 11 HE3 MET 1 HE3 MET 1 7.838 33.494 -0.564 12 H SER 2 HN SER 2 7.643 27.717 1.006 13 HA SER 2 HA SER 2 5.961 27.823 2.518 14 HB2 SER 2 HB2 SER 2 4.353 29.111 0.300 15 HB3 SER 2 HB1 SER 2 3.866 29.022 1.992 16 HG SER 2 HG SER 2 4.925 31.026 1.305 17 H TYR 3 HN TYR 3 3.539 27.078 2.786 18 HA TYR 3 HA TYR 3 3.171 24.621 1.206 19 HB2 TYR 3 HB2 TYR 3 2.487 24.931 4.140 20 HB3 TYR 3 HB1 TYR 3 2.467 23.451 3.188 21 HD1 TYR 3 HD1 TYR 3 4.600 25.876 4.933 22 HD2 TYR 3 HD2 TYR 3 4.516 22.259 2.691 23 HE1 TYR 3 HE1 TYR 3 6.913 25.400 5.621 24 HE2 TYR 3 HE2 TYR 3 6.827 21.774 3.372 25 HH TYR 3 HH TYR 3 8.754 22.811 4.213 26 H ILE 4 HN ILE 4 1.054 24.149 0.623 27 HA ILE 4 HA ILE 4 -0.906 26.245 1.297 28 HB ILE 4 HB ILE 4 -0.768 24.659 -1.274 29 HG12 ILE 4 HG12 ILE 4 1.056 26.290 -1.121 30 HG13 ILE 4 HG11 ILE 4 -0.118 26.770 -2.334 31 HG21 ILE 4 HG21 ILE 4 -2.489 26.248 -2.039 32 HG22 ILE 4 HG22 ILE 4 -2.560 26.917 -0.409 33 HG23 ILE 4 HG23 ILE 4 -3.036 25.243 -0.694 34 HD11 ILE 4 HD11 ILE 4 0.091 27.898 0.452 35 HD12 ILE 4 HD12 ILE 4 -1.076 28.387 -0.775 36 HD13 ILE 4 HD13 ILE 4 0.644 28.680 -1.031 37 HA PRO 5 HA PRO 5 -2.784 22.429 2.931 38 HB2 PRO 5 HB2 PRO 5 -4.119 24.294 4.752 39 HB3 PRO 5 HB1 PRO 5 -3.049 22.938 5.125 40 HG2 PRO 5 HG2 PRO 5 -2.287 25.496 5.492 41 HG3 PRO 5 HG1 PRO 5 -1.140 24.234 4.995 42 HD2 PRO 5 HD2 PRO 5 -2.535 26.290 3.308 43 HD3 PRO 5 HD1 PRO 5 -0.828 25.791 3.289 44 H GLY 6 HN GLY 6 -4.071 22.052 1.201 45 HA2 GLY 6 HA2 GLY 6 -6.787 22.398 1.286 46 HA3 GLY 6 HA1 GLY 6 -6.183 23.806 0.406 47 H GLN 7 HN GLN 7 -4.021 22.656 -0.881 48 HA GLN 7 HA GLN 7 -5.400 21.081 -2.898 49 HB2 GLN 7 HB2 GLN 7 -3.336 21.554 -4.260 50 HB3 GLN 7 HB1 GLN 7 -4.265 22.965 -3.804 51 HG2 GLN 7 HG2 GLN 7 -2.181 23.741 -3.370 52 HG3 GLN 7 HG1 GLN 7 -2.548 23.029 -1.803 53 HE21 GLN 7 HE21 GLN 7 -1.768 21.196 -4.700 54 HE22 GLN 7 HE22 GLN 7 -0.266 20.577 -4.105 55 HA PRO 8 HA PRO 8 -3.349 17.415 -1.400 56 HB2 PRO 8 HB2 PRO 8 -4.488 16.050 -3.696 57 HB3 PRO 8 HB1 PRO 8 -4.905 15.877 -1.992 58 HG2 PRO 8 HG2 PRO 8 -6.573 16.990 -3.831 59 HG3 PRO 8 HG1 PRO 8 -6.588 17.422 -2.111 60 HD2 PRO 8 HD2 PRO 8 -5.350 18.874 -4.421 61 HD3 PRO 8 HD1 PRO 8 -6.237 19.521 -3.022 62 H VAL 9 HN VAL 9 -1.477 16.376 -1.917 63 HA VAL 9 HA VAL 9 -0.068 17.205 -4.309 64 HB VAL 9 HB VAL 9 0.901 16.645 -1.894 65 HG11 VAL 9 HG11 VAL 9 0.150 14.314 -1.872 66 HG12 VAL 9 HG12 VAL 9 1.906 14.436 -1.755 67 HG13 VAL 9 HG13 VAL 9 1.154 13.979 -3.289 68 HG21 VAL 9 HG21 VAL 9 2.339 15.930 -4.444 69 HG22 VAL 9 HG22 VAL 9 3.104 16.321 -2.905 70 HG23 VAL 9 HG23 VAL 9 2.177 17.547 -3.768 71 H THR 10 HN THR 10 1.208 15.265 -5.323 72 HA THR 10 HA THR 10 -0.846 13.621 -6.520 73 HB THR 10 HB THR 10 0.810 13.290 -8.297 74 HG1 THR 10 HG1 THR 10 2.737 14.789 -8.023 75 HG21 THR 10 HG21 THR 10 0.988 15.717 -8.963 76 HG22 THR 10 HG22 THR 10 0.325 16.127 -7.369 77 HG23 THR 10 HG23 THR 10 -0.632 15.182 -8.517 78 H ALA 11 HN ALA 11 2.012 12.331 -7.077 79 HA ALA 11 HA ALA 11 2.551 10.701 -4.862 80 HB1 ALA 11 HB1 ALA 11 0.974 9.333 -7.047 81 HB2 ALA 11 HB2 ALA 11 0.385 9.679 -5.420 82 HB3 ALA 11 HB3 ALA 11 1.718 8.547 -5.652 83 H VAL 12 HN VAL 12 4.574 10.144 -5.040 84 HA VAL 12 HA VAL 12 5.715 10.075 -7.725 85 HB VAL 12 HB VAL 12 6.792 11.597 -6.281 86 HG11 VAL 12 HG11 VAL 12 6.263 10.698 -4.111 87 HG12 VAL 12 HG12 VAL 12 8.001 10.961 -4.264 88 HG13 VAL 12 HG13 VAL 12 7.341 9.333 -4.409 89 HG21 VAL 12 HG21 VAL 12 9.102 10.826 -6.459 90 HG22 VAL 12 HG22 VAL 12 8.167 10.408 -7.897 91 HG23 VAL 12 HG23 VAL 12 8.517 9.177 -6.682 92 H VAL 13 HN VAL 13 6.046 8.305 -8.647 93 HA VAL 13 HA VAL 13 5.817 5.795 -7.261 94 HB VAL 13 HB VAL 13 6.486 6.226 -10.173 95 HG11 VAL 13 HG11 VAL 13 5.558 3.954 -10.439 96 HG12 VAL 13 HG12 VAL 13 5.370 3.851 -8.687 97 HG13 VAL 13 HG13 VAL 13 6.980 3.987 -9.396 98 HG21 VAL 13 HG21 VAL 13 4.399 7.350 -9.676 99 HG22 VAL 13 HG22 VAL 13 3.792 5.913 -8.855 100 HG23 VAL 13 HG23 VAL 13 4.078 5.877 -10.595 101 H GLN 14 HN GLN 14 7.469 4.838 -6.353 102 HA GLN 14 HA GLN 14 10.125 5.111 -7.499 103 HB2 GLN 14 HB2 GLN 14 11.072 5.395 -5.255 104 HB3 GLN 14 HB1 GLN 14 9.991 6.715 -5.660 105 HG2 GLN 14 HG2 GLN 14 8.220 5.529 -4.344 106 HG3 GLN 14 HG1 GLN 14 9.470 4.411 -3.817 107 HE21 GLN 14 HE21 GLN 14 9.941 7.828 -4.327 108 HE22 GLN 14 HE22 GLN 14 10.243 8.210 -2.665 109 H ARG 15 HN ARG 15 11.595 3.456 -6.374 110 HA ARG 15 HA ARG 15 10.111 0.961 -6.269 111 HB2 ARG 15 HB2 ARG 15 12.833 1.560 -7.419 112 HB3 ARG 15 HB1 ARG 15 12.039 0.009 -7.406 113 HG2 ARG 15 HG2 ARG 15 10.176 1.638 -8.594 114 HG3 ARG 15 HG1 ARG 15 11.723 2.236 -9.213 115 HD2 ARG 15 HD2 ARG 15 12.344 -0.046 -9.855 116 HD3 ARG 15 HD1 ARG 15 10.781 -0.624 -9.275 117 HE ARG 15 HE ARG 15 9.898 1.056 -11.035 118 HH11 ARG 15 HH11 ARG 15 12.827 -0.843 -11.363 119 HH12 ARG 15 HH12 ARG 15 12.717 -0.943 -13.091 120 HH21 ARG 15 HH21 ARG 15 9.754 0.918 -13.320 121 HH22 ARG 15 HH22 ARG 15 10.995 0.069 -14.204 122 H VAL 16 HN VAL 16 10.384 -0.151 -4.458 123 HA VAL 16 HA VAL 16 12.922 0.148 -3.075 124 HB VAL 16 HB VAL 16 11.648 1.563 -1.729 125 HG11 VAL 16 HG11 VAL 16 9.475 1.144 -2.698 126 HG12 VAL 16 HG12 VAL 16 9.392 1.098 -0.935 127 HG13 VAL 16 HG13 VAL 16 9.387 -0.404 -1.856 128 HG21 VAL 16 HG21 VAL 16 11.323 0.428 0.404 129 HG22 VAL 16 HG22 VAL 16 12.802 -0.117 -0.393 130 HG23 VAL 16 HG23 VAL 16 11.361 -1.133 -0.423 131 H GLU 17 HN GLU 17 13.764 -1.712 -2.490 132 HA GLU 17 HA GLU 17 12.248 -4.176 -2.904 133 HB2 GLU 17 HB2 GLU 17 15.251 -3.789 -2.807 134 HB3 GLU 17 HB1 GLU 17 14.399 -5.263 -3.251 135 HG2 GLU 17 HG2 GLU 17 13.467 -4.123 -5.207 136 HG3 GLU 17 HG1 GLU 17 14.350 -2.664 -4.769 137 H ILE 18 HN ILE 18 11.482 -4.875 -1.101 138 HA ILE 18 HA ILE 18 12.877 -4.676 1.426 139 HB ILE 18 HB ILE 18 10.051 -5.514 0.724 140 HG12 ILE 18 HG12 ILE 18 10.924 -2.951 2.042 141 HG13 ILE 18 HG11 ILE 18 10.555 -3.106 0.322 142 HG21 ILE 18 HG21 ILE 18 9.594 -5.361 3.113 143 HG22 ILE 18 HG22 ILE 18 11.291 -4.983 3.413 144 HG23 ILE 18 HG23 ILE 18 10.839 -6.561 2.762 145 HD11 ILE 18 HD11 ILE 18 8.332 -3.991 0.976 146 HD12 ILE 18 HD12 ILE 18 8.617 -2.291 1.381 147 HD13 ILE 18 HD13 ILE 18 8.714 -3.531 2.638 148 H HIS 19 HN HIS 19 12.850 -6.738 2.637 149 HA HIS 19 HA HIS 19 12.830 -9.020 0.820 150 HB2 HIS 19 HB2 HIS 19 15.019 -8.303 0.850 151 HB3 HIS 19 HB1 HIS 19 15.007 -8.017 2.581 152 HD1 HIS 19 HD1 HIS 19 17.169 -9.476 2.824 153 HD2 HIS 19 HD2 HIS 19 13.850 -11.476 1.337 154 HE1 HIS 19 HE1 HIS 19 17.768 -11.920 2.922 155 HE2 HIS 19 HE2 HIS 19 15.795 -13.107 1.891 156 H LYS 20 HN LYS 20 11.699 -10.583 1.446 157 HA LYS 20 HA LYS 20 10.169 -11.049 3.640 158 HB2 LYS 20 HB2 LYS 20 11.587 -13.212 2.086 159 HB3 LYS 20 HB1 LYS 20 10.006 -13.296 2.847 160 HG2 LYS 20 HG2 LYS 20 10.704 -11.566 0.477 161 HG3 LYS 20 HG1 LYS 20 9.880 -13.120 0.404 162 HD2 LYS 20 HD2 LYS 20 8.804 -10.838 2.032 163 HD3 LYS 20 HD1 LYS 20 8.450 -11.005 0.312 164 HE2 LYS 20 HE2 LYS 20 7.865 -13.056 2.438 165 HE3 LYS 20 HE1 LYS 20 6.688 -11.979 1.691 166 HZ1 LYS 20 HZ1 LYS 20 6.706 -14.219 0.713 167 HZ2 LYS 20 HZ2 LYS 20 8.297 -13.986 0.209 168 HZ3 LYS 20 HZ3 LYS 20 7.058 -13.017 -0.425 169 H LEU 21 HN LEU 21 10.450 -12.831 5.388 170 HA LEU 21 HA LEU 21 13.222 -12.664 6.338 171 HB2 LEU 21 HB2 LEU 21 11.928 -10.915 7.441 172 HB3 LEU 21 HB1 LEU 21 10.781 -12.121 8.012 173 HG LEU 21 HG LEU 21 12.502 -13.148 9.401 174 HD11 LEU 21 HD11 LEU 21 14.319 -10.986 8.328 175 HD12 LEU 21 HD12 LEU 21 14.458 -12.720 8.017 176 HD13 LEU 21 HD13 LEU 21 14.708 -12.089 9.646 177 HD21 LEU 21 HD21 LEU 21 11.168 -11.348 10.343 178 HD22 LEU 21 HD22 LEU 21 12.329 -10.158 9.754 179 HD23 LEU 21 HD23 LEU 21 12.806 -11.316 10.997 180 H ARG 22 HN ARG 22 13.994 -14.294 7.363 181 HA ARG 22 HA ARG 22 13.093 -16.830 6.728 182 HB2 ARG 22 HB2 ARG 22 15.470 -15.920 7.381 183 HB3 ARG 22 HB1 ARG 22 15.000 -16.446 8.976 184 HG2 ARG 22 HG2 ARG 22 16.227 -18.203 8.011 185 HG3 ARG 22 HG1 ARG 22 14.525 -18.697 8.013 186 HD2 ARG 22 HD2 ARG 22 14.307 -18.459 5.767 187 HD3 ARG 22 HD1 ARG 22 15.532 -17.190 5.709 188 HE ARG 22 HE ARG 22 16.642 -19.752 6.380 189 HH11 ARG 22 HH11 ARG 22 15.593 -17.782 3.673 190 HH12 ARG 22 HH12 ARG 22 16.574 -18.621 2.520 191 HH21 ARG 22 HH21 ARG 22 17.933 -20.855 4.857 192 HH22 ARG 22 HH22 ARG 22 17.899 -20.369 3.191 193 H GLN 23 HN GLN 23 11.450 -17.840 7.493 194 HA GLN 23 HA GLN 23 11.478 -18.457 10.319 195 HB2 GLN 23 HB2 GLN 23 8.812 -18.692 9.482 196 HB3 GLN 23 HB1 GLN 23 9.479 -17.580 10.668 197 HG2 GLN 23 HG2 GLN 23 10.128 -16.211 8.549 198 HG3 GLN 23 HG1 GLN 23 8.814 -17.136 7.824 199 HE21 GLN 23 HE21 GLN 23 9.116 -14.285 8.456 200 HE22 GLN 23 HE22 GLN 23 7.730 -13.888 9.439 201 H GLY 24 HN GLY 24 12.785 -20.065 9.195 202 HA2 GLY 24 HA2 GLY 24 13.068 -22.237 8.570 203 HA3 GLY 24 HA1 GLY 24 11.670 -22.524 9.598 204 H GLU 25 HN GLU 25 12.686 -21.675 6.414 205 HA GLU 25 HA GLU 25 12.244 -22.668 4.419 206 HB2 GLU 25 HB2 GLU 25 10.560 -24.200 6.129 207 HB3 GLU 25 HB1 GLU 25 9.622 -23.662 4.752 208 HG2 GLU 25 HG2 GLU 25 12.212 -25.180 4.623 209 HG3 GLU 25 HG1 GLU 25 10.604 -25.855 4.359 210 H ASN 26 HN ASN 26 10.778 -20.464 6.331 211 HA ASN 26 HA ASN 26 9.165 -19.471 4.113 212 HB2 ASN 26 HB2 ASN 26 8.938 -19.136 7.075 213 HB3 ASN 26 HB1 ASN 26 7.969 -18.254 5.915 214 HD21 ASN 26 HD21 ASN 26 8.827 -21.329 7.104 215 HD22 ASN 26 HD22 ASN 26 7.395 -22.192 6.652 216 H LEU 27 HN LEU 27 9.560 -17.618 3.477 217 HA LEU 27 HA LEU 27 11.265 -15.772 4.974 218 HB2 LEU 27 HB2 LEU 27 11.065 -16.312 2.027 219 HB3 LEU 27 HB1 LEU 27 11.556 -14.753 2.609 220 HG LEU 27 HG LEU 27 13.481 -16.107 1.969 221 HD11 LEU 27 HD11 LEU 27 13.748 -14.453 3.738 222 HD12 LEU 27 HD12 LEU 27 14.791 -15.848 4.010 223 HD13 LEU 27 HD13 LEU 27 13.308 -15.660 4.946 224 HD21 LEU 27 HD21 LEU 27 14.066 -18.102 3.300 225 HD22 LEU 27 HD22 LEU 27 12.571 -18.308 2.387 226 HD23 LEU 27 HD23 LEU 27 12.506 -17.982 4.122 227 H ILE 28 HN ILE 28 9.778 -14.512 5.929 228 HA ILE 28 HA ILE 28 7.955 -12.911 4.350 229 HB ILE 28 HB ILE 28 6.010 -13.752 5.883 230 HG12 ILE 28 HG12 ILE 28 7.849 -16.147 5.563 231 HG13 ILE 28 HG11 ILE 28 7.397 -15.378 7.080 232 HG21 ILE 28 HG21 ILE 28 5.956 -13.629 3.503 233 HG22 ILE 28 HG22 ILE 28 5.372 -15.231 3.975 234 HG23 ILE 28 HG23 ILE 28 7.020 -15.021 3.359 235 HD11 ILE 28 HD11 ILE 28 5.453 -16.772 5.251 236 HD12 ILE 28 HD12 ILE 28 5.144 -16.157 6.877 237 HD13 ILE 28 HD13 ILE 28 6.240 -17.524 6.644 238 H LEU 29 HN LEU 29 6.489 -11.611 5.566 239 HA LEU 29 HA LEU 29 5.423 -10.746 7.304 240 HB2 LEU 29 HB2 LEU 29 7.038 -12.591 9.024 241 HB3 LEU 29 HB1 LEU 29 5.667 -11.627 9.561 242 HG LEU 29 HG LEU 29 5.638 -13.801 7.497 243 HD11 LEU 29 HD11 LEU 29 5.721 -14.639 9.791 244 HD12 LEU 29 HD12 LEU 29 4.140 -14.949 9.070 245 HD13 LEU 29 HD13 LEU 29 4.343 -13.624 10.216 246 HD21 LEU 29 HD21 LEU 29 4.108 -12.171 6.717 247 HD22 LEU 29 HD22 LEU 29 3.471 -11.905 8.346 248 HD23 LEU 29 HD23 LEU 29 3.149 -13.426 7.512 249 H GLY 30 HN GLY 30 6.388 -9.074 6.523 250 HA2 GLY 30 HA2 GLY 30 8.345 -7.787 8.353 251 HA3 GLY 30 HA1 GLY 30 8.056 -7.296 6.691 252 H PHE 31 HN PHE 31 5.280 -7.085 6.632 253 HA PHE 31 HA PHE 31 4.531 -5.174 8.674 254 HB2 PHE 31 HB2 PHE 31 4.451 -3.250 7.128 255 HB3 PHE 31 HB1 PHE 31 6.089 -3.810 7.457 256 HD1 PHE 31 HD2 PHE 31 7.265 -5.170 5.772 257 HD2 PHE 31 HD1 PHE 31 3.581 -3.230 4.977 258 HE1 PHE 31 HE2 PHE 31 7.692 -5.372 3.383 259 HE2 PHE 31 HE1 PHE 31 3.987 -3.416 2.583 260 HZ PHE 31 HZ PHE 31 6.000 -4.553 1.748 261 H SER 32 HN SER 32 2.582 -3.730 7.551 262 HA SER 32 HA SER 32 0.781 -5.798 6.453 263 HB2 SER 32 HB2 SER 32 0.311 -5.314 8.857 264 HB3 SER 32 HB1 SER 32 0.015 -3.630 8.429 265 HG SER 32 HG SER 32 -1.915 -4.171 7.811 266 H ILE 33 HN ILE 33 -0.786 -5.096 4.953 267 HA ILE 33 HA ILE 33 -0.451 -2.333 4.008 268 HB ILE 33 HB ILE 33 -0.416 -3.045 1.691 269 HG12 ILE 33 HG12 ILE 33 0.182 -5.672 1.498 270 HG13 ILE 33 HG11 ILE 33 -0.942 -5.716 2.854 271 HG21 ILE 33 HG21 ILE 33 1.674 -4.363 3.396 272 HG22 ILE 33 HG22 ILE 33 1.725 -2.759 2.657 273 HG23 ILE 33 HG23 ILE 33 1.786 -4.202 1.641 274 HD11 ILE 33 HD11 ILE 33 -1.498 -4.549 0.139 275 HD12 ILE 33 HD12 ILE 33 -2.630 -4.603 1.492 276 HD13 ILE 33 HD13 ILE 33 -2.079 -6.101 0.740 277 H GLY 34 HN GLY 34 -2.279 -1.506 2.885 278 HA2 GLY 34 HA2 GLY 34 -4.694 -3.152 3.328 279 HA3 GLY 34 HA1 GLY 34 -4.650 -1.433 3.722 280 H GLY 35 HN GLY 35 -6.034 -3.354 1.647 281 HA2 GLY 35 HA2 GLY 35 -6.112 -1.267 -0.397 282 HA3 GLY 35 HA1 GLY 35 -5.593 -2.866 -0.923 283 H GLY 36 HN GLY 36 -8.174 -0.903 -0.943 284 HA2 GLY 36 HA2 GLY 36 -10.187 -2.371 -1.736 285 HA3 GLY 36 HA1 GLY 36 -10.124 -2.970 -0.080 286 H ILE 37 HN ILE 37 -9.179 0.157 -0.015 287 HA ILE 37 HA ILE 37 -10.876 0.828 1.916 288 HB ILE 37 HB ILE 37 -10.334 3.227 1.402 289 HG12 ILE 37 HG12 ILE 37 -8.892 1.898 -0.911 290 HG13 ILE 37 HG11 ILE 37 -10.198 3.067 -1.032 291 HG21 ILE 37 HG21 ILE 37 -8.956 1.828 2.839 292 HG22 ILE 37 HG22 ILE 37 -7.956 2.924 1.884 293 HG23 ILE 37 HG23 ILE 37 -8.087 1.224 1.428 294 HD11 ILE 37 HD11 ILE 37 -7.435 3.579 0.027 295 HD12 ILE 37 HD12 ILE 37 -8.740 4.763 -0.032 296 HD13 ILE 37 HD13 ILE 37 -8.081 4.099 -1.527 297 H ASP 38 HN ASP 38 -11.397 2.127 -1.309 298 HA ASP 38 HA ASP 38 -14.181 2.685 -0.514 299 HB2 ASP 38 HB2 ASP 38 -12.867 4.709 -0.212 300 HB3 ASP 38 HB1 ASP 38 -12.146 4.496 -1.806 301 H GLN 39 HN GLN 39 -12.159 1.181 -2.588 302 HA GLN 39 HA GLN 39 -13.706 1.988 -4.956 303 HB2 GLN 39 HB2 GLN 39 -11.583 1.603 -6.275 304 HB3 GLN 39 HB1 GLN 39 -11.640 3.026 -5.248 305 HG2 GLN 39 HG2 GLN 39 -9.500 1.670 -5.238 306 HG3 GLN 39 HG1 GLN 39 -10.180 2.078 -3.673 307 HE21 GLN 39 HE21 GLN 39 -10.513 0.636 -2.326 308 HE22 GLN 39 HE22 GLN 39 -10.593 -1.039 -2.623 309 H ASP 40 HN ASP 40 -12.668 -0.612 -3.174 310 HA ASP 40 HA ASP 40 -12.243 -2.639 -4.979 311 HB2 ASP 40 HB2 ASP 40 -12.047 -2.710 -2.412 312 HB3 ASP 40 HB1 ASP 40 -13.765 -3.079 -2.417 313 HA PRO 41 HA PRO 41 -15.938 -3.145 -7.284 314 HB2 PRO 41 HB2 PRO 41 -15.755 -5.796 -7.839 315 HB3 PRO 41 HB1 PRO 41 -14.661 -4.594 -8.538 316 HG2 PRO 41 HG2 PRO 41 -14.224 -6.196 -6.039 317 HG3 PRO 41 HG1 PRO 41 -13.216 -6.152 -7.492 318 HD2 PRO 41 HD2 PRO 41 -12.544 -4.585 -5.556 319 HD3 PRO 41 HD1 PRO 41 -12.684 -3.854 -7.162 320 H SER 42 HN SER 42 -15.401 -4.817 -4.327 321 HA SER 42 HA SER 42 -17.868 -6.268 -4.306 322 HB2 SER 42 HB2 SER 42 -16.115 -5.562 -1.938 323 HB3 SER 42 HB1 SER 42 -17.250 -6.909 -2.071 324 HG SER 42 HG SER 42 -14.682 -6.594 -3.161 325 H GLN 43 HN GLN 43 -16.656 -3.164 -3.183 326 HA GLN 43 HA GLN 43 -19.277 -2.552 -2.005 327 HB2 GLN 43 HB2 GLN 43 -17.884 -0.599 -1.075 328 HB3 GLN 43 HB1 GLN 43 -17.600 -2.217 -0.446 329 HG2 GLN 43 HG2 GLN 43 -15.879 -1.667 -2.680 330 HG3 GLN 43 HG1 GLN 43 -15.696 -0.463 -1.400 331 HE21 GLN 43 HE21 GLN 43 -14.746 -0.988 0.421 332 HE22 GLN 43 HE22 GLN 43 -14.107 -2.551 0.837 333 H ASN 44 HN ASN 44 -16.737 -1.282 -4.024 334 HA ASN 44 HA ASN 44 -18.686 0.542 -5.299 335 HB2 ASN 44 HB2 ASN 44 -16.690 1.393 -3.792 336 HB3 ASN 44 HB1 ASN 44 -15.774 1.161 -5.282 337 HD21 ASN 44 HD21 ASN 44 -16.328 3.629 -3.924 338 HD22 ASN 44 HD22 ASN 44 -17.220 4.624 -5.027 339 HA PRO 45 HA PRO 45 -16.975 -2.058 -8.714 340 HB2 PRO 45 HB2 PRO 45 -19.347 -2.435 -9.978 341 HB3 PRO 45 HB1 PRO 45 -18.763 -3.495 -8.685 342 HG2 PRO 45 HG2 PRO 45 -20.771 -1.283 -8.568 343 HG3 PRO 45 HG1 PRO 45 -20.791 -2.862 -7.762 344 HD2 PRO 45 HD2 PRO 45 -20.080 -0.535 -6.524 345 HD3 PRO 45 HD1 PRO 45 -19.477 -2.131 -6.037 346 H PHE 46 HN PHE 46 -18.463 0.893 -8.244 347 HA PHE 46 HA PHE 46 -18.417 1.781 -10.996 348 HB2 PHE 46 HB2 PHE 46 -20.041 2.648 -9.281 349 HB3 PHE 46 HB1 PHE 46 -18.685 3.409 -8.451 350 HD1 PHE 46 HD2 PHE 46 -20.578 3.378 -11.635 351 HD2 PHE 46 HD1 PHE 46 -17.891 5.512 -9.117 352 HE1 PHE 46 HE2 PHE 46 -20.843 5.371 -13.051 353 HE2 PHE 46 HE1 PHE 46 -18.159 7.513 -10.527 354 HZ PHE 46 HZ PHE 46 -19.601 7.438 -12.509 355 H SER 47 HN SER 47 -16.322 1.583 -8.264 356 HA SER 47 HA SER 47 -14.371 3.335 -9.525 357 HB2 SER 47 HB2 SER 47 -14.455 1.997 -6.814 358 HB3 SER 47 HB1 SER 47 -13.098 2.966 -7.404 359 HG SER 47 HG SER 47 -15.636 3.763 -6.584 360 H GLU 48 HN GLU 48 -12.111 1.947 -8.466 361 HA GLU 48 HA GLU 48 -10.569 0.418 -9.075 362 HB2 GLU 48 HB2 GLU 48 -12.127 -1.261 -8.265 363 HB3 GLU 48 HB1 GLU 48 -12.992 -1.245 -9.798 364 HG2 GLU 48 HG2 GLU 48 -11.059 -2.167 -10.928 365 HG3 GLU 48 HG1 GLU 48 -10.123 -2.074 -9.438 366 H ASP 49 HN ASP 49 -12.921 1.522 -11.271 367 HA ASP 49 HA ASP 49 -11.902 0.614 -13.731 368 HB2 ASP 49 HB2 ASP 49 -14.151 1.543 -13.498 369 HB3 ASP 49 HB1 ASP 49 -13.482 3.107 -13.044 370 H LYS 50 HN LYS 50 -11.037 3.181 -11.614 371 HA LYS 50 HA LYS 50 -9.392 4.652 -13.432 372 HB2 LYS 50 HB2 LYS 50 -9.164 4.640 -10.441 373 HB3 LYS 50 HB1 LYS 50 -8.653 5.905 -11.542 374 HG2 LYS 50 HG2 LYS 50 -10.569 6.792 -10.600 375 HG3 LYS 50 HG1 LYS 50 -11.177 6.099 -12.103 376 HD2 LYS 50 HD2 LYS 50 -12.283 4.404 -11.037 377 HD3 LYS 50 HD1 LYS 50 -11.156 4.381 -9.678 378 HE2 LYS 50 HE2 LYS 50 -13.227 6.514 -10.211 379 HE3 LYS 50 HE1 LYS 50 -13.388 5.206 -9.040 380 HZ1 LYS 50 HZ1 LYS 50 -11.278 6.117 -8.002 381 HZ2 LYS 50 HZ2 LYS 50 -12.677 7.069 -7.827 382 HZ3 LYS 50 HZ3 LYS 50 -11.503 7.496 -8.972 383 H THR 51 HN THR 51 -9.055 1.653 -12.436 384 HA THR 51 HA THR 51 -7.530 0.199 -11.692 385 HB THR 51 HB THR 51 -5.261 0.330 -12.394 386 HG1 THR 51 HG1 THR 51 -5.674 3.110 -12.261 387 HG21 THR 51 HG21 THR 51 -6.845 0.128 -14.234 388 HG22 THR 51 HG22 THR 51 -5.424 1.043 -14.740 389 HG23 THR 51 HG23 THR 51 -6.930 1.887 -14.365 390 H ASP 52 HN ASP 52 -8.661 2.259 -10.088 391 HA ASP 52 HA ASP 52 -7.029 3.527 -8.258 392 HB2 ASP 52 HB2 ASP 52 -9.764 3.005 -8.538 393 HB3 ASP 52 HB1 ASP 52 -9.343 2.343 -6.963 394 H LYS 53 HN LYS 53 -8.827 0.691 -7.283 395 HA LYS 53 HA LYS 53 -8.425 -1.157 -6.129 396 HB2 LYS 53 HB2 LYS 53 -6.367 -1.193 -7.799 397 HB3 LYS 53 HB1 LYS 53 -5.468 -1.019 -6.295 398 HG2 LYS 53 HG2 LYS 53 -5.930 -3.390 -7.110 399 HG3 LYS 53 HG1 LYS 53 -6.307 -3.028 -5.420 400 HD2 LYS 53 HD2 LYS 53 -8.649 -2.668 -6.022 401 HD3 LYS 53 HD1 LYS 53 -8.279 -3.030 -7.707 402 HE2 LYS 53 HE2 LYS 53 -7.727 -5.295 -7.167 403 HE3 LYS 53 HE1 LYS 53 -7.841 -4.960 -5.440 404 HZ1 LYS 53 HZ1 LYS 53 -10.134 -4.696 -7.315 405 HZ2 LYS 53 HZ2 LYS 53 -10.175 -4.650 -5.615 406 HZ3 LYS 53 HZ3 LYS 53 -9.807 -6.094 -6.412 407 H GLY 54 HN GLY 54 -6.671 1.692 -5.245 408 HA2 GLY 54 HA2 GLY 54 -6.486 2.673 -3.174 409 HA3 GLY 54 HA1 GLY 54 -7.787 1.597 -2.682 410 H ILE 55 HN ILE 55 -4.430 1.053 -3.683 411 HA ILE 55 HA ILE 55 -4.087 -0.711 -1.354 412 HB ILE 55 HB ILE 55 -2.343 -0.547 -3.819 413 HG12 ILE 55 HG12 ILE 55 -4.589 -1.231 -4.486 414 HG13 ILE 55 HG11 ILE 55 -3.468 -2.580 -4.610 415 HG21 ILE 55 HG21 ILE 55 -2.545 -2.599 -1.623 416 HG22 ILE 55 HG22 ILE 55 -1.199 -1.499 -1.938 417 HG23 ILE 55 HG23 ILE 55 -1.579 -2.784 -3.089 418 HD11 ILE 55 HD11 ILE 55 -5.502 -2.121 -2.433 419 HD12 ILE 55 HD12 ILE 55 -4.317 -3.437 -2.463 420 HD13 ILE 55 HD13 ILE 55 -5.556 -3.336 -3.714 421 H TYR 56 HN TYR 56 -2.892 0.055 0.285 422 HA TYR 56 HA TYR 56 -0.422 1.445 -0.283 423 HB2 TYR 56 HB2 TYR 56 -0.844 3.453 0.869 424 HB3 TYR 56 HB1 TYR 56 -2.269 3.215 -0.130 425 HD1 TYR 56 HD2 TYR 56 -4.273 1.978 1.092 426 HD2 TYR 56 HD1 TYR 56 -1.102 4.004 3.063 427 HE1 TYR 56 HE2 TYR 56 -5.687 2.228 3.094 428 HE2 TYR 56 HE1 TYR 56 -2.502 4.271 5.063 429 HH TYR 56 HH TYR 56 -4.870 4.322 5.662 430 H VAL 57 HN VAL 57 1.026 1.480 1.543 431 HA VAL 57 HA VAL 57 0.669 -0.704 3.294 432 HB VAL 57 HB VAL 57 2.799 0.358 2.288 433 HG11 VAL 57 HG11 VAL 57 2.328 2.126 4.580 434 HG12 VAL 57 HG12 VAL 57 3.058 2.460 3.005 435 HG13 VAL 57 HG13 VAL 57 3.977 1.607 4.237 436 HG21 VAL 57 HG21 VAL 57 2.695 -1.633 3.641 437 HG22 VAL 57 HG22 VAL 57 2.754 -0.634 5.096 438 HG23 VAL 57 HG23 VAL 57 4.129 -0.676 3.993 439 H THR 58 HN THR 58 0.066 -0.738 5.345 440 HA THR 58 HA THR 58 -0.993 1.764 6.450 441 HB THR 58 HB THR 58 -2.450 0.353 7.817 442 HG1 THR 58 HG1 THR 58 -2.397 -1.918 7.546 443 HG21 THR 58 HG21 THR 58 -3.761 -0.657 5.975 444 HG22 THR 58 HG22 THR 58 -2.383 -0.385 4.902 445 HG23 THR 58 HG23 THR 58 -3.235 0.984 5.622 446 H ARG 59 HN ARG 59 1.385 -0.613 6.770 447 HA ARG 59 HA ARG 59 2.559 0.724 8.994 448 HB2 ARG 59 HB2 ARG 59 2.069 -0.556 10.773 449 HB3 ARG 59 HB1 ARG 59 0.671 -0.988 9.825 450 HG2 ARG 59 HG2 ARG 59 1.806 -2.986 9.022 451 HG3 ARG 59 HG1 ARG 59 3.210 -2.564 10.002 452 HD2 ARG 59 HD2 ARG 59 0.448 -3.060 11.065 453 HD3 ARG 59 HD1 ARG 59 1.750 -4.243 11.072 454 HE ARG 59 HE ARG 59 2.832 -2.154 12.385 455 HH11 ARG 59 HH11 ARG 59 -0.197 -3.868 12.748 456 HH12 ARG 59 HH12 ARG 59 -0.273 -3.625 14.470 457 HH21 ARG 59 HH21 ARG 59 2.703 -1.802 14.669 458 HH22 ARG 59 HH22 ARG 59 1.355 -2.452 15.552 459 H VAL 60 HN VAL 60 4.319 -0.590 9.931 460 HA VAL 60 HA VAL 60 5.644 -2.443 8.179 461 HB VAL 60 HB VAL 60 6.971 0.133 9.077 462 HG11 VAL 60 HG11 VAL 60 8.120 -2.210 7.558 463 HG12 VAL 60 HG12 VAL 60 8.395 -1.851 9.257 464 HG13 VAL 60 HG13 VAL 60 8.988 -0.742 8.021 465 HG21 VAL 60 HG21 VAL 60 6.033 -0.871 6.425 466 HG22 VAL 60 HG22 VAL 60 7.360 0.289 6.541 467 HG23 VAL 60 HG23 VAL 60 5.768 0.708 7.178 468 H SER 61 HN SER 61 5.892 -4.066 9.671 469 HA SER 61 HA SER 61 6.613 -3.127 12.394 470 HB2 SER 61 HB2 SER 61 5.708 -5.872 11.609 471 HB3 SER 61 HB1 SER 61 5.888 -5.220 13.230 472 HG SER 61 HG SER 61 3.919 -4.539 13.087 473 H GLU 62 HN GLU 62 8.608 -2.778 11.732 474 HA GLU 62 HA GLU 62 10.180 -4.935 10.825 475 HB2 GLU 62 HB2 GLU 62 10.048 -2.106 10.257 476 HB3 GLU 62 HB1 GLU 62 11.646 -2.807 10.338 477 HG2 GLU 62 HG2 GLU 62 9.366 -3.668 8.610 478 HG3 GLU 62 HG1 GLU 62 10.874 -2.929 8.128 479 H GLY 63 HN GLY 63 12.115 -5.093 11.210 480 HA2 GLY 63 HA2 GLY 63 13.356 -3.502 13.360 481 HA3 GLY 63 HA1 GLY 63 13.766 -5.209 13.130 482 H GLY 64 HN GLY 64 13.228 -4.570 10.101 483 HA2 GLY 64 HA2 GLY 64 15.774 -3.413 9.479 484 HA3 GLY 64 HA1 GLY 64 15.697 -5.149 9.224 485 HA PRO 65 HA PRO 65 14.946 -5.174 5.274 486 HB2 PRO 65 HB2 PRO 65 12.277 -6.399 5.548 487 HB3 PRO 65 HB1 PRO 65 13.681 -6.958 4.648 488 HG2 PRO 65 HG2 PRO 65 13.031 -8.087 6.969 489 HG3 PRO 65 HG1 PRO 65 14.727 -7.801 6.536 490 HD2 PRO 65 HD2 PRO 65 12.979 -6.296 8.435 491 HD3 PRO 65 HD1 PRO 65 14.717 -6.650 8.525 492 H ALA 66 HN ALA 66 11.704 -4.211 6.593 493 HA ALA 66 HA ALA 66 10.947 -3.303 3.951 494 HB1 ALA 66 HB1 ALA 66 9.149 -4.023 5.342 495 HB2 ALA 66 HB2 ALA 66 8.986 -2.269 5.166 496 HB3 ALA 66 HB3 ALA 66 9.649 -2.952 6.652 497 H GLU 67 HN GLU 67 12.108 -1.916 6.911 498 HA GLU 67 HA GLU 67 11.605 0.795 5.996 499 HB2 GLU 67 HB2 GLU 67 12.857 1.151 8.275 500 HB3 GLU 67 HB1 GLU 67 11.171 0.635 8.236 501 HG2 GLU 67 HG2 GLU 67 11.647 -1.445 8.935 502 HG3 GLU 67 HG1 GLU 67 13.169 -1.479 8.089 503 H ILE 68 HN ILE 68 14.233 -1.516 6.324 504 HA ILE 68 HA ILE 68 16.218 0.473 5.916 505 HB ILE 68 HB ILE 68 17.672 -1.386 5.369 506 HG12 ILE 68 HG12 ILE 68 16.451 -3.588 6.401 507 HG13 ILE 68 HG11 ILE 68 15.184 -2.853 5.443 508 HG21 ILE 68 HG21 ILE 68 17.725 -2.277 7.694 509 HG22 ILE 68 HG22 ILE 68 16.190 -1.444 7.949 510 HG23 ILE 68 HG23 ILE 68 17.644 -0.519 7.575 511 HD11 ILE 68 HD11 ILE 68 16.328 -4.493 4.138 512 HD12 ILE 68 HD12 ILE 68 17.886 -3.727 4.465 513 HD13 ILE 68 HD13 ILE 68 16.678 -2.888 3.492 514 H ALA 69 HN ALA 69 14.282 -1.650 4.084 515 HA ALA 69 HA ALA 69 15.371 -1.159 1.558 516 HB1 ALA 69 HB1 ALA 69 12.510 -1.655 2.349 517 HB2 ALA 69 HB2 ALA 69 13.692 -2.886 1.911 518 HB3 ALA 69 HB3 ALA 69 13.124 -1.734 0.698 519 H GLY 70 HN GLY 70 13.412 0.553 3.768 520 HA2 GLY 70 HA2 GLY 70 13.529 2.979 3.787 521 HA3 GLY 70 HA1 GLY 70 13.547 2.943 2.020 522 H LEU 71 HN LEU 71 11.417 1.048 4.121 523 HA LEU 71 HA LEU 71 9.169 2.269 2.765 524 HB2 LEU 71 HB2 LEU 71 9.497 -0.216 2.829 525 HB3 LEU 71 HB1 LEU 71 9.314 -0.138 4.577 526 HG LEU 71 HG LEU 71 7.029 0.830 4.196 527 HD11 LEU 71 HD11 LEU 71 7.536 -0.144 1.387 528 HD12 LEU 71 HD12 LEU 71 7.311 1.535 1.879 529 HD13 LEU 71 HD13 LEU 71 5.982 0.386 2.031 530 HD21 LEU 71 HD21 LEU 71 7.336 -1.410 4.921 531 HD22 LEU 71 HD22 LEU 71 7.717 -1.944 3.286 532 HD23 LEU 71 HD23 LEU 71 6.079 -1.412 3.685 533 H GLN 72 HN GLN 72 7.222 2.148 4.421 534 HA GLN 72 HA GLN 72 7.821 3.492 6.856 535 HB2 GLN 72 HB2 GLN 72 7.414 4.865 4.306 536 HB3 GLN 72 HB1 GLN 72 6.468 5.492 5.650 537 HG2 GLN 72 HG2 GLN 72 8.678 5.662 6.895 538 HG3 GLN 72 HG1 GLN 72 9.441 5.390 5.317 539 HE21 GLN 72 HE21 GLN 72 7.138 6.543 3.997 540 HE22 GLN 72 HE22 GLN 72 7.256 8.275 4.193 541 H ILE 73 HN ILE 73 5.744 4.568 7.595 542 HA ILE 73 HA ILE 73 3.531 2.784 7.137 543 HB ILE 73 HB ILE 73 3.479 5.205 8.899 544 HG12 ILE 73 HG12 ILE 73 5.579 4.215 9.526 545 HG13 ILE 73 HG11 ILE 73 4.399 3.752 10.746 546 HG21 ILE 73 HG21 ILE 73 2.263 2.478 9.030 547 HG22 ILE 73 HG22 ILE 73 1.451 3.994 8.654 548 HG23 ILE 73 HG23 ILE 73 2.085 3.712 10.275 549 HD11 ILE 73 HD11 ILE 73 5.417 2.027 8.491 550 HD12 ILE 73 HD12 ILE 73 4.179 1.554 9.664 551 HD13 ILE 73 HD13 ILE 73 5.826 1.883 10.207 552 H GLY 74 HN GLY 74 2.422 3.282 5.259 553 HA2 GLY 74 HA2 GLY 74 0.372 4.478 4.739 554 HA3 GLY 74 HA1 GLY 74 1.089 5.923 5.453 555 H ASP 75 HN ASP 75 1.680 3.569 2.891 556 HA ASP 75 HA ASP 75 2.424 5.735 1.042 557 HB2 ASP 75 HB2 ASP 75 4.351 4.439 2.549 558 HB3 ASP 75 HB1 ASP 75 4.349 3.521 1.045 559 H LYS 76 HN LYS 76 1.910 5.115 -1.146 560 HA LYS 76 HA LYS 76 0.049 2.880 -0.949 561 HB2 LYS 76 HB2 LYS 76 0.187 4.726 -3.312 562 HB3 LYS 76 HB1 LYS 76 -1.191 3.823 -2.694 563 HG2 LYS 76 HG2 LYS 76 -1.822 5.813 -1.870 564 HG3 LYS 76 HG1 LYS 76 -0.655 5.458 -0.593 565 HD2 LYS 76 HD2 LYS 76 0.053 7.547 -1.219 566 HD3 LYS 76 HD1 LYS 76 1.033 6.550 -2.297 567 HE2 LYS 76 HE2 LYS 76 0.201 8.163 -3.721 568 HE3 LYS 76 HE1 LYS 76 -0.916 6.821 -3.958 569 HZ1 LYS 76 HZ1 LYS 76 -2.417 7.926 -2.337 570 HZ2 LYS 76 HZ2 LYS 76 -2.164 8.821 -3.749 571 HZ3 LYS 76 HZ3 LYS 76 -1.365 9.255 -2.318 572 H ILE 77 HN ILE 77 0.963 1.051 -1.371 573 HA ILE 77 HA ILE 77 2.990 0.664 -3.343 574 HB ILE 77 HB ILE 77 1.277 -1.365 -1.900 575 HG12 ILE 77 HG12 ILE 77 4.109 -0.504 -1.288 576 HG13 ILE 77 HG11 ILE 77 2.697 0.161 -0.474 577 HG21 ILE 77 HG21 ILE 77 2.278 -2.281 -3.935 578 HG22 ILE 77 HG22 ILE 77 3.029 -2.973 -2.499 579 HG23 ILE 77 HG23 ILE 77 3.866 -1.720 -3.411 580 HD11 ILE 77 HD11 ILE 77 2.133 -2.038 0.374 581 HD12 ILE 77 HD12 ILE 77 3.771 -1.577 0.841 582 HD13 ILE 77 HD13 ILE 77 3.520 -2.728 -0.471 583 H MET 78 HN MET 78 2.583 0.723 -5.434 584 HA MET 78 HA MET 78 -0.162 0.219 -6.334 585 HB2 MET 78 HB2 MET 78 2.156 1.343 -7.908 586 HB3 MET 78 HB1 MET 78 0.463 1.337 -8.385 587 HG2 MET 78 HG2 MET 78 1.352 2.697 -5.884 588 HG3 MET 78 HG1 MET 78 1.496 3.492 -7.447 589 HE1 MET 78 HE1 MET 78 -1.658 1.154 -6.137 590 HE2 MET 78 HE2 MET 78 -2.439 2.471 -5.258 591 HE3 MET 78 HE3 MET 78 -0.820 1.943 -4.803 592 H GLN 79 HN GLN 79 3.000 -1.116 -6.440 593 HA GLN 79 HA GLN 79 1.988 -3.552 -7.487 594 HB2 GLN 79 HB2 GLN 79 4.032 -3.435 -9.182 595 HB3 GLN 79 HB1 GLN 79 2.365 -3.093 -9.624 596 HG2 GLN 79 HG2 GLN 79 3.060 -0.670 -8.958 597 HG3 GLN 79 HG1 GLN 79 4.667 -1.319 -9.296 598 HE21 GLN 79 HE21 GLN 79 5.130 -2.136 -11.312 599 HE22 GLN 79 HE22 GLN 79 4.240 -1.647 -12.724 600 H VAL 80 HN VAL 80 3.384 -5.168 -7.642 601 HA VAL 80 HA VAL 80 5.563 -4.925 -5.644 602 HB VAL 80 HB VAL 80 3.812 -6.002 -4.534 603 HG11 VAL 80 HG11 VAL 80 3.395 -7.693 -6.980 604 HG12 VAL 80 HG12 VAL 80 2.373 -6.358 -6.440 605 HG13 VAL 80 HG13 VAL 80 2.496 -7.829 -5.468 606 HG21 VAL 80 HG21 VAL 80 5.986 -7.215 -4.349 607 HG22 VAL 80 HG22 VAL 80 5.512 -8.231 -5.720 608 HG23 VAL 80 HG23 VAL 80 4.607 -8.314 -4.198 609 H ASN 81 HN ASN 81 7.490 -5.599 -6.376 610 HA ASN 81 HA ASN 81 9.108 -6.551 -7.649 611 HB2 ASN 81 HB2 ASN 81 6.963 -8.664 -7.882 612 HB3 ASN 81 HB1 ASN 81 8.571 -8.862 -8.578 613 HD21 ASN 81 HD21 ASN 81 6.921 -9.999 -6.219 614 HD22 ASN 81 HD22 ASN 81 8.093 -10.052 -4.926 615 H GLY 82 HN GLY 82 6.436 -5.299 -8.899 616 HA2 GLY 82 HA2 GLY 82 6.727 -4.039 -10.999 617 HA3 GLY 82 HA1 GLY 82 7.359 -5.529 -11.696 618 H TRP 83 HN TRP 83 4.795 -6.250 -9.611 619 HA TRP 83 HA TRP 83 3.046 -6.592 -11.905 620 HB2 TRP 83 HB2 TRP 83 2.593 -7.611 -9.133 621 HB3 TRP 83 HB1 TRP 83 1.808 -8.109 -10.600 622 HD1 TRP 83 HD1 TRP 83 5.443 -7.871 -9.688 623 HE1 TRP 83 HE1 TRP 83 6.466 -10.154 -9.871 624 HE3 TRP 83 HE3 TRP 83 1.365 -10.525 -11.193 625 HZ2 TRP 83 HZ2 TRP 83 5.786 -12.758 -10.647 626 HZ3 TRP 83 HZ3 TRP 83 1.651 -12.931 -11.661 627 HH2 TRP 83 HH2 TRP 83 3.839 -14.002 -11.383 628 H ASP 84 HN ASP 84 2.489 -4.340 -11.866 629 HA ASP 84 HA ASP 84 1.164 -2.771 -10.288 630 HB2 ASP 84 HB2 ASP 84 -0.657 -3.419 -12.454 631 HB3 ASP 84 HB1 ASP 84 0.272 -1.955 -12.181 632 H MET 85 HN MET 85 0.147 -3.312 -8.480 633 HA MET 85 HA MET 85 -1.653 -5.586 -8.321 634 HB2 MET 85 HB2 MET 85 -1.408 -3.559 -6.130 635 HB3 MET 85 HB1 MET 85 -1.572 -5.306 -6.018 636 HG2 MET 85 HG2 MET 85 0.735 -5.567 -6.781 637 HG3 MET 85 HG1 MET 85 0.890 -3.822 -6.894 638 HE1 MET 85 HE1 MET 85 -0.822 -6.110 -4.168 639 HE2 MET 85 HE2 MET 85 0.428 -6.145 -2.927 640 HE3 MET 85 HE3 MET 85 0.708 -6.943 -4.479 641 H THR 86 HN THR 86 -2.408 -3.259 -10.039 642 HA THR 86 HA THR 86 -4.348 -1.757 -8.530 643 HB THR 86 HB THR 86 -4.648 -0.524 -10.688 644 HG1 THR 86 HG1 THR 86 -2.867 -1.048 -12.225 645 HG21 THR 86 HG21 THR 86 -1.839 -0.847 -9.629 646 HG22 THR 86 HG22 THR 86 -3.072 0.242 -8.994 647 HG23 THR 86 HG23 THR 86 -2.409 0.507 -10.606 648 H MET 87 HN MET 87 -4.466 -4.396 -10.786 649 HA MET 87 HA MET 87 -7.409 -4.168 -10.778 650 HB2 MET 87 HB2 MET 87 -5.641 -5.090 -13.045 651 HB3 MET 87 HB1 MET 87 -7.389 -5.273 -13.026 652 HG2 MET 87 HG2 MET 87 -7.609 -2.824 -12.850 653 HG3 MET 87 HG1 MET 87 -5.855 -2.686 -12.965 654 HE1 MET 87 HE1 MET 87 -8.574 -4.251 -16.350 655 HE2 MET 87 HE2 MET 87 -9.181 -3.599 -14.827 656 HE3 MET 87 HE3 MET 87 -8.308 -5.133 -14.845 657 H VAL 88 HN VAL 88 -4.778 -6.095 -9.991 658 HA VAL 88 HA VAL 88 -6.075 -8.641 -10.345 659 HB VAL 88 HB VAL 88 -3.539 -8.199 -8.800 660 HG11 VAL 88 HG11 VAL 88 -2.890 -10.293 -9.889 661 HG12 VAL 88 HG12 VAL 88 -4.463 -10.346 -10.687 662 HG13 VAL 88 HG13 VAL 88 -4.359 -10.450 -8.927 663 HG21 VAL 88 HG21 VAL 88 -3.280 -6.779 -10.747 664 HG22 VAL 88 HG22 VAL 88 -3.775 -8.099 -11.807 665 HG23 VAL 88 HG23 VAL 88 -2.263 -8.212 -10.905 666 H THR 89 HN THR 89 -6.004 -10.175 -8.199 667 HA THR 89 HA THR 89 -7.759 -8.647 -6.433 668 HB THR 89 HB THR 89 -7.481 -11.446 -7.293 669 HG1 THR 89 HG1 THR 89 -9.496 -11.135 -7.791 670 HG21 THR 89 HG21 THR 89 -7.095 -11.920 -5.025 671 HG22 THR 89 HG22 THR 89 -8.773 -12.337 -5.381 672 HG23 THR 89 HG23 THR 89 -8.397 -10.848 -4.508 673 H HIS 90 HN HIS 90 -7.584 -9.273 -4.027 674 HA HIS 90 HA HIS 90 -5.040 -8.412 -3.152 675 HB2 HIS 90 HB2 HIS 90 -7.136 -7.998 -1.898 676 HB3 HIS 90 HB1 HIS 90 -7.236 -9.716 -1.522 677 HD1 HIS 90 HD1 HIS 90 -5.478 -6.577 -0.546 678 HD2 HIS 90 HD2 HIS 90 -5.402 -10.617 0.431 679 HE1 HIS 90 HE1 HIS 90 -4.149 -6.734 1.582 680 HE2 HIS 90 HE2 HIS 90 -4.269 -9.165 2.251 681 H ASP 91 HN ASP 91 -6.571 -11.567 -3.247 682 HA ASP 91 HA ASP 91 -4.425 -12.948 -1.973 683 HB2 ASP 91 HB2 ASP 91 -6.682 -13.895 -2.016 684 HB3 ASP 91 HB1 ASP 91 -6.601 -14.016 -3.779 685 H GLN 92 HN GLN 92 -5.245 -12.155 -5.278 686 HA GLN 92 HA GLN 92 -3.209 -13.624 -6.561 687 HB2 GLN 92 HB2 GLN 92 -4.023 -10.947 -7.552 688 HB3 GLN 92 HB1 GLN 92 -3.655 -12.403 -8.460 689 HG2 GLN 92 HG2 GLN 92 -6.102 -11.942 -6.813 690 HG3 GLN 92 HG1 GLN 92 -6.012 -11.804 -8.564 691 HE21 GLN 92 HE21 GLN 92 -4.208 -14.050 -8.728 692 HE22 GLN 92 HE22 GLN 92 -5.208 -15.430 -8.500 693 H ALA 93 HN ALA 93 -3.425 -10.446 -5.162 694 HA ALA 93 HA ALA 93 -0.849 -9.512 -5.778 695 HB1 ALA 93 HB1 ALA 93 -2.724 -8.864 -3.502 696 HB2 ALA 93 HB2 ALA 93 -2.536 -7.977 -5.014 697 HB3 ALA 93 HB3 ALA 93 -1.231 -7.991 -3.830 698 H ARG 94 HN ARG 94 -2.256 -11.315 -3.130 699 HA ARG 94 HA ARG 94 -0.004 -11.614 -1.551 700 HB2 ARG 94 HB2 ARG 94 -2.437 -13.338 -1.967 701 HB3 ARG 94 HB1 ARG 94 -1.169 -13.789 -0.826 702 HG2 ARG 94 HG2 ARG 94 -3.012 -11.413 -0.731 703 HG3 ARG 94 HG1 ARG 94 -2.894 -12.750 0.412 704 HD2 ARG 94 HD2 ARG 94 -1.764 -11.133 1.562 705 HD3 ARG 94 HD1 ARG 94 -0.429 -11.878 0.678 706 HE ARG 94 HE ARG 94 -1.193 -9.915 -0.991 707 HH11 ARG 94 HH11 ARG 94 -0.436 -9.951 2.408 708 HH12 ARG 94 HH12 ARG 94 0.063 -8.292 2.459 709 HH21 ARG 94 HH21 ARG 94 -0.526 -7.714 -0.949 710 HH22 ARG 94 HH22 ARG 94 0.031 -7.025 0.540 711 H LYS 95 HN LYS 95 -1.225 -13.576 -4.212 712 HA LYS 95 HA LYS 95 0.517 -15.703 -4.129 713 HB2 LYS 95 HB2 LYS 95 -0.797 -14.361 -6.482 714 HB3 LYS 95 HB1 LYS 95 0.115 -15.854 -6.627 715 HG2 LYS 95 HG2 LYS 95 -2.358 -15.459 -4.941 716 HG3 LYS 95 HG1 LYS 95 -2.287 -16.263 -6.511 717 HD2 LYS 95 HD2 LYS 95 -2.071 -18.127 -5.274 718 HD3 LYS 95 HD1 LYS 95 -0.383 -17.628 -5.151 719 HE2 LYS 95 HE2 LYS 95 -0.951 -18.033 -2.943 720 HE3 LYS 95 HE1 LYS 95 -1.186 -16.288 -3.085 721 HZ1 LYS 95 HZ1 LYS 95 -3.585 -16.754 -3.491 722 HZ2 LYS 95 HZ2 LYS 95 -3.049 -17.210 -1.954 723 HZ3 LYS 95 HZ3 LYS 95 -3.280 -18.388 -3.147 724 H ARG 96 HN ARG 96 1.124 -12.491 -5.551 725 HA ARG 96 HA ARG 96 3.525 -13.494 -6.830 726 HB2 ARG 96 HB2 ARG 96 3.786 -11.088 -7.535 727 HB3 ARG 96 HB1 ARG 96 2.396 -11.975 -8.151 728 HG2 ARG 96 HG2 ARG 96 1.121 -10.964 -6.192 729 HG3 ARG 96 HG1 ARG 96 2.490 -9.850 -6.061 730 HD2 ARG 96 HD2 ARG 96 1.982 -8.787 -7.957 731 HD3 ARG 96 HD1 ARG 96 1.466 -10.277 -8.762 732 HE ARG 96 HE ARG 96 -0.484 -9.848 -6.931 733 HH11 ARG 96 HH11 ARG 96 0.760 -7.929 -9.570 734 HH12 ARG 96 HH12 ARG 96 -0.617 -6.880 -9.632 735 HH21 ARG 96 HH21 ARG 96 -2.302 -8.480 -7.011 736 HH22 ARG 96 HH22 ARG 96 -2.359 -7.197 -8.173 737 H LEU 97 HN LEU 97 2.737 -11.572 -3.986 738 HA LEU 97 HA LEU 97 5.534 -10.930 -3.595 739 HB2 LEU 97 HB2 LEU 97 4.690 -9.834 -1.511 740 HB3 LEU 97 HB1 LEU 97 4.139 -9.165 -3.031 741 HG LEU 97 HG LEU 97 2.059 -10.691 -2.618 742 HD11 LEU 97 HD11 LEU 97 3.089 -11.837 -0.700 743 HD12 LEU 97 HD12 LEU 97 1.546 -11.071 -0.309 744 HD13 LEU 97 HD13 LEU 97 3.062 -10.316 0.187 745 HD21 LEU 97 HD21 LEU 97 0.991 -8.871 -1.413 746 HD22 LEU 97 HD22 LEU 97 2.025 -8.271 -2.709 747 HD23 LEU 97 HD23 LEU 97 2.572 -8.190 -1.031 748 H THR 98 HN THR 98 3.340 -13.332 -2.501 749 HA THR 98 HA THR 98 5.489 -14.330 -0.768 750 HB THR 98 HB THR 98 3.581 -15.575 0.472 751 HG1 THR 98 HG1 THR 98 2.133 -14.144 -1.227 752 HG21 THR 98 HG21 THR 98 5.006 -13.880 1.496 753 HG22 THR 98 HG22 THR 98 3.341 -13.711 2.043 754 HG23 THR 98 HG23 THR 98 3.980 -12.600 0.832 755 H LYS 99 HN LYS 99 5.628 -15.007 -3.339 756 HA LYS 99 HA LYS 99 4.436 -17.659 -3.597 757 HB2 LYS 99 HB2 LYS 99 5.580 -17.572 -5.858 758 HB3 LYS 99 HB1 LYS 99 4.324 -16.371 -5.595 759 HG2 LYS 99 HG2 LYS 99 6.086 -14.724 -5.040 760 HG3 LYS 99 HG1 LYS 99 7.296 -15.926 -5.452 761 HD2 LYS 99 HD2 LYS 99 6.328 -16.065 -7.716 762 HD3 LYS 99 HD1 LYS 99 5.197 -14.787 -7.274 763 HE2 LYS 99 HE2 LYS 99 6.993 -13.222 -6.967 764 HE3 LYS 99 HE1 LYS 99 8.198 -14.489 -7.195 765 HZ1 LYS 99 HZ1 LYS 99 6.262 -13.607 -9.266 766 HZ2 LYS 99 HZ2 LYS 99 7.491 -14.744 -9.468 767 HZ3 LYS 99 HZ3 LYS 99 7.882 -13.119 -9.195 768 H ARG 100 HN ARG 100 6.696 -18.629 -5.197 769 HA ARG 100 HA ARG 100 8.810 -18.825 -3.151 770 HB2 ARG 100 HB2 ARG 100 7.284 -20.885 -3.381 771 HB3 ARG 100 HB1 ARG 100 8.044 -21.107 -4.951 772 HG2 ARG 100 HG2 ARG 100 9.104 -22.486 -3.252 773 HG3 ARG 100 HG1 ARG 100 10.226 -21.282 -3.892 774 HD2 ARG 100 HD2 ARG 100 9.700 -19.846 -1.926 775 HD3 ARG 100 HD1 ARG 100 8.736 -21.172 -1.274 776 HE ARG 100 HE ARG 100 11.627 -21.411 -1.815 777 HH11 ARG 100 HH11 ARG 100 8.822 -21.965 0.214 778 HH12 ARG 100 HH12 ARG 100 9.727 -22.775 1.455 779 HH21 ARG 100 HH21 ARG 100 12.803 -22.473 -0.212 780 HH22 ARG 100 HH22 ARG 100 12.005 -23.069 1.223 781 H SER 101 HN SER 101 8.347 -17.257 -5.631 782 HA SER 101 HA SER 101 10.516 -18.264 -7.342 783 HB2 SER 101 HB2 SER 101 8.322 -18.004 -8.443 784 HB3 SER 101 HB1 SER 101 8.295 -16.306 -7.979 785 HG SER 101 HG SER 101 9.611 -17.554 -10.051 786 H GLU 102 HN GLU 102 9.971 -16.064 -4.923 787 HA GLU 102 HA GLU 102 11.995 -14.228 -5.947 788 HB2 GLU 102 HB2 GLU 102 10.992 -12.463 -4.739 789 HB3 GLU 102 HB1 GLU 102 9.667 -13.285 -5.549 790 HG2 GLU 102 HG2 GLU 102 10.418 -13.877 -2.704 791 HG3 GLU 102 HG1 GLU 102 9.312 -12.580 -3.132 792 H GLU 103 HN GLU 103 12.913 -13.070 -3.951 793 HA GLU 103 HA GLU 103 13.463 -14.935 -1.742 794 HB2 GLU 103 HB2 GLU 103 15.304 -12.734 -2.691 795 HB3 GLU 103 HB1 GLU 103 15.654 -13.955 -1.478 796 HG2 GLU 103 HG2 GLU 103 15.142 -14.626 -4.351 797 HG3 GLU 103 HG1 GLU 103 16.745 -14.229 -3.735 798 H VAL 104 HN VAL 104 11.810 -12.366 -2.722 799 HA VAL 104 HA VAL 104 12.486 -10.573 -0.526 800 HB VAL 104 HB VAL 104 14.099 -10.771 -2.663 801 HG11 VAL 104 HG11 VAL 104 12.449 -10.062 -4.275 802 HG12 VAL 104 HG12 VAL 104 13.746 -8.874 -4.152 803 HG13 VAL 104 HG13 VAL 104 12.199 -8.562 -3.374 804 HG21 VAL 104 HG21 VAL 104 13.509 -8.189 -1.282 805 HG22 VAL 104 HG22 VAL 104 15.002 -8.630 -2.116 806 HG23 VAL 104 HG23 VAL 104 14.523 -9.490 -0.651 807 H VAL 105 HN VAL 105 11.243 -8.404 -0.795 808 HA VAL 105 HA VAL 105 9.062 -8.752 -2.751 809 HB VAL 105 HB VAL 105 7.785 -7.143 -1.065 810 HG11 VAL 105 HG11 VAL 105 6.629 -9.105 -0.186 811 HG12 VAL 105 HG12 VAL 105 7.964 -10.132 -0.709 812 HG13 VAL 105 HG13 VAL 105 6.978 -9.290 -1.904 813 HG21 VAL 105 HG21 VAL 105 9.576 -7.027 0.585 814 HG22 VAL 105 HG22 VAL 105 9.545 -8.783 0.758 815 HG23 VAL 105 HG23 VAL 105 8.154 -7.822 1.262 816 H ARG 106 HN ARG 106 9.802 -7.482 -4.299 817 HA ARG 106 HA ARG 106 10.681 -4.799 -3.794 818 HB2 ARG 106 HB2 ARG 106 11.178 -6.544 -5.776 819 HB3 ARG 106 HB1 ARG 106 9.765 -5.740 -6.440 820 HG2 ARG 106 HG2 ARG 106 10.795 -3.705 -6.560 821 HG3 ARG 106 HG1 ARG 106 12.077 -4.198 -5.447 822 HD2 ARG 106 HD2 ARG 106 12.932 -4.128 -7.728 823 HD3 ARG 106 HD1 ARG 106 12.908 -5.783 -7.116 824 HE ARG 106 HE ARG 106 10.527 -5.475 -8.441 825 HH11 ARG 106 HH11 ARG 106 13.922 -5.270 -9.265 826 HH12 ARG 106 HH12 ARG 106 13.671 -5.706 -10.929 827 HH21 ARG 106 HH21 ARG 106 10.204 -6.105 -10.640 828 HH22 ARG 106 HH22 ARG 106 11.574 -6.178 -11.712 829 H LEU 107 HN LEU 107 9.377 -3.019 -4.104 830 HA LEU 107 HA LEU 107 6.863 -3.445 -5.424 831 HB2 LEU 107 HB2 LEU 107 6.056 -1.644 -3.516 832 HB3 LEU 107 HB1 LEU 107 5.571 -3.303 -3.690 833 HG LEU 107 HG LEU 107 6.117 -2.615 -1.383 834 HD11 LEU 107 HD11 LEU 107 7.541 -4.583 -0.870 835 HD12 LEU 107 HD12 LEU 107 7.741 -4.812 -2.610 836 HD13 LEU 107 HD13 LEU 107 6.140 -4.929 -1.887 837 HD21 LEU 107 HD21 LEU 107 8.661 -2.613 -0.957 838 HD22 LEU 107 HD22 LEU 107 7.851 -1.145 -1.516 839 HD23 LEU 107 HD23 LEU 107 8.747 -2.140 -2.660 840 H LEU 108 HN LEU 108 5.855 -1.723 -6.147 841 HA LEU 108 HA LEU 108 7.451 0.705 -6.474 842 HB2 LEU 108 HB2 LEU 108 5.452 -0.680 -8.218 843 HB3 LEU 108 HB1 LEU 108 5.752 1.040 -8.392 844 HG LEU 108 HG LEU 108 8.170 -0.631 -8.382 845 HD11 LEU 108 HD11 LEU 108 7.901 -1.348 -10.693 846 HD12 LEU 108 HD12 LEU 108 6.260 -0.697 -10.712 847 HD13 LEU 108 HD13 LEU 108 6.653 -2.067 -9.673 848 HD21 LEU 108 HD21 LEU 108 8.139 1.781 -8.723 849 HD22 LEU 108 HD22 LEU 108 7.121 1.556 -10.148 850 HD23 LEU 108 HD23 LEU 108 8.769 0.930 -10.134 851 H VAL 109 HN VAL 109 6.775 2.271 -5.222 852 HA VAL 109 HA VAL 109 4.055 2.187 -4.192 853 HB VAL 109 HB VAL 109 5.994 1.624 -2.662 854 HG11 VAL 109 HG11 VAL 109 7.247 3.539 -1.708 855 HG12 VAL 109 HG12 VAL 109 6.577 4.558 -2.981 856 HG13 VAL 109 HG13 VAL 109 7.640 3.216 -3.395 857 HG21 VAL 109 HG21 VAL 109 5.106 2.893 -0.779 858 HG22 VAL 109 HG22 VAL 109 3.843 2.192 -1.794 859 HG23 VAL 109 HG23 VAL 109 4.220 3.910 -1.916 860 H THR 110 HN THR 110 3.817 4.475 -3.139 861 HA THR 110 HA THR 110 4.614 6.520 -5.078 862 HB THR 110 HB THR 110 2.168 7.403 -4.875 863 HG1 THR 110 HG1 THR 110 1.930 4.648 -4.230 864 HG21 THR 110 HG21 THR 110 3.153 6.736 -6.975 865 HG22 THR 110 HG22 THR 110 1.511 6.095 -6.854 866 HG23 THR 110 HG23 THR 110 2.895 5.037 -6.584 867 H ARG 111 HN ARG 111 5.619 7.978 -3.914 868 HA ARG 111 HA ARG 111 4.970 8.213 -1.112 869 HB2 ARG 111 HB2 ARG 111 7.275 8.581 -2.843 870 HB3 ARG 111 HB1 ARG 111 7.065 9.913 -1.711 871 HG2 ARG 111 HG2 ARG 111 6.963 7.087 -0.780 872 HG3 ARG 111 HG1 ARG 111 8.497 7.926 -1.030 873 HD2 ARG 111 HD2 ARG 111 7.414 9.799 0.344 874 HD3 ARG 111 HD1 ARG 111 6.276 8.558 0.856 875 HE ARG 111 HE ARG 111 8.159 7.330 1.780 876 HH11 ARG 111 HH11 ARG 111 8.715 10.686 0.939 877 HH12 ARG 111 HH12 ARG 111 10.005 10.890 2.082 878 HH21 ARG 111 HH21 ARG 111 9.884 7.600 3.270 879 HH22 ARG 111 HH22 ARG 111 10.679 9.138 3.398 880 H GLN 112 HN GLN 112 4.134 9.962 -0.222 881 HA GLN 112 HA GLN 112 3.384 12.209 -1.857 882 HB2 GLN 112 HB2 GLN 112 2.987 11.931 1.087 883 HB3 GLN 112 HB1 GLN 112 2.034 12.822 -0.057 884 HG2 GLN 112 HG2 GLN 112 2.101 9.839 0.213 885 HG3 GLN 112 HG1 GLN 112 0.815 10.894 0.777 886 HE21 GLN 112 HE21 GLN 112 2.568 10.817 -2.331 887 HE22 GLN 112 HE22 GLN 112 1.152 10.576 -3.304 888 H SER 113 HN SER 113 5.228 11.330 0.874 889 HA SER 113 HA SER 113 6.989 12.147 1.992 890 HB2 SER 113 HB2 SER 113 7.153 13.786 -0.496 891 HB3 SER 113 HB1 SER 113 8.358 13.911 0.788 892 HG SER 113 HG SER 113 8.884 12.398 -0.936 893 H LEU 114 HN LEU 114 4.281 13.441 1.592 894 HA LEU 114 HA LEU 114 4.650 15.665 3.459 895 HB2 LEU 114 HB2 LEU 114 3.111 15.586 0.897 896 HB3 LEU 114 HB1 LEU 114 2.652 16.689 2.184 897 HG LEU 114 HG LEU 114 3.990 18.038 0.867 898 HD11 LEU 114 HD11 LEU 114 6.239 18.145 2.020 899 HD12 LEU 114 HD12 LEU 114 5.721 16.715 2.933 900 HD13 LEU 114 HD13 LEU 114 4.817 18.229 3.064 901 HD21 LEU 114 HD21 LEU 114 6.149 17.241 -0.128 902 HD22 LEU 114 HD22 LEU 114 4.703 16.463 -0.770 903 HD23 LEU 114 HD23 LEU 114 5.712 15.608 0.399 904 H GLN 115 HN GLN 115 4.117 13.010 3.639 905 HA GLN 115 HA GLN 115 1.507 12.140 3.883 906 HB2 GLN 115 HB2 GLN 115 3.932 11.374 5.514 907 HB3 GLN 115 HB1 GLN 115 2.441 10.455 5.425 908 HG2 GLN 115 HG2 GLN 115 2.780 9.885 3.178 909 HG3 GLN 115 HG1 GLN 115 4.019 11.120 2.969 910 HE21 GLN 115 HE21 GLN 115 3.312 7.929 4.141 911 HE22 GLN 115 HE22 GLN 115 4.951 7.448 4.390 912 H LYS 116 HN LYS 116 -0.095 12.841 5.083 913 HA LYS 116 HA LYS 116 0.516 14.836 7.093 914 HB2 LYS 116 HB2 LYS 116 -1.063 15.599 5.582 915 HB3 LYS 116 HB1 LYS 116 -1.968 14.093 5.586 916 HG2 LYS 116 HG2 LYS 116 -2.858 14.576 7.755 917 HG3 LYS 116 HG1 LYS 116 -1.793 15.968 7.936 918 HD2 LYS 116 HD2 LYS 116 -4.068 16.652 7.368 919 HD3 LYS 116 HD1 LYS 116 -2.922 17.096 6.103 920 HE2 LYS 116 HE2 LYS 116 -4.941 16.237 5.115 921 HE3 LYS 116 HE1 LYS 116 -3.612 15.119 4.816 922 HZ1 LYS 116 HZ1 LYS 116 -4.435 13.651 6.477 923 HZ2 LYS 116 HZ2 LYS 116 -5.756 14.066 5.492 924 HZ3 LYS 116 HZ3 LYS 116 -5.581 14.782 7.017 925 H ALA 117 HN ALA 117 0.291 14.676 9.147 926 HA ALA 117 HA ALA 117 -1.553 12.857 10.409 927 HB1 ALA 117 HB1 ALA 117 0.362 11.367 10.010 928 HB2 ALA 117 HB2 ALA 117 0.126 11.663 11.731 929 HB3 ALA 117 HB3 ALA 117 1.412 12.500 10.865 930 H VAL 118 HN VAL 118 -0.941 15.650 10.140 931 HA VAL 118 HA VAL 118 -0.044 16.404 12.811 932 HB VAL 118 HB VAL 118 -0.280 18.179 10.375 933 HG11 VAL 118 HG11 VAL 118 0.998 19.767 11.710 934 HG12 VAL 118 HG12 VAL 118 1.002 18.635 13.063 935 HG13 VAL 118 HG13 VAL 118 -0.514 19.343 12.512 936 HG21 VAL 118 HG21 VAL 118 2.146 18.070 10.261 937 HG22 VAL 118 HG22 VAL 118 1.457 16.453 10.111 938 HG23 VAL 118 HG23 VAL 118 2.184 16.965 11.635 939 H GLN 119 HN GLN 119 -2.036 15.811 13.666 940 HA GLN 119 HA GLN 119 -4.254 17.674 13.172 941 HB2 GLN 119 HB2 GLN 119 -4.211 15.137 14.822 942 HB3 GLN 119 HB1 GLN 119 -5.629 16.110 14.455 943 HG2 GLN 119 HG2 GLN 119 -5.470 15.546 12.127 944 HG3 GLN 119 HG1 GLN 119 -3.948 14.698 12.398 945 HE21 GLN 119 HE21 GLN 119 -7.390 14.594 12.743 946 HE22 GLN 119 HE22 GLN 119 -7.505 12.913 13.177 947 H GLN 120 HN GLN 120 -3.742 19.504 14.297 948 HA GLN 120 HA GLN 120 -2.717 19.168 17.037 949 HB2 GLN 120 HB2 GLN 120 -2.598 21.536 15.170 950 HB3 GLN 120 HB1 GLN 120 -2.006 21.548 16.825 951 HG2 GLN 120 HG2 GLN 120 -0.461 19.680 16.185 952 HG3 GLN 120 HG1 GLN 120 -0.963 19.935 14.514 953 HE21 GLN 120 HE21 GLN 120 -0.586 22.505 16.871 954 HE22 GLN 120 HE22 GLN 120 0.792 23.238 16.123 955 H SER 121 HN SER 121 -5.589 19.677 15.550 956 HA SER 121 HA SER 121 -7.632 20.435 16.199 957 HB2 SER 121 HB2 SER 121 -6.379 20.355 18.957 958 HB3 SER 121 HB1 SER 121 -8.106 20.411 18.608 959 HG SER 121 HG SER 121 -7.417 18.414 17.248 960 H MET 122 HN MET 122 -5.934 22.397 15.239 961 HA MET 122 HA MET 122 -5.883 24.669 16.995 962 HB2 MET 122 HB2 MET 122 -5.347 24.486 14.018 963 HB3 MET 122 HB1 MET 122 -5.050 25.899 15.017 964 HG2 MET 122 HG2 MET 122 -3.406 24.685 16.305 965 HG3 MET 122 HG1 MET 122 -3.731 23.223 15.377 966 HE1 MET 122 HE1 MET 122 -3.128 22.970 12.752 967 HE2 MET 122 HE2 MET 122 -2.459 24.295 11.799 968 HE3 MET 122 HE3 MET 122 -4.097 24.409 12.443 969 H LEU 123 HN LEU 123 -7.957 25.101 17.600 970 HA LEU 123 HA LEU 123 -10.196 25.263 15.922 971 HB2 LEU 123 HB2 LEU 123 -10.336 25.072 18.364 972 HB3 LEU 123 HB1 LEU 123 -9.665 26.682 18.536 973 HG LEU 123 HG LEU 123 -11.677 27.590 17.370 974 HD11 LEU 123 HD11 LEU 123 -12.636 24.743 17.608 975 HD12 LEU 123 HD12 LEU 123 -12.343 25.636 16.115 976 HD13 LEU 123 HD13 LEU 123 -13.650 26.122 17.193 977 HD21 LEU 123 HD21 LEU 123 -12.196 25.959 19.852 978 HD22 LEU 123 HD22 LEU 123 -13.192 27.294 19.270 979 HD23 LEU 123 HD23 LEU 123 -11.535 27.592 19.797 980 H SER 124 HN SER 124 -7.962 27.758 17.044 981 HA SER 124 HA SER 124 -7.452 29.835 16.315 982 HB2 SER 124 HB2 SER 124 -8.914 29.065 13.779 983 HB3 SER 124 HB1 SER 124 -7.757 30.382 13.967 984 HG SER 124 HG SER 124 -7.332 27.662 13.719 985 H1 LYS 161 HN LYS 161 -17.784 -1.552 0.978 986 HA LYS 161 HA LYS 161 -18.624 -3.723 2.762 987 HB2 LYS 161 HB2 LYS 161 -16.356 -3.743 0.763 988 HB3 LYS 161 HB1 LYS 161 -16.974 -5.117 1.666 989 HG2 LYS 161 HG2 LYS 161 -18.714 -3.584 -0.240 990 HG3 LYS 161 HG1 LYS 161 -17.642 -4.866 -0.798 991 HD2 LYS 161 HD2 LYS 161 -19.814 -5.821 -0.451 992 HD3 LYS 161 HD1 LYS 161 -18.765 -6.406 0.839 993 HE2 LYS 161 HE2 LYS 161 -19.692 -4.706 2.341 994 HE3 LYS 161 HE1 LYS 161 -20.761 -4.159 1.049 995 HZ1 LYS 161 HZ1 LYS 161 -21.797 -6.332 1.029 996 HZ2 LYS 161 HZ2 LYS 161 -21.889 -5.647 2.575 997 HZ3 LYS 161 HZ3 LYS 161 -20.752 -6.869 2.255 998 H GLU 162 HN GLU 162 -15.280 -3.113 1.909 999 HA GLU 162 HA GLU 162 -14.569 -1.629 4.170 1000 HB2 GLU 162 HB2 GLU 162 -15.319 -3.781 5.234 1001 HB3 GLU 162 HB1 GLU 162 -13.977 -4.561 4.421 1002 HG2 GLU 162 HG2 GLU 162 -12.385 -3.344 5.698 1003 HG3 GLU 162 HG1 GLU 162 -13.632 -2.281 6.348 1004 H ASN 163 HN ASN 163 -12.352 -4.074 4.004 1005 HA ASN 163 HA ASN 163 -10.861 -3.495 1.709 1006 HB2 ASN 163 HB2 ASN 163 -9.074 -2.111 2.603 1007 HB3 ASN 163 HB1 ASN 163 -10.609 -1.275 2.805 1008 HD21 ASN 163 HD21 ASN 163 -7.912 -2.729 4.373 1009 HD22 ASN 163 HD22 ASN 163 -8.322 -2.238 5.990 1010 H LEU 164 HN LEU 164 -8.774 -4.623 1.750 1011 HA LEU 164 HA LEU 164 -8.683 -6.623 3.893 1012 HB2 LEU 164 HB2 LEU 164 -7.578 -6.708 1.088 1013 HB3 LEU 164 HB1 LEU 164 -7.310 -7.955 2.291 1014 HG LEU 164 HG LEU 164 -9.909 -8.040 2.392 1015 HD11 LEU 164 HD11 LEU 164 -9.486 -6.900 -0.364 1016 HD12 LEU 164 HD12 LEU 164 -10.284 -6.077 0.975 1017 HD13 LEU 164 HD13 LEU 164 -11.002 -7.531 0.281 1018 HD21 LEU 164 HD21 LEU 164 -8.480 -9.872 1.642 1019 HD22 LEU 164 HD22 LEU 164 -8.369 -9.140 0.039 1020 HD23 LEU 164 HD23 LEU 164 -9.920 -9.740 0.633 1021 H GLU 165 HN GLU 165 -7.158 -6.453 5.344 1022 HA GLU 165 HA GLU 165 -4.572 -5.296 4.545 1023 HB2 GLU 165 HB2 GLU 165 -6.028 -5.231 7.151 1024 HB3 GLU 165 HB1 GLU 165 -4.267 -5.208 7.153 1025 HG2 GLU 165 HG2 GLU 165 -4.402 -3.245 5.600 1026 HG3 GLU 165 HG1 GLU 165 -6.138 -3.218 5.909 1027 H SER 166 HN SER 166 -2.669 -6.340 5.232 1028 HA SER 166 HA SER 166 -2.816 -8.983 6.375 1029 HB2 SER 166 HB2 SER 166 -1.988 -8.666 3.481 1030 HB3 SER 166 HB1 SER 166 -2.009 -10.174 4.399 1031 HG SER 166 HG SER 166 -4.413 -9.369 4.664 1032 H MET 167 HN MET 167 -0.824 -9.606 7.200 1033 HA MET 167 HA MET 167 1.466 -7.903 6.511 1034 HB2 MET 167 HB2 MET 167 1.150 -9.888 8.771 1035 HB3 MET 167 HB1 MET 167 2.612 -8.957 8.442 1036 HG2 MET 167 HG2 MET 167 1.298 -6.881 8.806 1037 HG3 MET 167 HG1 MET 167 -0.083 -7.880 9.258 1038 HE1 MET 167 HE1 MET 167 3.570 -6.809 10.145 1039 HE2 MET 167 HE2 MET 167 3.729 -8.565 10.098 1040 HE3 MET 167 HE3 MET 167 3.874 -7.705 11.632 1041 H VAL 168 HN VAL 168 3.169 -8.681 5.427 1042 HA VAL 168 HA VAL 168 3.480 -11.553 5.058 1043 HB VAL 168 HB VAL 168 3.803 -11.266 2.606 1044 HG11 VAL 168 HG11 VAL 168 1.038 -10.672 3.631 1045 HG12 VAL 168 HG12 VAL 168 1.772 -12.266 3.467 1046 HG13 VAL 168 HG13 VAL 168 1.425 -11.304 2.031 1047 HG21 VAL 168 HG21 VAL 168 2.881 -9.320 1.483 1048 HG22 VAL 168 HG22 VAL 168 4.125 -8.824 2.631 1049 HG23 VAL 168 HG23 VAL 168 2.422 -8.621 3.035 Start of MODEL 16 1 H1 MET 1 HT1 MET 1 -5.848 12.815 -16.475 2 H2 MET 1 HT2 MET 1 -4.313 13.105 -17.143 3 H3 MET 1 HT3 MET 1 -4.982 14.200 -16.040 4 HA MET 1 HA MET 1 -4.304 11.401 -15.400 5 HB2 MET 1 HB2 MET 1 -2.764 13.958 -14.947 6 HB3 MET 1 HB1 MET 1 -2.465 12.495 -14.014 7 HG2 MET 1 HG2 MET 1 -2.220 12.755 -17.005 8 HG3 MET 1 HG1 MET 1 -0.887 12.729 -15.851 9 HE1 MET 1 HE1 MET 1 -1.130 10.738 -18.395 10 HE2 MET 1 HE2 MET 1 -0.518 9.274 -17.624 11 HE3 MET 1 HE3 MET 1 0.226 10.835 -17.274 12 H SER 2 HN SER 2 -4.831 10.765 -13.357 13 HA SER 2 HA SER 2 -6.478 12.648 -11.835 14 HB2 SER 2 HB2 SER 2 -7.563 10.512 -12.426 15 HB3 SER 2 HB1 SER 2 -6.283 9.628 -11.592 16 HG SER 2 HG SER 2 -8.408 10.185 -10.459 17 H TYR 3 HN TYR 3 -5.529 13.649 -10.235 18 HA TYR 3 HA TYR 3 -3.440 12.256 -8.699 19 HB2 TYR 3 HB2 TYR 3 -2.548 14.497 -8.152 20 HB3 TYR 3 HB1 TYR 3 -2.530 14.171 -9.876 21 HD1 TYR 3 HD1 TYR 3 -4.231 15.278 -11.350 22 HD2 TYR 3 HD2 TYR 3 -3.756 16.334 -7.256 23 HE1 TYR 3 HE1 TYR 3 -5.459 17.366 -11.752 24 HE2 TYR 3 HE2 TYR 3 -4.983 18.429 -7.649 25 HH TYR 3 HH TYR 3 -5.544 19.916 -9.492 26 H ILE 4 HN ILE 4 -6.234 12.072 -8.385 27 HA ILE 4 HA ILE 4 -7.799 11.932 -6.761 28 HB ILE 4 HB ILE 4 -5.733 13.218 -4.981 29 HG12 ILE 4 HG12 ILE 4 -6.614 10.333 -5.200 30 HG13 ILE 4 HG11 ILE 4 -5.125 10.985 -5.873 31 HG21 ILE 4 HG21 ILE 4 -7.134 12.452 -3.112 32 HG22 ILE 4 HG22 ILE 4 -8.348 11.898 -4.264 33 HG23 ILE 4 HG23 ILE 4 -7.980 13.617 -4.131 34 HD11 ILE 4 HD11 ILE 4 -4.349 11.539 -3.622 35 HD12 ILE 4 HD12 ILE 4 -4.710 9.820 -3.792 36 HD13 ILE 4 HD13 ILE 4 -5.842 10.880 -2.955 37 HA PRO 5 HA PRO 5 -9.005 16.199 -7.767 38 HB2 PRO 5 HB2 PRO 5 -11.569 15.035 -8.485 39 HB3 PRO 5 HB1 PRO 5 -10.410 15.888 -9.506 40 HG2 PRO 5 HG2 PRO 5 -10.918 13.220 -9.730 41 HG3 PRO 5 HG1 PRO 5 -9.362 13.955 -10.155 42 HD2 PRO 5 HD2 PRO 5 -10.144 12.467 -7.677 43 HD3 PRO 5 HD1 PRO 5 -8.627 12.403 -8.600 44 H GLY 6 HN GLY 6 -9.072 16.860 -5.672 45 HA2 GLY 6 HA2 GLY 6 -11.361 17.632 -4.479 46 HA3 GLY 6 HA1 GLY 6 -11.149 15.991 -3.861 47 H GLN 7 HN GLN 7 -8.466 15.801 -3.567 48 HA GLN 7 HA GLN 7 -7.607 18.112 -1.997 49 HB2 GLN 7 HB2 GLN 7 -7.557 15.222 -1.129 50 HB3 GLN 7 HB1 GLN 7 -6.615 16.478 -0.361 51 HG2 GLN 7 HG2 GLN 7 -8.778 17.686 0.076 52 HG3 GLN 7 HG1 GLN 7 -9.603 16.226 -0.462 53 HE21 GLN 7 HE21 GLN 7 -7.735 17.725 2.028 54 HE22 GLN 7 HE22 GLN 7 -7.936 16.469 3.217 55 HA PRO 8 HA PRO 8 -4.446 17.257 -5.143 56 HB2 PRO 8 HB2 PRO 8 -2.997 19.525 -4.500 57 HB3 PRO 8 HB1 PRO 8 -4.309 19.452 -5.678 58 HG2 PRO 8 HG2 PRO 8 -4.363 20.362 -2.834 59 HG3 PRO 8 HG1 PRO 8 -5.195 21.036 -4.247 60 HD2 PRO 8 HD2 PRO 8 -6.484 19.518 -2.443 61 HD3 PRO 8 HD1 PRO 8 -6.873 19.432 -4.180 62 H VAL 9 HN VAL 9 -2.760 15.982 -4.897 63 HA VAL 9 HA VAL 9 -0.822 16.490 -2.796 64 HB VAL 9 HB VAL 9 -2.585 14.779 -1.999 65 HG11 VAL 9 HG11 VAL 9 -2.743 13.471 -4.048 66 HG12 VAL 9 HG12 VAL 9 -2.248 12.467 -2.683 67 HG13 VAL 9 HG13 VAL 9 -1.055 12.985 -3.873 68 HG21 VAL 9 HG21 VAL 9 -0.921 13.422 -0.840 69 HG22 VAL 9 HG22 VAL 9 -0.471 15.126 -0.844 70 HG23 VAL 9 HG23 VAL 9 0.324 13.999 -1.942 71 H THR 10 HN THR 10 0.939 14.533 -3.157 72 HA THR 10 HA THR 10 1.491 14.589 -6.000 73 HB THR 10 HB THR 10 3.819 15.230 -5.530 74 HG1 THR 10 HG1 THR 10 3.595 14.675 -3.176 75 HG21 THR 10 HG21 THR 10 1.674 17.155 -4.662 76 HG22 THR 10 HG22 THR 10 2.209 16.849 -6.320 77 HG23 THR 10 HG23 THR 10 3.308 17.615 -5.166 78 H ALA 11 HN ALA 11 1.460 12.645 -6.416 79 HA ALA 11 HA ALA 11 2.412 10.554 -4.676 80 HB1 ALA 11 HB1 ALA 11 1.326 10.378 -7.486 81 HB2 ALA 11 HB2 ALA 11 0.407 10.142 -6.000 82 HB3 ALA 11 HB3 ALA 11 1.689 9.011 -6.435 83 H VAL 12 HN VAL 12 4.463 10.686 -4.446 84 HA VAL 12 HA VAL 12 6.364 10.943 -6.568 85 HB VAL 12 HB VAL 12 6.810 9.838 -3.826 86 HG11 VAL 12 HG11 VAL 12 8.635 9.543 -5.440 87 HG12 VAL 12 HG12 VAL 12 9.095 10.612 -4.114 88 HG13 VAL 12 HG13 VAL 12 8.678 11.288 -5.690 89 HG21 VAL 12 HG21 VAL 12 5.703 11.909 -3.475 90 HG22 VAL 12 HG22 VAL 12 6.684 12.709 -4.706 91 HG23 VAL 12 HG23 VAL 12 7.423 12.187 -3.191 92 H VAL 13 HN VAL 13 6.766 9.394 -7.932 93 HA VAL 13 HA VAL 13 6.041 6.641 -7.415 94 HB VAL 13 HB VAL 13 7.397 7.812 -9.841 95 HG11 VAL 13 HG11 VAL 13 6.613 5.811 -10.989 96 HG12 VAL 13 HG12 VAL 13 5.924 5.213 -9.480 97 HG13 VAL 13 HG13 VAL 13 7.671 5.399 -9.639 98 HG21 VAL 13 HG21 VAL 13 5.226 8.868 -9.436 99 HG22 VAL 13 HG22 VAL 13 4.470 7.276 -9.376 100 HG23 VAL 13 HG23 VAL 13 5.189 7.855 -10.880 101 H GLN 14 HN GLN 14 7.365 5.354 -6.390 102 HA GLN 14 HA GLN 14 10.225 5.496 -6.803 103 HB2 GLN 14 HB2 GLN 14 10.105 6.891 -4.933 104 HB3 GLN 14 HB1 GLN 14 8.748 6.018 -4.243 105 HG2 GLN 14 HG2 GLN 14 10.143 4.241 -3.556 106 HG3 GLN 14 HG1 GLN 14 11.527 4.895 -4.434 107 HE21 GLN 14 HE21 GLN 14 9.328 6.939 -2.679 108 HE22 GLN 14 HE22 GLN 14 10.432 7.385 -1.409 109 H ARG 15 HN ARG 15 11.256 3.513 -6.231 110 HA ARG 15 HA ARG 15 9.472 1.258 -5.877 111 HB2 ARG 15 HB2 ARG 15 11.851 1.600 -7.688 112 HB3 ARG 15 HB1 ARG 15 11.157 0.051 -7.290 113 HG2 ARG 15 HG2 ARG 15 8.963 0.955 -8.176 114 HG3 ARG 15 HG1 ARG 15 9.915 2.291 -8.830 115 HD2 ARG 15 HD2 ARG 15 11.373 0.513 -9.906 116 HD3 ARG 15 HD1 ARG 15 10.110 -0.636 -9.472 117 HE ARG 15 HE ARG 15 9.288 1.702 -11.017 118 HH11 ARG 15 HH11 ARG 15 10.117 -1.703 -11.011 119 HH12 ARG 15 HH12 ARG 15 9.409 -2.022 -12.563 120 HH21 ARG 15 HH21 ARG 15 8.376 1.308 -13.073 121 HH22 ARG 15 HH22 ARG 15 8.444 -0.292 -13.760 122 H VAL 16 HN VAL 16 10.180 -0.311 -4.518 123 HA VAL 16 HA VAL 16 12.735 0.070 -3.207 124 HB VAL 16 HB VAL 16 11.333 1.448 -1.838 125 HG11 VAL 16 HG11 VAL 16 9.240 0.648 -0.847 126 HG12 VAL 16 HG12 VAL 16 9.384 -0.832 -1.793 127 HG13 VAL 16 HG13 VAL 16 9.189 0.724 -2.612 128 HG21 VAL 16 HG21 VAL 16 11.561 -1.226 -0.470 129 HG22 VAL 16 HG22 VAL 16 11.347 0.334 0.333 130 HG23 VAL 16 HG23 VAL 16 12.827 -0.003 -0.570 131 H GLU 17 HN GLU 17 13.402 -1.915 -2.152 132 HA GLU 17 HA GLU 17 11.794 -4.247 -2.930 133 HB2 GLU 17 HB2 GLU 17 14.817 -4.147 -2.732 134 HB3 GLU 17 HB1 GLU 17 13.841 -5.482 -3.334 135 HG2 GLU 17 HG2 GLU 17 13.081 -4.052 -5.190 136 HG3 GLU 17 HG1 GLU 17 14.132 -2.765 -4.602 137 H ILE 18 HN ILE 18 10.904 -5.028 -1.084 138 HA ILE 18 HA ILE 18 12.332 -4.827 1.436 139 HB ILE 18 HB ILE 18 9.485 -5.608 0.779 140 HG12 ILE 18 HG12 ILE 18 8.799 -3.721 1.953 141 HG13 ILE 18 HG11 ILE 18 10.290 -3.628 2.879 142 HG21 ILE 18 HG21 ILE 18 10.883 -5.767 3.442 143 HG22 ILE 18 HG22 ILE 18 10.373 -7.141 2.455 144 HG23 ILE 18 HG23 ILE 18 9.163 -6.064 3.158 145 HD11 ILE 18 HD11 ILE 18 9.896 -1.821 1.229 146 HD12 ILE 18 HD12 ILE 18 10.141 -3.031 -0.041 147 HD13 ILE 18 HD13 ILE 18 11.436 -2.666 1.102 148 H HIS 19 HN HIS 19 13.640 -6.458 1.858 149 HA HIS 19 HA HIS 19 12.613 -9.134 1.310 150 HB2 HIS 19 HB2 HIS 19 14.469 -9.617 0.241 151 HB3 HIS 19 HB1 HIS 19 14.928 -7.947 0.376 152 HD1 HIS 19 HD1 HIS 19 15.472 -11.258 2.168 153 HD2 HIS 19 HD2 HIS 19 17.190 -7.492 1.779 154 HE1 HIS 19 HE1 HIS 19 17.673 -11.393 3.371 155 HE2 HIS 19 HE2 HIS 19 18.581 -9.042 3.324 156 H LYS 20 HN LYS 20 11.865 -9.983 3.091 157 HA LYS 20 HA LYS 20 13.226 -9.545 5.612 158 HB2 LYS 20 HB2 LYS 20 10.586 -9.805 5.083 159 HB3 LYS 20 HB1 LYS 20 11.000 -11.451 5.554 160 HG2 LYS 20 HG2 LYS 20 11.500 -8.961 7.160 161 HG3 LYS 20 HG1 LYS 20 10.250 -10.165 7.466 162 HD2 LYS 20 HD2 LYS 20 11.781 -11.761 8.176 163 HD3 LYS 20 HD1 LYS 20 13.120 -10.982 7.331 164 HE2 LYS 20 HE2 LYS 20 12.888 -9.068 8.944 165 HE3 LYS 20 HE1 LYS 20 11.764 -10.073 9.860 166 HZ1 LYS 20 HZ1 LYS 20 14.524 -10.930 9.195 167 HZ2 LYS 20 HZ2 LYS 20 13.464 -11.629 10.320 168 HZ3 LYS 20 HZ3 LYS 20 14.137 -10.107 10.622 169 H LEU 21 HN LEU 21 11.736 -12.618 4.954 170 HA LEU 21 HA LEU 21 14.286 -13.886 4.476 171 HB2 LEU 21 HB2 LEU 21 14.414 -13.565 6.866 172 HB3 LEU 21 HB1 LEU 21 12.850 -14.334 7.082 173 HG LEU 21 HG LEU 21 13.740 -16.478 6.450 174 HD11 LEU 21 HD11 LEU 21 16.313 -15.026 5.865 175 HD12 LEU 21 HD12 LEU 21 15.251 -15.804 4.689 176 HD13 LEU 21 HD13 LEU 21 16.111 -16.779 5.881 177 HD21 LEU 21 HD21 LEU 21 15.426 -16.814 8.202 178 HD22 LEU 21 HD22 LEU 21 14.068 -15.842 8.767 179 HD23 LEU 21 HD23 LEU 21 15.596 -15.067 8.357 180 H ARG 22 HN ARG 22 13.885 -15.391 3.010 181 HA ARG 22 HA ARG 22 11.490 -16.976 3.016 182 HB2 ARG 22 HB2 ARG 22 12.890 -16.470 0.966 183 HB3 ARG 22 HB1 ARG 22 14.131 -17.517 1.636 184 HG2 ARG 22 HG2 ARG 22 11.377 -18.569 1.183 185 HG3 ARG 22 HG1 ARG 22 12.523 -18.438 -0.156 186 HD2 ARG 22 HD2 ARG 22 12.941 -19.914 2.424 187 HD3 ARG 22 HD1 ARG 22 12.622 -20.648 0.854 188 HE ARG 22 HE ARG 22 14.886 -18.982 0.667 189 HH11 ARG 22 HH11 ARG 22 13.908 -22.076 1.948 190 HH12 ARG 22 HH12 ARG 22 15.521 -22.701 2.034 191 HH21 ARG 22 HH21 ARG 22 17.021 -19.783 0.787 192 HH22 ARG 22 HH22 ARG 22 17.292 -21.385 1.409 193 H GLN 23 HN GLN 23 11.174 -18.335 4.672 194 HA GLN 23 HA GLN 23 13.475 -19.736 5.783 195 HB2 GLN 23 HB2 GLN 23 11.297 -19.804 7.607 196 HB3 GLN 23 HB1 GLN 23 12.885 -19.087 7.815 197 HG2 GLN 23 HG2 GLN 23 11.964 -17.108 6.514 198 HG3 GLN 23 HG1 GLN 23 10.377 -17.808 6.827 199 HE21 GLN 23 HE21 GLN 23 11.559 -15.305 7.716 200 HE22 GLN 23 HE22 GLN 23 11.485 -15.323 9.457 201 H GLY 24 HN GLY 24 12.894 -20.951 3.840 202 HA2 GLY 24 HA2 GLY 24 12.543 -23.185 3.306 203 HA3 GLY 24 HA1 GLY 24 11.706 -23.373 4.843 204 H GLU 25 HN GLU 25 9.592 -23.478 4.854 205 HA GLU 25 HA GLU 25 8.125 -23.259 2.398 206 HB2 GLU 25 HB2 GLU 25 7.737 -24.633 4.727 207 HB3 GLU 25 HB1 GLU 25 6.608 -23.301 4.920 208 HG2 GLU 25 HG2 GLU 25 5.680 -23.859 2.668 209 HG3 GLU 25 HG1 GLU 25 6.688 -25.305 2.684 210 H ASN 26 HN ASN 26 9.362 -21.048 4.496 211 HA ASN 26 HA ASN 26 7.044 -19.320 4.459 212 HB2 ASN 26 HB2 ASN 26 9.533 -19.283 6.113 213 HB3 ASN 26 HB1 ASN 26 8.383 -17.977 6.079 214 HD21 ASN 26 HD21 ASN 26 8.972 -21.187 6.912 215 HD22 ASN 26 HD22 ASN 26 7.674 -21.389 8.059 216 H LEU 27 HN LEU 27 7.051 -17.731 3.456 217 HA LEU 27 HA LEU 27 9.442 -16.382 2.432 218 HB2 LEU 27 HB2 LEU 27 6.716 -16.809 1.201 219 HB3 LEU 27 HB1 LEU 27 7.700 -15.451 0.741 220 HG LEU 27 HG LEU 27 7.932 -17.234 -0.883 221 HD11 LEU 27 HD11 LEU 27 9.906 -15.808 -0.237 222 HD12 LEU 27 HD12 LEU 27 10.282 -17.346 -1.010 223 HD13 LEU 27 HD13 LEU 27 10.466 -17.173 0.738 224 HD21 LEU 27 HD21 LEU 27 7.363 -19.126 0.496 225 HD22 LEU 27 HD22 LEU 27 8.818 -18.898 1.470 226 HD23 LEU 27 HD23 LEU 27 8.953 -19.388 -0.224 227 H ILE 28 HN ILE 28 9.689 -14.721 3.747 228 HA ILE 28 HA ILE 28 7.319 -13.586 5.031 229 HB ILE 28 HB ILE 28 10.190 -13.365 5.836 230 HG12 ILE 28 HG12 ILE 28 9.559 -15.701 5.930 231 HG13 ILE 28 HG11 ILE 28 9.702 -15.063 7.555 232 HG21 ILE 28 HG21 ILE 28 7.666 -12.518 7.127 233 HG22 ILE 28 HG22 ILE 28 9.152 -11.602 6.818 234 HG23 ILE 28 HG23 ILE 28 9.118 -12.843 8.075 235 HD11 ILE 28 HD11 ILE 28 7.323 -15.022 7.812 236 HD12 ILE 28 HD12 ILE 28 7.802 -16.623 7.217 237 HD13 ILE 28 HD13 ILE 28 7.091 -15.437 6.112 238 H LEU 29 HN LEU 29 6.685 -11.717 4.380 239 HA LEU 29 HA LEU 29 8.548 -9.773 3.233 240 HB2 LEU 29 HB2 LEU 29 6.692 -10.081 1.842 241 HB3 LEU 29 HB1 LEU 29 5.579 -10.202 3.182 242 HG LEU 29 HG LEU 29 6.891 -7.573 2.681 243 HD11 LEU 29 HD11 LEU 29 5.081 -7.020 1.096 244 HD12 LEU 29 HD12 LEU 29 4.603 -8.719 1.083 245 HD13 LEU 29 HD13 LEU 29 6.183 -8.241 0.461 246 HD21 LEU 29 HD21 LEU 29 5.457 -7.854 4.618 247 HD22 LEU 29 HD22 LEU 29 4.157 -8.463 3.591 248 HD23 LEU 29 HD23 LEU 29 4.689 -6.786 3.442 249 H GLY 30 HN GLY 30 6.437 -10.382 6.012 250 HA2 GLY 30 HA2 GLY 30 7.038 -9.674 8.161 251 HA3 GLY 30 HA1 GLY 30 8.090 -8.460 7.460 252 H PHE 31 HN PHE 31 6.499 -6.865 5.989 253 HA PHE 31 HA PHE 31 5.059 -5.555 8.128 254 HB2 PHE 31 HB2 PHE 31 4.865 -3.645 6.625 255 HB3 PHE 31 HB1 PHE 31 6.523 -4.208 6.745 256 HD1 PHE 31 HD2 PHE 31 7.610 -5.255 4.846 257 HD2 PHE 31 HD1 PHE 31 3.644 -3.757 4.573 258 HE1 PHE 31 HE2 PHE 31 7.745 -5.377 2.409 259 HE2 PHE 31 HE1 PHE 31 3.767 -3.882 2.124 260 HZ PHE 31 HZ PHE 31 5.846 -4.545 1.028 261 H SER 32 HN SER 32 2.967 -4.270 7.194 262 HA SER 32 HA SER 32 1.244 -6.354 6.014 263 HB2 SER 32 HB2 SER 32 0.845 -6.204 8.475 264 HB3 SER 32 HB1 SER 32 0.425 -4.506 8.274 265 HG SER 32 HG SER 32 -1.506 -5.381 8.106 266 H ILE 33 HN ILE 33 -0.596 -5.548 4.869 267 HA ILE 33 HA ILE 33 -0.197 -2.806 3.905 268 HB ILE 33 HB ILE 33 -0.554 -3.528 1.596 269 HG12 ILE 33 HG12 ILE 33 -0.317 -6.363 2.622 270 HG13 ILE 33 HG11 ILE 33 -1.852 -5.600 2.222 271 HG21 ILE 33 HG21 ILE 33 1.712 -3.282 2.275 272 HG22 ILE 33 HG22 ILE 33 1.626 -4.764 1.321 273 HG23 ILE 33 HG23 ILE 33 1.710 -4.849 3.086 274 HD11 ILE 33 HD11 ILE 33 0.423 -6.094 0.313 275 HD12 ILE 33 HD12 ILE 33 -1.118 -5.326 -0.088 276 HD13 ILE 33 HD13 ILE 33 -1.077 -7.017 0.419 277 H GLY 34 HN GLY 34 -2.054 -1.754 3.214 278 HA2 GLY 34 HA2 GLY 34 -4.425 -3.022 4.393 279 HA3 GLY 34 HA1 GLY 34 -4.143 -1.286 4.298 280 H GLY 35 HN GLY 35 -6.166 -3.417 3.272 281 HA2 GLY 35 HA2 GLY 35 -6.432 -2.576 0.503 282 HA3 GLY 35 HA1 GLY 35 -7.573 -3.561 1.423 283 H GLY 36 HN GLY 36 -6.867 -0.490 0.253 284 HA2 GLY 36 HA2 GLY 36 -8.674 0.821 2.183 285 HA3 GLY 36 HA1 GLY 36 -7.180 1.571 1.629 286 H ILE 37 HN ILE 37 -9.393 -0.312 -0.269 287 HA ILE 37 HA ILE 37 -9.528 1.372 -2.442 288 HB ILE 37 HB ILE 37 -12.012 -0.065 -2.078 289 HG12 ILE 37 HG12 ILE 37 -10.628 -1.528 -0.657 290 HG13 ILE 37 HG11 ILE 37 -11.088 -2.333 -2.145 291 HG21 ILE 37 HG21 ILE 37 -11.214 0.721 -4.227 292 HG22 ILE 37 HG22 ILE 37 -11.379 -1.036 -4.236 293 HG23 ILE 37 HG23 ILE 37 -9.783 -0.298 -4.087 294 HD11 ILE 37 HD11 ILE 37 -8.789 -2.795 -1.539 295 HD12 ILE 37 HD12 ILE 37 -8.435 -1.068 -1.597 296 HD13 ILE 37 HD13 ILE 37 -8.892 -1.926 -3.069 297 H ASP 38 HN ASP 38 -11.575 1.143 0.313 298 HA ASP 38 HA ASP 38 -12.686 3.574 0.466 299 HB2 ASP 38 HB2 ASP 38 -13.360 3.429 -1.930 300 HB3 ASP 38 HB1 ASP 38 -14.302 1.988 -1.561 301 H GLN 39 HN GLN 39 -13.005 0.195 0.372 302 HA GLN 39 HA GLN 39 -13.753 -1.331 1.741 303 HB2 GLN 39 HB2 GLN 39 -14.061 1.020 3.560 304 HB3 GLN 39 HB1 GLN 39 -14.477 -0.623 4.049 305 HG2 GLN 39 HG2 GLN 39 -12.305 -0.419 4.723 306 HG3 GLN 39 HG1 GLN 39 -12.159 -1.239 3.195 307 HE21 GLN 39 HE21 GLN 39 -11.097 -0.304 1.588 308 HE22 GLN 39 HE22 GLN 39 -10.269 1.208 1.716 309 H ASP 40 HN ASP 40 -15.552 -2.229 2.729 310 HA ASP 40 HA ASP 40 -17.757 -2.846 2.836 311 HB2 ASP 40 HB2 ASP 40 -18.054 -0.489 3.405 312 HB3 ASP 40 HB1 ASP 40 -18.116 -0.096 1.712 313 HA PRO 41 HA PRO 41 -18.605 -4.666 -1.253 314 HB2 PRO 41 HB2 PRO 41 -21.240 -3.631 -1.572 315 HB3 PRO 41 HB1 PRO 41 -20.779 -5.244 -1.022 316 HG2 PRO 41 HG2 PRO 41 -21.497 -2.835 0.561 317 HG3 PRO 41 HG1 PRO 41 -21.748 -4.531 0.933 318 HD2 PRO 41 HD2 PRO 41 -19.889 -3.153 2.206 319 HD3 PRO 41 HD1 PRO 41 -19.536 -4.818 1.703 320 H SER 42 HN SER 42 -19.347 -1.489 -0.524 321 HA SER 42 HA SER 42 -19.648 -0.017 -2.790 322 HB2 SER 42 HB2 SER 42 -19.552 0.872 -0.492 323 HB3 SER 42 HB1 SER 42 -17.811 0.560 -0.441 324 HG SER 42 HG SER 42 -17.620 2.500 -1.237 325 H GLN 43 HN GLN 43 -16.687 -1.575 -1.676 326 HA GLN 43 HA GLN 43 -14.979 0.098 -3.266 327 HB2 GLN 43 HB2 GLN 43 -13.230 -1.042 -2.145 328 HB3 GLN 43 HB1 GLN 43 -14.512 -0.789 -0.968 329 HG2 GLN 43 HG2 GLN 43 -15.263 -3.165 -1.636 330 HG3 GLN 43 HG1 GLN 43 -13.625 -3.317 -2.262 331 HE21 GLN 43 HE21 GLN 43 -15.591 -2.766 0.511 332 HE22 GLN 43 HE22 GLN 43 -14.397 -3.117 1.722 333 H ASN 44 HN ASN 44 -16.606 -2.863 -3.551 334 HA ASN 44 HA ASN 44 -16.758 -4.462 -5.143 335 HB2 ASN 44 HB2 ASN 44 -17.438 -2.343 -6.202 336 HB3 ASN 44 HB1 ASN 44 -15.808 -2.204 -6.850 337 HD21 ASN 44 HD21 ASN 44 -17.714 -5.155 -6.552 338 HD22 ASN 44 HD22 ASN 44 -17.853 -5.455 -8.252 339 HA PRO 45 HA PRO 45 -12.393 -5.806 -5.505 340 HB2 PRO 45 HB2 PRO 45 -12.833 -8.351 -4.753 341 HB3 PRO 45 HB1 PRO 45 -12.649 -7.050 -3.560 342 HG2 PRO 45 HG2 PRO 45 -15.154 -8.312 -4.617 343 HG3 PRO 45 HG1 PRO 45 -14.728 -7.901 -2.945 344 HD2 PRO 45 HD2 PRO 45 -16.328 -6.338 -4.497 345 HD3 PRO 45 HD1 PRO 45 -15.285 -5.690 -3.216 346 H PHE 46 HN PHE 46 -15.122 -5.991 -7.144 347 HA PHE 46 HA PHE 46 -14.189 -7.963 -9.075 348 HB2 PHE 46 HB2 PHE 46 -16.788 -6.452 -8.806 349 HB3 PHE 46 HB1 PHE 46 -16.379 -7.422 -10.225 350 HD1 PHE 46 HD2 PHE 46 -16.204 -9.862 -10.046 351 HD2 PHE 46 HD1 PHE 46 -17.375 -7.469 -6.727 352 HE1 PHE 46 HE2 PHE 46 -17.056 -11.868 -8.906 353 HE2 PHE 46 HE1 PHE 46 -18.232 -9.472 -5.584 354 HZ PHE 46 HZ PHE 46 -18.027 -11.685 -6.660 355 H SER 47 HN SER 47 -14.271 -4.568 -8.415 356 HA SER 47 HA SER 47 -13.405 -3.980 -11.105 357 HB2 SER 47 HB2 SER 47 -12.860 -1.706 -10.169 358 HB3 SER 47 HB1 SER 47 -14.556 -2.169 -10.072 359 HG SER 47 HG SER 47 -12.761 -1.592 -8.080 360 H GLU 48 HN GLU 48 -11.623 -2.875 -8.283 361 HA GLU 48 HA GLU 48 -9.353 -2.788 -7.929 362 HB2 GLU 48 HB2 GLU 48 -9.836 -5.688 -8.556 363 HB3 GLU 48 HB1 GLU 48 -8.268 -5.108 -8.007 364 HG2 GLU 48 HG2 GLU 48 -9.367 -4.261 -5.943 365 HG3 GLU 48 HG1 GLU 48 -10.877 -4.981 -6.493 366 H ASP 49 HN ASP 49 -10.132 -1.968 -10.449 367 HA ASP 49 HA ASP 49 -8.516 -3.411 -12.395 368 HB2 ASP 49 HB2 ASP 49 -9.865 -2.282 -14.122 369 HB3 ASP 49 HB1 ASP 49 -10.850 -3.193 -12.982 370 H LYS 50 HN LYS 50 -8.741 -0.244 -10.959 371 HA LYS 50 HA LYS 50 -6.210 0.576 -11.665 372 HB2 LYS 50 HB2 LYS 50 -8.059 0.859 -13.865 373 HB3 LYS 50 HB1 LYS 50 -7.472 2.438 -13.349 374 HG2 LYS 50 HG2 LYS 50 -5.926 0.104 -14.404 375 HG3 LYS 50 HG1 LYS 50 -5.898 1.797 -14.923 376 HD2 LYS 50 HD2 LYS 50 -4.635 2.472 -13.115 377 HD3 LYS 50 HD1 LYS 50 -5.131 1.082 -12.139 378 HE2 LYS 50 HE2 LYS 50 -2.825 0.799 -12.745 379 HE3 LYS 50 HE1 LYS 50 -3.780 -0.370 -13.650 380 HZ1 LYS 50 HZ1 LYS 50 -2.049 0.730 -14.970 381 HZ2 LYS 50 HZ2 LYS 50 -2.823 2.217 -14.742 382 HZ3 LYS 50 HZ3 LYS 50 -3.600 0.978 -15.600 383 H THR 51 HN THR 51 -9.372 2.070 -11.810 384 HA THR 51 HA THR 51 -8.469 4.559 -10.796 385 HB THR 51 HB THR 51 -11.365 3.762 -10.782 386 HG1 THR 51 HG1 THR 51 -11.114 3.171 -12.809 387 HG21 THR 51 HG21 THR 51 -9.903 6.271 -11.609 388 HG22 THR 51 HG22 THR 51 -10.718 6.019 -10.064 389 HG23 THR 51 HG23 THR 51 -11.653 6.064 -11.560 390 H ASP 52 HN ASP 52 -9.417 1.658 -9.394 391 HA ASP 52 HA ASP 52 -10.488 2.273 -6.942 392 HB2 ASP 52 HB2 ASP 52 -8.453 0.192 -7.728 393 HB3 ASP 52 HB1 ASP 52 -9.410 0.153 -6.248 394 H LYS 53 HN LYS 53 -7.054 1.672 -7.606 395 HA LYS 53 HA LYS 53 -5.122 2.484 -6.707 396 HB2 LYS 53 HB2 LYS 53 -6.462 4.646 -7.430 397 HB3 LYS 53 HB1 LYS 53 -6.575 4.904 -5.695 398 HG2 LYS 53 HG2 LYS 53 -4.703 6.122 -6.669 399 HG3 LYS 53 HG1 LYS 53 -4.145 4.900 -5.520 400 HD2 LYS 53 HD2 LYS 53 -3.451 3.452 -7.255 401 HD3 LYS 53 HD1 LYS 53 -4.312 4.388 -8.479 402 HE2 LYS 53 HE2 LYS 53 -1.964 5.399 -6.877 403 HE3 LYS 53 HE1 LYS 53 -1.858 4.748 -8.509 404 HZ1 LYS 53 HZ1 LYS 53 -1.936 7.152 -8.560 405 HZ2 LYS 53 HZ2 LYS 53 -3.393 7.152 -7.696 406 HZ3 LYS 53 HZ3 LYS 53 -3.342 6.514 -9.260 407 H GLY 54 HN GLY 54 -7.067 0.955 -5.139 408 HA2 GLY 54 HA2 GLY 54 -7.090 2.131 -2.491 409 HA3 GLY 54 HA1 GLY 54 -7.961 0.699 -3.017 410 H ILE 55 HN ILE 55 -4.484 1.086 -3.479 411 HA ILE 55 HA ILE 55 -4.114 -1.010 -1.435 412 HB ILE 55 HB ILE 55 -2.622 -0.779 -4.059 413 HG12 ILE 55 HG12 ILE 55 -4.869 -1.629 -4.408 414 HG13 ILE 55 HG11 ILE 55 -3.706 -2.934 -4.606 415 HG21 ILE 55 HG21 ILE 55 -2.367 -2.778 -1.816 416 HG22 ILE 55 HG22 ILE 55 -1.156 -1.610 -2.350 417 HG23 ILE 55 HG23 ILE 55 -1.617 -2.945 -3.406 418 HD11 ILE 55 HD11 ILE 55 -5.653 -3.702 -3.394 419 HD12 ILE 55 HD12 ILE 55 -5.429 -2.438 -2.183 420 HD13 ILE 55 HD13 ILE 55 -4.233 -3.731 -2.345 421 H TYR 56 HN TYR 56 -2.926 -0.273 0.210 422 HA TYR 56 HA TYR 56 -0.425 1.048 -0.353 423 HB2 TYR 56 HB2 TYR 56 -0.799 2.992 1.059 424 HB3 TYR 56 HB1 TYR 56 -1.965 2.962 -0.256 425 HD1 TYR 56 HD2 TYR 56 -4.324 2.563 0.188 426 HD2 TYR 56 HD1 TYR 56 -1.488 2.700 3.344 427 HE1 TYR 56 HE2 TYR 56 -6.164 2.758 1.814 428 HE2 TYR 56 HE1 TYR 56 -3.310 2.898 4.992 429 HH TYR 56 HH TYR 56 -6.634 2.428 4.129 430 H VAL 57 HN VAL 57 0.988 1.143 1.495 431 HA VAL 57 HA VAL 57 0.700 -1.068 3.226 432 HB VAL 57 HB VAL 57 2.808 0.143 2.193 433 HG11 VAL 57 HG11 VAL 57 3.524 1.156 4.745 434 HG12 VAL 57 HG12 VAL 57 2.100 1.996 4.133 435 HG13 VAL 57 HG13 VAL 57 3.579 1.944 3.167 436 HG21 VAL 57 HG21 VAL 57 4.165 -1.068 3.668 437 HG22 VAL 57 HG22 VAL 57 2.652 -1.961 3.489 438 HG23 VAL 57 HG23 VAL 57 2.944 -0.989 4.937 439 H THR 58 HN THR 58 0.067 -1.122 5.262 440 HA THR 58 HA THR 58 -0.569 1.411 6.611 441 HB THR 58 HB THR 58 -2.588 0.100 6.080 442 HG1 THR 58 HG1 THR 58 -1.779 0.459 8.762 443 HG21 THR 58 HG21 THR 58 -1.563 -2.136 6.102 444 HG22 THR 58 HG22 THR 58 -2.989 -2.059 7.137 445 HG23 THR 58 HG23 THR 58 -1.375 -2.027 7.851 446 H ARG 59 HN ARG 59 1.458 -1.269 6.576 447 HA ARG 59 HA ARG 59 2.376 -0.613 9.271 448 HB2 ARG 59 HB2 ARG 59 1.585 -3.360 8.398 449 HB3 ARG 59 HB1 ARG 59 2.786 -3.113 9.647 450 HG2 ARG 59 HG2 ARG 59 0.447 -1.552 10.064 451 HG3 ARG 59 HG1 ARG 59 0.064 -3.269 10.011 452 HD2 ARG 59 HD2 ARG 59 0.533 -2.688 12.290 453 HD3 ARG 59 HD1 ARG 59 1.914 -3.601 11.687 454 HE ARG 59 HE ARG 59 2.027 -0.672 11.629 455 HH11 ARG 59 HH11 ARG 59 3.104 -3.680 13.067 456 HH12 ARG 59 HH12 ARG 59 4.488 -2.966 13.828 457 HH21 ARG 59 HH21 ARG 59 3.814 0.272 12.677 458 HH22 ARG 59 HH22 ARG 59 4.897 -0.726 13.614 459 H VAL 60 HN VAL 60 4.313 -1.750 9.792 460 HA VAL 60 HA VAL 60 5.943 -2.761 7.647 461 HB VAL 60 HB VAL 60 6.555 -0.179 9.071 462 HG11 VAL 60 HG11 VAL 60 8.910 -0.489 8.193 463 HG12 VAL 60 HG12 VAL 60 8.481 -2.191 7.972 464 HG13 VAL 60 HG13 VAL 60 8.438 -1.477 9.578 465 HG21 VAL 60 HG21 VAL 60 6.956 0.694 6.937 466 HG22 VAL 60 HG22 VAL 60 5.544 -0.346 6.714 467 HG23 VAL 60 HG23 VAL 60 7.140 -0.906 6.216 468 H SER 61 HN SER 61 7.082 -4.443 8.472 469 HA SER 61 HA SER 61 7.335 -4.913 11.248 470 HB2 SER 61 HB2 SER 61 9.403 -6.308 10.299 471 HB3 SER 61 HB1 SER 61 7.738 -6.855 10.148 472 HG SER 61 HG SER 61 7.908 -6.664 8.059 473 H GLU 62 HN GLU 62 8.254 -3.465 12.474 474 HA GLU 62 HA GLU 62 9.990 -1.529 11.419 475 HB2 GLU 62 HB2 GLU 62 8.796 -2.030 14.105 476 HB3 GLU 62 HB1 GLU 62 9.920 -0.746 13.814 477 HG2 GLU 62 HG2 GLU 62 8.488 0.401 12.409 478 HG3 GLU 62 HG1 GLU 62 7.497 -1.022 12.124 479 H GLY 63 HN GLY 63 11.900 -1.064 11.977 480 HA2 GLY 63 HA2 GLY 63 14.154 -1.476 12.301 481 HA3 GLY 63 HA1 GLY 63 13.667 -2.512 13.650 482 H GLY 64 HN GLY 64 12.625 -2.947 10.308 483 HA2 GLY 64 HA2 GLY 64 14.003 -5.550 10.391 484 HA3 GLY 64 HA1 GLY 64 12.330 -5.354 9.863 485 HA PRO 65 HA PRO 65 14.379 -5.178 5.936 486 HB2 PRO 65 HB2 PRO 65 12.315 -6.173 4.583 487 HB3 PRO 65 HB1 PRO 65 13.343 -7.184 5.594 488 HG2 PRO 65 HG2 PRO 65 10.566 -6.321 6.015 489 HG3 PRO 65 HG1 PRO 65 11.435 -7.686 6.733 490 HD2 PRO 65 HD2 PRO 65 10.909 -5.102 7.888 491 HD3 PRO 65 HD1 PRO 65 11.757 -6.487 8.614 492 H ALA 66 HN ALA 66 11.115 -3.975 6.501 493 HA ALA 66 HA ALA 66 10.715 -3.134 3.826 494 HB1 ALA 66 HB1 ALA 66 9.222 -2.519 6.366 495 HB2 ALA 66 HB2 ALA 66 8.798 -3.704 5.128 496 HB3 ALA 66 HB3 ALA 66 8.714 -1.975 4.769 497 H GLU 67 HN GLU 67 11.848 -1.633 6.739 498 HA GLU 67 HA GLU 67 11.257 1.022 5.715 499 HB2 GLU 67 HB2 GLU 67 12.358 1.521 8.032 500 HB3 GLU 67 HB1 GLU 67 10.710 0.896 7.950 501 HG2 GLU 67 HG2 GLU 67 11.311 -1.176 8.669 502 HG3 GLU 67 HG1 GLU 67 12.926 -1.017 8.007 503 H ILE 68 HN ILE 68 13.808 -1.251 6.133 504 HA ILE 68 HA ILE 68 15.808 0.733 5.904 505 HB ILE 68 HB ILE 68 17.325 -1.138 5.782 506 HG12 ILE 68 HG12 ILE 68 15.929 -3.256 6.815 507 HG13 ILE 68 HG11 ILE 68 14.884 -2.647 5.542 508 HG21 ILE 68 HG21 ILE 68 17.065 -1.800 8.146 509 HG22 ILE 68 HG22 ILE 68 15.460 -1.068 8.103 510 HG23 ILE 68 HG23 ILE 68 16.890 -0.066 7.878 511 HD11 ILE 68 HD11 ILE 68 16.723 -2.848 3.944 512 HD12 ILE 68 HD12 ILE 68 16.330 -4.393 4.700 513 HD13 ILE 68 HD13 ILE 68 17.754 -3.493 5.222 514 H ALA 69 HN ALA 69 14.101 -1.560 4.101 515 HA ALA 69 HA ALA 69 15.430 -1.265 1.638 516 HB1 ALA 69 HB1 ALA 69 12.506 -1.808 2.168 517 HB2 ALA 69 HB2 ALA 69 13.763 -3.036 2.047 518 HB3 ALA 69 HB3 ALA 69 13.337 -2.063 0.636 519 H GLY 70 HN GLY 70 13.229 0.586 3.518 520 HA2 GLY 70 HA2 GLY 70 13.311 3.023 3.223 521 HA3 GLY 70 HA1 GLY 70 13.349 2.745 1.481 522 H LEU 71 HN LEU 71 11.265 1.288 3.960 523 HA LEU 71 HA LEU 71 8.951 2.471 2.633 524 HB2 LEU 71 HB2 LEU 71 9.332 -0.024 2.332 525 HB3 LEU 71 HB1 LEU 71 9.121 -0.176 4.068 526 HG LEU 71 HG LEU 71 6.830 0.896 3.731 527 HD11 LEU 71 HD11 LEU 71 5.836 0.570 1.516 528 HD12 LEU 71 HD12 LEU 71 7.406 0.069 0.886 529 HD13 LEU 71 HD13 LEU 71 7.170 1.720 1.462 530 HD21 LEU 71 HD21 LEU 71 6.955 -1.328 4.372 531 HD22 LEU 71 HD22 LEU 71 7.678 -1.819 2.843 532 HD23 LEU 71 HD23 LEU 71 5.968 -1.376 2.906 533 H GLN 72 HN GLN 72 7.116 2.499 4.185 534 HA GLN 72 HA GLN 72 7.573 2.612 6.913 535 HB2 GLN 72 HB2 GLN 72 7.329 5.110 7.167 536 HB3 GLN 72 HB1 GLN 72 8.850 4.513 6.553 537 HG2 GLN 72 HG2 GLN 72 8.197 6.556 5.473 538 HG3 GLN 72 HG1 GLN 72 8.342 5.207 4.347 539 HE21 GLN 72 HE21 GLN 72 6.644 4.619 3.174 540 HE22 GLN 72 HE22 GLN 72 5.085 5.345 3.306 541 H ILE 73 HN ILE 73 5.565 4.122 7.805 542 HA ILE 73 HA ILE 73 3.411 2.483 6.870 543 HB ILE 73 HB ILE 73 3.226 4.651 8.948 544 HG12 ILE 73 HG12 ILE 73 5.145 3.449 9.671 545 HG13 ILE 73 HG11 ILE 73 3.804 2.776 10.593 546 HG21 ILE 73 HG21 ILE 73 1.555 3.161 9.901 547 HG22 ILE 73 HG22 ILE 73 1.848 2.016 8.594 548 HG23 ILE 73 HG23 ILE 73 1.171 3.603 8.239 549 HD11 ILE 73 HD11 ILE 73 5.079 1.567 8.142 550 HD12 ILE 73 HD12 ILE 73 3.701 0.895 9.028 551 HD13 ILE 73 HD13 ILE 73 5.273 1.023 9.814 552 H GLY 74 HN GLY 74 2.332 3.061 5.124 553 HA2 GLY 74 HA2 GLY 74 0.359 4.400 4.524 554 HA3 GLY 74 HA1 GLY 74 1.219 5.818 5.128 555 H ASP 75 HN ASP 75 1.623 3.188 2.789 556 HA ASP 75 HA ASP 75 2.743 5.124 0.864 557 HB2 ASP 75 HB2 ASP 75 4.378 3.540 2.412 558 HB3 ASP 75 HB1 ASP 75 4.137 2.541 0.977 559 H LYS 76 HN LYS 76 1.805 4.730 -1.155 560 HA LYS 76 HA LYS 76 -0.022 2.467 -1.155 561 HB2 LYS 76 HB2 LYS 76 0.192 4.630 -3.247 562 HB3 LYS 76 HB1 LYS 76 -1.110 3.469 -3.060 563 HG2 LYS 76 HG2 LYS 76 -2.077 5.284 -2.111 564 HG3 LYS 76 HG1 LYS 76 -1.297 4.597 -0.686 565 HD2 LYS 76 HD2 LYS 76 0.629 6.102 -1.059 566 HD3 LYS 76 HD1 LYS 76 -0.233 6.826 -2.424 567 HE2 LYS 76 HE2 LYS 76 -1.147 6.798 0.459 568 HE3 LYS 76 HE1 LYS 76 -0.475 8.184 -0.395 569 HZ1 LYS 76 HZ1 LYS 76 -2.931 8.203 -0.238 570 HZ2 LYS 76 HZ2 LYS 76 -2.980 6.790 -1.172 571 HZ3 LYS 76 HZ3 LYS 76 -2.366 8.218 -1.836 572 H ILE 77 HN ILE 77 0.824 0.684 -1.732 573 HA ILE 77 HA ILE 77 2.993 0.428 -3.594 574 HB ILE 77 HB ILE 77 1.285 -1.756 -2.380 575 HG12 ILE 77 HG12 ILE 77 3.956 -0.753 -1.387 576 HG13 ILE 77 HG11 ILE 77 2.423 -0.192 -0.729 577 HG21 ILE 77 HG21 ILE 77 3.226 -3.192 -2.832 578 HG22 ILE 77 HG22 ILE 77 4.048 -1.829 -3.590 579 HG23 ILE 77 HG23 ILE 77 2.582 -2.484 -4.316 580 HD11 ILE 77 HD11 ILE 77 3.391 -3.037 -0.730 581 HD12 ILE 77 HD12 ILE 77 1.885 -2.443 -0.028 582 HD13 ILE 77 HD13 ILE 77 3.432 -1.930 0.643 583 H MET 78 HN MET 78 2.874 -0.056 -5.743 584 HA MET 78 HA MET 78 0.118 -0.127 -6.805 585 HB2 MET 78 HB2 MET 78 2.572 1.002 -8.156 586 HB3 MET 78 HB1 MET 78 0.903 1.146 -8.691 587 HG2 MET 78 HG2 MET 78 1.780 2.257 -6.059 588 HG3 MET 78 HG1 MET 78 2.050 3.151 -7.551 589 HE1 MET 78 HE1 MET 78 -2.038 2.346 -5.563 590 HE2 MET 78 HE2 MET 78 -0.465 1.953 -4.879 591 HE3 MET 78 HE3 MET 78 -1.122 0.979 -6.192 592 H GLN 79 HN GLN 79 3.085 -1.658 -6.531 593 HA GLN 79 HA GLN 79 2.318 -3.842 -8.171 594 HB2 GLN 79 HB2 GLN 79 3.447 -3.362 -10.027 595 HB3 GLN 79 HB1 GLN 79 3.710 -1.758 -9.399 596 HG2 GLN 79 HG2 GLN 79 5.682 -2.596 -8.217 597 HG3 GLN 79 HG1 GLN 79 5.481 -4.132 -9.085 598 HE21 GLN 79 HE21 GLN 79 4.520 -2.622 -11.459 599 HE22 GLN 79 HE22 GLN 79 5.968 -2.034 -12.211 600 H VAL 80 HN VAL 80 3.711 -5.531 -8.020 601 HA VAL 80 HA VAL 80 5.786 -5.365 -5.938 602 HB VAL 80 HB VAL 80 4.145 -6.288 -4.633 603 HG11 VAL 80 HG11 VAL 80 3.099 -7.755 -7.041 604 HG12 VAL 80 HG12 VAL 80 2.480 -6.226 -6.403 605 HG13 VAL 80 HG13 VAL 80 2.350 -7.708 -5.439 606 HG21 VAL 80 HG21 VAL 80 5.279 -8.681 -6.106 607 HG22 VAL 80 HG22 VAL 80 4.459 -8.748 -4.538 608 HG23 VAL 80 HG23 VAL 80 5.987 -7.882 -4.696 609 H ASN 81 HN ASN 81 7.642 -6.216 -6.648 610 HA ASN 81 HA ASN 81 9.185 -7.409 -7.823 611 HB2 ASN 81 HB2 ASN 81 6.895 -9.370 -7.942 612 HB3 ASN 81 HB1 ASN 81 8.535 -9.734 -8.494 613 HD21 ASN 81 HD21 ASN 81 6.729 -10.606 -6.247 614 HD22 ASN 81 HD22 ASN 81 7.764 -10.574 -4.846 615 H GLY 82 HN GLY 82 6.928 -5.837 -9.136 616 HA2 GLY 82 HA2 GLY 82 7.247 -4.869 -11.336 617 HA3 GLY 82 HA1 GLY 82 7.744 -6.463 -11.901 618 H TRP 83 HN TRP 83 5.105 -6.779 -9.847 619 HA TRP 83 HA TRP 83 3.316 -7.081 -12.126 620 HB2 TRP 83 HB2 TRP 83 2.834 -8.066 -9.338 621 HB3 TRP 83 HB1 TRP 83 2.062 -8.573 -10.811 622 HD1 TRP 83 HD1 TRP 83 5.720 -8.399 -9.970 623 HE1 TRP 83 HE1 TRP 83 6.695 -10.716 -10.053 624 HE3 TRP 83 HE3 TRP 83 1.538 -11.018 -11.210 625 HZ2 TRP 83 HZ2 TRP 83 5.910 -13.337 -10.654 626 HZ3 TRP 83 HZ3 TRP 83 1.753 -13.450 -11.559 627 HH2 TRP 83 HH2 TRP 83 3.913 -14.561 -11.279 628 H ASP 84 HN ASP 84 2.687 -4.976 -12.240 629 HA ASP 84 HA ASP 84 1.866 -3.221 -10.315 630 HB2 ASP 84 HB2 ASP 84 1.706 -3.296 -13.063 631 HB3 ASP 84 HB1 ASP 84 0.014 -3.249 -12.581 632 H MET 85 HN MET 85 0.636 -3.549 -8.641 633 HA MET 85 HA MET 85 -1.319 -5.660 -8.521 634 HB2 MET 85 HB2 MET 85 -0.959 -3.536 -6.423 635 HB3 MET 85 HB1 MET 85 -1.464 -5.209 -6.219 636 HG2 MET 85 HG2 MET 85 0.763 -5.965 -6.772 637 HG3 MET 85 HG1 MET 85 1.278 -4.305 -7.039 638 HE1 MET 85 HE1 MET 85 0.528 -6.341 -2.989 639 HE2 MET 85 HE2 MET 85 0.759 -7.163 -4.539 640 HE3 MET 85 HE3 MET 85 -0.741 -6.275 -4.215 641 H THR 86 HN THR 86 -1.556 -2.633 -9.788 642 HA THR 86 HA THR 86 -4.073 -1.862 -8.603 643 HB THR 86 HB THR 86 -4.000 0.034 -10.170 644 HG1 THR 86 HG1 THR 86 -1.440 -0.687 -11.076 645 HG21 THR 86 HG21 THR 86 -1.970 1.101 -9.309 646 HG22 THR 86 HG22 THR 86 -1.347 -0.471 -8.811 647 HG23 THR 86 HG23 THR 86 -2.787 0.187 -8.036 648 H MET 87 HN MET 87 -3.011 -3.758 -11.216 649 HA MET 87 HA MET 87 -5.675 -3.821 -12.465 650 HB2 MET 87 HB2 MET 87 -3.068 -5.107 -13.339 651 HB3 MET 87 HB1 MET 87 -4.562 -5.081 -14.254 652 HG2 MET 87 HG2 MET 87 -3.052 -2.600 -13.501 653 HG3 MET 87 HG1 MET 87 -2.777 -3.486 -14.997 654 HE1 MET 87 HE1 MET 87 -5.801 -4.478 -15.527 655 HE2 MET 87 HE2 MET 87 -4.796 -3.871 -16.844 656 HE3 MET 87 HE3 MET 87 -6.416 -3.222 -16.597 657 H VAL 88 HN VAL 88 -4.835 -4.950 -9.827 658 HA VAL 88 HA VAL 88 -5.106 -7.834 -10.290 659 HB VAL 88 HB VAL 88 -2.909 -6.255 -9.030 660 HG11 VAL 88 HG11 VAL 88 -2.019 -8.244 -7.967 661 HG12 VAL 88 HG12 VAL 88 -3.489 -9.124 -8.391 662 HG13 VAL 88 HG13 VAL 88 -3.567 -7.758 -7.277 663 HG21 VAL 88 HG21 VAL 88 -2.954 -8.628 -10.873 664 HG22 VAL 88 HG22 VAL 88 -1.509 -7.780 -10.317 665 HG23 VAL 88 HG23 VAL 88 -2.694 -6.942 -11.324 666 H THR 89 HN THR 89 -5.787 -9.075 -8.318 667 HA THR 89 HA THR 89 -7.404 -7.463 -6.553 668 HB THR 89 HB THR 89 -7.137 -10.359 -7.192 669 HG1 THR 89 HG1 THR 89 -9.302 -8.509 -7.166 670 HG21 THR 89 HG21 THR 89 -8.567 -9.270 -4.807 671 HG22 THR 89 HG22 THR 89 -7.171 -10.351 -4.827 672 HG23 THR 89 HG23 THR 89 -8.730 -10.913 -5.431 673 H HIS 90 HN HIS 90 -7.044 -7.350 -4.417 674 HA HIS 90 HA HIS 90 -4.361 -7.213 -3.578 675 HB2 HIS 90 HB2 HIS 90 -6.091 -5.827 -2.598 676 HB3 HIS 90 HB1 HIS 90 -6.945 -7.242 -2.001 677 HD1 HIS 90 HD1 HIS 90 -6.561 -7.779 0.357 678 HD2 HIS 90 HD2 HIS 90 -3.427 -5.547 -1.214 679 HE1 HIS 90 HE1 HIS 90 -5.035 -7.306 2.292 680 HE2 HIS 90 HE2 HIS 90 -3.070 -6.117 1.290 681 H ASP 91 HN ASP 91 -6.726 -9.667 -3.203 682 HA ASP 91 HA ASP 91 -5.316 -11.241 -1.295 683 HB2 ASP 91 HB2 ASP 91 -7.773 -11.339 -1.506 684 HB3 ASP 91 HB1 ASP 91 -7.590 -11.993 -3.138 685 H GLN 92 HN GLN 92 -5.526 -11.163 -4.839 686 HA GLN 92 HA GLN 92 -4.168 -13.688 -4.949 687 HB2 GLN 92 HB2 GLN 92 -4.555 -13.636 -7.311 688 HB3 GLN 92 HB1 GLN 92 -6.037 -13.199 -6.491 689 HG2 GLN 92 HG2 GLN 92 -6.054 -11.675 -8.111 690 HG3 GLN 92 HG1 GLN 92 -5.123 -10.775 -6.918 691 HE21 GLN 92 HE21 GLN 92 -2.957 -10.679 -7.104 692 HE22 GLN 92 HE22 GLN 92 -2.168 -10.958 -8.590 693 H ALA 93 HN ALA 93 -3.618 -10.336 -4.912 694 HA ALA 93 HA ALA 93 -0.976 -10.365 -6.053 695 HB1 ALA 93 HB1 ALA 93 -0.845 -8.098 -5.296 696 HB2 ALA 93 HB2 ALA 93 -2.242 -8.316 -4.244 697 HB3 ALA 93 HB3 ALA 93 -2.443 -8.356 -5.995 698 H ARG 94 HN ARG 94 -2.490 -10.696 -2.925 699 HA ARG 94 HA ARG 94 -0.151 -10.324 -1.399 700 HB2 ARG 94 HB2 ARG 94 -1.463 -10.797 0.458 701 HB3 ARG 94 HB1 ARG 94 -2.693 -10.307 -0.709 702 HG2 ARG 94 HG2 ARG 94 -3.321 -12.551 -1.115 703 HG3 ARG 94 HG1 ARG 94 -1.955 -13.170 -0.174 704 HD2 ARG 94 HD2 ARG 94 -4.164 -11.472 0.975 705 HD3 ARG 94 HD1 ARG 94 -4.170 -13.238 0.995 706 HE ARG 94 HE ARG 94 -1.915 -11.812 2.209 707 HH11 ARG 94 HH11 ARG 94 -4.739 -13.845 2.541 708 HH12 ARG 94 HH12 ARG 94 -4.430 -14.233 4.209 709 HH21 ARG 94 HH21 ARG 94 -1.484 -12.340 4.405 710 HH22 ARG 94 HH22 ARG 94 -2.567 -13.391 5.268 711 H LYS 95 HN LYS 95 -1.697 -13.145 -2.824 712 HA LYS 95 HA LYS 95 0.191 -14.969 -1.655 713 HB2 LYS 95 HB2 LYS 95 -0.977 -16.692 -2.886 714 HB3 LYS 95 HB1 LYS 95 -2.130 -15.627 -2.100 715 HG2 LYS 95 HG2 LYS 95 -2.189 -14.420 -4.417 716 HG3 LYS 95 HG1 LYS 95 -1.530 -15.955 -5.001 717 HD2 LYS 95 HD2 LYS 95 -4.116 -15.536 -3.509 718 HD3 LYS 95 HD1 LYS 95 -3.920 -16.035 -5.191 719 HE2 LYS 95 HE2 LYS 95 -3.043 -18.141 -4.562 720 HE3 LYS 95 HE1 LYS 95 -2.837 -17.633 -2.886 721 HZ1 LYS 95 HZ1 LYS 95 -5.411 -18.073 -4.304 722 HZ2 LYS 95 HZ2 LYS 95 -5.274 -17.448 -2.728 723 HZ3 LYS 95 HZ3 LYS 95 -4.759 -19.032 -3.063 724 H ARG 96 HN ARG 96 0.092 -13.092 -4.604 725 HA ARG 96 HA ARG 96 2.028 -14.842 -5.866 726 HB2 ARG 96 HB2 ARG 96 1.841 -13.415 -7.795 727 HB3 ARG 96 HB1 ARG 96 0.243 -13.866 -7.222 728 HG2 ARG 96 HG2 ARG 96 -0.212 -11.700 -7.437 729 HG3 ARG 96 HG1 ARG 96 0.648 -11.525 -5.907 730 HD2 ARG 96 HD2 ARG 96 2.700 -11.004 -7.065 731 HD3 ARG 96 HD1 ARG 96 1.920 -11.346 -8.608 732 HE ARG 96 HE ARG 96 1.658 -8.950 -7.027 733 HH11 ARG 96 HH11 ARG 96 0.290 -10.895 -9.593 734 HH12 ARG 96 HH12 ARG 96 -0.577 -9.581 -10.316 735 HH21 ARG 96 HH21 ARG 96 0.528 -7.194 -7.987 736 HH22 ARG 96 HH22 ARG 96 -0.441 -7.464 -9.398 737 H LEU 97 HN LEU 97 2.007 -12.025 -3.893 738 HA LEU 97 HA LEU 97 4.687 -11.283 -4.577 739 HB2 LEU 97 HB2 LEU 97 4.574 -9.793 -2.659 740 HB3 LEU 97 HB1 LEU 97 3.206 -9.578 -3.727 741 HG LEU 97 HG LEU 97 1.993 -11.167 -2.035 742 HD11 LEU 97 HD11 LEU 97 4.056 -11.701 -0.800 743 HD12 LEU 97 HD12 LEU 97 2.817 -10.982 0.231 744 HD13 LEU 97 HD13 LEU 97 4.187 -10.010 -0.313 745 HD21 LEU 97 HD21 LEU 97 1.358 -9.203 -0.681 746 HD22 LEU 97 HD22 LEU 97 1.343 -8.873 -2.414 747 HD23 LEU 97 HD23 LEU 97 2.678 -8.290 -1.417 748 H THR 98 HN THR 98 3.108 -13.341 -2.243 749 HA THR 98 HA THR 98 5.619 -14.020 -0.962 750 HB THR 98 HB THR 98 4.022 -15.862 0.058 751 HG1 THR 98 HG1 THR 98 2.084 -13.874 -0.461 752 HG21 THR 98 HG21 THR 98 5.022 -14.100 1.373 753 HG22 THR 98 HG22 THR 98 3.313 -14.236 1.785 754 HG23 THR 98 HG23 THR 98 3.867 -12.928 0.742 755 H LYS 99 HN LYS 99 5.961 -14.461 -3.559 756 HA LYS 99 HA LYS 99 5.140 -17.099 -4.268 757 HB2 LYS 99 HB2 LYS 99 6.376 -16.589 -6.394 758 HB3 LYS 99 HB1 LYS 99 5.082 -15.456 -6.024 759 HG2 LYS 99 HG2 LYS 99 7.000 -14.077 -4.916 760 HG3 LYS 99 HG1 LYS 99 8.033 -15.050 -5.957 761 HD2 LYS 99 HD2 LYS 99 5.643 -13.615 -7.057 762 HD3 LYS 99 HD1 LYS 99 7.180 -12.786 -6.834 763 HE2 LYS 99 HE2 LYS 99 7.225 -15.382 -8.255 764 HE3 LYS 99 HE1 LYS 99 6.526 -14.005 -9.109 765 HZ1 LYS 99 HZ1 LYS 99 8.962 -14.352 -9.463 766 HZ2 LYS 99 HZ2 LYS 99 9.209 -13.939 -7.830 767 HZ3 LYS 99 HZ3 LYS 99 8.543 -12.809 -8.905 768 H ARG 100 HN ARG 100 6.960 -18.422 -5.278 769 HA ARG 100 HA ARG 100 8.941 -18.744 -3.150 770 HB2 ARG 100 HB2 ARG 100 7.679 -20.627 -5.106 771 HB3 ARG 100 HB1 ARG 100 9.222 -21.035 -4.373 772 HG2 ARG 100 HG2 ARG 100 7.444 -22.079 -3.137 773 HG3 ARG 100 HG1 ARG 100 8.187 -20.828 -2.143 774 HD2 ARG 100 HD2 ARG 100 6.354 -19.311 -2.644 775 HD3 ARG 100 HD1 ARG 100 5.626 -20.516 -3.707 776 HE ARG 100 HE ARG 100 6.051 -21.425 -1.001 777 HH11 ARG 100 HH11 ARG 100 3.818 -19.729 -3.117 778 HH12 ARG 100 HH12 ARG 100 2.417 -20.185 -2.191 779 HH21 ARG 100 HH21 ARG 100 4.235 -21.985 0.208 780 HH22 ARG 100 HH22 ARG 100 2.653 -21.463 -0.290 781 H SER 101 HN SER 101 9.015 -16.935 -5.612 782 HA SER 101 HA SER 101 11.225 -18.183 -7.088 783 HB2 SER 101 HB2 SER 101 9.364 -17.149 -8.363 784 HB3 SER 101 HB1 SER 101 9.776 -15.590 -7.655 785 HG SER 101 HG SER 101 11.962 -16.064 -8.590 786 H GLU 102 HN GLU 102 10.592 -15.647 -4.804 787 HA GLU 102 HA GLU 102 13.360 -15.418 -4.216 788 HB2 GLU 102 HB2 GLU 102 13.512 -13.022 -4.560 789 HB3 GLU 102 HB1 GLU 102 13.147 -13.829 -6.077 790 HG2 GLU 102 HG2 GLU 102 10.935 -12.733 -4.415 791 HG3 GLU 102 HG1 GLU 102 11.899 -11.650 -5.425 792 H GLU 103 HN GLU 103 13.622 -13.911 -2.413 793 HA GLU 103 HA GLU 103 11.268 -13.940 -0.676 794 HB2 GLU 103 HB2 GLU 103 12.815 -14.004 1.222 795 HB3 GLU 103 HB1 GLU 103 13.080 -15.372 0.152 796 HG2 GLU 103 HG2 GLU 103 15.001 -14.222 -0.825 797 HG3 GLU 103 HG1 GLU 103 14.735 -12.865 0.270 798 H VAL 104 HN VAL 104 12.806 -12.119 -2.631 799 HA VAL 104 HA VAL 104 12.732 -9.691 -0.983 800 HB VAL 104 HB VAL 104 13.750 -10.106 -3.790 801 HG11 VAL 104 HG11 VAL 104 13.940 -7.670 -2.024 802 HG12 VAL 104 HG12 VAL 104 12.862 -7.844 -3.410 803 HG13 VAL 104 HG13 VAL 104 14.610 -7.838 -3.647 804 HG21 VAL 104 HG21 VAL 104 15.188 -11.150 -2.187 805 HG22 VAL 104 HG22 VAL 104 15.161 -9.703 -1.178 806 HG23 VAL 104 HG23 VAL 104 15.954 -9.663 -2.754 807 H VAL 105 HN VAL 105 11.087 -8.302 -1.209 808 HA VAL 105 HA VAL 105 9.255 -8.876 -3.435 809 HB VAL 105 HB VAL 105 8.222 -9.306 -1.222 810 HG11 VAL 105 HG11 VAL 105 9.355 -7.630 0.116 811 HG12 VAL 105 HG12 VAL 105 7.605 -7.458 0.241 812 HG13 VAL 105 HG13 VAL 105 8.532 -6.348 -0.767 813 HG21 VAL 105 HG21 VAL 105 6.158 -8.088 -1.635 814 HG22 VAL 105 HG22 VAL 105 6.849 -8.713 -3.134 815 HG23 VAL 105 HG23 VAL 105 7.011 -7.002 -2.733 816 H ARG 106 HN ARG 106 9.458 -7.500 -4.971 817 HA ARG 106 HA ARG 106 10.611 -4.895 -4.508 818 HB2 ARG 106 HB2 ARG 106 10.514 -6.686 -6.658 819 HB3 ARG 106 HB1 ARG 106 9.498 -5.333 -7.139 820 HG2 ARG 106 HG2 ARG 106 11.240 -3.798 -6.864 821 HG3 ARG 106 HG1 ARG 106 12.280 -5.008 -6.105 822 HD2 ARG 106 HD2 ARG 106 12.028 -6.296 -8.316 823 HD3 ARG 106 HD1 ARG 106 11.440 -4.771 -8.977 824 HE ARG 106 HE ARG 106 14.031 -4.817 -7.600 825 HH11 ARG 106 HH11 ARG 106 12.240 -4.601 -10.603 826 HH12 ARG 106 HH12 ARG 106 13.560 -3.918 -11.501 827 HH21 ARG 106 HH21 ARG 106 15.772 -3.935 -8.771 828 HH22 ARG 106 HH22 ARG 106 15.586 -3.565 -10.458 829 H LEU 107 HN LEU 107 9.509 -3.002 -4.574 830 HA LEU 107 HA LEU 107 6.616 -3.206 -5.053 831 HB2 LEU 107 HB2 LEU 107 7.758 -1.253 -3.065 832 HB3 LEU 107 HB1 LEU 107 6.084 -1.694 -3.308 833 HG LEU 107 HG LEU 107 6.704 -2.642 -1.254 834 HD11 LEU 107 HD11 LEU 107 6.903 -5.140 -1.772 835 HD12 LEU 107 HD12 LEU 107 6.745 -4.644 -3.465 836 HD13 LEU 107 HD13 LEU 107 5.454 -4.284 -2.314 837 HD21 LEU 107 HD21 LEU 107 8.713 -4.056 -1.018 838 HD22 LEU 107 HD22 LEU 107 9.061 -2.367 -1.403 839 HD23 LEU 107 HD23 LEU 107 9.159 -3.598 -2.665 840 H LEU 108 HN LEU 108 5.856 -1.839 -6.400 841 HA LEU 108 HA LEU 108 7.265 0.693 -6.877 842 HB2 LEU 108 HB2 LEU 108 5.780 -0.898 -8.635 843 HB3 LEU 108 HB1 LEU 108 4.702 0.416 -8.221 844 HG LEU 108 HG LEU 108 7.433 0.653 -9.478 845 HD11 LEU 108 HD11 LEU 108 5.658 -0.035 -10.998 846 HD12 LEU 108 HD12 LEU 108 6.205 1.604 -11.351 847 HD13 LEU 108 HD13 LEU 108 4.683 1.347 -10.497 848 HD21 LEU 108 HD21 LEU 108 5.539 2.801 -8.546 849 HD22 LEU 108 HD22 LEU 108 6.962 3.071 -9.554 850 HD23 LEU 108 HD23 LEU 108 7.151 2.459 -7.908 851 H VAL 109 HN VAL 109 6.387 2.561 -5.955 852 HA VAL 109 HA VAL 109 3.944 2.232 -4.485 853 HB VAL 109 HB VAL 109 6.063 1.526 -3.191 854 HG11 VAL 109 HG11 VAL 109 7.222 3.302 -2.001 855 HG12 VAL 109 HG12 VAL 109 6.333 4.506 -2.933 856 HG13 VAL 109 HG13 VAL 109 7.465 3.427 -3.744 857 HG21 VAL 109 HG21 VAL 109 4.101 3.456 -2.043 858 HG22 VAL 109 HG22 VAL 109 5.129 2.367 -1.108 859 HG23 VAL 109 HG23 VAL 109 3.910 1.711 -2.203 860 H THR 110 HN THR 110 3.608 4.280 -3.292 861 HA THR 110 HA THR 110 4.408 6.625 -4.864 862 HB THR 110 HB THR 110 1.956 7.424 -4.549 863 HG1 THR 110 HG1 THR 110 1.734 4.599 -4.321 864 HG21 THR 110 HG21 THR 110 1.310 6.391 -6.692 865 HG22 THR 110 HG22 THR 110 2.725 5.344 -6.582 866 HG23 THR 110 HG23 THR 110 2.928 7.091 -6.721 867 H ARG 111 HN ARG 111 5.333 7.953 -3.527 868 HA ARG 111 HA ARG 111 4.474 8.144 -0.761 869 HB2 ARG 111 HB2 ARG 111 6.743 9.403 -2.304 870 HB3 ARG 111 HB1 ARG 111 6.348 9.851 -0.652 871 HG2 ARG 111 HG2 ARG 111 7.059 7.072 -1.513 872 HG3 ARG 111 HG1 ARG 111 8.195 8.252 -0.864 873 HD2 ARG 111 HD2 ARG 111 6.861 8.385 1.171 874 HD3 ARG 111 HD1 ARG 111 5.770 7.165 0.530 875 HE ARG 111 HE ARG 111 7.307 5.535 0.982 876 HH11 ARG 111 HH11 ARG 111 8.814 8.676 1.368 877 HH12 ARG 111 HH12 ARG 111 10.287 8.036 2.009 878 HH21 ARG 111 HH21 ARG 111 9.268 4.694 1.806 879 HH22 ARG 111 HH22 ARG 111 10.549 5.772 2.247 880 H GLN 112 HN GLN 112 3.945 10.200 0.140 881 HA GLN 112 HA GLN 112 2.715 12.035 -1.725 882 HB2 GLN 112 HB2 GLN 112 2.610 11.975 1.262 883 HB3 GLN 112 HB1 GLN 112 1.520 12.785 0.178 884 HG2 GLN 112 HG2 GLN 112 1.780 9.809 0.468 885 HG3 GLN 112 HG1 GLN 112 0.486 10.798 1.135 886 HE21 GLN 112 HE21 GLN 112 1.871 9.471 -1.773 887 HE22 GLN 112 HE22 GLN 112 0.495 9.740 -2.793 888 H SER 113 HN SER 113 4.994 11.641 0.736 889 HA SER 113 HA SER 113 6.912 12.653 1.335 890 HB2 SER 113 HB2 SER 113 6.324 13.969 -1.259 891 HB3 SER 113 HB1 SER 113 7.764 14.399 -0.329 892 HG SER 113 HG SER 113 8.497 12.763 -1.552 893 H LEU 114 HN LEU 114 4.193 13.742 1.876 894 HA LEU 114 HA LEU 114 5.154 16.048 3.328 895 HB2 LEU 114 HB2 LEU 114 3.721 17.577 2.401 896 HB3 LEU 114 HB1 LEU 114 4.108 16.558 1.041 897 HG LEU 114 HG LEU 114 1.826 17.093 0.847 898 HD11 LEU 114 HD11 LEU 114 0.706 14.961 0.927 899 HD12 LEU 114 HD12 LEU 114 1.973 14.319 1.972 900 HD13 LEU 114 HD13 LEU 114 2.353 14.792 0.316 901 HD21 LEU 114 HD21 LEU 114 1.366 17.847 3.095 902 HD22 LEU 114 HD22 LEU 114 1.431 16.183 3.681 903 HD23 LEU 114 HD23 LEU 114 0.154 16.678 2.568 904 H GLN 115 HN GLN 115 4.028 13.335 3.253 905 HA GLN 115 HA GLN 115 2.084 12.174 4.082 906 HB2 GLN 115 HB2 GLN 115 4.123 12.474 6.268 907 HB3 GLN 115 HB1 GLN 115 3.069 11.111 5.964 908 HG2 GLN 115 HG2 GLN 115 5.251 12.042 4.142 909 HG3 GLN 115 HG1 GLN 115 5.376 10.693 5.268 910 HE21 GLN 115 HE21 GLN 115 4.217 8.779 4.815 911 HE22 GLN 115 HE22 GLN 115 3.612 8.444 3.231 912 H LYS 116 HN LYS 116 0.238 13.348 4.402 913 HA LYS 116 HA LYS 116 -0.038 14.624 7.040 914 HB2 LYS 116 HB2 LYS 116 -2.019 15.771 6.150 915 HB3 LYS 116 HB1 LYS 116 -0.589 16.125 5.196 916 HG2 LYS 116 HG2 LYS 116 -1.341 14.545 3.479 917 HG3 LYS 116 HG1 LYS 116 -2.777 14.192 4.447 918 HD2 LYS 116 HD2 LYS 116 -3.422 16.570 4.313 919 HD3 LYS 116 HD1 LYS 116 -2.018 16.880 3.291 920 HE2 LYS 116 HE2 LYS 116 -4.228 14.943 2.614 921 HE3 LYS 116 HE1 LYS 116 -4.170 16.614 2.055 922 HZ1 LYS 116 HZ1 LYS 116 -2.112 14.553 1.480 923 HZ2 LYS 116 HZ2 LYS 116 -2.119 16.144 0.897 924 HZ3 LYS 116 HZ3 LYS 116 -3.321 15.052 0.402 925 H ALA 117 HN ALA 117 -1.938 14.160 8.296 926 HA ALA 117 HA ALA 117 -3.335 11.690 7.650 927 HB1 ALA 117 HB1 ALA 117 -1.650 11.995 10.143 928 HB2 ALA 117 HB2 ALA 117 -1.295 10.920 8.791 929 HB3 ALA 117 HB3 ALA 117 -2.722 10.640 9.791 930 H VAL 118 HN VAL 118 -3.641 14.521 8.024 931 HA VAL 118 HA VAL 118 -4.640 16.160 9.225 932 HB VAL 118 HB VAL 118 -6.149 15.387 7.494 933 HG11 VAL 118 HG11 VAL 118 -7.503 13.771 9.641 934 HG12 VAL 118 HG12 VAL 118 -6.588 13.125 8.279 935 HG13 VAL 118 HG13 VAL 118 -8.086 14.015 7.994 936 HG21 VAL 118 HG21 VAL 118 -6.625 17.313 8.859 937 HG22 VAL 118 HG22 VAL 118 -7.501 16.302 10.007 938 HG23 VAL 118 HG23 VAL 118 -8.111 16.502 8.362 939 H GLN 119 HN GLN 119 -3.877 16.270 11.233 940 HA GLN 119 HA GLN 119 -5.582 15.100 13.325 941 HB2 GLN 119 HB2 GLN 119 -3.703 15.480 14.870 942 HB3 GLN 119 HB1 GLN 119 -3.299 14.376 13.564 943 HG2 GLN 119 HG2 GLN 119 -2.004 16.025 12.460 944 HG3 GLN 119 HG1 GLN 119 -2.588 17.295 13.538 945 HE21 GLN 119 HE21 GLN 119 -1.939 17.274 15.708 946 HE22 GLN 119 HE22 GLN 119 -0.444 16.513 16.180 947 H GLN 120 HN GLN 120 -6.260 17.361 11.766 948 HA GLN 120 HA GLN 120 -6.360 19.420 13.864 949 HB2 GLN 120 HB2 GLN 120 -5.974 19.815 10.893 950 HB3 GLN 120 HB1 GLN 120 -6.445 21.107 11.992 951 HG2 GLN 120 HG2 GLN 120 -4.396 20.829 13.241 952 HG3 GLN 120 HG1 GLN 120 -3.927 19.480 12.206 953 HE21 GLN 120 HE21 GLN 120 -2.635 22.067 12.749 954 HE22 GLN 120 HE22 GLN 120 -2.400 22.802 11.199 955 H SER 121 HN SER 121 -8.345 20.433 14.099 956 HA SER 121 HA SER 121 -10.596 20.439 14.277 957 HB2 SER 121 HB2 SER 121 -10.485 21.163 11.883 958 HB3 SER 121 HB1 SER 121 -10.623 19.470 11.404 959 HG SER 121 HG SER 121 -12.675 19.422 12.065 960 H MET 122 HN MET 122 -10.449 18.796 15.809 961 HA MET 122 HA MET 122 -10.793 16.774 16.773 962 HB2 MET 122 HB2 MET 122 -12.145 16.069 14.156 963 HB3 MET 122 HB1 MET 122 -12.184 15.079 15.608 964 HG2 MET 122 HG2 MET 122 -13.328 17.848 15.319 965 HG3 MET 122 HG1 MET 122 -14.239 16.340 15.334 966 HE1 MET 122 HE1 MET 122 -15.219 17.963 18.754 967 HE2 MET 122 HE2 MET 122 -15.831 17.182 17.297 968 HE3 MET 122 HE3 MET 122 -15.000 18.732 17.185 969 H LEU 123 HN LEU 123 -10.591 14.175 15.785 970 HA LEU 123 HA LEU 123 -9.088 12.583 15.217 971 HB2 LEU 123 HB2 LEU 123 -8.335 14.698 13.219 972 HB3 LEU 123 HB1 LEU 123 -7.485 13.169 13.297 973 HG LEU 123 HG LEU 123 -9.085 13.005 11.550 974 HD11 LEU 123 HD11 LEU 123 -10.504 11.162 12.306 975 HD12 LEU 123 HD12 LEU 123 -10.125 11.568 13.980 976 HD13 LEU 123 HD13 LEU 123 -8.850 11.011 12.897 977 HD21 LEU 123 HD21 LEU 123 -10.550 14.840 12.166 978 HD22 LEU 123 HD22 LEU 123 -11.173 13.906 13.525 979 HD23 LEU 123 HD23 LEU 123 -11.484 13.371 11.876 980 H SER 124 HN SER 124 -7.905 12.289 17.009 981 HA SER 124 HA SER 124 -5.814 14.066 17.821 982 HB2 SER 124 HB2 SER 124 -6.373 11.222 18.699 983 HB3 SER 124 HB1 SER 124 -5.361 12.396 19.542 984 HG SER 124 HG SER 124 -7.122 12.961 20.518 985 H1 LYS 161 HN LYS 161 -15.880 -8.344 1.102 986 HA LYS 161 HA LYS 161 -15.167 -5.738 -0.060 987 HB2 LYS 161 HB2 LYS 161 -17.845 -6.921 0.623 988 HB3 LYS 161 HB1 LYS 161 -17.629 -5.187 0.418 989 HG2 LYS 161 HG2 LYS 161 -18.441 -5.996 -1.618 990 HG3 LYS 161 HG1 LYS 161 -16.731 -5.659 -1.862 991 HD2 LYS 161 HD2 LYS 161 -16.611 -7.720 -2.740 992 HD3 LYS 161 HD1 LYS 161 -16.708 -8.294 -1.080 993 HE2 LYS 161 HE2 LYS 161 -19.114 -7.816 -2.814 994 HE3 LYS 161 HE1 LYS 161 -18.298 -9.373 -2.703 995 HZ1 LYS 161 HZ1 LYS 161 -19.813 -7.933 -0.612 996 HZ2 LYS 161 HZ2 LYS 161 -18.703 -9.151 -0.211 997 HZ3 LYS 161 HZ3 LYS 161 -20.036 -9.508 -1.195 998 H GLU 162 HN GLU 162 -13.689 -5.598 1.863 999 HA GLU 162 HA GLU 162 -14.798 -3.632 3.540 1000 HB2 GLU 162 HB2 GLU 162 -14.480 -4.722 5.742 1001 HB3 GLU 162 HB1 GLU 162 -15.779 -5.420 4.790 1002 HG2 GLU 162 HG2 GLU 162 -14.357 -7.291 4.177 1003 HG3 GLU 162 HG1 GLU 162 -13.022 -6.578 5.078 1004 H ASN 163 HN ASN 163 -13.151 -3.313 5.510 1005 HA ASN 163 HA ASN 163 -10.731 -2.468 4.446 1006 HB2 ASN 163 HB2 ASN 163 -9.973 -2.177 6.783 1007 HB3 ASN 163 HB1 ASN 163 -11.609 -1.572 6.551 1008 HD21 ASN 163 HD21 ASN 163 -13.327 -2.616 7.524 1009 HD22 ASN 163 HD22 ASN 163 -13.108 -3.820 8.764 1010 H LEU 164 HN LEU 164 -8.911 -3.464 3.905 1011 HA LEU 164 HA LEU 164 -8.598 -6.251 4.798 1012 HB2 LEU 164 HB2 LEU 164 -8.209 -4.928 2.195 1013 HB3 LEU 164 HB1 LEU 164 -6.988 -6.107 2.636 1014 HG LEU 164 HG LEU 164 -9.932 -6.708 2.644 1015 HD11 LEU 164 HD11 LEU 164 -9.585 -7.812 0.494 1016 HD12 LEU 164 HD12 LEU 164 -7.898 -7.296 0.487 1017 HD13 LEU 164 HD13 LEU 164 -9.188 -6.097 0.375 1018 HD21 LEU 164 HD21 LEU 164 -9.138 -9.038 2.604 1019 HD22 LEU 164 HD22 LEU 164 -8.599 -8.166 4.040 1020 HD23 LEU 164 HD23 LEU 164 -7.477 -8.450 2.709 1021 H GLU 165 HN GLU 165 -6.657 -7.008 5.459 1022 HA GLU 165 HA GLU 165 -4.291 -5.342 5.165 1023 HB2 GLU 165 HB2 GLU 165 -5.411 -6.198 7.791 1024 HB3 GLU 165 HB1 GLU 165 -3.663 -6.243 7.574 1025 HG2 GLU 165 HG2 GLU 165 -3.856 -3.835 6.798 1026 HG3 GLU 165 HG1 GLU 165 -5.497 -3.876 7.451 1027 H SER 166 HN SER 166 -2.328 -6.522 5.343 1028 HA SER 166 HA SER 166 -2.430 -9.392 5.568 1029 HB2 SER 166 HB2 SER 166 -1.614 -8.192 2.911 1030 HB3 SER 166 HB1 SER 166 -1.693 -9.906 3.318 1031 HG SER 166 HG SER 166 -4.066 -9.047 3.841 1032 H MET 167 HN MET 167 -0.786 -9.186 7.165 1033 HA MET 167 HA MET 167 1.794 -8.317 6.146 1034 HB2 MET 167 HB2 MET 167 2.793 -9.195 8.204 1035 HB3 MET 167 HB1 MET 167 1.491 -8.048 8.561 1036 HG2 MET 167 HG2 MET 167 -0.026 -9.959 8.985 1037 HG3 MET 167 HG1 MET 167 1.329 -11.052 8.721 1038 HE1 MET 167 HE1 MET 167 1.322 -7.551 10.520 1039 HE2 MET 167 HE2 MET 167 1.069 -8.031 12.198 1040 HE3 MET 167 HE3 MET 167 -0.209 -8.277 11.006 1041 H VAL 168 HN VAL 168 3.287 -9.627 5.299 1042 HA VAL 168 HA VAL 168 2.626 -12.479 5.141 1043 HB VAL 168 HB VAL 168 3.218 -12.206 2.569 1044 HG11 VAL 168 HG11 VAL 168 0.502 -11.576 3.726 1045 HG12 VAL 168 HG12 VAL 168 1.158 -13.186 3.427 1046 HG13 VAL 168 HG13 VAL 168 0.815 -12.105 2.075 1047 HG21 VAL 168 HG21 VAL 168 3.627 -9.811 2.658 1048 HG22 VAL 168 HG22 VAL 168 1.999 -9.538 3.278 1049 HG23 VAL 168 HG23 VAL 168 2.228 -10.155 1.641 Start of MODEL 17 1 H1 MET 1 HT1 MET 1 -2.374 15.205 12.572 2 H2 MET 1 HT2 MET 1 -3.154 16.425 11.693 3 H3 MET 1 HT3 MET 1 -1.481 16.507 11.949 4 HA MET 1 HA MET 1 -1.243 14.408 10.676 5 HB2 MET 1 HB2 MET 1 -3.597 13.684 10.992 6 HB3 MET 1 HB1 MET 1 -4.129 15.009 9.971 7 HG2 MET 1 HG2 MET 1 -2.961 14.040 8.070 8 HG3 MET 1 HG1 MET 1 -2.368 12.732 9.093 9 HE1 MET 1 HE1 MET 1 -3.862 12.306 6.352 10 HE2 MET 1 HE2 MET 1 -5.011 11.022 6.723 11 HE3 MET 1 HE3 MET 1 -3.360 10.930 7.337 12 H SER 2 HN SER 2 -0.412 14.688 8.643 13 HA SER 2 HA SER 2 0.339 15.737 6.790 14 HB2 SER 2 HB2 SER 2 -2.122 15.952 6.292 15 HB3 SER 2 HB1 SER 2 -2.074 17.553 7.021 16 HG SER 2 HG SER 2 -1.359 18.283 5.197 17 H TYR 3 HN TYR 3 0.596 18.249 5.960 18 HA TYR 3 HA TYR 3 1.482 19.880 8.232 19 HB2 TYR 3 HB2 TYR 3 3.094 18.835 5.983 20 HB3 TYR 3 HB1 TYR 3 3.312 20.541 6.344 21 HD1 TYR 3 HD1 TYR 3 4.012 21.196 8.701 22 HD2 TYR 3 HD2 TYR 3 4.106 17.184 7.289 23 HE1 TYR 3 HE1 TYR 3 5.530 20.586 10.543 24 HE2 TYR 3 HE2 TYR 3 5.618 16.566 9.121 25 HH TYR 3 HH TYR 3 7.141 17.524 10.669 26 H ILE 4 HN ILE 4 1.187 22.066 7.964 27 HA ILE 4 HA ILE 4 0.043 23.909 7.313 28 HB ILE 4 HB ILE 4 1.118 23.136 4.604 29 HG12 ILE 4 HG12 ILE 4 2.856 23.217 6.338 30 HG13 ILE 4 HG11 ILE 4 3.034 24.535 5.194 31 HG21 ILE 4 HG21 ILE 4 1.002 25.530 4.104 32 HG22 ILE 4 HG22 ILE 4 0.270 25.826 5.682 33 HG23 ILE 4 HG23 ILE 4 -0.595 24.875 4.474 34 HD11 ILE 4 HD11 ILE 4 3.437 25.281 7.460 35 HD12 ILE 4 HD12 ILE 4 1.832 24.731 7.942 36 HD13 ILE 4 HD13 ILE 4 2.002 26.063 6.796 37 HA PRO 5 HA PRO 5 -3.775 21.616 6.154 38 HB2 PRO 5 HB2 PRO 5 -4.851 23.933 7.676 39 HB3 PRO 5 HB1 PRO 5 -5.250 22.217 7.810 40 HG2 PRO 5 HG2 PRO 5 -3.746 23.414 9.655 41 HG3 PRO 5 HG1 PRO 5 -3.396 21.757 9.132 42 HD2 PRO 5 HD2 PRO 5 -2.009 24.305 8.415 43 HD3 PRO 5 HD1 PRO 5 -1.330 22.690 8.707 44 H GLY 6 HN GLY 6 -4.133 21.996 4.046 45 HA2 GLY 6 HA2 GLY 6 -5.739 23.483 2.753 46 HA3 GLY 6 HA1 GLY 6 -4.617 24.773 3.188 47 H GLN 7 HN GLN 7 -2.282 22.919 2.888 48 HA GLN 7 HA GLN 7 -2.250 22.801 -0.048 49 HB2 GLN 7 HB2 GLN 7 -0.062 23.638 1.851 50 HB3 GLN 7 HB1 GLN 7 0.177 23.356 0.138 51 HG2 GLN 7 HG2 GLN 7 -1.524 25.125 -0.315 52 HG3 GLN 7 HG1 GLN 7 -1.539 25.467 1.416 53 HE21 GLN 7 HE21 GLN 7 0.245 25.692 -1.540 54 HE22 GLN 7 HE22 GLN 7 1.493 26.747 -0.951 55 HA PRO 8 HA PRO 8 -1.000 18.604 1.097 56 HB2 PRO 8 HB2 PRO 8 -2.400 17.325 -0.769 57 HB3 PRO 8 HB1 PRO 8 -3.204 18.044 0.632 58 HG2 PRO 8 HG2 PRO 8 -3.095 18.995 -2.184 59 HG3 PRO 8 HG1 PRO 8 -4.396 19.160 -0.992 60 HD2 PRO 8 HD2 PRO 8 -2.445 21.100 -1.683 61 HD3 PRO 8 HD1 PRO 8 -3.612 21.184 -0.344 62 H VAL 9 HN VAL 9 -0.491 16.718 -0.685 63 HA VAL 9 HA VAL 9 1.268 17.856 -2.760 64 HB VAL 9 HB VAL 9 2.439 16.905 -0.624 65 HG11 VAL 9 HG11 VAL 9 1.765 14.332 -2.037 66 HG12 VAL 9 HG12 VAL 9 1.155 14.851 -0.464 67 HG13 VAL 9 HG13 VAL 9 2.872 14.507 -0.670 68 HG21 VAL 9 HG21 VAL 9 4.282 15.975 -1.994 69 HG22 VAL 9 HG22 VAL 9 3.692 17.535 -2.561 70 HG23 VAL 9 HG23 VAL 9 3.225 16.059 -3.407 71 H THR 10 HN THR 10 2.039 15.673 -4.070 72 HA THR 10 HA THR 10 -0.512 14.592 -4.974 73 HB THR 10 HB THR 10 0.536 14.466 -7.220 74 HG1 THR 10 HG1 THR 10 2.503 15.858 -7.388 75 HG21 THR 10 HG21 THR 10 -0.852 16.356 -6.698 76 HG22 THR 10 HG22 THR 10 0.566 16.956 -7.562 77 HG23 THR 10 HG23 THR 10 0.460 17.135 -5.801 78 H ALA 11 HN ALA 11 2.631 13.595 -5.953 79 HA ALA 11 HA ALA 11 2.783 11.202 -4.441 80 HB1 ALA 11 HB1 ALA 11 0.959 10.378 -5.709 81 HB2 ALA 11 HB2 ALA 11 2.421 9.649 -6.386 82 HB3 ALA 11 HB3 ALA 11 1.639 10.994 -7.216 83 H VAL 12 HN VAL 12 4.601 10.279 -4.580 84 HA VAL 12 HA VAL 12 6.470 10.967 -6.752 85 HB VAL 12 HB VAL 12 7.266 9.997 -4.068 86 HG11 VAL 12 HG11 VAL 12 8.955 9.876 -5.759 87 HG12 VAL 12 HG12 VAL 12 9.396 11.114 -4.583 88 HG13 VAL 12 HG13 VAL 12 8.736 11.584 -6.149 89 HG21 VAL 12 HG21 VAL 12 6.054 11.911 -3.444 90 HG22 VAL 12 HG22 VAL 12 6.714 12.851 -4.784 91 HG23 VAL 12 HG23 VAL 12 7.754 12.393 -3.433 92 H VAL 13 HN VAL 13 7.466 9.230 -7.681 93 HA VAL 13 HA VAL 13 6.507 6.579 -6.864 94 HB VAL 13 HB VAL 13 7.560 7.356 -9.588 95 HG11 VAL 13 HG11 VAL 13 6.597 5.209 -10.293 96 HG12 VAL 13 HG12 VAL 13 6.144 4.872 -8.622 97 HG13 VAL 13 HG13 VAL 13 7.844 4.998 -9.066 98 HG21 VAL 13 HG21 VAL 13 5.463 8.520 -9.102 99 HG22 VAL 13 HG22 VAL 13 4.703 6.985 -8.684 100 HG23 VAL 13 HG23 VAL 13 5.235 7.283 -10.339 101 H GLN 14 HN GLN 14 7.928 5.150 -6.121 102 HA GLN 14 HA GLN 14 10.749 5.434 -6.776 103 HB2 GLN 14 HB2 GLN 14 9.595 5.235 -3.993 104 HB3 GLN 14 HB1 GLN 14 11.250 4.778 -4.355 105 HG2 GLN 14 HG2 GLN 14 11.730 6.888 -3.834 106 HG3 GLN 14 HG1 GLN 14 11.133 7.256 -5.449 107 HE21 GLN 14 HE21 GLN 14 8.371 6.591 -4.667 108 HE22 GLN 14 HE22 GLN 14 7.817 7.954 -3.744 109 H ARG 15 HN ARG 15 11.939 3.471 -6.062 110 HA ARG 15 HA ARG 15 10.352 1.075 -6.436 111 HB2 ARG 15 HB2 ARG 15 13.129 1.786 -7.368 112 HB3 ARG 15 HB1 ARG 15 12.338 0.248 -7.607 113 HG2 ARG 15 HG2 ARG 15 10.496 1.977 -8.627 114 HG3 ARG 15 HG1 ARG 15 12.027 2.739 -9.056 115 HD2 ARG 15 HD2 ARG 15 11.356 -0.131 -9.556 116 HD3 ARG 15 HD1 ARG 15 11.232 1.149 -10.769 117 HE ARG 15 HE ARG 15 13.830 1.195 -9.737 118 HH11 ARG 15 HH11 ARG 15 11.801 -0.874 -11.696 119 HH12 ARG 15 HH12 ARG 15 13.135 -1.668 -12.479 120 HH21 ARG 15 HH21 ARG 15 15.583 0.167 -10.757 121 HH22 ARG 15 HH22 ARG 15 15.294 -1.078 -11.933 122 H VAL 16 HN VAL 16 10.500 -0.289 -4.766 123 HA VAL 16 HA VAL 16 12.912 -0.207 -3.150 124 HB VAL 16 HB VAL 16 11.475 1.341 -2.013 125 HG11 VAL 16 HG11 VAL 16 9.432 -0.856 -1.949 126 HG12 VAL 16 HG12 VAL 16 9.327 0.662 -2.851 127 HG13 VAL 16 HG13 VAL 16 9.302 0.673 -1.083 128 HG21 VAL 16 HG21 VAL 16 11.582 -1.280 -0.555 129 HG22 VAL 16 HG22 VAL 16 11.300 0.292 0.203 130 HG23 VAL 16 HG23 VAL 16 12.839 -0.047 -0.597 131 H GLU 17 HN GLU 17 13.538 -2.155 -2.567 132 HA GLU 17 HA GLU 17 11.799 -4.398 -3.256 133 HB2 GLU 17 HB2 GLU 17 14.818 -4.203 -3.195 134 HB3 GLU 17 HB1 GLU 17 13.911 -5.656 -3.591 135 HG2 GLU 17 HG2 GLU 17 12.924 -4.529 -5.514 136 HG3 GLU 17 HG1 GLU 17 13.821 -3.064 -5.119 137 H ILE 18 HN ILE 18 10.903 -5.232 -1.537 138 HA ILE 18 HA ILE 18 12.096 -5.051 1.074 139 HB ILE 18 HB ILE 18 9.352 -6.121 0.413 140 HG12 ILE 18 HG12 ILE 18 9.284 -3.999 -0.594 141 HG13 ILE 18 HG11 ILE 18 8.554 -3.783 0.995 142 HG21 ILE 18 HG21 ILE 18 10.154 -6.556 2.648 143 HG22 ILE 18 HG22 ILE 18 8.835 -5.387 2.685 144 HG23 ILE 18 HG23 ILE 18 10.500 -4.844 2.880 145 HD11 ILE 18 HD11 ILE 18 10.603 -2.825 1.823 146 HD12 ILE 18 HD12 ILE 18 10.050 -1.957 0.393 147 HD13 ILE 18 HD13 ILE 18 11.379 -3.116 0.267 148 H HIS 19 HN HIS 19 13.133 -6.652 1.899 149 HA HIS 19 HA HIS 19 12.153 -9.353 1.599 150 HB2 HIS 19 HB2 HIS 19 14.372 -10.155 1.108 151 HB3 HIS 19 HB1 HIS 19 13.867 -9.001 -0.096 152 HD1 HIS 19 HD1 HIS 19 16.457 -9.629 2.503 153 HD2 HIS 19 HD2 HIS 19 15.336 -6.583 -0.102 154 HE1 HIS 19 HE1 HIS 19 18.374 -8.005 2.483 155 HE2 HIS 19 HE2 HIS 19 17.755 -6.282 0.754 156 H LYS 20 HN LYS 20 11.818 -10.118 3.668 157 HA LYS 20 HA LYS 20 13.511 -9.123 5.809 158 HB2 LYS 20 HB2 LYS 20 11.111 -9.121 6.224 159 HB3 LYS 20 HB1 LYS 20 11.070 -10.861 5.960 160 HG2 LYS 20 HG2 LYS 20 11.056 -10.444 8.300 161 HG3 LYS 20 HG1 LYS 20 12.616 -11.132 7.854 162 HD2 LYS 20 HD2 LYS 20 13.570 -8.850 7.809 163 HD3 LYS 20 HD1 LYS 20 12.021 -8.220 8.365 164 HE2 LYS 20 HE2 LYS 20 13.461 -8.392 10.257 165 HE3 LYS 20 HE1 LYS 20 12.252 -9.667 10.391 166 HZ1 LYS 20 HZ1 LYS 20 14.623 -10.305 10.877 167 HZ2 LYS 20 HZ2 LYS 20 14.934 -10.135 9.216 168 HZ3 LYS 20 HZ3 LYS 20 13.811 -11.285 9.760 169 H LEU 21 HN LEU 21 12.110 -12.322 5.397 170 HA LEU 21 HA LEU 21 14.757 -13.499 5.277 171 HB2 LEU 21 HB2 LEU 21 14.550 -13.283 7.652 172 HB3 LEU 21 HB1 LEU 21 12.911 -13.913 7.624 173 HG LEU 21 HG LEU 21 13.708 -16.132 7.095 174 HD11 LEU 21 HD11 LEU 21 16.452 -14.888 6.985 175 HD12 LEU 21 HD12 LEU 21 15.564 -15.631 5.652 176 HD13 LEU 21 HD13 LEU 21 16.130 -16.622 6.995 177 HD21 LEU 21 HD21 LEU 21 15.340 -14.927 9.324 178 HD22 LEU 21 HD22 LEU 21 14.950 -16.635 9.123 179 HD23 LEU 21 HD23 LEU 21 13.667 -15.468 9.450 180 H ARG 22 HN ARG 22 14.546 -14.850 3.632 181 HA ARG 22 HA ARG 22 12.225 -16.462 3.230 182 HB2 ARG 22 HB2 ARG 22 13.874 -15.690 1.425 183 HB3 ARG 22 HB1 ARG 22 14.999 -16.863 2.089 184 HG2 ARG 22 HG2 ARG 22 12.290 -17.663 1.094 185 HG3 ARG 22 HG1 ARG 22 13.689 -17.534 0.026 186 HD2 ARG 22 HD2 ARG 22 14.887 -19.144 1.392 187 HD3 ARG 22 HD1 ARG 22 13.513 -19.234 2.493 188 HE ARG 22 HE ARG 22 12.357 -19.947 0.214 189 HH11 ARG 22 HH11 ARG 22 15.470 -20.919 1.509 190 HH12 ARG 22 HH12 ARG 22 15.375 -22.532 0.855 191 HH21 ARG 22 HH21 ARG 22 12.234 -22.069 -0.634 192 HH22 ARG 22 HH22 ARG 22 13.530 -23.189 -0.337 193 H GLN 23 HN GLN 23 11.759 -18.026 4.586 194 HA GLN 23 HA GLN 23 13.937 -19.667 5.628 195 HB2 GLN 23 HB2 GLN 23 11.866 -20.020 7.422 196 HB3 GLN 23 HB1 GLN 23 13.322 -19.068 7.678 197 HG2 GLN 23 HG2 GLN 23 12.177 -17.102 6.777 198 HG3 GLN 23 HG1 GLN 23 10.710 -18.065 6.606 199 HE21 GLN 23 HE21 GLN 23 11.329 -15.683 8.165 200 HE22 GLN 23 HE22 GLN 23 10.910 -16.058 9.815 201 H GLY 24 HN GLY 24 13.316 -20.505 3.458 202 HA2 GLY 24 HA2 GLY 24 12.926 -22.588 2.556 203 HA3 GLY 24 HA1 GLY 24 12.185 -23.046 4.086 204 H GLU 25 HN GLU 25 10.089 -23.010 4.327 205 HA GLU 25 HA GLU 25 8.451 -22.649 1.983 206 HB2 GLU 25 HB2 GLU 25 7.926 -23.507 4.817 207 HB3 GLU 25 HB1 GLU 25 6.634 -23.221 3.662 208 HG2 GLU 25 HG2 GLU 25 7.758 -24.907 2.164 209 HG3 GLU 25 HG1 GLU 25 8.816 -25.280 3.525 210 H ASN 26 HN ASN 26 9.798 -20.598 4.067 211 HA ASN 26 HA ASN 26 7.492 -18.834 4.130 212 HB2 ASN 26 HB2 ASN 26 9.873 -18.946 5.933 213 HB3 ASN 26 HB1 ASN 26 8.697 -17.669 5.941 214 HD21 ASN 26 HD21 ASN 26 9.283 -20.941 6.461 215 HD22 ASN 26 HD22 ASN 26 7.961 -21.263 7.569 216 H LEU 27 HN LEU 27 7.626 -17.220 3.139 217 HA LEU 27 HA LEU 27 10.146 -15.840 2.576 218 HB2 LEU 27 HB2 LEU 27 7.666 -16.208 0.926 219 HB3 LEU 27 HB1 LEU 27 8.512 -14.686 0.824 220 HG LEU 27 HG LEU 27 9.259 -16.104 -0.966 221 HD11 LEU 27 HD11 LEU 27 11.370 -16.006 1.180 222 HD12 LEU 27 HD12 LEU 27 10.906 -14.645 0.156 223 HD13 LEU 27 HD13 LEU 27 11.636 -16.083 -0.562 224 HD21 LEU 27 HD21 LEU 27 10.381 -18.254 -0.520 225 HD22 LEU 27 HD22 LEU 27 8.688 -18.271 -0.019 226 HD23 LEU 27 HD23 LEU 27 9.962 -18.099 1.193 227 H ILE 28 HN ILE 28 10.280 -14.288 4.006 228 HA ILE 28 HA ILE 28 7.819 -13.362 5.285 229 HB ILE 28 HB ILE 28 10.681 -13.317 6.177 230 HG12 ILE 28 HG12 ILE 28 9.861 -15.572 6.059 231 HG13 ILE 28 HG11 ILE 28 10.004 -15.094 7.744 232 HG21 ILE 28 HG21 ILE 28 8.205 -12.404 7.550 233 HG22 ILE 28 HG22 ILE 28 9.709 -11.521 7.230 234 HG23 ILE 28 HG23 ILE 28 9.680 -12.825 8.423 235 HD11 ILE 28 HD11 ILE 28 7.421 -15.136 6.199 236 HD12 ILE 28 HD12 ILE 28 7.623 -14.884 7.936 237 HD13 ILE 28 HD13 ILE 28 8.009 -16.457 7.218 238 H LEU 29 HN LEU 29 7.138 -11.400 4.935 239 HA LEU 29 HA LEU 29 9.093 -9.236 4.490 240 HB2 LEU 29 HB2 LEU 29 6.140 -9.364 3.859 241 HB3 LEU 29 HB1 LEU 29 7.120 -7.926 3.689 242 HG LEU 29 HG LEU 29 6.849 -8.794 1.539 243 HD11 LEU 29 HD11 LEU 29 9.546 -9.689 2.514 244 HD12 LEU 29 HD12 LEU 29 9.107 -8.051 2.028 245 HD13 LEU 29 HD13 LEU 29 9.112 -9.355 0.840 246 HD21 LEU 29 HD21 LEU 29 6.071 -11.022 2.079 247 HD22 LEU 29 HD22 LEU 29 7.695 -11.489 2.584 248 HD23 LEU 29 HD23 LEU 29 7.375 -11.096 0.894 249 H GLY 30 HN GLY 30 6.002 -10.036 6.048 250 HA2 GLY 30 HA2 GLY 30 5.601 -9.879 8.358 251 HA3 GLY 30 HA1 GLY 30 7.009 -8.843 8.518 252 H PHE 31 HN PHE 31 6.316 -6.929 6.535 253 HA PHE 31 HA PHE 31 4.599 -5.291 8.110 254 HB2 PHE 31 HB2 PHE 31 5.007 -3.565 6.558 255 HB3 PHE 31 HB1 PHE 31 6.506 -4.475 6.665 256 HD1 PHE 31 HD2 PHE 31 7.137 -6.005 4.840 257 HD2 PHE 31 HD1 PHE 31 3.835 -3.353 4.528 258 HE1 PHE 31 HE2 PHE 31 7.181 -6.267 2.423 259 HE2 PHE 31 HE1 PHE 31 3.851 -3.617 2.098 260 HZ PHE 31 HZ PHE 31 5.482 -5.022 1.015 261 H SER 32 HN SER 32 2.673 -4.085 6.919 262 HA SER 32 HA SER 32 1.074 -6.170 5.561 263 HB2 SER 32 HB2 SER 32 -0.211 -4.426 7.625 264 HB3 SER 32 HB1 SER 32 -0.674 -6.037 7.076 265 HG SER 32 HG SER 32 1.565 -6.538 8.094 266 H ILE 33 HN ILE 33 -0.633 -5.363 4.186 267 HA ILE 33 HA ILE 33 -0.546 -2.455 3.875 268 HB ILE 33 HB ILE 33 -0.090 -2.389 1.670 269 HG12 ILE 33 HG12 ILE 33 -2.122 -3.932 1.188 270 HG13 ILE 33 HG11 ILE 33 -0.849 -3.805 -0.019 271 HG21 ILE 33 HG21 ILE 33 1.108 -5.081 2.271 272 HG22 ILE 33 HG22 ILE 33 1.775 -3.534 2.786 273 HG23 ILE 33 HG23 ILE 33 1.660 -3.915 1.067 274 HD11 ILE 33 HD11 ILE 33 -1.579 -6.078 0.209 275 HD12 ILE 33 HD12 ILE 33 -1.244 -6.054 1.946 276 HD13 ILE 33 HD13 ILE 33 0.081 -5.924 0.785 277 H GLY 34 HN GLY 34 -2.390 -1.588 2.792 278 HA2 GLY 34 HA2 GLY 34 -4.742 -3.284 3.205 279 HA3 GLY 34 HA1 GLY 34 -4.608 -1.780 4.117 280 H GLY 35 HN GLY 35 -6.092 -3.093 1.629 281 HA2 GLY 35 HA2 GLY 35 -7.602 -1.186 0.676 282 HA3 GLY 35 HA1 GLY 35 -6.081 -0.714 -0.094 283 H GLY 36 HN GLY 36 -8.241 -1.421 -1.732 284 HA2 GLY 36 HA2 GLY 36 -7.013 -2.760 -3.658 285 HA3 GLY 36 HA1 GLY 36 -7.536 -4.089 -2.640 286 H ILE 37 HN ILE 37 -9.093 -5.033 -3.333 287 HA ILE 37 HA ILE 37 -10.657 -5.552 -4.973 288 HB ILE 37 HB ILE 37 -12.822 -5.247 -3.697 289 HG12 ILE 37 HG12 ILE 37 -10.857 -3.772 -1.995 290 HG13 ILE 37 HG11 ILE 37 -12.545 -3.412 -2.306 291 HG21 ILE 37 HG21 ILE 37 -11.403 -7.247 -3.639 292 HG22 ILE 37 HG22 ILE 37 -12.121 -6.922 -2.060 293 HG23 ILE 37 HG23 ILE 37 -10.432 -6.507 -2.365 294 HD11 ILE 37 HD11 ILE 37 -13.206 -5.233 -0.830 295 HD12 ILE 37 HD12 ILE 37 -12.188 -4.048 -0.006 296 HD13 ILE 37 HD13 ILE 37 -11.503 -5.588 -0.528 297 H ASP 38 HN ASP 38 -11.934 -2.611 -3.729 298 HA ASP 38 HA ASP 38 -12.250 -1.068 -5.904 299 HB2 ASP 38 HB2 ASP 38 -13.326 -3.092 -6.986 300 HB3 ASP 38 HB1 ASP 38 -14.616 -2.961 -5.799 301 H GLN 39 HN GLN 39 -13.578 -2.590 -3.163 302 HA GLN 39 HA GLN 39 -15.776 -2.036 -2.342 303 HB2 GLN 39 HB2 GLN 39 -14.920 -0.791 -0.168 304 HB3 GLN 39 HB1 GLN 39 -14.722 -2.506 -0.458 305 HG2 GLN 39 HG2 GLN 39 -12.735 -1.184 0.398 306 HG3 GLN 39 HG1 GLN 39 -12.473 -2.287 -0.926 307 HE21 GLN 39 HE21 GLN 39 -11.345 -1.601 -2.486 308 HE22 GLN 39 HE22 GLN 39 -11.191 0.015 -3.006 309 H ASP 40 HN ASP 40 -14.363 0.802 -1.066 310 HA ASP 40 HA ASP 40 -16.480 2.362 -2.374 311 HB2 ASP 40 HB2 ASP 40 -17.032 1.283 0.021 312 HB3 ASP 40 HB1 ASP 40 -16.245 2.766 0.551 313 HA PRO 41 HA PRO 41 -13.340 5.523 -2.281 314 HB2 PRO 41 HB2 PRO 41 -14.710 7.379 -3.595 315 HB3 PRO 41 HB1 PRO 41 -14.229 5.883 -4.418 316 HG2 PRO 41 HG2 PRO 41 -16.858 6.546 -3.114 317 HG3 PRO 41 HG1 PRO 41 -16.567 5.940 -4.744 318 HD2 PRO 41 HD2 PRO 41 -17.237 4.295 -2.732 319 HD3 PRO 41 HD1 PRO 41 -16.123 3.789 -4.019 320 H SER 42 HN SER 42 -16.329 5.522 -0.705 321 HA SER 42 HA SER 42 -16.994 8.053 0.011 322 HB2 SER 42 HB2 SER 42 -18.267 6.036 0.624 323 HB3 SER 42 HB1 SER 42 -17.033 5.620 1.819 324 HG SER 42 HG SER 42 -18.958 6.748 2.615 325 H GLN 43 HN GLN 43 -14.481 6.092 1.496 326 HA GLN 43 HA GLN 43 -14.236 7.927 3.717 327 HB2 GLN 43 HB2 GLN 43 -12.971 6.184 4.685 328 HB3 GLN 43 HB1 GLN 43 -14.346 5.444 3.865 329 HG2 GLN 43 HG2 GLN 43 -12.753 5.114 1.910 330 HG3 GLN 43 HG1 GLN 43 -11.468 5.442 3.070 331 HE21 GLN 43 HE21 GLN 43 -14.019 3.305 2.140 332 HE22 GLN 43 HE22 GLN 43 -13.503 1.945 3.108 333 H ASN 44 HN ASN 44 -12.997 7.826 0.706 334 HA ASN 44 HA ASN 44 -10.391 8.019 0.505 335 HB2 ASN 44 HB2 ASN 44 -10.659 9.679 -1.200 336 HB3 ASN 44 HB1 ASN 44 -11.957 8.514 -1.293 337 HD21 ASN 44 HD21 ASN 44 -13.451 9.762 0.924 338 HD22 ASN 44 HD22 ASN 44 -14.123 11.212 0.273 339 HA PRO 45 HA PRO 45 -9.053 11.245 3.354 340 HB2 PRO 45 HB2 PRO 45 -6.555 10.294 3.620 341 HB3 PRO 45 HB1 PRO 45 -7.919 9.555 4.478 342 HG2 PRO 45 HG2 PRO 45 -6.543 8.662 1.969 343 HG3 PRO 45 HG1 PRO 45 -7.092 7.693 3.348 344 HD2 PRO 45 HD2 PRO 45 -8.489 7.944 0.996 345 HD3 PRO 45 HD1 PRO 45 -9.239 7.574 2.560 346 H PHE 46 HN PHE 46 -8.315 10.329 0.199 347 HA PHE 46 HA PHE 46 -7.032 12.837 -0.404 348 HB2 PHE 46 HB2 PHE 46 -5.147 11.397 0.355 349 HB3 PHE 46 HB1 PHE 46 -5.549 10.245 -0.919 350 HD1 PHE 46 HD1 PHE 46 -5.304 13.970 -0.926 351 HD2 PHE 46 HD2 PHE 46 -3.837 10.279 -2.458 352 HE1 PHE 46 HE1 PHE 46 -3.833 15.198 -2.467 353 HE2 PHE 46 HE2 PHE 46 -2.363 11.503 -4.003 354 HZ PHE 46 HZ PHE 46 -2.358 13.961 -4.007 355 H SER 47 HN SER 47 -7.579 9.565 -1.749 356 HA SER 47 HA SER 47 -8.677 8.799 -3.533 357 HB2 SER 47 HB2 SER 47 -10.362 10.604 -2.768 358 HB3 SER 47 HB1 SER 47 -9.717 11.539 -4.116 359 HG SER 47 HG SER 47 -10.978 10.411 -5.361 360 H GLU 48 HN GLU 48 -6.115 10.601 -3.540 361 HA GLU 48 HA GLU 48 -4.411 10.863 -5.018 362 HB2 GLU 48 HB2 GLU 48 -6.298 9.118 -6.389 363 HB3 GLU 48 HB1 GLU 48 -5.237 10.004 -7.486 364 HG2 GLU 48 HG2 GLU 48 -4.217 8.403 -5.162 365 HG3 GLU 48 HG1 GLU 48 -4.502 7.695 -6.749 366 H ASP 49 HN ASP 49 -7.472 11.437 -6.650 367 HA ASP 49 HA ASP 49 -7.546 14.041 -7.302 368 HB2 ASP 49 HB2 ASP 49 -5.335 14.073 -8.284 369 HB3 ASP 49 HB1 ASP 49 -5.666 12.606 -9.200 370 H LYS 50 HN LYS 50 -7.419 10.862 -8.609 371 HA LYS 50 HA LYS 50 -9.876 11.192 -10.094 372 HB2 LYS 50 HB2 LYS 50 -9.193 8.701 -10.739 373 HB3 LYS 50 HB1 LYS 50 -8.535 10.097 -11.576 374 HG2 LYS 50 HG2 LYS 50 -7.101 8.997 -9.200 375 HG3 LYS 50 HG1 LYS 50 -6.958 8.193 -10.765 376 HD2 LYS 50 HD2 LYS 50 -6.003 10.102 -11.769 377 HD3 LYS 50 HD1 LYS 50 -6.473 11.143 -10.425 378 HE2 LYS 50 HE2 LYS 50 -4.104 10.710 -10.323 379 HE3 LYS 50 HE1 LYS 50 -4.904 9.919 -8.969 380 HZ1 LYS 50 HZ1 LYS 50 -3.979 8.611 -11.476 381 HZ2 LYS 50 HZ2 LYS 50 -4.811 7.832 -10.217 382 HZ3 LYS 50 HZ3 LYS 50 -3.272 8.477 -9.939 383 H THR 51 HN THR 51 -9.012 8.100 -8.938 384 HA THR 51 HA THR 51 -10.862 8.338 -6.707 385 HB THR 51 HB THR 51 -12.067 7.343 -8.697 386 HG1 THR 51 HG1 THR 51 -12.570 5.323 -7.245 387 HG21 THR 51 HG21 THR 51 -10.179 6.037 -9.597 388 HG22 THR 51 HG22 THR 51 -11.594 5.028 -9.296 389 HG23 THR 51 HG23 THR 51 -10.234 4.996 -8.173 390 H ASP 52 HN ASP 52 -7.936 8.053 -7.517 391 HA ASP 52 HA ASP 52 -6.043 7.291 -6.607 392 HB2 ASP 52 HB2 ASP 52 -7.509 7.811 -4.612 393 HB3 ASP 52 HB1 ASP 52 -7.764 6.102 -4.478 394 H LYS 53 HN LYS 53 -4.900 5.332 -5.994 395 HA LYS 53 HA LYS 53 -5.589 3.215 -7.847 396 HB2 LYS 53 HB2 LYS 53 -3.203 3.560 -6.025 397 HB3 LYS 53 HB1 LYS 53 -3.408 2.211 -7.130 398 HG2 LYS 53 HG2 LYS 53 -2.011 3.639 -8.291 399 HG3 LYS 53 HG1 LYS 53 -3.597 4.015 -8.960 400 HD2 LYS 53 HD2 LYS 53 -3.767 5.987 -7.610 401 HD3 LYS 53 HD1 LYS 53 -2.294 5.566 -6.736 402 HE2 LYS 53 HE2 LYS 53 -2.417 6.154 -9.692 403 HE3 LYS 53 HE1 LYS 53 -1.968 7.330 -8.458 404 HZ1 LYS 53 HZ1 LYS 53 -0.507 4.868 -9.243 405 HZ2 LYS 53 HZ2 LYS 53 -0.164 5.718 -7.823 406 HZ3 LYS 53 HZ3 LYS 53 0.033 6.474 -9.322 407 H GLY 54 HN GLY 54 -5.782 3.813 -4.464 408 HA2 GLY 54 HA2 GLY 54 -7.105 2.687 -2.928 409 HA3 GLY 54 HA1 GLY 54 -7.462 1.492 -4.167 410 H ILE 55 HN ILE 55 -4.097 1.789 -3.748 411 HA ILE 55 HA ILE 55 -4.087 -0.320 -1.679 412 HB ILE 55 HB ILE 55 -2.240 -0.169 -4.081 413 HG12 ILE 55 HG12 ILE 55 -4.583 -1.127 -4.388 414 HG13 ILE 55 HG11 ILE 55 -3.235 -2.154 -4.867 415 HG21 ILE 55 HG21 ILE 55 -0.903 -0.912 -2.283 416 HG22 ILE 55 HG22 ILE 55 -1.376 -2.376 -3.156 417 HG23 ILE 55 HG23 ILE 55 -2.185 -1.945 -1.646 418 HD11 ILE 55 HD11 ILE 55 -4.833 -2.362 -2.321 419 HD12 ILE 55 HD12 ILE 55 -3.437 -3.365 -2.725 420 HD13 ILE 55 HD13 ILE 55 -4.903 -3.452 -3.706 421 H TYR 56 HN TYR 56 -3.202 0.460 0.119 422 HA TYR 56 HA TYR 56 -0.746 2.089 -0.109 423 HB2 TYR 56 HB2 TYR 56 -2.986 2.345 1.905 424 HB3 TYR 56 HB1 TYR 56 -1.394 3.051 2.118 425 HD1 TYR 56 HD1 TYR 56 -3.970 2.953 -0.571 426 HD2 TYR 56 HD2 TYR 56 -1.307 5.335 1.740 427 HE1 TYR 56 HE1 TYR 56 -4.709 4.955 -1.791 428 HE2 TYR 56 HE2 TYR 56 -2.049 7.345 0.530 429 HH TYR 56 HH TYR 56 -3.157 8.081 -1.320 430 H VAL 57 HN VAL 57 0.652 1.903 1.911 431 HA VAL 57 HA VAL 57 0.375 -0.692 3.144 432 HB VAL 57 HB VAL 57 2.557 0.262 2.077 433 HG11 VAL 57 HG11 VAL 57 3.897 1.247 4.094 434 HG12 VAL 57 HG12 VAL 57 2.301 1.872 4.517 435 HG13 VAL 57 HG13 VAL 57 3.024 2.263 2.955 436 HG21 VAL 57 HG21 VAL 57 2.589 -0.878 4.826 437 HG22 VAL 57 HG22 VAL 57 3.868 -1.007 3.619 438 HG23 VAL 57 HG23 VAL 57 2.315 -1.802 3.352 439 H THR 58 HN THR 58 -0.181 -0.818 5.243 440 HA THR 58 HA THR 58 -0.598 1.711 6.677 441 HB THR 58 HB THR 58 -2.763 0.714 6.053 442 HG1 THR 58 HG1 THR 58 -1.961 0.817 8.746 443 HG21 THR 58 HG21 THR 58 -1.779 -1.701 7.572 444 HG22 THR 58 HG22 THR 58 -2.154 -1.619 5.853 445 HG23 THR 58 HG23 THR 58 -3.445 -1.462 7.045 446 H ARG 59 HN ARG 59 1.185 -0.996 6.407 447 HA ARG 59 HA ARG 59 2.062 -0.817 9.155 448 HB2 ARG 59 HB2 ARG 59 0.523 -2.998 8.052 449 HB3 ARG 59 HB1 ARG 59 2.062 -3.532 8.721 450 HG2 ARG 59 HG2 ARG 59 0.548 -1.602 10.254 451 HG3 ARG 59 HG1 ARG 59 -0.149 -3.222 10.171 452 HD2 ARG 59 HD2 ARG 59 2.668 -2.553 11.049 453 HD3 ARG 59 HD1 ARG 59 1.332 -2.935 12.135 454 HE ARG 59 HE ARG 59 1.373 -5.084 10.532 455 HH11 ARG 59 HH11 ARG 59 3.915 -3.452 12.310 456 HH12 ARG 59 HH12 ARG 59 4.830 -4.902 12.571 457 HH21 ARG 59 HH21 ARG 59 2.580 -6.987 10.856 458 HH22 ARG 59 HH22 ARG 59 4.068 -6.933 11.738 459 H VAL 60 HN VAL 60 4.129 -0.972 9.334 460 HA VAL 60 HA VAL 60 5.601 -2.600 7.415 461 HB VAL 60 HB VAL 60 6.397 0.112 8.473 462 HG11 VAL 60 HG11 VAL 60 8.058 -2.095 7.330 463 HG12 VAL 60 HG12 VAL 60 8.278 -1.229 8.843 464 HG13 VAL 60 HG13 VAL 60 8.596 -0.415 7.311 465 HG21 VAL 60 HG21 VAL 60 5.121 0.134 6.398 466 HG22 VAL 60 HG22 VAL 60 6.247 -1.017 5.679 467 HG23 VAL 60 HG23 VAL 60 6.796 0.607 6.100 468 H SER 61 HN SER 61 6.624 -4.198 8.475 469 HA SER 61 HA SER 61 6.876 -4.157 11.310 470 HB2 SER 61 HB2 SER 61 8.606 -6.045 10.718 471 HB3 SER 61 HB1 SER 61 6.872 -6.306 10.547 472 HG SER 61 HG SER 61 7.916 -6.977 8.660 473 H GLU 62 HN GLU 62 8.018 -2.596 12.152 474 HA GLU 62 HA GLU 62 10.228 -1.460 10.842 475 HB2 GLU 62 HB2 GLU 62 10.355 -0.081 12.859 476 HB3 GLU 62 HB1 GLU 62 8.787 -0.025 12.107 477 HG2 GLU 62 HG2 GLU 62 9.212 -1.998 14.242 478 HG3 GLU 62 HG1 GLU 62 9.165 -0.300 14.713 479 H GLY 63 HN GLY 63 12.207 -1.301 11.756 480 HA2 GLY 63 HA2 GLY 63 14.199 -2.355 12.263 481 HA3 GLY 63 HA1 GLY 63 13.314 -3.204 13.537 482 H GLY 64 HN GLY 64 12.326 -3.320 10.164 483 HA2 GLY 64 HA2 GLY 64 13.076 -6.169 10.157 484 HA3 GLY 64 HA1 GLY 64 11.518 -5.576 9.572 485 HA PRO 65 HA PRO 65 13.951 -5.510 5.829 486 HB2 PRO 65 HB2 PRO 65 12.020 -6.331 4.240 487 HB3 PRO 65 HB1 PRO 65 12.825 -7.442 5.347 488 HG2 PRO 65 HG2 PRO 65 10.106 -6.292 5.472 489 HG3 PRO 65 HG1 PRO 65 10.717 -7.810 6.150 490 HD2 PRO 65 HD2 PRO 65 10.322 -5.326 7.499 491 HD3 PRO 65 HD1 PRO 65 11.026 -6.822 8.157 492 H ALA 66 HN ALA 66 10.761 -4.112 6.258 493 HA ALA 66 HA ALA 66 10.578 -3.276 3.509 494 HB1 ALA 66 HB1 ALA 66 8.894 -2.798 5.946 495 HB2 ALA 66 HB2 ALA 66 8.508 -3.740 4.507 496 HB3 ALA 66 HB3 ALA 66 8.561 -1.974 4.431 497 H GLU 67 HN GLU 67 11.393 -1.871 6.554 498 HA GLU 67 HA GLU 67 11.098 0.855 5.683 499 HB2 GLU 67 HB2 GLU 67 12.322 1.131 7.973 500 HB3 GLU 67 HB1 GLU 67 10.641 0.591 7.930 501 HG2 GLU 67 HG2 GLU 67 11.155 -1.501 8.576 502 HG3 GLU 67 HG1 GLU 67 12.667 -1.480 7.685 503 H ILE 68 HN ILE 68 13.636 -1.521 6.001 504 HA ILE 68 HA ILE 68 15.708 0.427 5.890 505 HB ILE 68 HB ILE 68 17.129 -1.538 5.618 506 HG12 ILE 68 HG12 ILE 68 14.666 -3.076 6.345 507 HG13 ILE 68 HG11 ILE 68 15.390 -3.048 4.736 508 HG21 ILE 68 HG21 ILE 68 16.884 -0.442 7.719 509 HG22 ILE 68 HG22 ILE 68 16.895 -2.186 8.000 510 HG23 ILE 68 HG23 ILE 68 15.370 -1.293 8.009 511 HD11 ILE 68 HD11 ILE 68 16.662 -4.057 7.254 512 HD12 ILE 68 HD12 ILE 68 17.447 -3.965 5.680 513 HD13 ILE 68 HD13 ILE 68 16.057 -5.028 5.910 514 H ALA 69 HN ALA 69 13.998 -1.746 3.915 515 HA ALA 69 HA ALA 69 15.530 -1.371 1.563 516 HB1 ALA 69 HB1 ALA 69 12.632 -2.101 1.944 517 HB2 ALA 69 HB2 ALA 69 13.976 -3.207 1.638 518 HB3 ALA 69 HB3 ALA 69 13.441 -2.086 0.377 519 H GLY 70 HN GLY 70 13.125 0.331 3.312 520 HA2 GLY 70 HA2 GLY 70 13.207 2.791 3.074 521 HA3 GLY 70 HA1 GLY 70 13.278 2.538 1.331 522 H LEU 71 HN LEU 71 11.156 1.150 3.862 523 HA LEU 71 HA LEU 71 8.883 2.374 2.498 524 HB2 LEU 71 HB2 LEU 71 9.207 -0.105 2.121 525 HB3 LEU 71 HB1 LEU 71 8.973 -0.315 3.849 526 HG LEU 71 HG LEU 71 6.723 0.768 3.580 527 HD11 LEU 71 HD11 LEU 71 5.721 0.686 1.345 528 HD12 LEU 71 HD12 LEU 71 7.289 0.252 0.664 529 HD13 LEU 71 HD13 LEU 71 7.061 1.830 1.417 530 HD21 LEU 71 HD21 LEU 71 5.817 -1.385 2.508 531 HD22 LEU 71 HD22 LEU 71 6.773 -1.502 3.986 532 HD23 LEU 71 HD23 LEU 71 7.522 -1.858 2.428 533 H GLN 72 HN GLN 72 7.049 2.542 3.970 534 HA GLN 72 HA GLN 72 7.372 2.487 6.725 535 HB2 GLN 72 HB2 GLN 72 7.283 4.987 7.088 536 HB3 GLN 72 HB1 GLN 72 8.793 4.313 6.531 537 HG2 GLN 72 HG2 GLN 72 8.348 6.431 5.502 538 HG3 GLN 72 HG1 GLN 72 8.441 5.127 4.324 539 HE21 GLN 72 HE21 GLN 72 6.695 4.591 3.166 540 HE22 GLN 72 HE22 GLN 72 5.235 5.504 3.193 541 H ILE 73 HN ILE 73 5.444 4.038 7.606 542 HA ILE 73 HA ILE 73 3.209 2.586 6.514 543 HB ILE 73 HB ILE 73 2.805 4.586 8.681 544 HG12 ILE 73 HG12 ILE 73 5.018 3.818 9.330 545 HG13 ILE 73 HG11 ILE 73 3.823 3.086 10.391 546 HG21 ILE 73 HG21 ILE 73 1.090 3.047 7.965 547 HG22 ILE 73 HG22 ILE 73 1.546 2.763 9.643 548 HG23 ILE 73 HG23 ILE 73 2.134 1.689 8.375 549 HD11 ILE 73 HD11 ILE 73 5.524 1.485 9.791 550 HD12 ILE 73 HD12 ILE 73 5.209 1.756 8.069 551 HD13 ILE 73 HD13 ILE 73 3.971 1.011 9.094 552 H GLY 74 HN GLY 74 2.172 3.314 4.873 553 HA2 GLY 74 HA2 GLY 74 0.248 4.818 4.447 554 HA3 GLY 74 HA1 GLY 74 1.262 6.149 5.021 555 H ASP 75 HN ASP 75 1.713 3.446 2.797 556 HA ASP 75 HA ASP 75 2.893 5.394 0.900 557 HB2 ASP 75 HB2 ASP 75 4.355 3.605 2.402 558 HB3 ASP 75 HB1 ASP 75 4.107 2.714 0.901 559 H LYS 76 HN LYS 76 2.306 5.071 -1.233 560 HA LYS 76 HA LYS 76 0.088 3.235 -1.569 561 HB2 LYS 76 HB2 LYS 76 1.319 5.176 -3.538 562 HB3 LYS 76 HB1 LYS 76 -0.196 4.316 -3.755 563 HG2 LYS 76 HG2 LYS 76 -1.332 5.673 -2.300 564 HG3 LYS 76 HG1 LYS 76 0.124 6.097 -1.393 565 HD2 LYS 76 HD2 LYS 76 0.892 7.518 -3.162 566 HD3 LYS 76 HD1 LYS 76 -0.399 6.976 -4.231 567 HE2 LYS 76 HE2 LYS 76 -1.155 8.219 -1.640 568 HE3 LYS 76 HE1 LYS 76 -0.529 9.267 -2.912 569 HZ1 LYS 76 HZ1 LYS 76 -2.264 8.645 -4.357 570 HZ2 LYS 76 HZ2 LYS 76 -2.999 8.963 -2.860 571 HZ3 LYS 76 HZ3 LYS 76 -2.760 7.368 -3.353 572 H ILE 77 HN ILE 77 0.758 1.183 -1.834 573 HA ILE 77 HA ILE 77 3.046 0.550 -3.492 574 HB ILE 77 HB ILE 77 1.015 -1.305 -2.243 575 HG12 ILE 77 HG12 ILE 77 3.790 -0.593 -1.282 576 HG13 ILE 77 HG11 ILE 77 2.322 0.157 -0.666 577 HG21 ILE 77 HG21 ILE 77 2.724 -3.030 -2.571 578 HG22 ILE 77 HG22 ILE 77 3.750 -1.850 -3.390 579 HG23 ILE 77 HG23 ILE 77 2.210 -2.328 -4.106 580 HD11 ILE 77 HD11 ILE 77 1.527 -2.007 0.090 581 HD12 ILE 77 HD12 ILE 77 3.092 -1.604 0.801 582 HD13 ILE 77 HD13 ILE 77 2.996 -2.763 -0.527 583 H MET 78 HN MET 78 2.873 0.681 -5.608 584 HA MET 78 HA MET 78 0.286 0.337 -6.884 585 HB2 MET 78 HB2 MET 78 2.939 1.014 -8.153 586 HB3 MET 78 HB1 MET 78 1.346 1.172 -8.880 587 HG2 MET 78 HG2 MET 78 2.281 2.717 -6.480 588 HG3 MET 78 HG1 MET 78 2.358 3.304 -8.139 589 HE1 MET 78 HE1 MET 78 -1.416 2.906 -5.536 590 HE2 MET 78 HE2 MET 78 0.248 2.987 -4.958 591 HE3 MET 78 HE3 MET 78 -0.338 1.528 -5.759 592 H GLN 79 HN GLN 79 3.457 -1.197 -6.809 593 HA GLN 79 HA GLN 79 2.283 -3.657 -7.774 594 HB2 GLN 79 HB2 GLN 79 4.519 -3.645 -9.279 595 HB3 GLN 79 HB1 GLN 79 2.882 -3.376 -9.853 596 HG2 GLN 79 HG2 GLN 79 3.390 -0.912 -9.313 597 HG3 GLN 79 HG1 GLN 79 5.066 -1.482 -9.383 598 HE21 GLN 79 HE21 GLN 79 5.863 -2.328 -11.225 599 HE22 GLN 79 HE22 GLN 79 5.173 -2.009 -12.787 600 H VAL 80 HN VAL 80 3.361 -5.407 -7.591 601 HA VAL 80 HA VAL 80 5.664 -5.281 -5.719 602 HB VAL 80 HB VAL 80 3.639 -6.174 -4.713 603 HG11 VAL 80 HG11 VAL 80 2.532 -6.963 -6.708 604 HG12 VAL 80 HG12 VAL 80 2.625 -8.252 -5.507 605 HG13 VAL 80 HG13 VAL 80 3.722 -8.250 -6.889 606 HG21 VAL 80 HG21 VAL 80 4.564 -8.369 -3.967 607 HG22 VAL 80 HG22 VAL 80 5.769 -7.080 -3.953 608 HG23 VAL 80 HG23 VAL 80 5.761 -8.267 -5.263 609 H ASN 81 HN ASN 81 7.470 -6.522 -6.262 610 HA ASN 81 HA ASN 81 8.915 -7.665 -7.567 611 HB2 ASN 81 HB2 ASN 81 6.423 -9.271 -7.701 612 HB3 ASN 81 HB1 ASN 81 7.719 -9.677 -8.822 613 HD21 ASN 81 HD21 ASN 81 6.592 -9.853 -5.613 614 HD22 ASN 81 HD22 ASN 81 7.948 -10.717 -4.940 615 H GLY 82 HN GLY 82 7.027 -5.529 -8.786 616 HA2 GLY 82 HA2 GLY 82 7.668 -4.373 -10.777 617 HA3 GLY 82 HA1 GLY 82 8.084 -5.911 -11.504 618 H TRP 83 HN TRP 83 5.065 -6.416 -10.103 619 HA TRP 83 HA TRP 83 3.760 -5.587 -12.573 620 HB2 TRP 83 HB2 TRP 83 2.187 -7.562 -11.705 621 HB3 TRP 83 HB1 TRP 83 3.477 -7.789 -12.878 622 HD1 TRP 83 HD1 TRP 83 2.964 -7.877 -9.115 623 HE1 TRP 83 HE1 TRP 83 4.376 -9.789 -8.168 624 HE3 TRP 83 HE3 TRP 83 5.081 -9.608 -13.422 625 HZ2 TRP 83 HZ2 TRP 83 6.052 -11.818 -9.065 626 HZ3 TRP 83 HZ3 TRP 83 6.562 -11.574 -13.284 627 HH2 TRP 83 HH2 TRP 83 7.021 -12.636 -11.133 628 H ASP 84 HN ASP 84 2.601 -3.954 -12.149 629 HA ASP 84 HA ASP 84 1.390 -2.804 -10.172 630 HB2 ASP 84 HB2 ASP 84 0.954 -2.180 -12.512 631 HB3 ASP 84 HB1 ASP 84 -0.123 -3.560 -12.689 632 H MET 85 HN MET 85 0.389 -3.383 -8.447 633 HA MET 85 HA MET 85 -1.556 -5.590 -8.612 634 HB2 MET 85 HB2 MET 85 -1.083 -6.041 -6.251 635 HB3 MET 85 HB1 MET 85 0.341 -6.236 -7.260 636 HG2 MET 85 HG2 MET 85 1.154 -4.054 -6.520 637 HG3 MET 85 HG1 MET 85 -0.266 -3.871 -5.504 638 HE1 MET 85 HE1 MET 85 -0.521 -7.014 -4.724 639 HE2 MET 85 HE2 MET 85 -0.801 -5.798 -3.467 640 HE3 MET 85 HE3 MET 85 0.342 -7.124 -3.188 641 H THR 86 HN THR 86 -2.208 -2.871 -9.160 642 HA THR 86 HA THR 86 -3.449 -1.755 -6.805 643 HB THR 86 HB THR 86 -4.341 -0.027 -8.321 644 HG1 THR 86 HG1 THR 86 -2.950 -1.450 -10.384 645 HG21 THR 86 HG21 THR 86 -2.130 0.301 -7.389 646 HG22 THR 86 HG22 THR 86 -2.167 0.899 -9.048 647 HG23 THR 86 HG23 THR 86 -1.411 -0.653 -8.687 648 H MET 87 HN MET 87 -4.449 -3.675 -9.536 649 HA MET 87 HA MET 87 -7.279 -3.465 -8.738 650 HB2 MET 87 HB2 MET 87 -7.812 -4.303 -10.929 651 HB3 MET 87 HB1 MET 87 -6.644 -3.008 -11.104 652 HG2 MET 87 HG2 MET 87 -4.866 -4.576 -11.477 653 HG3 MET 87 HG1 MET 87 -5.947 -5.929 -11.144 654 HE1 MET 87 HE1 MET 87 -5.325 -6.364 -14.971 655 HE2 MET 87 HE2 MET 87 -5.243 -7.114 -13.375 656 HE3 MET 87 HE3 MET 87 -4.144 -5.798 -13.791 657 H VAL 88 HN VAL 88 -5.109 -4.905 -7.501 658 HA VAL 88 HA VAL 88 -5.305 -7.673 -8.164 659 HB VAL 88 HB VAL 88 -3.558 -5.859 -6.758 660 HG11 VAL 88 HG11 VAL 88 -4.129 -6.964 -4.742 661 HG12 VAL 88 HG12 VAL 88 -2.555 -7.568 -5.259 662 HG13 VAL 88 HG13 VAL 88 -4.004 -8.551 -5.502 663 HG21 VAL 88 HG21 VAL 88 -1.886 -7.497 -7.541 664 HG22 VAL 88 HG22 VAL 88 -2.964 -6.886 -8.800 665 HG23 VAL 88 HG23 VAL 88 -3.212 -8.503 -8.130 666 H THR 89 HN THR 89 -5.706 -9.378 -6.613 667 HA THR 89 HA THR 89 -7.712 -8.646 -4.600 668 HB THR 89 HB THR 89 -7.368 -10.906 -6.488 669 HG1 THR 89 HG1 THR 89 -8.984 -8.984 -6.469 670 HG21 THR 89 HG21 THR 89 -8.827 -11.190 -3.891 671 HG22 THR 89 HG22 THR 89 -7.346 -12.016 -4.380 672 HG23 THR 89 HG23 THR 89 -8.858 -12.344 -5.228 673 H HIS 90 HN HIS 90 -7.587 -9.842 -2.644 674 HA HIS 90 HA HIS 90 -5.155 -9.893 -1.366 675 HB2 HIS 90 HB2 HIS 90 -7.290 -9.868 -0.188 676 HB3 HIS 90 HB1 HIS 90 -7.706 -11.447 -0.830 677 HD1 HIS 90 HD1 HIS 90 -7.733 -10.660 2.195 678 HD2 HIS 90 HD2 HIS 90 -4.692 -12.763 0.283 679 HE1 HIS 90 HE1 HIS 90 -6.579 -11.981 4.000 680 HE2 HIS 90 HE2 HIS 90 -4.662 -13.121 2.845 681 H ASP 91 HN ASP 91 -6.856 -12.595 -2.714 682 HA ASP 91 HA ASP 91 -5.129 -14.649 -1.921 683 HB2 ASP 91 HB2 ASP 91 -7.385 -15.104 -2.675 684 HB3 ASP 91 HB1 ASP 91 -7.025 -14.374 -4.239 685 H GLN 92 HN GLN 92 -5.317 -12.831 -4.948 686 HA GLN 92 HA GLN 92 -3.011 -14.232 -5.863 687 HB2 GLN 92 HB2 GLN 92 -3.310 -12.846 -7.948 688 HB3 GLN 92 HB1 GLN 92 -4.534 -14.040 -7.574 689 HG2 GLN 92 HG2 GLN 92 -5.844 -12.323 -8.153 690 HG3 GLN 92 HG1 GLN 92 -5.647 -11.916 -6.447 691 HE21 GLN 92 HE21 GLN 92 -3.966 -10.568 -5.891 692 HE22 GLN 92 HE22 GLN 92 -3.412 -9.362 -6.994 693 H ALA 93 HN ALA 93 -3.626 -11.254 -4.243 694 HA ALA 93 HA ALA 93 -1.130 -10.018 -4.865 695 HB1 ALA 93 HB1 ALA 93 -1.517 -8.725 -2.812 696 HB2 ALA 93 HB2 ALA 93 -2.871 -9.778 -2.399 697 HB3 ALA 93 HB3 ALA 93 -2.957 -8.750 -3.829 698 H ARG 94 HN ARG 94 -2.406 -12.246 -2.510 699 HA ARG 94 HA ARG 94 -0.193 -12.453 -0.863 700 HB2 ARG 94 HB2 ARG 94 -2.547 -14.169 -1.495 701 HB3 ARG 94 HB1 ARG 94 -1.226 -14.888 -0.561 702 HG2 ARG 94 HG2 ARG 94 -2.836 -12.441 0.135 703 HG3 ARG 94 HG1 ARG 94 -2.901 -14.002 0.942 704 HD2 ARG 94 HD2 ARG 94 -0.433 -13.673 1.464 705 HD3 ARG 94 HD1 ARG 94 -0.688 -11.986 0.991 706 HE ARG 94 HE ARG 94 -1.852 -11.634 2.930 707 HH11 ARG 94 HH11 ARG 94 -1.471 -15.071 2.430 708 HH12 ARG 94 HH12 ARG 94 -2.092 -15.515 3.985 709 HH21 ARG 94 HH21 ARG 94 -2.659 -12.201 5.006 710 HH22 ARG 94 HH22 ARG 94 -2.784 -13.874 5.455 711 H LYS 95 HN LYS 95 -1.004 -14.290 -3.798 712 HA LYS 95 HA LYS 95 1.461 -15.724 -3.761 713 HB2 LYS 95 HB2 LYS 95 0.839 -15.953 -6.333 714 HB3 LYS 95 HB1 LYS 95 0.063 -16.899 -5.074 715 HG2 LYS 95 HG2 LYS 95 -1.813 -15.368 -5.051 716 HG3 LYS 95 HG1 LYS 95 -1.049 -14.357 -6.285 717 HD2 LYS 95 HD2 LYS 95 -2.771 -15.917 -7.183 718 HD3 LYS 95 HD1 LYS 95 -1.169 -16.160 -7.886 719 HE2 LYS 95 HE2 LYS 95 -0.783 -18.087 -6.531 720 HE3 LYS 95 HE1 LYS 95 -2.228 -17.776 -5.573 721 HZ1 LYS 95 HZ1 LYS 95 -2.453 -18.251 -8.476 722 HZ2 LYS 95 HZ2 LYS 95 -3.604 -18.504 -7.251 723 HZ3 LYS 95 HZ3 LYS 95 -2.287 -19.557 -7.409 724 H ARG 96 HN ARG 96 0.760 -12.480 -4.773 725 HA ARG 96 HA ARG 96 3.089 -12.374 -6.522 726 HB2 ARG 96 HB2 ARG 96 1.353 -10.117 -5.514 727 HB3 ARG 96 HB1 ARG 96 2.581 -9.990 -6.760 728 HG2 ARG 96 HG2 ARG 96 -0.039 -11.450 -6.900 729 HG3 ARG 96 HG1 ARG 96 0.472 -10.038 -7.824 730 HD2 ARG 96 HD2 ARG 96 2.226 -11.414 -8.884 731 HD3 ARG 96 HD1 ARG 96 1.607 -12.824 -8.017 732 HE ARG 96 HE ARG 96 -0.371 -11.442 -9.601 733 HH11 ARG 96 HH11 ARG 96 2.056 -13.965 -9.596 734 HH12 ARG 96 HH12 ARG 96 1.362 -14.817 -10.944 735 HH21 ARG 96 HH21 ARG 96 -1.315 -12.571 -11.332 736 HH22 ARG 96 HH22 ARG 96 -0.567 -14.028 -11.923 737 H LEU 97 HN LEU 97 2.298 -11.793 -3.251 738 HA LEU 97 HA LEU 97 4.634 -10.204 -2.624 739 HB2 LEU 97 HB2 LEU 97 2.646 -11.501 -0.761 740 HB3 LEU 97 HB1 LEU 97 3.741 -10.183 -0.384 741 HG LEU 97 HG LEU 97 1.470 -10.029 -2.353 742 HD11 LEU 97 HD11 LEU 97 0.583 -10.249 -0.151 743 HD12 LEU 97 HD12 LEU 97 0.416 -8.571 -0.673 744 HD13 LEU 97 HD13 LEU 97 1.686 -9.022 0.468 745 HD21 LEU 97 HD21 LEU 97 3.259 -7.887 -1.248 746 HD22 LEU 97 HD22 LEU 97 1.979 -7.687 -2.445 747 HD23 LEU 97 HD23 LEU 97 3.415 -8.637 -2.837 748 H THR 98 HN THR 98 3.429 -13.409 -2.282 749 HA THR 98 HA THR 98 6.133 -14.307 -1.570 750 HB THR 98 HB THR 98 5.027 -16.257 -0.363 751 HG1 THR 98 HG1 THR 98 2.815 -14.923 -1.178 752 HG21 THR 98 HG21 THR 98 6.146 -14.456 0.852 753 HG22 THR 98 HG22 THR 98 4.698 -14.977 1.715 754 HG23 THR 98 HG23 THR 98 4.680 -13.479 0.785 755 H LYS 99 HN LYS 99 6.203 -14.355 -3.956 756 HA LYS 99 HA LYS 99 4.841 -16.515 -5.287 757 HB2 LYS 99 HB2 LYS 99 6.521 -15.984 -7.113 758 HB3 LYS 99 HB1 LYS 99 5.366 -14.721 -6.696 759 HG2 LYS 99 HG2 LYS 99 7.112 -13.641 -5.338 760 HG3 LYS 99 HG1 LYS 99 8.238 -14.911 -5.807 761 HD2 LYS 99 HD2 LYS 99 6.832 -13.087 -7.738 762 HD3 LYS 99 HD1 LYS 99 8.472 -12.837 -7.135 763 HE2 LYS 99 HE2 LYS 99 9.171 -14.950 -8.090 764 HE3 LYS 99 HE1 LYS 99 7.526 -15.277 -8.626 765 HZ1 LYS 99 HZ1 LYS 99 9.211 -13.012 -9.552 766 HZ2 LYS 99 HZ2 LYS 99 7.651 -13.384 -10.094 767 HZ3 LYS 99 HZ3 LYS 99 8.929 -14.445 -10.418 768 H ARG 100 HN ARG 100 7.472 -16.973 -6.755 769 HA ARG 100 HA ARG 100 8.161 -19.471 -5.945 770 HB2 ARG 100 HB2 ARG 100 8.843 -18.335 -8.061 771 HB3 ARG 100 HB1 ARG 100 10.075 -17.486 -7.143 772 HG2 ARG 100 HG2 ARG 100 9.973 -20.480 -7.196 773 HG3 ARG 100 HG1 ARG 100 10.734 -19.567 -8.496 774 HD2 ARG 100 HD2 ARG 100 11.463 -19.357 -5.576 775 HD3 ARG 100 HD1 ARG 100 12.331 -20.331 -6.763 776 HE ARG 100 HE ARG 100 12.267 -17.766 -7.794 777 HH11 ARG 100 HH11 ARG 100 13.575 -19.370 -4.954 778 HH12 ARG 100 HH12 ARG 100 14.823 -18.174 -4.726 779 HH21 ARG 100 HH21 ARG 100 13.943 -16.240 -7.496 780 HH22 ARG 100 HH22 ARG 100 15.035 -16.423 -6.149 781 H SER 101 HN SER 101 9.185 -16.488 -4.705 782 HA SER 101 HA SER 101 10.113 -16.835 -2.297 783 HB2 SER 101 HB2 SER 101 11.457 -18.817 -2.987 784 HB3 SER 101 HB1 SER 101 12.383 -17.788 -4.075 785 HG SER 101 HG SER 101 12.450 -16.617 -1.727 786 H GLU 102 HN GLU 102 10.640 -15.808 -5.449 787 HA GLU 102 HA GLU 102 11.479 -13.995 -6.530 788 HB2 GLU 102 HB2 GLU 102 10.895 -11.783 -5.538 789 HB3 GLU 102 HB1 GLU 102 9.579 -12.925 -5.749 790 HG2 GLU 102 HG2 GLU 102 10.813 -13.101 -3.127 791 HG3 GLU 102 HG1 GLU 102 10.156 -11.496 -3.485 792 H GLU 103 HN GLU 103 12.802 -14.237 -3.405 793 HA GLU 103 HA GLU 103 14.857 -13.860 -2.577 794 HB2 GLU 103 HB2 GLU 103 15.518 -12.202 -5.015 795 HB3 GLU 103 HB1 GLU 103 16.641 -12.723 -3.773 796 HG2 GLU 103 HG2 GLU 103 15.209 -14.518 -5.715 797 HG3 GLU 103 HG1 GLU 103 16.892 -14.008 -5.827 798 H VAL 104 HN VAL 104 12.592 -11.708 -3.728 799 HA VAL 104 HA VAL 104 12.667 -9.939 -1.576 800 HB VAL 104 HB VAL 104 14.924 -9.489 -2.355 801 HG11 VAL 104 HG11 VAL 104 14.534 -10.061 -4.718 802 HG12 VAL 104 HG12 VAL 104 15.373 -8.516 -4.525 803 HG13 VAL 104 HG13 VAL 104 13.654 -8.544 -4.922 804 HG21 VAL 104 HG21 VAL 104 13.011 -7.216 -2.882 805 HG22 VAL 104 HG22 VAL 104 14.745 -7.042 -2.582 806 HG23 VAL 104 HG23 VAL 104 13.688 -7.669 -1.316 807 H VAL 105 HN VAL 105 11.073 -8.202 -1.820 808 HA VAL 105 HA VAL 105 9.473 -8.707 -4.248 809 HB VAL 105 HB VAL 105 7.534 -7.813 -3.080 810 HG11 VAL 105 HG11 VAL 105 8.979 -9.945 -1.522 811 HG12 VAL 105 HG12 VAL 105 7.966 -10.187 -2.945 812 HG13 VAL 105 HG13 VAL 105 7.250 -9.611 -1.440 813 HG21 VAL 105 HG21 VAL 105 9.304 -7.577 -0.655 814 HG22 VAL 105 HG22 VAL 105 7.565 -7.280 -0.721 815 HG23 VAL 105 HG23 VAL 105 8.676 -6.226 -1.599 816 H ARG 106 HN ARG 106 9.403 -7.260 -5.767 817 HA ARG 106 HA ARG 106 10.677 -4.705 -5.400 818 HB2 ARG 106 HB2 ARG 106 9.472 -6.108 -7.761 819 HB3 ARG 106 HB1 ARG 106 9.963 -4.416 -7.819 820 HG2 ARG 106 HG2 ARG 106 11.730 -5.740 -8.673 821 HG3 ARG 106 HG1 ARG 106 12.164 -5.078 -7.110 822 HD2 ARG 106 HD2 ARG 106 11.718 -7.198 -6.040 823 HD3 ARG 106 HD1 ARG 106 11.186 -7.880 -7.576 824 HE ARG 106 HE ARG 106 13.934 -6.871 -7.310 825 HH11 ARG 106 HH11 ARG 106 11.737 -9.591 -7.597 826 HH12 ARG 106 HH12 ARG 106 12.956 -10.685 -8.175 827 HH21 ARG 106 HH21 ARG 106 15.544 -8.302 -8.060 828 HH22 ARG 106 HH22 ARG 106 15.129 -9.954 -8.430 829 H LEU 107 HN LEU 107 9.569 -3.195 -4.486 830 HA LEU 107 HA LEU 107 6.711 -3.013 -5.078 831 HB2 LEU 107 HB2 LEU 107 8.332 -2.300 -2.728 832 HB3 LEU 107 HB1 LEU 107 6.940 -1.301 -3.074 833 HG LEU 107 HG LEU 107 5.435 -3.110 -2.802 834 HD11 LEU 107 HD11 LEU 107 7.830 -4.929 -2.675 835 HD12 LEU 107 HD12 LEU 107 6.721 -4.782 -4.038 836 HD13 LEU 107 HD13 LEU 107 6.143 -5.418 -2.495 837 HD21 LEU 107 HD21 LEU 107 5.758 -3.702 -0.563 838 HD22 LEU 107 HD22 LEU 107 6.560 -2.143 -0.756 839 HD23 LEU 107 HD23 LEU 107 7.515 -3.631 -0.712 840 H LEU 108 HN LEU 108 6.137 -1.644 -6.456 841 HA LEU 108 HA LEU 108 7.694 0.825 -6.790 842 HB2 LEU 108 HB2 LEU 108 5.415 -0.303 -8.410 843 HB3 LEU 108 HB1 LEU 108 6.091 1.298 -8.665 844 HG LEU 108 HG LEU 108 7.256 -1.375 -9.279 845 HD11 LEU 108 HD11 LEU 108 7.224 1.253 -10.749 846 HD12 LEU 108 HD12 LEU 108 6.133 -0.106 -11.024 847 HD13 LEU 108 HD13 LEU 108 7.856 -0.274 -11.362 848 HD21 LEU 108 HD21 LEU 108 9.480 -0.447 -9.475 849 HD22 LEU 108 HD22 LEU 108 8.910 -0.315 -7.813 850 HD23 LEU 108 HD23 LEU 108 8.923 1.108 -8.856 851 H VAL 109 HN VAL 109 7.145 2.379 -5.450 852 HA VAL 109 HA VAL 109 4.466 2.324 -4.344 853 HB VAL 109 HB VAL 109 6.293 1.365 -2.904 854 HG11 VAL 109 HG11 VAL 109 8.095 2.880 -3.350 855 HG12 VAL 109 HG12 VAL 109 7.680 2.966 -1.639 856 HG13 VAL 109 HG13 VAL 109 7.148 4.237 -2.738 857 HG21 VAL 109 HG21 VAL 109 4.701 3.660 -1.863 858 HG22 VAL 109 HG22 VAL 109 5.469 2.422 -0.870 859 HG23 VAL 109 HG23 VAL 109 4.186 1.982 -1.996 860 H THR 110 HN THR 110 3.979 4.267 -3.282 861 HA THR 110 HA THR 110 4.939 6.563 -4.829 862 HB THR 110 HB THR 110 2.096 6.677 -4.165 863 HG1 THR 110 HG1 THR 110 2.723 4.337 -4.791 864 HG21 THR 110 HG21 THR 110 3.306 8.220 -5.678 865 HG22 THR 110 HG22 THR 110 1.921 7.439 -6.445 866 HG23 THR 110 HG23 THR 110 3.558 6.878 -6.792 867 H ARG 111 HN ARG 111 5.789 7.944 -3.511 868 HA ARG 111 HA ARG 111 5.097 7.969 -0.690 869 HB2 ARG 111 HB2 ARG 111 7.404 9.040 -2.301 870 HB3 ARG 111 HB1 ARG 111 7.163 9.477 -0.616 871 HG2 ARG 111 HG2 ARG 111 7.344 6.619 -1.508 872 HG3 ARG 111 HG1 ARG 111 8.764 7.582 -1.086 873 HD2 ARG 111 HD2 ARG 111 7.652 8.080 1.089 874 HD3 ARG 111 HD1 ARG 111 6.421 6.897 0.667 875 HE ARG 111 HE ARG 111 8.009 5.177 0.852 876 HH11 ARG 111 HH11 ARG 111 9.293 8.315 1.727 877 HH12 ARG 111 HH12 ARG 111 10.689 7.667 2.526 878 HH21 ARG 111 HH21 ARG 111 9.868 4.333 1.904 879 HH22 ARG 111 HH22 ARG 111 10.996 5.426 2.650 880 H GLN 112 HN GLN 112 5.090 10.064 0.425 881 HA GLN 112 HA GLN 112 3.479 11.968 -1.057 882 HB2 GLN 112 HB2 GLN 112 3.986 11.788 1.884 883 HB3 GLN 112 HB1 GLN 112 2.768 12.755 1.087 884 HG2 GLN 112 HG2 GLN 112 2.927 9.765 1.184 885 HG3 GLN 112 HG1 GLN 112 1.787 10.773 2.066 886 HE21 GLN 112 HE21 GLN 112 2.641 9.405 -0.979 887 HE22 GLN 112 HE22 GLN 112 1.214 9.868 -1.834 888 H SER 113 HN SER 113 6.447 11.550 -0.549 889 HA SER 113 HA SER 113 8.215 12.812 -1.259 890 HB2 SER 113 HB2 SER 113 6.336 14.314 -2.246 891 HB3 SER 113 HB1 SER 113 6.668 15.321 -0.842 892 HG SER 113 HG SER 113 8.430 16.002 -1.749 893 H LEU 114 HN LEU 114 7.275 12.193 1.427 894 HA LEU 114 HA LEU 114 8.176 12.298 3.508 895 HB2 LEU 114 HB2 LEU 114 10.171 13.666 1.815 896 HB3 LEU 114 HB1 LEU 114 10.457 13.421 3.531 897 HG LEU 114 HG LEU 114 11.569 11.612 2.534 898 HD11 LEU 114 HD11 LEU 114 8.773 10.744 3.244 899 HD12 LEU 114 HD12 LEU 114 10.210 10.744 4.274 900 HD13 LEU 114 HD13 LEU 114 10.093 9.613 2.925 901 HD21 LEU 114 HD21 LEU 114 10.528 10.256 0.704 902 HD22 LEU 114 HD22 LEU 114 10.880 11.927 0.262 903 HD23 LEU 114 HD23 LEU 114 9.224 11.450 0.636 904 H GLN 115 HN GLN 115 6.264 13.774 3.390 905 HA GLN 115 HA GLN 115 6.070 16.433 3.310 906 HB2 GLN 115 HB2 GLN 115 4.730 14.409 5.024 907 HB3 GLN 115 HB1 GLN 115 4.384 16.108 5.281 908 HG2 GLN 115 HG2 GLN 115 4.105 14.685 2.654 909 HG3 GLN 115 HG1 GLN 115 2.780 15.014 3.772 910 HE21 GLN 115 HE21 GLN 115 3.240 15.914 1.009 911 HE22 GLN 115 HE22 GLN 115 3.181 17.639 1.067 912 H LYS 116 HN LYS 116 7.551 17.780 3.992 913 HA LYS 116 HA LYS 116 7.631 18.269 6.879 914 HB2 LYS 116 HB2 LYS 116 10.023 18.494 5.023 915 HB3 LYS 116 HB1 LYS 116 9.986 19.026 6.697 916 HG2 LYS 116 HG2 LYS 116 9.566 16.677 7.381 917 HG3 LYS 116 HG1 LYS 116 9.761 16.200 5.693 918 HD2 LYS 116 HD2 LYS 116 12.031 17.123 5.706 919 HD3 LYS 116 HD1 LYS 116 11.837 17.561 7.405 920 HE2 LYS 116 HE2 LYS 116 11.727 14.762 6.276 921 HE3 LYS 116 HE1 LYS 116 13.095 15.472 7.127 922 HZ1 LYS 116 HZ1 LYS 116 10.418 14.849 8.244 923 HZ2 LYS 116 HZ2 LYS 116 11.579 15.765 9.068 924 HZ3 LYS 116 HZ3 LYS 116 11.904 14.153 8.665 925 H ALA 117 HN ALA 117 7.610 20.511 7.394 926 HA ALA 117 HA ALA 117 7.146 22.248 5.067 927 HB1 ALA 117 HB1 ALA 117 4.959 21.637 5.978 928 HB2 ALA 117 HB2 ALA 117 5.297 23.347 6.257 929 HB3 ALA 117 HB3 ALA 117 5.468 22.187 7.576 930 H VAL 118 HN VAL 118 9.282 21.656 6.912 931 HA VAL 118 HA VAL 118 9.686 24.298 8.118 932 HB VAL 118 HB VAL 118 11.032 21.744 9.001 933 HG11 VAL 118 HG11 VAL 118 11.586 23.037 10.977 934 HG12 VAL 118 HG12 VAL 118 10.727 24.427 10.316 935 HG13 VAL 118 HG13 VAL 118 12.179 23.830 9.518 936 HG21 VAL 118 HG21 VAL 118 9.490 21.702 10.897 937 HG22 VAL 118 HG22 VAL 118 8.624 21.527 9.370 938 HG23 VAL 118 HG23 VAL 118 8.611 23.073 10.220 939 H GLN 119 HN GLN 119 10.482 25.029 6.164 940 HA GLN 119 HA GLN 119 13.021 23.852 5.255 941 HB2 GLN 119 HB2 GLN 119 10.978 25.409 3.661 942 HB3 GLN 119 HB1 GLN 119 12.521 24.834 3.046 943 HG2 GLN 119 HG2 GLN 119 11.807 22.528 3.430 944 HG3 GLN 119 HG1 GLN 119 10.253 23.114 4.026 945 HE21 GLN 119 HE21 GLN 119 10.918 21.410 1.743 946 HE22 GLN 119 HE22 GLN 119 10.237 22.190 0.346 947 H GLN 120 HN GLN 120 14.273 25.590 3.930 948 HA GLN 120 HA GLN 120 14.347 28.060 5.520 949 HB2 GLN 120 HB2 GLN 120 16.666 28.316 4.670 950 HB3 GLN 120 HB1 GLN 120 16.442 26.838 5.594 951 HG2 GLN 120 HG2 GLN 120 16.227 25.590 3.472 952 HG3 GLN 120 HG1 GLN 120 16.566 27.080 2.596 953 HE21 GLN 120 HE21 GLN 120 18.107 26.223 5.615 954 HE22 GLN 120 HE22 GLN 120 19.689 25.969 4.962 955 H SER 121 HN SER 121 13.851 29.943 4.562 956 HA SER 121 HA SER 121 12.955 29.874 1.809 957 HB2 SER 121 HB2 SER 121 12.987 32.220 3.724 958 HB3 SER 121 HB1 SER 121 12.037 32.064 2.246 959 HG SER 121 HG SER 121 11.781 30.561 4.643 960 H MET 122 HN MET 122 13.535 31.826 0.430 961 HA MET 122 HA MET 122 14.994 33.104 -0.713 962 HB2 MET 122 HB2 MET 122 16.576 32.979 1.845 963 HB3 MET 122 HB1 MET 122 17.159 33.815 0.415 964 HG2 MET 122 HG2 MET 122 16.192 35.483 1.710 965 HG3 MET 122 HG1 MET 122 14.986 35.124 0.479 966 HE1 MET 122 HE1 MET 122 15.978 33.248 3.797 967 HE2 MET 122 HE2 MET 122 14.736 33.837 4.899 968 HE3 MET 122 HE3 MET 122 15.941 34.951 4.256 969 H LEU 123 HN LEU 123 15.572 31.986 -2.389 970 HA LEU 123 HA LEU 123 16.885 30.853 -3.838 971 HB2 LEU 123 HB2 LEU 123 18.819 30.654 -1.529 972 HB3 LEU 123 HB1 LEU 123 19.173 30.169 -3.175 973 HG LEU 123 HG LEU 123 18.552 32.982 -2.266 974 HD11 LEU 123 HD11 LEU 123 20.892 33.431 -2.802 975 HD12 LEU 123 HD12 LEU 123 21.134 31.724 -3.178 976 HD13 LEU 123 HD13 LEU 123 20.745 32.216 -1.531 977 HD21 LEU 123 HD21 LEU 123 19.113 33.645 -4.535 978 HD22 LEU 123 HD22 LEU 123 17.758 32.513 -4.544 979 HD23 LEU 123 HD23 LEU 123 19.373 31.959 -4.982 980 H SER 124 HN SER 124 18.367 28.611 -3.711 981 HA SER 124 HA SER 124 18.257 26.360 -3.649 982 HB2 SER 124 HB2 SER 124 18.189 26.820 -1.132 983 HB3 SER 124 HB1 SER 124 16.455 26.542 -1.234 984 HG SER 124 HG SER 124 18.179 24.721 -0.817 985 H1 LYS 161 HN LYS 161 -11.312 2.049 -1.453 986 HA LYS 161 HA LYS 161 -9.246 3.883 -0.454 987 HB2 LYS 161 HB2 LYS 161 -12.201 4.228 0.079 988 HB3 LYS 161 HB1 LYS 161 -10.908 5.224 0.731 989 HG2 LYS 161 HG2 LYS 161 -11.468 4.960 -2.208 990 HG3 LYS 161 HG1 LYS 161 -12.176 6.211 -1.185 991 HD2 LYS 161 HD2 LYS 161 -10.236 7.363 -1.018 992 HD3 LYS 161 HD1 LYS 161 -9.246 5.903 -1.021 993 HE2 LYS 161 HE2 LYS 161 -9.051 7.437 -3.038 994 HE3 LYS 161 HE1 LYS 161 -9.307 5.723 -3.351 995 HZ1 LYS 161 HZ1 LYS 161 -11.662 6.190 -3.691 996 HZ2 LYS 161 HZ2 LYS 161 -10.692 7.058 -4.767 997 HZ3 LYS 161 HZ3 LYS 161 -11.386 7.845 -3.444 998 H GLU 162 HN GLU 162 -11.757 1.518 0.211 999 HA GLU 162 HA GLU 162 -11.074 1.309 3.001 1000 HB2 GLU 162 HB2 GLU 162 -13.383 0.906 2.089 1001 HB3 GLU 162 HB1 GLU 162 -12.777 -0.577 1.369 1002 HG2 GLU 162 HG2 GLU 162 -12.390 -1.560 3.479 1003 HG3 GLU 162 HG1 GLU 162 -12.593 -0.018 4.310 1004 H ASN 163 HN ASN 163 -10.427 -0.724 3.938 1005 HA ASN 163 HA ASN 163 -7.979 -1.449 2.541 1006 HB2 ASN 163 HB2 ASN 163 -7.267 -2.379 4.740 1007 HB3 ASN 163 HB1 ASN 163 -7.692 -0.674 4.792 1008 HD21 ASN 163 HD21 ASN 163 -9.508 -0.017 5.950 1009 HD22 ASN 163 HD22 ASN 163 -10.325 -1.083 7.061 1010 H LEU 164 HN LEU 164 -7.619 -3.278 1.517 1011 HA LEU 164 HA LEU 164 -8.908 -5.729 2.485 1012 HB2 LEU 164 HB2 LEU 164 -9.677 -5.745 0.337 1013 HB3 LEU 164 HB1 LEU 164 -8.464 -4.609 -0.211 1014 HG LEU 164 HG LEU 164 -6.881 -6.690 0.025 1015 HD11 LEU 164 HD11 LEU 164 -8.518 -8.216 0.952 1016 HD12 LEU 164 HD12 LEU 164 -8.028 -8.778 -0.653 1017 HD13 LEU 164 HD13 LEU 164 -9.581 -7.960 -0.431 1018 HD21 LEU 164 HD21 LEU 164 -8.791 -6.245 -2.261 1019 HD22 LEU 164 HD22 LEU 164 -7.324 -7.219 -2.350 1020 HD23 LEU 164 HD23 LEU 164 -7.213 -5.490 -2.028 1021 H GLU 165 HN GLU 165 -7.440 -7.618 2.315 1022 HA GLU 165 HA GLU 165 -5.504 -8.750 2.051 1023 HB2 GLU 165 HB2 GLU 165 -4.735 -6.921 0.485 1024 HB3 GLU 165 HB1 GLU 165 -3.936 -6.185 1.871 1025 HG2 GLU 165 HG2 GLU 165 -2.533 -7.657 0.348 1026 HG3 GLU 165 HG1 GLU 165 -2.413 -7.944 2.079 1027 H SER 166 HN SER 166 -3.013 -7.095 3.499 1028 HA SER 166 HA SER 166 -3.466 -8.210 6.080 1029 HB2 SER 166 HB2 SER 166 -2.393 -10.067 3.949 1030 HB3 SER 166 HB1 SER 166 -2.415 -10.423 5.675 1031 HG SER 166 HG SER 166 -4.520 -10.307 3.830 1032 H MET 167 HN MET 167 -1.282 -9.380 6.807 1033 HA MET 167 HA MET 167 1.056 -7.937 5.777 1034 HB2 MET 167 HB2 MET 167 2.281 -8.808 7.676 1035 HB3 MET 167 HB1 MET 167 0.784 -8.076 8.263 1036 HG2 MET 167 HG2 MET 167 -0.227 -10.270 8.498 1037 HG3 MET 167 HG1 MET 167 1.211 -11.021 7.809 1038 HE1 MET 167 HE1 MET 167 0.892 -8.072 10.454 1039 HE2 MET 167 HE2 MET 167 1.012 -9.000 11.950 1040 HE3 MET 167 HE3 MET 167 -0.373 -9.225 10.881 1041 H VAL 168 HN VAL 168 2.995 -9.283 5.384 1042 HA VAL 168 HA VAL 168 2.433 -12.120 4.926 1043 HB VAL 168 HB VAL 168 4.078 -11.890 2.901 1044 HG11 VAL 168 HG11 VAL 168 1.732 -12.626 2.743 1045 HG12 VAL 168 HG12 VAL 168 2.191 -11.616 1.376 1046 HG13 VAL 168 HG13 VAL 168 1.215 -10.941 2.677 1047 HG21 VAL 168 HG21 VAL 168 3.838 -9.779 1.679 1048 HG22 VAL 168 HG22 VAL 168 4.604 -9.527 3.247 1049 HG23 VAL 168 HG23 VAL 168 2.908 -9.109 3.019 Start of MODEL 18 1 H1 MET 1 HT1 MET 1 0.223 18.339 -24.731 2 H2 MET 1 HT2 MET 1 -1.058 18.812 -25.733 3 H3 MET 1 HT3 MET 1 -0.072 17.511 -26.186 4 HA MET 1 HA MET 1 -2.171 16.709 -25.363 5 HB2 MET 1 HB2 MET 1 0.166 16.230 -23.505 6 HB3 MET 1 HB1 MET 1 -1.309 15.278 -23.496 7 HG2 MET 1 HG2 MET 1 -0.888 14.600 -25.804 8 HG3 MET 1 HG1 MET 1 0.606 15.536 -25.800 9 HE1 MET 1 HE1 MET 1 -0.934 13.327 -22.897 10 HE2 MET 1 HE2 MET 1 -0.129 11.786 -23.197 11 HE3 MET 1 HE3 MET 1 -1.290 12.418 -24.365 12 H SER 2 HN SER 2 -0.380 18.208 -22.668 13 HA SER 2 HA SER 2 -1.035 19.366 -20.841 14 HB2 SER 2 HB2 SER 2 -2.301 20.757 -22.498 15 HB3 SER 2 HB1 SER 2 -3.710 19.737 -22.211 16 HG SER 2 HG SER 2 -4.008 21.334 -20.788 17 H TYR 3 HN TYR 3 -1.192 18.210 -19.072 18 HA TYR 3 HA TYR 3 -3.655 16.707 -18.581 19 HB2 TYR 3 HB2 TYR 3 -2.011 15.079 -19.407 20 HB3 TYR 3 HB1 TYR 3 -0.875 15.590 -18.163 21 HD1 TYR 3 HD2 TYR 3 -4.193 13.997 -18.684 22 HD2 TYR 3 HD1 TYR 3 -0.949 14.639 -16.011 23 HE1 TYR 3 HE2 TYR 3 -5.139 12.333 -17.149 24 HE2 TYR 3 HE1 TYR 3 -1.891 12.977 -14.462 25 HH TYR 3 HH TYR 3 -4.097 11.982 -13.961 26 H ILE 4 HN ILE 4 -4.448 17.859 -16.963 27 HA ILE 4 HA ILE 4 -2.839 18.148 -14.554 28 HB ILE 4 HB ILE 4 -4.299 20.485 -14.530 29 HG12 ILE 4 HG12 ILE 4 -3.474 21.641 -16.651 30 HG13 ILE 4 HG11 ILE 4 -3.216 20.032 -17.311 31 HG21 ILE 4 HG21 ILE 4 -2.086 20.223 -13.641 32 HG22 ILE 4 HG22 ILE 4 -2.101 21.585 -14.763 33 HG23 ILE 4 HG23 ILE 4 -1.414 20.038 -15.263 34 HD11 ILE 4 HD11 ILE 4 -5.844 21.169 -16.391 35 HD12 ILE 4 HD12 ILE 4 -5.595 19.548 -17.041 36 HD13 ILE 4 HD13 ILE 4 -5.318 20.959 -18.062 37 HA PRO 5 HA PRO 5 -6.870 16.598 -13.211 38 HB2 PRO 5 HB2 PRO 5 -5.354 15.691 -10.883 39 HB3 PRO 5 HB1 PRO 5 -6.223 14.730 -12.080 40 HG2 PRO 5 HG2 PRO 5 -3.528 14.724 -11.915 41 HG3 PRO 5 HG1 PRO 5 -4.384 14.536 -13.459 42 HD2 PRO 5 HD2 PRO 5 -3.111 16.992 -12.289 43 HD3 PRO 5 HD1 PRO 5 -3.018 16.357 -13.947 44 H GLY 6 HN GLY 6 -7.209 16.487 -10.394 45 HA2 GLY 6 HA2 GLY 6 -7.721 19.238 -9.786 46 HA3 GLY 6 HA1 GLY 6 -7.962 17.865 -8.704 47 H GLN 7 HN GLN 7 -5.126 19.221 -10.302 48 HA GLN 7 HA GLN 7 -2.959 19.228 -9.474 49 HB2 GLN 7 HB2 GLN 7 -2.717 21.461 -8.417 50 HB3 GLN 7 HB1 GLN 7 -3.565 21.439 -9.944 51 HG2 GLN 7 HG2 GLN 7 -5.702 21.546 -8.698 52 HG3 GLN 7 HG1 GLN 7 -4.779 21.700 -7.203 53 HE21 GLN 7 HE21 GLN 7 -6.672 23.547 -8.494 54 HE22 GLN 7 HE22 GLN 7 -5.809 25.031 -8.709 55 HA PRO 8 HA PRO 8 -2.980 17.635 -5.217 56 HB2 PRO 8 HB2 PRO 8 -1.764 15.321 -5.712 57 HB3 PRO 8 HB1 PRO 8 -3.467 15.545 -6.128 58 HG2 PRO 8 HG2 PRO 8 -1.069 15.541 -7.895 59 HG3 PRO 8 HG1 PRO 8 -2.705 14.943 -8.217 60 HD2 PRO 8 HD2 PRO 8 -1.633 17.437 -9.002 61 HD3 PRO 8 HD1 PRO 8 -3.343 16.946 -9.068 62 H VAL 9 HN VAL 9 -0.895 16.444 -4.163 63 HA VAL 9 HA VAL 9 1.323 18.262 -4.542 64 HB VAL 9 HB VAL 9 0.472 17.386 -2.283 65 HG11 VAL 9 HG11 VAL 9 0.273 15.072 -2.738 66 HG12 VAL 9 HG12 VAL 9 1.583 15.245 -1.566 67 HG13 VAL 9 HG13 VAL 9 1.949 14.963 -3.272 68 HG21 VAL 9 HG21 VAL 9 2.699 17.390 -1.276 69 HG22 VAL 9 HG22 VAL 9 2.560 18.652 -2.500 70 HG23 VAL 9 HG23 VAL 9 3.424 17.157 -2.867 71 H THR 10 HN THR 10 0.262 15.496 -5.647 72 HA THR 10 HA THR 10 0.882 14.068 -7.248 73 HB THR 10 HB THR 10 2.619 14.549 -8.767 74 HG1 THR 10 HG1 THR 10 3.730 15.995 -6.613 75 HG21 THR 10 HG21 THR 10 1.466 17.102 -7.643 76 HG22 THR 10 HG22 THR 10 0.693 16.015 -8.810 77 HG23 THR 10 HG23 THR 10 2.144 16.909 -9.273 78 H ALA 11 HN ALA 11 1.142 12.243 -6.572 79 HA ALA 11 HA ALA 11 2.819 11.198 -4.642 80 HB1 ALA 11 HB1 ALA 11 0.934 9.909 -5.264 81 HB2 ALA 11 HB2 ALA 11 2.359 8.996 -5.788 82 HB3 ALA 11 HB3 ALA 11 1.415 9.912 -6.961 83 H VAL 12 HN VAL 12 4.666 10.490 -4.598 84 HA VAL 12 HA VAL 12 6.449 10.679 -6.871 85 HB VAL 12 HB VAL 12 7.090 9.385 -4.277 86 HG11 VAL 12 HG11 VAL 12 8.726 11.041 -6.178 87 HG12 VAL 12 HG12 VAL 12 8.802 9.292 -5.966 88 HG13 VAL 12 HG13 VAL 12 9.320 10.363 -4.663 89 HG21 VAL 12 HG21 VAL 12 7.696 11.573 -3.318 90 HG22 VAL 12 HG22 VAL 12 5.958 11.390 -3.608 91 HG23 VAL 12 HG23 VAL 12 6.952 12.351 -4.715 92 H VAL 13 HN VAL 13 7.368 8.877 -7.819 93 HA VAL 13 HA VAL 13 6.244 6.261 -7.104 94 HB VAL 13 HB VAL 13 7.126 7.080 -9.868 95 HG11 VAL 13 HG11 VAL 13 7.343 4.708 -9.452 96 HG12 VAL 13 HG12 VAL 13 5.993 5.004 -10.549 97 HG13 VAL 13 HG13 VAL 13 5.685 4.641 -8.852 98 HG21 VAL 13 HG21 VAL 13 5.132 8.335 -9.277 99 HG22 VAL 13 HG22 VAL 13 4.336 6.855 -8.742 100 HG23 VAL 13 HG23 VAL 13 4.724 7.081 -10.448 101 H GLN 14 HN GLN 14 7.731 4.989 -6.258 102 HA GLN 14 HA GLN 14 10.400 4.958 -7.389 103 HB2 GLN 14 HB2 GLN 14 11.347 4.797 -5.074 104 HB3 GLN 14 HB1 GLN 14 10.746 6.382 -5.535 105 HG2 GLN 14 HG2 GLN 14 8.866 4.599 -4.124 106 HG3 GLN 14 HG1 GLN 14 10.223 5.233 -3.198 107 HE21 GLN 14 HE21 GLN 14 10.450 7.487 -2.974 108 HE22 GLN 14 HE22 GLN 14 9.079 8.540 -3.170 109 H ARG 15 HN ARG 15 11.662 3.175 -6.240 110 HA ARG 15 HA ARG 15 10.026 0.761 -6.320 111 HB2 ARG 15 HB2 ARG 15 12.501 1.599 -7.777 112 HB3 ARG 15 HB1 ARG 15 12.199 -0.087 -7.458 113 HG2 ARG 15 HG2 ARG 15 10.052 1.522 -8.715 114 HG3 ARG 15 HG1 ARG 15 11.439 1.019 -9.702 115 HD2 ARG 15 HD2 ARG 15 10.978 -1.328 -8.701 116 HD3 ARG 15 HD1 ARG 15 9.392 -0.668 -8.312 117 HE ARG 15 HE ARG 15 9.403 -0.106 -10.845 118 HH11 ARG 15 HH11 ARG 15 10.745 -2.970 -9.372 119 HH12 ARG 15 HH12 ARG 15 10.479 -3.978 -10.764 120 HH21 ARG 15 HH21 ARG 15 9.058 -1.413 -12.700 121 HH22 ARG 15 HH22 ARG 15 9.529 -3.087 -12.644 122 H VAL 16 HN VAL 16 10.280 -0.332 -4.459 123 HA VAL 16 HA VAL 16 12.939 -0.332 -3.264 124 HB VAL 16 HB VAL 16 11.853 1.145 -1.800 125 HG11 VAL 16 HG11 VAL 16 9.598 0.942 -2.628 126 HG12 VAL 16 HG12 VAL 16 9.626 0.803 -0.868 127 HG13 VAL 16 HG13 VAL 16 9.446 -0.640 -1.863 128 HG21 VAL 16 HG21 VAL 16 11.383 -1.550 -0.547 129 HG22 VAL 16 HG22 VAL 16 11.548 -0.008 0.310 130 HG23 VAL 16 HG23 VAL 16 12.921 -0.687 -0.578 131 H GLU 17 HN GLU 17 13.564 -2.280 -2.453 132 HA GLU 17 HA GLU 17 11.763 -4.544 -2.864 133 HB2 GLU 17 HB2 GLU 17 14.419 -5.499 -2.889 134 HB3 GLU 17 HB1 GLU 17 13.278 -5.450 -4.222 135 HG2 GLU 17 HG2 GLU 17 15.221 -4.394 -4.996 136 HG3 GLU 17 HG1 GLU 17 14.081 -3.096 -4.657 137 H ILE 18 HN ILE 18 11.179 -5.404 -1.037 138 HA ILE 18 HA ILE 18 12.736 -4.984 1.386 139 HB ILE 18 HB ILE 18 9.799 -5.433 0.892 140 HG12 ILE 18 HG12 ILE 18 10.923 -3.034 2.247 141 HG13 ILE 18 HG11 ILE 18 11.049 -3.154 0.490 142 HG21 ILE 18 HG21 ILE 18 9.496 -5.100 3.293 143 HG22 ILE 18 HG22 ILE 18 11.247 -5.049 3.504 144 HG23 ILE 18 HG23 ILE 18 10.469 -6.529 2.945 145 HD11 ILE 18 HD11 ILE 18 8.579 -3.202 2.168 146 HD12 ILE 18 HD12 ILE 18 8.613 -3.631 0.453 147 HD13 ILE 18 HD13 ILE 18 9.060 -1.996 0.967 148 H HIS 19 HN HIS 19 13.505 -6.645 2.385 149 HA HIS 19 HA HIS 19 12.477 -9.304 1.813 150 HB2 HIS 19 HB2 HIS 19 14.856 -10.043 1.840 151 HB3 HIS 19 HB1 HIS 19 14.418 -9.024 0.488 152 HD1 HIS 19 HD1 HIS 19 16.644 -9.195 3.451 153 HD2 HIS 19 HD2 HIS 19 15.632 -6.471 0.483 154 HE1 HIS 19 HE1 HIS 19 18.385 -7.388 3.569 155 HE2 HIS 19 HE2 HIS 19 17.858 -5.852 1.643 156 H LYS 20 HN LYS 20 11.501 -9.789 3.759 157 HA LYS 20 HA LYS 20 12.818 -9.269 6.253 158 HB2 LYS 20 HB2 LYS 20 10.223 -9.666 5.640 159 HB3 LYS 20 HB1 LYS 20 10.672 -11.263 6.220 160 HG2 LYS 20 HG2 LYS 20 11.002 -8.685 7.731 161 HG3 LYS 20 HG1 LYS 20 9.754 -9.898 8.002 162 HD2 LYS 20 HD2 LYS 20 11.464 -11.528 8.622 163 HD3 LYS 20 HD1 LYS 20 12.725 -10.333 8.316 164 HE2 LYS 20 HE2 LYS 20 11.729 -8.898 10.066 165 HE3 LYS 20 HE1 LYS 20 10.560 -10.169 10.405 166 HZ1 LYS 20 HZ1 LYS 20 12.426 -10.186 11.951 167 HZ2 LYS 20 HZ2 LYS 20 13.502 -10.455 10.672 168 HZ3 LYS 20 HZ3 LYS 20 12.345 -11.631 11.061 169 H LEU 21 HN LEU 21 11.447 -12.416 5.851 170 HA LEU 21 HA LEU 21 14.012 -13.674 5.451 171 HB2 LEU 21 HB2 LEU 21 14.246 -13.217 7.793 172 HB3 LEU 21 HB1 LEU 21 12.643 -13.863 8.131 173 HG LEU 21 HG LEU 21 13.376 -16.109 7.672 174 HD11 LEU 21 HD11 LEU 21 15.817 -16.515 7.165 175 HD12 LEU 21 HD12 LEU 21 15.927 -14.802 6.750 176 HD13 LEU 21 HD13 LEU 21 14.845 -15.869 5.844 177 HD21 LEU 21 HD21 LEU 21 15.430 -14.688 9.373 178 HD22 LEU 21 HD22 LEU 21 15.019 -16.404 9.440 179 HD23 LEU 21 HD23 LEU 21 13.828 -15.192 9.909 180 H ARG 22 HN ARG 22 13.731 -15.536 4.388 181 HA ARG 22 HA ARG 22 11.198 -16.830 4.245 182 HB2 ARG 22 HB2 ARG 22 12.121 -17.854 2.487 183 HB3 ARG 22 HB1 ARG 22 13.520 -16.823 2.726 184 HG2 ARG 22 HG2 ARG 22 14.529 -18.859 2.695 185 HG3 ARG 22 HG1 ARG 22 14.158 -18.732 4.420 186 HD2 ARG 22 HD2 ARG 22 13.447 -20.866 3.801 187 HD3 ARG 22 HD1 ARG 22 12.003 -19.884 3.924 188 HE ARG 22 HE ARG 22 11.965 -19.793 1.492 189 HH11 ARG 22 HH11 ARG 22 14.094 -22.187 2.895 190 HH12 ARG 22 HH12 ARG 22 13.943 -23.288 1.558 191 HH21 ARG 22 HH21 ARG 22 11.814 -21.228 -0.297 192 HH22 ARG 22 HH22 ARG 22 12.679 -22.732 -0.271 193 H GLN 23 HN GLN 23 10.465 -18.450 5.424 194 HA GLN 23 HA GLN 23 12.195 -19.638 7.445 195 HB2 GLN 23 HB2 GLN 23 9.331 -18.984 8.010 196 HB3 GLN 23 HB1 GLN 23 10.641 -19.288 9.132 197 HG2 GLN 23 HG2 GLN 23 11.686 -17.161 8.129 198 HG3 GLN 23 HG1 GLN 23 10.048 -16.844 7.549 199 HE21 GLN 23 HE21 GLN 23 9.983 -15.002 8.792 200 HE22 GLN 23 HE22 GLN 23 9.712 -15.053 10.519 201 H GLY 24 HN GLY 24 12.102 -20.980 5.413 202 HA2 GLY 24 HA2 GLY 24 11.772 -23.155 4.760 203 HA3 GLY 24 HA1 GLY 24 10.737 -23.357 6.170 204 H GLU 25 HN GLU 25 8.628 -23.338 5.948 205 HA GLU 25 HA GLU 25 7.444 -23.301 3.348 206 HB2 GLU 25 HB2 GLU 25 6.340 -23.423 6.145 207 HB3 GLU 25 HB1 GLU 25 5.316 -23.380 4.719 208 HG2 GLU 25 HG2 GLU 25 7.314 -25.502 5.465 209 HG3 GLU 25 HG1 GLU 25 5.557 -25.649 5.470 210 H ASN 26 HN ASN 26 8.540 -20.928 5.295 211 HA ASN 26 HA ASN 26 6.412 -19.077 4.680 212 HB2 ASN 26 HB2 ASN 26 8.474 -19.073 6.867 213 HB3 ASN 26 HB1 ASN 26 7.491 -17.687 6.465 214 HD21 ASN 26 HD21 ASN 26 7.618 -20.800 7.716 215 HD22 ASN 26 HD22 ASN 26 6.072 -20.818 8.526 216 H LEU 27 HN LEU 27 6.850 -17.354 3.912 217 HA LEU 27 HA LEU 27 9.506 -16.407 3.227 218 HB2 LEU 27 HB2 LEU 27 7.180 -16.911 1.415 219 HB3 LEU 27 HB1 LEU 27 8.096 -15.450 1.166 220 HG LEU 27 HG LEU 27 8.872 -17.197 -0.335 221 HD11 LEU 27 HD11 LEU 27 10.866 -16.647 1.856 222 HD12 LEU 27 HD12 LEU 27 10.524 -15.605 0.473 223 HD13 LEU 27 HD13 LEU 27 11.244 -17.196 0.226 224 HD21 LEU 27 HD21 LEU 27 8.243 -19.159 0.890 225 HD22 LEU 27 HD22 LEU 27 9.359 -18.758 2.198 226 HD23 LEU 27 HD23 LEU 27 9.984 -19.212 0.607 227 H ILE 28 HN ILE 28 9.599 -14.610 4.423 228 HA ILE 28 HA ILE 28 7.050 -13.391 5.163 229 HB ILE 28 HB ILE 28 9.718 -13.221 6.493 230 HG12 ILE 28 HG12 ILE 28 8.896 -15.495 6.563 231 HG13 ILE 28 HG11 ILE 28 8.817 -14.775 8.157 232 HG21 ILE 28 HG21 ILE 28 7.072 -12.156 7.256 233 HG22 ILE 28 HG22 ILE 28 8.636 -11.331 7.123 234 HG23 ILE 28 HG23 ILE 28 8.337 -12.467 8.444 235 HD11 ILE 28 HD11 ILE 28 6.426 -14.512 7.953 236 HD12 ILE 28 HD12 ILE 28 6.875 -16.188 7.603 237 HD13 ILE 28 HD13 ILE 28 6.482 -15.082 6.283 238 H LEU 29 HN LEU 29 6.568 -11.529 4.541 239 HA LEU 29 HA LEU 29 8.506 -9.640 3.481 240 HB2 LEU 29 HB2 LEU 29 6.418 -10.033 2.282 241 HB3 LEU 29 HB1 LEU 29 5.491 -9.628 3.711 242 HG LEU 29 HG LEU 29 5.983 -7.341 3.525 243 HD11 LEU 29 HD11 LEU 29 8.380 -7.682 3.171 244 HD12 LEU 29 HD12 LEU 29 7.705 -6.457 2.087 245 HD13 LEU 29 HD13 LEU 29 8.062 -8.076 1.480 246 HD21 LEU 29 HD21 LEU 29 5.292 -6.771 1.269 247 HD22 LEU 29 HD22 LEU 29 4.405 -8.198 1.815 248 HD23 LEU 29 HD23 LEU 29 5.757 -8.373 0.696 249 H GLY 30 HN GLY 30 6.140 -10.018 6.082 250 HA2 GLY 30 HA2 GLY 30 6.686 -9.431 8.313 251 HA3 GLY 30 HA1 GLY 30 7.819 -8.248 7.695 252 H PHE 31 HN PHE 31 6.190 -6.769 5.972 253 HA PHE 31 HA PHE 31 4.793 -5.328 8.066 254 HB2 PHE 31 HB2 PHE 31 4.783 -3.419 6.616 255 HB3 PHE 31 HB1 PHE 31 6.393 -4.107 6.668 256 HD1 PHE 31 HD1 PHE 31 3.399 -3.648 4.595 257 HD2 PHE 31 HD2 PHE 31 7.456 -4.888 4.711 258 HE1 PHE 31 HE1 PHE 31 3.466 -3.578 2.168 259 HE2 PHE 31 HE2 PHE 31 7.535 -4.835 2.256 260 HZ PHE 31 HZ PHE 31 5.539 -4.179 0.971 261 H SER 32 HN SER 32 2.784 -4.005 7.157 262 HA SER 32 HA SER 32 0.970 -6.012 5.958 263 HB2 SER 32 HB2 SER 32 0.699 -5.989 8.416 264 HB3 SER 32 HB1 SER 32 0.390 -4.254 8.362 265 HG SER 32 HG SER 32 -1.210 -5.752 6.693 266 H ILE 33 HN ILE 33 -0.618 -5.181 4.544 267 HA ILE 33 HA ILE 33 -0.574 -2.251 4.308 268 HB ILE 33 HB ILE 33 -0.443 -2.242 1.991 269 HG12 ILE 33 HG12 ILE 33 -2.138 -4.043 1.620 270 HG13 ILE 33 HG11 ILE 33 -0.784 -4.091 0.500 271 HG21 ILE 33 HG21 ILE 33 1.322 -4.512 2.881 272 HG22 ILE 33 HG22 ILE 33 1.693 -2.789 2.962 273 HG23 ILE 33 HG23 ILE 33 1.524 -3.583 1.395 274 HD11 ILE 33 HD11 ILE 33 -1.483 -6.301 1.233 275 HD12 ILE 33 HD12 ILE 33 -1.123 -5.866 2.907 276 HD13 ILE 33 HD13 ILE 33 0.180 -5.944 1.716 277 H GLY 34 HN GLY 34 -2.489 -1.511 2.984 278 HA2 GLY 34 HA2 GLY 34 -4.785 -3.238 3.639 279 HA3 GLY 34 HA1 GLY 34 -4.820 -1.501 3.953 280 H GLY 35 HN GLY 35 -6.334 -3.448 2.098 281 HA2 GLY 35 HA2 GLY 35 -6.173 -1.675 -0.235 282 HA3 GLY 35 HA1 GLY 35 -6.235 -3.425 -0.435 283 H GLY 36 HN GLY 36 -8.071 -1.467 -1.432 284 HA2 GLY 36 HA2 GLY 36 -10.500 -2.802 -0.591 285 HA3 GLY 36 HA1 GLY 36 -10.445 -1.088 -0.191 286 H ILE 37 HN ILE 37 -9.686 -3.145 -3.009 287 HA ILE 37 HA ILE 37 -11.224 -1.260 -4.651 288 HB ILE 37 HB ILE 37 -9.706 -1.863 -6.556 289 HG12 ILE 37 HG12 ILE 37 -8.654 -3.847 -5.304 290 HG13 ILE 37 HG11 ILE 37 -7.577 -2.814 -6.234 291 HG21 ILE 37 HG21 ILE 37 -9.624 0.285 -5.547 292 HG22 ILE 37 HG22 ILE 37 -7.971 -0.240 -5.865 293 HG23 ILE 37 HG23 ILE 37 -8.624 -0.318 -4.228 294 HD11 ILE 37 HD11 ILE 37 -7.995 -2.599 -3.263 295 HD12 ILE 37 HD12 ILE 37 -6.806 -1.734 -4.238 296 HD13 ILE 37 HD13 ILE 37 -6.677 -3.483 -4.033 297 H ASP 38 HN ASP 38 -9.819 -4.529 -4.795 298 HA ASP 38 HA ASP 38 -12.282 -5.415 -6.147 299 HB2 ASP 38 HB2 ASP 38 -10.013 -5.695 -7.311 300 HB3 ASP 38 HB1 ASP 38 -9.652 -6.900 -6.080 301 H GLN 39 HN GLN 39 -11.539 -4.979 -3.278 302 HA GLN 39 HA GLN 39 -11.389 -7.627 -2.134 303 HB2 GLN 39 HB2 GLN 39 -11.792 -5.097 -0.585 304 HB3 GLN 39 HB1 GLN 39 -11.016 -6.582 -0.071 305 HG2 GLN 39 HG2 GLN 39 -9.956 -4.572 -2.014 306 HG3 GLN 39 HG1 GLN 39 -9.370 -4.878 -0.387 307 HE21 GLN 39 HE21 GLN 39 -7.793 -4.936 -2.727 308 HE22 GLN 39 HE22 GLN 39 -7.165 -6.534 -2.886 309 H ASP 40 HN ASP 40 -13.404 -4.916 -1.237 310 HA ASP 40 HA ASP 40 -15.730 -6.684 -1.124 311 HB2 ASP 40 HB2 ASP 40 -15.162 -6.620 1.125 312 HB3 ASP 40 HB1 ASP 40 -14.536 -4.983 1.036 313 HA PRO 41 HA PRO 41 -17.339 -3.386 -3.597 314 HB2 PRO 41 HB2 PRO 41 -19.865 -4.271 -3.782 315 HB3 PRO 41 HB1 PRO 41 -18.533 -5.135 -4.565 316 HG2 PRO 41 HG2 PRO 41 -19.815 -5.688 -1.903 317 HG3 PRO 41 HG1 PRO 41 -19.509 -6.812 -3.232 318 HD2 PRO 41 HD2 PRO 41 -17.839 -6.655 -1.147 319 HD3 PRO 41 HD1 PRO 41 -17.229 -6.919 -2.794 320 H SER 42 HN SER 42 -18.372 -4.220 -0.444 321 HA SER 42 HA SER 42 -20.486 -2.375 -0.118 322 HB2 SER 42 HB2 SER 42 -18.698 -3.415 2.086 323 HB3 SER 42 HB1 SER 42 -20.409 -2.982 2.175 324 HG SER 42 HG SER 42 -19.186 -5.308 1.275 325 H GLN 43 HN GLN 43 -16.978 -2.182 0.367 326 HA GLN 43 HA GLN 43 -17.200 0.380 1.676 327 HB2 GLN 43 HB2 GLN 43 -14.822 0.157 1.916 328 HB3 GLN 43 HB1 GLN 43 -15.589 -1.372 2.321 329 HG2 GLN 43 HG2 GLN 43 -15.104 -1.895 -0.209 330 HG3 GLN 43 HG1 GLN 43 -13.871 -0.661 0.004 331 HE21 GLN 43 HE21 GLN 43 -15.035 -2.969 2.351 332 HE22 GLN 43 HE22 GLN 43 -13.532 -3.800 2.538 333 H ASN 44 HN ASN 44 -16.475 -0.956 -1.420 334 HA ASN 44 HA ASN 44 -16.303 1.614 -2.710 335 HB2 ASN 44 HB2 ASN 44 -14.047 0.810 -1.452 336 HB3 ASN 44 HB1 ASN 44 -13.820 0.092 -3.051 337 HD21 ASN 44 HD21 ASN 44 -12.751 2.492 -1.451 338 HD22 ASN 44 HD22 ASN 44 -12.769 3.781 -2.597 339 HA PRO 45 HA PRO 45 -17.476 -1.552 -5.757 340 HB2 PRO 45 HB2 PRO 45 -19.341 -0.050 -6.990 341 HB3 PRO 45 HB1 PRO 45 -19.689 -0.918 -5.482 342 HG2 PRO 45 HG2 PRO 45 -19.053 1.973 -5.908 343 HG3 PRO 45 HG1 PRO 45 -20.251 1.236 -4.829 344 HD2 PRO 45 HD2 PRO 45 -17.784 2.133 -4.012 345 HD3 PRO 45 HD1 PRO 45 -18.710 0.871 -3.179 346 H PHE 46 HN PHE 46 -15.682 1.135 -5.662 347 HA PHE 46 HA PHE 46 -15.280 1.220 -8.575 348 HB2 PHE 46 HB2 PHE 46 -14.895 3.448 -6.561 349 HB3 PHE 46 HB1 PHE 46 -14.436 3.544 -8.264 350 HD1 PHE 46 HD2 PHE 46 -16.203 3.490 -10.006 351 HD2 PHE 46 HD1 PHE 46 -17.118 3.791 -5.861 352 HE1 PHE 46 HE2 PHE 46 -18.460 4.293 -10.565 353 HE2 PHE 46 HE1 PHE 46 -19.382 4.588 -6.417 354 HZ PHE 46 HZ PHE 46 -20.056 4.841 -8.764 355 H SER 47 HN SER 47 -13.474 2.240 -5.656 356 HA SER 47 HA SER 47 -11.235 0.694 -5.830 357 HB2 SER 47 HB2 SER 47 -11.349 2.872 -7.857 358 HB3 SER 47 HB1 SER 47 -9.838 2.632 -6.996 359 HG SER 47 HG SER 47 -11.233 0.531 -8.288 360 H GLU 48 HN GLU 48 -12.252 4.003 -5.864 361 HA GLU 48 HA GLU 48 -12.173 4.639 -3.229 362 HB2 GLU 48 HB2 GLU 48 -9.555 4.292 -4.081 363 HB3 GLU 48 HB1 GLU 48 -9.781 6.040 -4.097 364 HG2 GLU 48 HG2 GLU 48 -10.239 4.196 -1.771 365 HG3 GLU 48 HG1 GLU 48 -8.912 5.345 -1.958 366 H ASP 49 HN ASP 49 -10.365 6.612 -5.478 367 HA ASP 49 HA ASP 49 -12.769 8.268 -5.897 368 HB2 ASP 49 HB2 ASP 49 -10.783 9.352 -4.741 369 HB3 ASP 49 HB1 ASP 49 -9.902 9.168 -6.253 370 H LYS 50 HN LYS 50 -12.326 5.923 -7.257 371 HA LYS 50 HA LYS 50 -12.500 5.035 -9.328 372 HB2 LYS 50 HB2 LYS 50 -13.659 7.159 -9.958 373 HB3 LYS 50 HB1 LYS 50 -12.086 7.825 -10.396 374 HG2 LYS 50 HG2 LYS 50 -13.532 6.883 -12.276 375 HG3 LYS 50 HG1 LYS 50 -11.834 6.397 -12.208 376 HD2 LYS 50 HD2 LYS 50 -12.525 4.363 -10.983 377 HD3 LYS 50 HD1 LYS 50 -14.210 4.818 -11.242 378 HE2 LYS 50 HE2 LYS 50 -12.179 4.296 -13.408 379 HE3 LYS 50 HE1 LYS 50 -13.430 3.169 -12.896 380 HZ1 LYS 50 HZ1 LYS 50 -15.104 4.786 -13.581 381 HZ2 LYS 50 HZ2 LYS 50 -14.097 4.344 -14.877 382 HZ3 LYS 50 HZ3 LYS 50 -13.883 5.839 -14.117 383 H THR 51 HN THR 51 -10.223 7.691 -9.615 384 HA THR 51 HA THR 51 -8.502 6.144 -11.315 385 HB THR 51 HB THR 51 -7.679 8.822 -10.309 386 HG1 THR 51 HG1 THR 51 -9.333 9.845 -11.292 387 HG21 THR 51 HG21 THR 51 -7.125 9.103 -12.680 388 HG22 THR 51 HG22 THR 51 -7.862 7.540 -13.027 389 HG23 THR 51 HG23 THR 51 -6.413 7.622 -12.026 390 H ASP 52 HN ASP 52 -8.816 5.896 -8.172 391 HA ASP 52 HA ASP 52 -6.019 6.038 -7.420 392 HB2 ASP 52 HB2 ASP 52 -8.042 6.637 -5.875 393 HB3 ASP 52 HB1 ASP 52 -8.180 4.892 -5.663 394 H LYS 53 HN LYS 53 -5.732 3.928 -5.851 395 HA LYS 53 HA LYS 53 -5.881 1.649 -7.711 396 HB2 LYS 53 HB2 LYS 53 -3.458 2.361 -6.060 397 HB3 LYS 53 HB1 LYS 53 -3.577 1.122 -7.302 398 HG2 LYS 53 HG2 LYS 53 -3.713 4.102 -7.736 399 HG3 LYS 53 HG1 LYS 53 -2.365 3.037 -8.138 400 HD2 LYS 53 HD2 LYS 53 -3.728 1.863 -9.750 401 HD3 LYS 53 HD1 LYS 53 -5.136 2.819 -9.288 402 HE2 LYS 53 HE2 LYS 53 -4.143 4.819 -10.141 403 HE3 LYS 53 HE1 LYS 53 -2.609 3.997 -10.426 404 HZ1 LYS 53 HZ1 LYS 53 -3.989 4.318 -12.444 405 HZ2 LYS 53 HZ2 LYS 53 -5.142 3.269 -11.780 406 HZ3 LYS 53 HZ3 LYS 53 -3.589 2.697 -12.137 407 H GLY 54 HN GLY 54 -6.083 2.930 -4.588 408 HA2 GLY 54 HA2 GLY 54 -7.161 2.078 -2.747 409 HA3 GLY 54 HA1 GLY 54 -7.551 0.655 -3.703 410 H ILE 55 HN ILE 55 -4.282 0.671 -3.858 411 HA ILE 55 HA ILE 55 -4.044 -0.926 -1.393 412 HB ILE 55 HB ILE 55 -2.268 -0.902 -3.847 413 HG12 ILE 55 HG12 ILE 55 -4.492 -2.052 -4.050 414 HG13 ILE 55 HG11 ILE 55 -3.096 -3.094 -4.309 415 HG21 ILE 55 HG21 ILE 55 -2.040 -2.532 -1.314 416 HG22 ILE 55 HG22 ILE 55 -0.914 -1.299 -1.883 417 HG23 ILE 55 HG23 ILE 55 -1.098 -2.807 -2.781 418 HD11 ILE 55 HD11 ILE 55 -4.777 -2.933 -1.812 419 HD12 ILE 55 HD12 ILE 55 -3.329 -3.926 -1.997 420 HD13 ILE 55 HD13 ILE 55 -4.752 -4.244 -2.989 421 H TYR 56 HN TYR 56 -2.785 -0.274 0.223 422 HA TYR 56 HA TYR 56 -0.444 1.352 -0.207 423 HB2 TYR 56 HB2 TYR 56 -1.091 3.220 1.182 424 HB3 TYR 56 HB1 TYR 56 -2.283 3.058 -0.103 425 HD1 TYR 56 HD2 TYR 56 -4.435 1.787 0.461 426 HD2 TYR 56 HD1 TYR 56 -1.770 3.299 3.401 427 HE1 TYR 56 HE2 TYR 56 -6.249 1.705 2.128 428 HE2 TYR 56 HE1 TYR 56 -3.570 3.228 5.083 429 HH TYR 56 HH TYR 56 -6.474 1.577 4.605 430 H VAL 57 HN VAL 57 0.944 1.301 1.662 431 HA VAL 57 HA VAL 57 0.505 -0.917 3.367 432 HB VAL 57 HB VAL 57 2.689 0.087 2.391 433 HG11 VAL 57 HG11 VAL 57 3.869 1.273 4.375 434 HG12 VAL 57 HG12 VAL 57 2.225 1.820 4.726 435 HG13 VAL 57 HG13 VAL 57 2.971 2.172 3.164 436 HG21 VAL 57 HG21 VAL 57 3.963 -1.001 4.084 437 HG22 VAL 57 HG22 VAL 57 2.487 -1.906 3.749 438 HG23 VAL 57 HG23 VAL 57 2.599 -0.898 5.195 439 H THR 58 HN THR 58 -0.046 -0.976 5.441 440 HA THR 58 HA THR 58 -0.850 1.563 6.677 441 HB THR 58 HB THR 58 -2.768 0.097 6.191 442 HG1 THR 58 HG1 THR 58 -2.006 0.736 8.819 443 HG21 THR 58 HG21 THR 58 -3.042 -2.013 7.451 444 HG22 THR 58 HG22 THR 58 -1.379 -1.867 8.023 445 HG23 THR 58 HG23 THR 58 -1.705 -2.083 6.303 446 H ARG 59 HN ARG 59 1.345 -0.989 6.822 447 HA ARG 59 HA ARG 59 2.531 0.160 9.135 448 HB2 ARG 59 HB2 ARG 59 2.038 -1.238 10.814 449 HB3 ARG 59 HB1 ARG 59 0.697 -1.725 9.820 450 HG2 ARG 59 HG2 ARG 59 1.742 -3.679 9.105 451 HG3 ARG 59 HG1 ARG 59 3.324 -3.120 9.636 452 HD2 ARG 59 HD2 ARG 59 1.023 -3.700 11.500 453 HD3 ARG 59 HD1 ARG 59 2.294 -4.857 11.113 454 HE ARG 59 HE ARG 59 3.872 -3.178 12.069 455 HH11 ARG 59 HH11 ARG 59 0.507 -3.218 13.043 456 HH12 ARG 59 HH12 ARG 59 0.810 -2.468 14.574 457 HH21 ARG 59 HH21 ARG 59 4.282 -2.176 14.087 458 HH22 ARG 59 HH22 ARG 59 2.952 -1.865 15.164 459 H VAL 60 HN VAL 60 4.373 -1.274 9.867 460 HA VAL 60 HA VAL 60 5.642 -2.536 7.583 461 HB VAL 60 HB VAL 60 6.582 -0.059 8.997 462 HG11 VAL 60 HG11 VAL 60 8.443 -1.426 9.314 463 HG12 VAL 60 HG12 VAL 60 8.817 -0.508 7.849 464 HG13 VAL 60 HG13 VAL 60 8.263 -2.185 7.739 465 HG21 VAL 60 HG21 VAL 60 7.042 0.701 6.739 466 HG22 VAL 60 HG22 VAL 60 5.375 0.135 6.868 467 HG23 VAL 60 HG23 VAL 60 6.595 -0.881 6.098 468 H SER 61 HN SER 61 6.905 -4.241 8.175 469 HA SER 61 HA SER 61 7.268 -4.994 10.863 470 HB2 SER 61 HB2 SER 61 9.311 -6.260 9.756 471 HB3 SER 61 HB1 SER 61 7.644 -6.776 9.488 472 HG SER 61 HG SER 61 8.404 -6.626 7.458 473 H GLU 62 HN GLU 62 8.137 -3.593 12.166 474 HA GLU 62 HA GLU 62 9.825 -1.555 11.220 475 HB2 GLU 62 HB2 GLU 62 9.520 -0.702 13.476 476 HB3 GLU 62 HB1 GLU 62 7.999 -1.084 12.721 477 HG2 GLU 62 HG2 GLU 62 8.497 -3.392 13.940 478 HG3 GLU 62 HG1 GLU 62 9.375 -2.300 15.002 479 H GLY 63 HN GLY 63 11.690 -1.020 12.043 480 HA2 GLY 63 HA2 GLY 63 13.940 -1.400 12.397 481 HA3 GLY 63 HA1 GLY 63 13.417 -2.475 13.699 482 H GLY 64 HN GLY 64 12.556 -2.866 10.302 483 HA2 GLY 64 HA2 GLY 64 13.995 -5.428 10.405 484 HA3 GLY 64 HA1 GLY 64 12.327 -5.287 9.857 485 HA PRO 65 HA PRO 65 14.459 -5.023 5.996 486 HB2 PRO 65 HB2 PRO 65 12.505 -6.119 4.582 487 HB3 PRO 65 HB1 PRO 65 13.521 -7.070 5.657 488 HG2 PRO 65 HG2 PRO 65 10.700 -6.302 5.943 489 HG3 PRO 65 HG1 PRO 65 11.579 -7.633 6.709 490 HD2 PRO 65 HD2 PRO 65 10.930 -5.051 7.820 491 HD3 PRO 65 HD1 PRO 65 11.792 -6.405 8.592 492 H ALA 66 HN ALA 66 11.134 -3.922 6.471 493 HA ALA 66 HA ALA 66 10.784 -3.111 3.756 494 HB1 ALA 66 HB1 ALA 66 8.759 -1.913 4.708 495 HB2 ALA 66 HB2 ALA 66 9.225 -2.581 6.276 496 HB3 ALA 66 HB3 ALA 66 8.818 -3.663 4.943 497 H GLU 67 HN GLU 67 11.801 -1.592 6.712 498 HA GLU 67 HA GLU 67 11.254 1.048 5.629 499 HB2 GLU 67 HB2 GLU 67 12.265 1.607 7.948 500 HB3 GLU 67 HB1 GLU 67 10.641 0.924 7.837 501 HG2 GLU 67 HG2 GLU 67 11.288 -1.102 8.637 502 HG3 GLU 67 HG1 GLU 67 12.911 -0.917 7.998 503 H ILE 68 HN ILE 68 13.848 -1.180 6.126 504 HA ILE 68 HA ILE 68 15.828 0.836 5.910 505 HB ILE 68 HB ILE 68 17.354 -1.005 5.794 506 HG12 ILE 68 HG12 ILE 68 15.049 -2.809 6.369 507 HG13 ILE 68 HG11 ILE 68 15.720 -2.598 4.752 508 HG21 ILE 68 HG21 ILE 68 16.829 -0.012 7.915 509 HG22 ILE 68 HG22 ILE 68 17.021 -1.753 8.129 510 HG23 ILE 68 HG23 ILE 68 15.407 -1.042 8.058 511 HD11 ILE 68 HD11 ILE 68 16.583 -4.580 5.858 512 HD12 ILE 68 HD12 ILE 68 17.230 -3.562 7.149 513 HD13 ILE 68 HD13 ILE 68 17.851 -3.404 5.507 514 H ALA 69 HN ALA 69 14.188 -1.526 4.076 515 HA ALA 69 HA ALA 69 15.606 -1.220 1.663 516 HB1 ALA 69 HB1 ALA 69 14.042 -3.069 1.980 517 HB2 ALA 69 HB2 ALA 69 13.584 -2.109 0.572 518 HB3 ALA 69 HB3 ALA 69 12.702 -1.927 2.086 519 H GLY 70 HN GLY 70 13.262 0.578 3.399 520 HA2 GLY 70 HA2 GLY 70 13.295 3.017 2.986 521 HA3 GLY 70 HA1 GLY 70 13.317 2.645 1.263 522 H LEU 71 HN LEU 71 11.286 1.323 3.883 523 HA LEU 71 HA LEU 71 8.943 2.516 2.590 524 HB2 LEU 71 HB2 LEU 71 9.322 0.003 2.293 525 HB3 LEU 71 HB1 LEU 71 9.090 -0.124 4.030 526 HG LEU 71 HG LEU 71 6.834 1.017 3.643 527 HD11 LEU 71 HD11 LEU 71 5.846 0.660 1.452 528 HD12 LEU 71 HD12 LEU 71 7.372 0.017 0.845 529 HD13 LEU 71 HD13 LEU 71 7.256 1.711 1.325 530 HD21 LEU 71 HD21 LEU 71 7.033 -1.210 4.380 531 HD22 LEU 71 HD22 LEU 71 7.538 -1.762 2.790 532 HD23 LEU 71 HD23 LEU 71 5.873 -1.224 3.049 533 H GLN 72 HN GLN 72 7.156 2.583 4.173 534 HA GLN 72 HA GLN 72 7.613 2.569 6.896 535 HB2 GLN 72 HB2 GLN 72 7.437 5.056 7.286 536 HB3 GLN 72 HB1 GLN 72 8.949 4.444 6.664 537 HG2 GLN 72 HG2 GLN 72 8.405 6.551 5.667 538 HG3 GLN 72 HG1 GLN 72 8.453 5.259 4.469 539 HE21 GLN 72 HE21 GLN 72 6.657 4.697 3.405 540 HE22 GLN 72 HE22 GLN 72 5.165 5.533 3.567 541 H ILE 73 HN ILE 73 5.636 4.229 7.783 542 HA ILE 73 HA ILE 73 3.448 2.607 6.914 543 HB ILE 73 HB ILE 73 3.205 4.830 8.902 544 HG12 ILE 73 HG12 ILE 73 5.278 3.865 9.598 545 HG13 ILE 73 HG11 ILE 73 4.039 3.189 10.648 546 HG21 ILE 73 HG21 ILE 73 1.255 3.550 8.343 547 HG22 ILE 73 HG22 ILE 73 1.747 3.202 10.001 548 HG23 ILE 73 HG23 ILE 73 2.107 2.055 8.712 549 HD11 ILE 73 HD11 ILE 73 5.616 1.484 9.984 550 HD12 ILE 73 HD12 ILE 73 5.310 1.832 8.276 551 HD13 ILE 73 HD13 ILE 73 4.030 1.145 9.289 552 H GLY 74 HN GLY 74 2.383 3.185 5.129 553 HA2 GLY 74 HA2 GLY 74 0.364 4.531 4.622 554 HA3 GLY 74 HA1 GLY 74 1.297 5.951 5.107 555 H ASP 75 HN ASP 75 1.547 3.197 2.871 556 HA ASP 75 HA ASP 75 2.756 5.049 0.919 557 HB2 ASP 75 HB2 ASP 75 4.176 3.193 2.516 558 HB3 ASP 75 HB1 ASP 75 4.110 2.517 0.892 559 H LYS 76 HN LYS 76 1.706 4.759 -1.029 560 HA LYS 76 HA LYS 76 -0.139 2.534 -1.172 561 HB2 LYS 76 HB2 LYS 76 0.380 4.645 -3.267 562 HB3 LYS 76 HB1 LYS 76 -1.015 3.587 -3.150 563 HG2 LYS 76 HG2 LYS 76 -1.938 4.783 -1.399 564 HG3 LYS 76 HG1 LYS 76 -0.387 5.507 -0.952 565 HD2 LYS 76 HD2 LYS 76 -1.675 7.209 -2.018 566 HD3 LYS 76 HD1 LYS 76 -0.405 6.704 -3.140 567 HE2 LYS 76 HE2 LYS 76 -2.414 6.924 -4.401 568 HE3 LYS 76 HE1 LYS 76 -2.090 5.200 -4.228 569 HZ1 LYS 76 HZ1 LYS 76 -4.421 5.646 -3.853 570 HZ2 LYS 76 HZ2 LYS 76 -4.052 6.785 -2.661 571 HZ3 LYS 76 HZ3 LYS 76 -3.707 5.154 -2.398 572 H ILE 77 HN ILE 77 0.746 0.701 -1.656 573 HA ILE 77 HA ILE 77 2.953 0.428 -3.480 574 HB ILE 77 HB ILE 77 1.252 -1.662 -2.115 575 HG12 ILE 77 HG12 ILE 77 4.057 -0.781 -1.453 576 HG13 ILE 77 HG11 ILE 77 2.633 -0.079 -0.692 577 HG21 ILE 77 HG21 ILE 77 2.281 -2.582 -4.103 578 HG22 ILE 77 HG22 ILE 77 3.086 -3.212 -2.664 579 HG23 ILE 77 HG23 ILE 77 3.852 -1.940 -3.617 580 HD11 ILE 77 HD11 ILE 77 3.654 -1.807 0.686 581 HD12 ILE 77 HD12 ILE 77 3.406 -2.984 -0.607 582 HD13 ILE 77 HD13 ILE 77 2.019 -2.242 0.192 583 H MET 78 HN MET 78 2.731 0.363 -5.603 584 HA MET 78 HA MET 78 0.044 -0.056 -6.694 585 HB2 MET 78 HB2 MET 78 2.458 1.030 -8.131 586 HB3 MET 78 HB1 MET 78 0.769 1.189 -8.589 587 HG2 MET 78 HG2 MET 78 1.840 2.367 -6.056 588 HG3 MET 78 HG1 MET 78 1.944 3.222 -7.592 589 HE1 MET 78 HE1 MET 78 -0.231 2.089 -4.637 590 HE2 MET 78 HE2 MET 78 -1.016 1.047 -5.823 591 HE3 MET 78 HE3 MET 78 -1.883 2.423 -5.148 592 H GLN 79 HN GLN 79 3.052 -1.562 -6.379 593 HA GLN 79 HA GLN 79 2.331 -3.702 -8.168 594 HB2 GLN 79 HB2 GLN 79 4.853 -2.139 -8.694 595 HB3 GLN 79 HB1 GLN 79 4.387 -3.626 -9.482 596 HG2 GLN 79 HG2 GLN 79 2.387 -2.420 -10.317 597 HG3 GLN 79 HG1 GLN 79 3.097 -0.927 -9.705 598 HE21 GLN 79 HE21 GLN 79 5.770 -2.206 -10.437 599 HE22 GLN 79 HE22 GLN 79 5.876 -1.961 -12.150 600 H VAL 80 HN VAL 80 3.617 -5.487 -7.944 601 HA VAL 80 HA VAL 80 5.726 -5.330 -5.887 602 HB VAL 80 HB VAL 80 4.252 -6.362 -4.530 603 HG11 VAL 80 HG11 VAL 80 2.410 -6.021 -6.088 604 HG12 VAL 80 HG12 VAL 80 2.278 -7.576 -5.245 605 HG13 VAL 80 HG13 VAL 80 2.837 -7.525 -6.918 606 HG21 VAL 80 HG21 VAL 80 5.039 -8.713 -6.283 607 HG22 VAL 80 HG22 VAL 80 4.396 -8.830 -4.637 608 HG23 VAL 80 HG23 VAL 80 5.967 -8.069 -4.916 609 H ASN 81 HN ASN 81 7.573 -6.157 -6.592 610 HA ASN 81 HA ASN 81 9.135 -7.198 -7.851 611 HB2 ASN 81 HB2 ASN 81 6.937 -9.255 -7.898 612 HB3 ASN 81 HB1 ASN 81 8.522 -9.541 -8.630 613 HD21 ASN 81 HD21 ASN 81 6.872 -10.333 -6.081 614 HD22 ASN 81 HD22 ASN 81 8.109 -10.367 -4.854 615 H GLY 82 HN GLY 82 6.709 -5.740 -9.111 616 HA2 GLY 82 HA2 GLY 82 7.197 -4.631 -11.256 617 HA3 GLY 82 HA1 GLY 82 7.567 -6.234 -11.893 618 H TRP 83 HN TRP 83 4.997 -6.670 -9.882 619 HA TRP 83 HA TRP 83 3.213 -6.749 -12.166 620 HB2 TRP 83 HB2 TRP 83 2.768 -7.932 -9.444 621 HB3 TRP 83 HB1 TRP 83 1.920 -8.298 -10.924 622 HD1 TRP 83 HD1 TRP 83 5.470 -8.392 -9.676 623 HE1 TRP 83 HE1 TRP 83 6.539 -10.560 -10.361 624 HE3 TRP 83 HE3 TRP 83 1.628 -10.396 -12.344 625 HZ2 TRP 83 HZ2 TRP 83 5.938 -12.855 -11.868 626 HZ3 TRP 83 HZ3 TRP 83 1.972 -12.607 -13.389 627 HH2 TRP 83 HH2 TRP 83 4.097 -13.787 -13.137 628 H ASP 84 HN ASP 84 2.416 -4.749 -12.254 629 HA ASP 84 HA ASP 84 1.436 -3.058 -10.381 630 HB2 ASP 84 HB2 ASP 84 1.301 -2.561 -12.759 631 HB3 ASP 84 HB1 ASP 84 0.079 -3.812 -12.977 632 H MET 85 HN MET 85 0.437 -3.626 -8.591 633 HA MET 85 HA MET 85 -1.794 -5.541 -8.683 634 HB2 MET 85 HB2 MET 85 -1.605 -5.306 -6.137 635 HB3 MET 85 HB1 MET 85 -0.340 -6.178 -6.986 636 HG2 MET 85 HG2 MET 85 1.240 -4.623 -6.531 637 HG3 MET 85 HG1 MET 85 0.097 -3.288 -6.594 638 HE1 MET 85 HE1 MET 85 -0.002 -6.110 -2.964 639 HE2 MET 85 HE2 MET 85 1.078 -6.463 -4.310 640 HE3 MET 85 HE3 MET 85 -0.670 -6.447 -4.563 641 H THR 86 HN THR 86 -2.239 -2.893 -9.721 642 HA THR 86 HA THR 86 -3.604 -1.464 -7.579 643 HB THR 86 HB THR 86 -3.898 0.355 -9.155 644 HG1 THR 86 HG1 THR 86 -2.664 -1.368 -11.087 645 HG21 THR 86 HG21 THR 86 -1.547 0.871 -9.623 646 HG22 THR 86 HG22 THR 86 -1.115 -0.810 -9.309 647 HG23 THR 86 HG23 THR 86 -1.748 0.196 -8.005 648 H MET 87 HN MET 87 -4.371 -3.534 -10.211 649 HA MET 87 HA MET 87 -7.219 -2.844 -9.975 650 HB2 MET 87 HB2 MET 87 -5.777 -4.003 -12.366 651 HB3 MET 87 HB1 MET 87 -7.465 -3.531 -12.295 652 HG2 MET 87 HG2 MET 87 -6.871 -1.221 -12.031 653 HG3 MET 87 HG1 MET 87 -5.160 -1.635 -11.937 654 HE1 MET 87 HE1 MET 87 -5.225 0.166 -15.363 655 HE2 MET 87 HE2 MET 87 -4.346 -0.043 -13.847 656 HE3 MET 87 HE3 MET 87 -5.986 0.605 -13.835 657 H VAL 88 HN VAL 88 -5.499 -4.796 -8.507 658 HA VAL 88 HA VAL 88 -6.740 -7.320 -9.339 659 HB VAL 88 HB VAL 88 -4.282 -7.459 -7.726 660 HG11 VAL 88 HG11 VAL 88 -3.710 -8.934 -9.798 661 HG12 VAL 88 HG12 VAL 88 -5.452 -8.819 -10.091 662 HG13 VAL 88 HG13 VAL 88 -4.836 -9.492 -8.563 663 HG21 VAL 88 HG21 VAL 88 -3.726 -5.487 -9.049 664 HG22 VAL 88 HG22 VAL 88 -4.134 -6.358 -10.526 665 HG23 VAL 88 HG23 VAL 88 -2.765 -6.882 -9.547 666 H THR 89 HN THR 89 -6.421 -8.944 -7.130 667 HA THR 89 HA THR 89 -8.341 -7.713 -5.339 668 HB THR 89 HB THR 89 -7.385 -10.570 -5.487 669 HG1 THR 89 HG1 THR 89 -9.440 -9.391 -7.090 670 HG21 THR 89 HG21 THR 89 -8.898 -10.029 -3.680 671 HG22 THR 89 HG22 THR 89 -9.666 -11.088 -4.857 672 HG23 THR 89 HG23 THR 89 -10.054 -9.368 -4.832 673 H HIS 90 HN HIS 90 -7.891 -9.487 -3.160 674 HA HIS 90 HA HIS 90 -5.460 -8.628 -1.864 675 HB2 HIS 90 HB2 HIS 90 -7.542 -8.986 -0.618 676 HB3 HIS 90 HB1 HIS 90 -7.569 -10.667 -1.145 677 HD1 HIS 90 HD1 HIS 90 -7.613 -11.484 1.293 678 HD2 HIS 90 HD2 HIS 90 -4.257 -9.226 0.345 679 HE1 HIS 90 HE1 HIS 90 -6.038 -11.764 3.232 680 HE2 HIS 90 HE2 HIS 90 -4.109 -10.228 2.719 681 H ASP 91 HN ASP 91 -6.781 -11.761 -2.708 682 HA ASP 91 HA ASP 91 -4.675 -13.363 -1.923 683 HB2 ASP 91 HB2 ASP 91 -6.881 -14.269 -2.387 684 HB3 ASP 91 HB1 ASP 91 -6.664 -13.912 -4.107 685 H GLN 92 HN GLN 92 -5.402 -12.661 -5.385 686 HA GLN 92 HA GLN 92 -3.213 -13.851 -6.511 687 HB2 GLN 92 HB2 GLN 92 -3.384 -11.861 -8.212 688 HB3 GLN 92 HB1 GLN 92 -4.643 -13.079 -8.095 689 HG2 GLN 92 HG2 GLN 92 -5.454 -10.743 -8.225 690 HG3 GLN 92 HG1 GLN 92 -6.031 -11.642 -6.832 691 HE21 GLN 92 HE21 GLN 92 -5.418 -11.035 -4.835 692 HE22 GLN 92 HE22 GLN 92 -4.546 -9.577 -4.512 693 H ALA 93 HN ALA 93 -3.267 -10.656 -5.047 694 HA ALA 93 HA ALA 93 -0.692 -9.856 -5.852 695 HB1 ALA 93 HB1 ALA 93 -2.605 -8.926 -3.720 696 HB2 ALA 93 HB2 ALA 93 -2.225 -8.152 -5.262 697 HB3 ALA 93 HB3 ALA 93 -1.030 -8.179 -3.965 698 H ARG 94 HN ARG 94 -2.143 -11.368 -3.033 699 HA ARG 94 HA ARG 94 0.065 -11.577 -1.379 700 HB2 ARG 94 HB2 ARG 94 -2.340 -13.336 -1.811 701 HB3 ARG 94 HB1 ARG 94 -1.098 -13.775 -0.637 702 HG2 ARG 94 HG2 ARG 94 -1.522 -11.513 0.421 703 HG3 ARG 94 HG1 ARG 94 -2.942 -11.414 -0.629 704 HD2 ARG 94 HD2 ARG 94 -2.364 -13.329 1.600 705 HD3 ARG 94 HD1 ARG 94 -3.787 -12.317 1.334 706 HE ARG 94 HE ARG 94 -3.684 -14.113 -0.776 707 HH11 ARG 94 HH11 ARG 94 -4.085 -14.206 2.697 708 HH12 ARG 94 HH12 ARG 94 -4.913 -15.742 2.690 709 HH21 ARG 94 HH21 ARG 94 -4.819 -16.101 -0.821 710 HH22 ARG 94 HH22 ARG 94 -5.374 -16.793 0.684 711 H LYS 95 HN LYS 95 -0.924 -13.427 -4.162 712 HA LYS 95 HA LYS 95 1.003 -15.514 -3.855 713 HB2 LYS 95 HB2 LYS 95 -0.180 -14.883 -6.525 714 HB3 LYS 95 HB1 LYS 95 0.096 -16.445 -5.771 715 HG2 LYS 95 HG2 LYS 95 -2.097 -14.490 -5.094 716 HG3 LYS 95 HG1 LYS 95 -2.264 -16.024 -5.952 717 HD2 LYS 95 HD2 LYS 95 -1.023 -16.100 -3.257 718 HD3 LYS 95 HD1 LYS 95 -2.755 -15.767 -3.348 719 HE2 LYS 95 HE2 LYS 95 -1.441 -18.084 -4.727 720 HE3 LYS 95 HE1 LYS 95 -2.123 -18.191 -3.104 721 HZ1 LYS 95 HZ1 LYS 95 -3.815 -18.914 -4.518 722 HZ2 LYS 95 HZ2 LYS 95 -3.520 -17.698 -5.666 723 HZ3 LYS 95 HZ3 LYS 95 -4.240 -17.303 -4.182 724 H ARG 96 HN ARG 96 1.060 -12.335 -5.234 725 HA ARG 96 HA ARG 96 3.440 -12.767 -6.780 726 HB2 ARG 96 HB2 ARG 96 2.095 -10.221 -5.883 727 HB3 ARG 96 HB1 ARG 96 3.439 -10.305 -7.014 728 HG2 ARG 96 HG2 ARG 96 0.677 -11.433 -7.410 729 HG3 ARG 96 HG1 ARG 96 1.394 -10.049 -8.237 730 HD2 ARG 96 HD2 ARG 96 1.626 -11.775 -9.770 731 HD3 ARG 96 HD1 ARG 96 3.205 -11.694 -8.998 732 HE ARG 96 HE ARG 96 2.521 -13.642 -7.675 733 HH11 ARG 96 HH11 ARG 96 0.715 -12.931 -10.577 734 HH12 ARG 96 HH12 ARG 96 0.201 -14.575 -10.807 735 HH21 ARG 96 HH21 ARG 96 1.851 -15.801 -7.973 736 HH22 ARG 96 HH22 ARG 96 0.832 -16.198 -9.323 737 H LEU 97 HN LEU 97 2.738 -11.213 -3.678 738 HA LEU 97 HA LEU 97 5.398 -10.368 -3.229 739 HB2 LEU 97 HB2 LEU 97 4.601 -9.994 -0.886 740 HB3 LEU 97 HB1 LEU 97 3.699 -9.170 -2.142 741 HG LEU 97 HG LEU 97 2.126 -11.262 -1.974 742 HD11 LEU 97 HD11 LEU 97 2.023 -12.233 0.216 743 HD12 LEU 97 HD12 LEU 97 3.354 -11.214 0.769 744 HD13 LEU 97 HD13 LEU 97 3.643 -12.455 -0.451 745 HD21 LEU 97 HD21 LEU 97 2.169 -9.103 0.129 746 HD22 LEU 97 HD22 LEU 97 0.778 -10.085 -0.331 747 HD23 LEU 97 HD23 LEU 97 1.482 -8.959 -1.489 748 H THR 98 HN THR 98 3.725 -13.345 -2.459 749 HA THR 98 HA THR 98 6.357 -14.395 -1.689 750 HB THR 98 HB THR 98 5.110 -14.501 0.341 751 HG1 THR 98 HG1 THR 98 5.274 -16.975 -1.027 752 HG21 THR 98 HG21 THR 98 2.939 -15.666 0.533 753 HG22 THR 98 HG22 THR 98 2.889 -15.811 -1.224 754 HG23 THR 98 HG23 THR 98 2.848 -14.217 -0.467 755 H LYS 99 HN LYS 99 6.086 -14.374 -4.173 756 HA LYS 99 HA LYS 99 4.569 -16.482 -5.342 757 HB2 LYS 99 HB2 LYS 99 5.870 -16.016 -7.398 758 HB3 LYS 99 HB1 LYS 99 5.170 -14.558 -6.702 759 HG2 LYS 99 HG2 LYS 99 7.452 -14.283 -5.550 760 HG3 LYS 99 HG1 LYS 99 8.023 -15.460 -6.733 761 HD2 LYS 99 HD2 LYS 99 7.362 -14.014 -8.550 762 HD3 LYS 99 HD1 LYS 99 6.619 -12.882 -7.416 763 HE2 LYS 99 HE2 LYS 99 8.678 -11.906 -7.902 764 HE3 LYS 99 HE1 LYS 99 8.939 -12.712 -6.358 765 HZ1 LYS 99 HZ1 LYS 99 9.671 -13.885 -8.986 766 HZ2 LYS 99 HZ2 LYS 99 10.066 -14.486 -7.457 767 HZ3 LYS 99 HZ3 LYS 99 10.752 -13.034 -7.993 768 H ARG 100 HN ARG 100 7.289 -16.458 -3.574 769 HA ARG 100 HA ARG 100 8.617 -18.130 -2.784 770 HB2 ARG 100 HB2 ARG 100 6.654 -19.631 -4.385 771 HB3 ARG 100 HB1 ARG 100 8.185 -20.454 -4.108 772 HG2 ARG 100 HG2 ARG 100 6.573 -19.245 -1.881 773 HG3 ARG 100 HG1 ARG 100 6.321 -20.897 -2.451 774 HD2 ARG 100 HD2 ARG 100 9.043 -19.920 -1.662 775 HD3 ARG 100 HD1 ARG 100 7.903 -20.505 -0.455 776 HE ARG 100 HE ARG 100 7.962 -22.659 -1.527 777 HH11 ARG 100 HH11 ARG 100 10.389 -20.403 -2.673 778 HH12 ARG 100 HH12 ARG 100 11.493 -21.645 -3.184 779 HH21 ARG 100 HH21 ARG 100 9.408 -24.293 -2.196 780 HH22 ARG 100 HH22 ARG 100 10.924 -23.861 -2.928 781 H SER 101 HN SER 101 8.823 -16.675 -5.578 782 HA SER 101 HA SER 101 11.244 -18.151 -6.391 783 HB2 SER 101 HB2 SER 101 9.289 -18.164 -8.014 784 HB3 SER 101 HB1 SER 101 9.543 -16.432 -8.210 785 HG SER 101 HG SER 101 11.677 -18.244 -8.554 786 H GLU 102 HN GLU 102 10.700 -15.858 -4.465 787 HA GLU 102 HA GLU 102 12.633 -13.985 -5.594 788 HB2 GLU 102 HB2 GLU 102 11.594 -12.189 -4.391 789 HB3 GLU 102 HB1 GLU 102 10.359 -12.992 -5.346 790 HG2 GLU 102 HG2 GLU 102 10.805 -13.580 -2.434 791 HG3 GLU 102 HG1 GLU 102 9.713 -12.323 -3.006 792 H GLU 103 HN GLU 103 13.472 -12.680 -3.709 793 HA GLU 103 HA GLU 103 14.113 -14.272 -1.352 794 HB2 GLU 103 HB2 GLU 103 16.171 -12.813 -3.019 795 HB3 GLU 103 HB1 GLU 103 16.484 -13.707 -1.537 796 HG2 GLU 103 HG2 GLU 103 16.102 -15.772 -2.574 797 HG3 GLU 103 HG1 GLU 103 15.332 -15.013 -3.967 798 H VAL 104 HN VAL 104 12.476 -12.071 -2.380 799 HA VAL 104 HA VAL 104 12.892 -9.944 -0.610 800 HB VAL 104 HB VAL 104 15.046 -9.934 -1.801 801 HG11 VAL 104 HG11 VAL 104 15.171 -9.188 -4.132 802 HG12 VAL 104 HG12 VAL 104 13.410 -9.229 -4.227 803 HG13 VAL 104 HG13 VAL 104 14.312 -10.723 -3.971 804 HG21 VAL 104 HG21 VAL 104 14.266 -7.870 -0.850 805 HG22 VAL 104 HG22 VAL 104 13.314 -7.533 -2.294 806 HG23 VAL 104 HG23 VAL 104 15.073 -7.543 -2.381 807 H VAL 105 HN VAL 105 11.299 -8.348 -0.933 808 HA VAL 105 HA VAL 105 9.409 -9.044 -3.082 809 HB VAL 105 HB VAL 105 8.658 -7.382 -0.711 810 HG11 VAL 105 HG11 VAL 105 6.476 -8.438 -1.069 811 HG12 VAL 105 HG12 VAL 105 7.161 -9.378 -2.395 812 HG13 VAL 105 HG13 VAL 105 7.066 -7.622 -2.517 813 HG21 VAL 105 HG21 VAL 105 8.035 -9.446 0.525 814 HG22 VAL 105 HG22 VAL 105 9.777 -9.227 0.333 815 HG23 VAL 105 HG23 VAL 105 8.913 -10.385 -0.686 816 H ARG 106 HN ARG 106 9.694 -7.677 -4.720 817 HA ARG 106 HA ARG 106 10.604 -4.990 -4.215 818 HB2 ARG 106 HB2 ARG 106 10.995 -6.737 -6.285 819 HB3 ARG 106 HB1 ARG 106 9.694 -5.716 -6.901 820 HG2 ARG 106 HG2 ARG 106 10.960 -3.779 -6.687 821 HG3 ARG 106 HG1 ARG 106 12.200 -4.609 -5.739 822 HD2 ARG 106 HD2 ARG 106 12.715 -5.996 -7.723 823 HD3 ARG 106 HD1 ARG 106 11.552 -5.054 -8.652 824 HE ARG 106 HE ARG 106 13.407 -3.296 -7.490 825 HH11 ARG 106 HH11 ARG 106 13.261 -5.763 -9.984 826 HH12 ARG 106 HH12 ARG 106 14.573 -5.085 -10.896 827 HH21 ARG 106 HH21 ARG 106 15.108 -2.396 -8.707 828 HH22 ARG 106 HH22 ARG 106 15.628 -3.193 -10.170 829 H LEU 107 HN LEU 107 9.302 -3.199 -4.467 830 HA LEU 107 HA LEU 107 6.769 -3.610 -5.762 831 HB2 LEU 107 HB2 LEU 107 5.929 -1.895 -3.819 832 HB3 LEU 107 HB1 LEU 107 5.544 -3.582 -3.974 833 HG LEU 107 HG LEU 107 6.100 -2.827 -1.683 834 HD11 LEU 107 HD11 LEU 107 7.812 -4.970 -2.898 835 HD12 LEU 107 HD12 LEU 107 6.202 -5.149 -2.207 836 HD13 LEU 107 HD13 LEU 107 7.566 -4.741 -1.164 837 HD21 LEU 107 HD21 LEU 107 8.577 -2.649 -1.222 838 HD22 LEU 107 HD22 LEU 107 7.785 -1.269 -2.000 839 HD23 LEU 107 HD23 LEU 107 8.756 -2.380 -2.964 840 H LEU 108 HN LEU 108 5.686 -1.857 -6.376 841 HA LEU 108 HA LEU 108 7.226 0.625 -6.731 842 HB2 LEU 108 HB2 LEU 108 5.102 -0.704 -8.292 843 HB3 LEU 108 HB1 LEU 108 4.864 1.015 -8.076 844 HG LEU 108 HG LEU 108 7.075 -0.392 -9.538 845 HD11 LEU 108 HD11 LEU 108 5.045 0.158 -10.764 846 HD12 LEU 108 HD12 LEU 108 6.410 1.119 -11.335 847 HD13 LEU 108 HD13 LEU 108 5.196 1.845 -10.277 848 HD21 LEU 108 HD21 LEU 108 8.204 1.212 -8.158 849 HD22 LEU 108 HD22 LEU 108 7.044 2.465 -8.594 850 HD23 LEU 108 HD23 LEU 108 8.144 1.816 -9.811 851 H VAL 109 HN VAL 109 6.400 2.529 -5.802 852 HA VAL 109 HA VAL 109 3.947 2.318 -4.346 853 HB VAL 109 HB VAL 109 5.786 1.468 -2.899 854 HG11 VAL 109 HG11 VAL 109 6.782 4.305 -2.992 855 HG12 VAL 109 HG12 VAL 109 7.606 2.893 -3.655 856 HG13 VAL 109 HG13 VAL 109 7.373 3.040 -1.916 857 HG21 VAL 109 HG21 VAL 109 5.104 2.703 -0.943 858 HG22 VAL 109 HG22 VAL 109 3.740 2.329 -2.001 859 HG23 VAL 109 HG23 VAL 109 4.423 3.955 -1.981 860 H THR 110 HN THR 110 3.393 4.317 -3.440 861 HA THR 110 HA THR 110 4.536 6.608 -4.891 862 HB THR 110 HB THR 110 2.183 7.639 -4.604 863 HG1 THR 110 HG1 THR 110 1.677 4.857 -4.269 864 HG21 THR 110 HG21 THR 110 1.444 6.604 -6.704 865 HG22 THR 110 HG22 THR 110 2.657 5.338 -6.498 866 HG23 THR 110 HG23 THR 110 3.163 7.009 -6.751 867 H ARG 111 HN ARG 111 5.612 7.887 -3.596 868 HA ARG 111 HA ARG 111 5.040 7.787 -0.756 869 HB2 ARG 111 HB2 ARG 111 7.453 8.173 -2.400 870 HB3 ARG 111 HB1 ARG 111 7.401 8.981 -0.832 871 HG2 ARG 111 HG2 ARG 111 6.567 6.168 -0.944 872 HG3 ARG 111 HG1 ARG 111 8.297 6.516 -1.113 873 HD2 ARG 111 HD2 ARG 111 7.890 8.043 0.927 874 HD3 ARG 111 HD1 ARG 111 6.437 7.079 1.155 875 HE ARG 111 HE ARG 111 7.854 5.129 1.366 876 HH11 ARG 111 HH11 ARG 111 9.403 8.266 1.669 877 HH12 ARG 111 HH12 ARG 111 10.790 7.638 2.505 878 HH21 ARG 111 HH21 ARG 111 9.711 4.327 2.450 879 HH22 ARG 111 HH22 ARG 111 10.950 5.435 2.963 880 H GLN 112 HN GLN 112 5.828 9.853 0.441 881 HA GLN 112 HA GLN 112 5.179 11.849 1.108 882 HB2 GLN 112 HB2 GLN 112 6.677 12.670 -0.369 883 HB3 GLN 112 HB1 GLN 112 5.813 12.069 -1.767 884 HG2 GLN 112 HG2 GLN 112 4.240 13.980 -0.420 885 HG3 GLN 112 HG1 GLN 112 5.852 14.621 -0.717 886 HE21 GLN 112 HE21 GLN 112 4.365 12.156 -2.607 887 HE22 GLN 112 HE22 GLN 112 4.165 13.068 -4.066 888 H SER 113 HN SER 113 3.479 9.819 -0.151 889 HA SER 113 HA SER 113 1.038 11.358 -0.685 890 HB2 SER 113 HB2 SER 113 1.937 9.581 -2.275 891 HB3 SER 113 HB1 SER 113 1.485 8.406 -1.027 892 HG SER 113 HG SER 113 -0.674 9.330 -1.171 893 H LEU 114 HN LEU 114 2.492 10.572 1.824 894 HA LEU 114 HA LEU 114 0.249 9.314 3.228 895 HB2 LEU 114 HB2 LEU 114 1.942 8.813 5.010 896 HB3 LEU 114 HB1 LEU 114 2.061 7.919 3.517 897 HG LEU 114 HG LEU 114 4.231 8.631 4.634 898 HD11 LEU 114 HD11 LEU 114 3.760 9.334 1.748 899 HD12 LEU 114 HD12 LEU 114 4.206 7.758 2.402 900 HD13 LEU 114 HD13 LEU 114 5.338 9.107 2.496 901 HD21 LEU 114 HD21 LEU 114 3.716 10.922 5.193 902 HD22 LEU 114 HD22 LEU 114 3.479 11.315 3.490 903 HD23 LEU 114 HD23 LEU 114 5.080 10.863 4.075 904 H GLN 115 HN GLN 115 0.836 12.015 2.456 905 HA GLN 115 HA GLN 115 1.435 13.540 4.789 906 HB2 GLN 115 HB2 GLN 115 0.435 14.261 2.049 907 HB3 GLN 115 HB1 GLN 115 0.637 15.453 3.314 908 HG2 GLN 115 HG2 GLN 115 2.812 13.672 2.275 909 HG3 GLN 115 HG1 GLN 115 2.554 15.346 1.785 910 HE21 GLN 115 HE21 GLN 115 1.795 16.175 4.481 911 HE22 GLN 115 HE22 GLN 115 3.264 16.245 5.388 912 H LYS 116 HN LYS 116 -0.054 12.864 6.323 913 HA LYS 116 HA LYS 116 -2.720 14.028 5.953 914 HB2 LYS 116 HB2 LYS 116 -3.353 12.610 7.986 915 HB3 LYS 116 HB1 LYS 116 -3.099 11.766 6.469 916 HG2 LYS 116 HG2 LYS 116 -2.016 10.387 7.938 917 HG3 LYS 116 HG1 LYS 116 -0.684 11.405 7.395 918 HD2 LYS 116 HD2 LYS 116 -0.833 12.738 9.409 919 HD3 LYS 116 HD1 LYS 116 -2.276 11.860 9.921 920 HE2 LYS 116 HE2 LYS 116 -0.999 9.816 10.151 921 HE3 LYS 116 HE1 LYS 116 0.441 10.604 9.513 922 HZ1 LYS 116 HZ1 LYS 116 0.486 10.410 11.935 923 HZ2 LYS 116 HZ2 LYS 116 -0.930 11.340 12.048 924 HZ3 LYS 116 HZ3 LYS 116 0.488 12.032 11.448 925 H ALA 117 HN ALA 117 -3.273 15.736 7.120 926 HA ALA 117 HA ALA 117 -1.617 16.466 9.430 927 HB1 ALA 117 HB1 ALA 117 -2.376 18.356 7.197 928 HB2 ALA 117 HB2 ALA 117 -0.763 17.694 7.466 929 HB3 ALA 117 HB3 ALA 117 -1.481 18.779 8.657 930 H VAL 118 HN VAL 118 -4.204 15.323 8.919 931 HA VAL 118 HA VAL 118 -5.889 17.273 10.261 932 HB VAL 118 HB VAL 118 -6.577 17.246 7.969 933 HG11 VAL 118 HG11 VAL 118 -7.379 15.217 6.841 934 HG12 VAL 118 HG12 VAL 118 -6.820 14.259 8.213 935 HG13 VAL 118 HG13 VAL 118 -5.661 15.151 7.230 936 HG21 VAL 118 HG21 VAL 118 -8.474 15.672 9.681 937 HG22 VAL 118 HG22 VAL 118 -8.905 16.512 8.192 938 HG23 VAL 118 HG23 VAL 118 -8.341 17.427 9.592 939 H GLN 119 HN GLN 119 -5.483 16.329 12.210 940 HA GLN 119 HA GLN 119 -6.635 13.646 12.590 941 HB2 GLN 119 HB2 GLN 119 -4.463 15.005 14.208 942 HB3 GLN 119 HB1 GLN 119 -5.197 13.456 14.612 943 HG2 GLN 119 HG2 GLN 119 -4.417 12.592 12.415 944 HG3 GLN 119 HG1 GLN 119 -3.546 14.105 12.184 945 HE21 GLN 119 HE21 GLN 119 -3.903 12.518 15.260 946 HE22 GLN 119 HE22 GLN 119 -2.237 12.052 15.423 947 H GLN 120 HN GLN 120 -8.371 13.517 13.812 948 HA GLN 120 HA GLN 120 -9.470 16.020 14.805 949 HB2 GLN 120 HB2 GLN 120 -10.785 13.301 14.647 950 HB3 GLN 120 HB1 GLN 120 -11.588 14.851 14.881 951 HG2 GLN 120 HG2 GLN 120 -10.917 15.556 12.655 952 HG3 GLN 120 HG1 GLN 120 -10.052 14.040 12.419 953 HE21 GLN 120 HE21 GLN 120 -13.130 15.609 12.454 954 HE22 GLN 120 HE22 GLN 120 -14.049 14.268 11.863 955 H SER 121 HN SER 121 -8.670 16.514 16.736 956 HA SER 121 HA SER 121 -8.276 16.501 18.959 957 HB2 SER 121 HB2 SER 121 -9.908 13.952 18.994 958 HB3 SER 121 HB1 SER 121 -9.382 14.844 20.423 959 HG SER 121 HG SER 121 -11.172 15.678 18.393 960 H MET 122 HN MET 122 -6.560 15.940 20.192 961 HA MET 122 HA MET 122 -4.851 13.854 19.025 962 HB2 MET 122 HB2 MET 122 -4.134 16.290 20.663 963 HB3 MET 122 HB1 MET 122 -2.981 15.100 20.081 964 HG2 MET 122 HG2 MET 122 -3.460 15.670 17.800 965 HG3 MET 122 HG1 MET 122 -4.747 16.762 18.305 966 HE1 MET 122 HE1 MET 122 -1.265 16.308 20.082 967 HE2 MET 122 HE2 MET 122 -0.288 17.508 19.238 968 HE3 MET 122 HE3 MET 122 -0.872 16.090 18.372 969 H LEU 123 HN LEU 123 -4.692 12.023 20.114 970 HA LEU 123 HA LEU 123 -4.393 10.534 21.803 971 HB2 LEU 123 HB2 LEU 123 -3.303 12.953 23.244 972 HB3 LEU 123 HB1 LEU 123 -3.038 11.284 23.711 973 HG LEU 123 HG LEU 123 -2.103 12.509 21.116 974 HD11 LEU 123 HD11 LEU 123 0.142 12.360 22.101 975 HD12 LEU 123 HD12 LEU 123 -0.575 11.872 23.636 976 HD13 LEU 123 HD13 LEU 123 -0.903 13.476 22.980 977 HD21 LEU 123 HD21 LEU 123 -2.525 10.135 20.905 978 HD22 LEU 123 HD22 LEU 123 -1.592 9.809 22.365 979 HD23 LEU 123 HD23 LEU 123 -0.786 10.431 20.924 980 H SER 124 HN SER 124 -6.963 11.506 21.652 981 HA SER 124 HA SER 124 -8.941 11.471 22.745 982 HB2 SER 124 HB2 SER 124 -7.974 9.538 23.955 983 HB3 SER 124 HB1 SER 124 -7.323 10.632 25.171 984 HG SER 124 HG SER 124 -9.297 10.955 25.964 985 H1 LYS 161 HN LYS 161 -15.848 0.661 6.645 986 HA LYS 161 HA LYS 161 -16.309 -2.115 6.321 987 HB2 LYS 161 HB2 LYS 161 -17.693 -0.237 5.287 988 HB3 LYS 161 HB1 LYS 161 -16.396 -0.028 4.119 989 HG2 LYS 161 HG2 LYS 161 -17.982 -1.332 3.015 990 HG3 LYS 161 HG1 LYS 161 -16.737 -2.472 3.529 991 HD2 LYS 161 HD2 LYS 161 -18.963 -3.373 3.961 992 HD3 LYS 161 HD1 LYS 161 -18.103 -3.092 5.477 993 HE2 LYS 161 HE2 LYS 161 -19.326 -1.023 5.818 994 HE3 LYS 161 HE1 LYS 161 -20.114 -1.204 4.252 995 HZ1 LYS 161 HZ1 LYS 161 -21.483 -1.874 6.205 996 HZ2 LYS 161 HZ2 LYS 161 -20.416 -3.172 6.456 997 HZ3 LYS 161 HZ3 LYS 161 -21.312 -3.077 5.019 998 H GLU 162 HN GLU 162 -14.075 0.175 4.914 999 HA GLU 162 HA GLU 162 -12.803 -1.778 3.215 1000 HB2 GLU 162 HB2 GLU 162 -11.266 0.326 2.843 1001 HB3 GLU 162 HB1 GLU 162 -12.877 0.229 2.136 1002 HG2 GLU 162 HG2 GLU 162 -13.780 1.650 3.831 1003 HG3 GLU 162 HG1 GLU 162 -12.296 1.566 4.774 1004 H ASN 163 HN ASN 163 -11.434 -3.143 4.041 1005 HA ASN 163 HA ASN 163 -8.965 -2.452 5.059 1006 HB2 ASN 163 HB2 ASN 163 -10.107 -1.715 7.088 1007 HB3 ASN 163 HB1 ASN 163 -10.870 -3.291 7.260 1008 HD21 ASN 163 HD21 ASN 163 -7.933 -1.478 7.555 1009 HD22 ASN 163 HD22 ASN 163 -7.042 -2.679 8.441 1010 H LEU 164 HN LEU 164 -8.615 -4.109 3.426 1011 HA LEU 164 HA LEU 164 -7.843 -6.401 4.947 1012 HB2 LEU 164 HB2 LEU 164 -9.045 -8.110 4.031 1013 HB3 LEU 164 HB1 LEU 164 -10.261 -6.853 4.023 1014 HG LEU 164 HG LEU 164 -9.380 -6.467 1.570 1015 HD11 LEU 164 HD11 LEU 164 -8.673 -9.353 2.078 1016 HD12 LEU 164 HD12 LEU 164 -7.556 -8.058 1.643 1017 HD13 LEU 164 HD13 LEU 164 -8.773 -8.604 0.483 1018 HD21 LEU 164 HD21 LEU 164 -11.192 -8.725 2.415 1019 HD22 LEU 164 HD22 LEU 164 -11.107 -8.051 0.789 1020 HD23 LEU 164 HD23 LEU 164 -11.656 -7.046 2.130 1021 H GLU 165 HN GLU 165 -6.064 -7.287 4.190 1022 HA GLU 165 HA GLU 165 -5.139 -7.684 1.689 1023 HB2 GLU 165 HB2 GLU 165 -5.311 -5.066 1.676 1024 HB3 GLU 165 HB1 GLU 165 -3.796 -5.155 2.565 1025 HG2 GLU 165 HG2 GLU 165 -3.582 -4.865 0.098 1026 HG3 GLU 165 HG1 GLU 165 -2.700 -6.231 0.786 1027 H SER 166 HN SER 166 -4.079 -6.307 4.815 1028 HA SER 166 HA SER 166 -3.380 -7.610 6.588 1029 HB2 SER 166 HB2 SER 166 -2.852 -9.801 4.584 1030 HB3 SER 166 HB1 SER 166 -2.946 -9.968 6.334 1031 HG SER 166 HG SER 166 -5.190 -9.091 6.027 1032 H MET 167 HN MET 167 -1.326 -9.034 7.151 1033 HA MET 167 HA MET 167 1.019 -7.846 5.827 1034 HB2 MET 167 HB2 MET 167 2.327 -8.670 7.797 1035 HB3 MET 167 HB1 MET 167 1.112 -7.448 8.206 1036 HG2 MET 167 HG2 MET 167 -0.410 -9.261 8.927 1037 HG3 MET 167 HG1 MET 167 0.881 -10.420 8.624 1038 HE1 MET 167 HE1 MET 167 3.554 -9.417 11.282 1039 HE2 MET 167 HE2 MET 167 3.469 -8.882 9.605 1040 HE3 MET 167 HE3 MET 167 3.116 -10.560 10.013 1041 H VAL 168 HN VAL 168 2.873 -9.274 5.554 1042 HA VAL 168 HA VAL 168 2.216 -12.111 5.383 1043 HB VAL 168 HB VAL 168 3.436 -12.020 3.045 1044 HG11 VAL 168 HG11 VAL 168 0.546 -11.213 3.398 1045 HG12 VAL 168 HG12 VAL 168 1.165 -12.862 3.438 1046 HG13 VAL 168 HG13 VAL 168 1.254 -11.924 1.948 1047 HG21 VAL 168 HG21 VAL 168 3.887 -9.612 3.136 1048 HG22 VAL 168 HG22 VAL 168 2.155 -9.292 3.205 1049 HG23 VAL 168 HG23 VAL 168 2.857 -10.029 1.765 Start of MODEL 19 1 H1 MET 1 HT1 MET 1 -21.981 22.060 -3.597 2 H2 MET 1 HT2 MET 1 -22.808 22.937 -4.792 3 H3 MET 1 HT3 MET 1 -22.281 23.720 -3.385 4 HA MET 1 HA MET 1 -20.575 22.559 -5.514 5 HB2 MET 1 HB2 MET 1 -21.569 24.710 -6.122 6 HB3 MET 1 HB1 MET 1 -21.019 25.414 -4.608 7 HG2 MET 1 HG2 MET 1 -18.676 24.936 -5.333 8 HG3 MET 1 HG1 MET 1 -19.326 24.458 -6.900 9 HE1 MET 1 HE1 MET 1 -20.555 26.139 -8.575 10 HE2 MET 1 HE2 MET 1 -20.913 27.816 -8.167 11 HE3 MET 1 HE3 MET 1 -21.710 26.506 -7.296 12 H SER 2 HN SER 2 -18.826 21.647 -4.647 13 HA SER 2 HA SER 2 -17.390 23.199 -2.617 14 HB2 SER 2 HB2 SER 2 -18.451 21.225 -1.525 15 HB3 SER 2 HB1 SER 2 -17.596 20.173 -2.649 16 HG SER 2 HG SER 2 -15.639 21.341 -1.771 17 H TYR 3 HN TYR 3 -16.911 20.235 -4.510 18 HA TYR 3 HA TYR 3 -15.264 19.485 -5.844 19 HB2 TYR 3 HB2 TYR 3 -15.258 22.399 -6.519 20 HB3 TYR 3 HB1 TYR 3 -14.052 21.326 -7.230 21 HD1 TYR 3 HD2 TYR 3 -17.636 22.103 -7.019 22 HD2 TYR 3 HD1 TYR 3 -14.680 19.673 -8.878 23 HE1 TYR 3 HE2 TYR 3 -19.273 21.430 -8.724 24 HE2 TYR 3 HE1 TYR 3 -16.308 18.997 -10.593 25 HH TYR 3 HH TYR 3 -19.288 20.581 -11.013 26 H ILE 4 HN ILE 4 -13.398 18.656 -5.373 27 HA ILE 4 HA ILE 4 -11.489 18.183 -4.275 28 HB ILE 4 HB ILE 4 -11.056 21.146 -4.008 29 HG12 ILE 4 HG12 ILE 4 -10.167 19.322 -6.253 30 HG13 ILE 4 HG11 ILE 4 -11.481 20.489 -6.369 31 HG21 ILE 4 HG21 ILE 4 -9.590 19.855 -2.615 32 HG22 ILE 4 HG22 ILE 4 -8.672 20.501 -3.975 33 HG23 ILE 4 HG23 ILE 4 -9.166 18.809 -3.969 34 HD11 ILE 4 HD11 ILE 4 -8.587 21.144 -5.857 35 HD12 ILE 4 HD12 ILE 4 -9.906 22.306 -6.006 36 HD13 ILE 4 HD13 ILE 4 -9.439 21.322 -7.391 37 HA PRO 5 HA PRO 5 -13.247 18.517 -0.100 38 HB2 PRO 5 HB2 PRO 5 -11.608 16.092 0.244 39 HB3 PRO 5 HB1 PRO 5 -13.337 16.320 0.528 40 HG2 PRO 5 HG2 PRO 5 -12.442 14.871 -1.536 41 HG3 PRO 5 HG1 PRO 5 -13.884 15.894 -1.682 42 HD2 PRO 5 HD2 PRO 5 -11.080 16.430 -2.600 43 HD3 PRO 5 HD1 PRO 5 -12.614 16.725 -3.446 44 H GLY 6 HN GLY 6 -11.234 17.080 1.641 45 HA2 GLY 6 HA2 GLY 6 -9.538 19.253 2.291 46 HA3 GLY 6 HA1 GLY 6 -9.383 17.605 2.902 47 H GLN 7 HN GLN 7 -8.986 19.404 -0.126 48 HA GLN 7 HA GLN 7 -7.382 18.358 -1.779 49 HB2 GLN 7 HB2 GLN 7 -5.902 20.395 -1.811 50 HB3 GLN 7 HB1 GLN 7 -7.629 20.707 -1.841 51 HG2 GLN 7 HG2 GLN 7 -7.585 21.237 0.534 52 HG3 GLN 7 HG1 GLN 7 -5.861 20.882 0.590 53 HE21 GLN 7 HE21 GLN 7 -5.351 22.926 1.298 54 HE22 GLN 7 HE22 GLN 7 -5.422 24.311 0.259 55 HA PRO 8 HA PRO 8 -4.117 16.404 0.645 56 HB2 PRO 8 HB2 PRO 8 -4.074 14.101 -0.671 57 HB3 PRO 8 HB1 PRO 8 -5.430 14.497 0.392 58 HG2 PRO 8 HG2 PRO 8 -5.274 14.554 -2.580 59 HG3 PRO 8 HG1 PRO 8 -6.638 14.127 -1.538 60 HD2 PRO 8 HD2 PRO 8 -6.191 16.616 -2.793 61 HD3 PRO 8 HD1 PRO 8 -7.395 16.266 -1.529 62 H VAL 9 HN VAL 9 -2.172 14.974 -0.320 63 HA VAL 9 HA VAL 9 -0.871 16.649 -2.345 64 HB VAL 9 HB VAL 9 0.176 15.811 -0.059 65 HG11 VAL 9 HG11 VAL 9 0.891 13.529 -1.901 66 HG12 VAL 9 HG12 VAL 9 -0.172 13.417 -0.493 67 HG13 VAL 9 HG13 VAL 9 1.532 13.812 -0.279 68 HG21 VAL 9 HG21 VAL 9 1.703 15.840 -2.652 69 HG22 VAL 9 HG22 VAL 9 2.407 16.003 -1.043 70 HG23 VAL 9 HG23 VAL 9 1.307 17.239 -1.652 71 H THR 10 HN THR 10 0.758 15.127 -3.643 72 HA THR 10 HA THR 10 -1.030 13.601 -5.316 73 HB THR 10 HB THR 10 0.751 13.833 -6.997 74 HG1 THR 10 HG1 THR 10 2.540 15.263 -6.345 75 HG21 THR 10 HG21 THR 10 -0.867 15.590 -6.919 76 HG22 THR 10 HG22 THR 10 0.710 16.375 -7.052 77 HG23 THR 10 HG23 THR 10 -0.118 16.300 -5.485 78 H ALA 11 HN ALA 11 2.058 12.799 -5.825 79 HA ALA 11 HA ALA 11 2.494 10.607 -4.082 80 HB1 ALA 11 HB1 ALA 11 0.637 9.575 -5.280 81 HB2 ALA 11 HB2 ALA 11 2.162 8.778 -5.690 82 HB3 ALA 11 HB3 ALA 11 1.430 9.916 -6.821 83 H VAL 12 HN VAL 12 4.498 10.260 -4.043 84 HA VAL 12 HA VAL 12 6.184 10.843 -6.362 85 HB VAL 12 HB VAL 12 7.085 9.833 -3.722 86 HG11 VAL 12 HG11 VAL 12 8.728 9.862 -5.493 87 HG12 VAL 12 HG12 VAL 12 9.151 11.036 -4.247 88 HG13 VAL 12 HG13 VAL 12 8.428 11.579 -5.762 89 HG21 VAL 12 HG21 VAL 12 7.439 12.196 -2.989 90 HG22 VAL 12 HG22 VAL 12 5.748 11.706 -3.091 91 HG23 VAL 12 HG23 VAL 12 6.459 12.702 -4.366 92 H VAL 13 HN VAL 13 7.234 9.184 -7.378 93 HA VAL 13 HA VAL 13 6.319 6.477 -6.707 94 HB VAL 13 HB VAL 13 7.358 7.430 -9.375 95 HG11 VAL 13 HG11 VAL 13 6.441 5.323 -10.224 96 HG12 VAL 13 HG12 VAL 13 5.976 4.865 -8.584 97 HG13 VAL 13 HG13 VAL 13 7.682 5.044 -9.002 98 HG21 VAL 13 HG21 VAL 13 5.257 8.535 -8.850 99 HG22 VAL 13 HG22 VAL 13 4.517 6.980 -8.468 100 HG23 VAL 13 HG23 VAL 13 5.018 7.333 -10.121 101 H GLN 14 HN GLN 14 7.746 5.063 -5.984 102 HA GLN 14 HA GLN 14 10.545 5.297 -6.741 103 HB2 GLN 14 HB2 GLN 14 9.499 5.107 -3.919 104 HB3 GLN 14 HB1 GLN 14 11.128 4.624 -4.352 105 HG2 GLN 14 HG2 GLN 14 11.660 6.719 -3.823 106 HG3 GLN 14 HG1 GLN 14 11.031 7.103 -5.423 107 HE21 GLN 14 HE21 GLN 14 8.276 6.485 -4.581 108 HE22 GLN 14 HE22 GLN 14 7.775 7.858 -3.638 109 H ARG 15 HN ARG 15 11.737 3.327 -6.173 110 HA ARG 15 HA ARG 15 10.106 0.937 -6.363 111 HB2 ARG 15 HB2 ARG 15 12.792 1.555 -7.580 112 HB3 ARG 15 HB1 ARG 15 11.925 0.052 -7.721 113 HG2 ARG 15 HG2 ARG 15 10.077 1.860 -8.599 114 HG3 ARG 15 HG1 ARG 15 11.607 2.522 -9.188 115 HD2 ARG 15 HD2 ARG 15 12.169 0.353 -10.167 116 HD3 ARG 15 HD1 ARG 15 10.617 -0.285 -9.621 117 HE ARG 15 HE ARG 15 9.586 1.417 -11.121 118 HH11 ARG 15 HH11 ARG 15 12.900 0.430 -11.685 119 HH12 ARG 15 HH12 ARG 15 12.823 0.710 -13.403 120 HH21 ARG 15 HH21 ARG 15 9.479 1.805 -13.353 121 HH22 ARG 15 HH22 ARG 15 10.876 1.511 -14.351 122 H VAL 16 HN VAL 16 10.478 -0.492 -4.801 123 HA VAL 16 HA VAL 16 12.993 -0.391 -3.377 124 HB VAL 16 HB VAL 16 11.647 1.099 -2.077 125 HG11 VAL 16 HG11 VAL 16 9.454 0.422 -2.857 126 HG12 VAL 16 HG12 VAL 16 9.516 0.455 -1.091 127 HG13 VAL 16 HG13 VAL 16 9.589 -1.086 -1.947 128 HG21 VAL 16 HG21 VAL 16 13.070 -0.415 -0.803 129 HG22 VAL 16 HG22 VAL 16 11.740 -1.569 -0.692 130 HG23 VAL 16 HG23 VAL 16 11.611 0.007 0.101 131 H GLU 17 HN GLU 17 13.616 -2.381 -2.647 132 HA GLU 17 HA GLU 17 11.853 -4.623 -3.279 133 HB2 GLU 17 HB2 GLU 17 14.847 -4.465 -2.903 134 HB3 GLU 17 HB1 GLU 17 13.985 -5.993 -2.960 135 HG2 GLU 17 HG2 GLU 17 14.773 -5.731 -5.116 136 HG3 GLU 17 HG1 GLU 17 13.102 -5.183 -5.226 137 H ILE 18 HN ILE 18 10.723 -5.233 -1.554 138 HA ILE 18 HA ILE 18 11.769 -4.993 1.129 139 HB ILE 18 HB ILE 18 8.975 -5.753 0.267 140 HG12 ILE 18 HG12 ILE 18 9.464 -3.536 -0.631 141 HG13 ILE 18 HG11 ILE 18 8.333 -3.411 0.716 142 HG21 ILE 18 HG21 ILE 18 8.389 -5.065 2.533 143 HG22 ILE 18 HG22 ILE 18 10.088 -4.704 2.850 144 HG23 ILE 18 HG23 ILE 18 9.585 -6.363 2.523 145 HD11 ILE 18 HD11 ILE 18 10.082 -2.686 2.173 146 HD12 ILE 18 HD12 ILE 18 10.083 -1.684 0.722 147 HD13 ILE 18 HD13 ILE 18 11.289 -2.958 0.918 148 H HIS 19 HN HIS 19 12.584 -6.699 2.013 149 HA HIS 19 HA HIS 19 11.757 -9.258 0.943 150 HB2 HIS 19 HB2 HIS 19 13.879 -10.094 1.903 151 HB3 HIS 19 HB1 HIS 19 14.011 -8.878 0.645 152 HD1 HIS 19 HD1 HIS 19 14.424 -9.186 4.413 153 HD2 HIS 19 HD2 HIS 19 15.568 -6.787 1.219 154 HE1 HIS 19 HE1 HIS 19 16.167 -7.624 5.329 155 HE2 HIS 19 HE2 HIS 19 17.056 -6.422 3.301 156 H LYS 20 HN LYS 20 9.811 -8.978 2.127 157 HA LYS 20 HA LYS 20 9.959 -9.896 4.919 158 HB2 LYS 20 HB2 LYS 20 8.095 -8.204 3.394 159 HB3 LYS 20 HB1 LYS 20 7.320 -9.392 4.436 160 HG2 LYS 20 HG2 LYS 20 9.402 -7.429 5.353 161 HG3 LYS 20 HG1 LYS 20 7.659 -7.183 5.496 162 HD2 LYS 20 HD2 LYS 20 7.708 -9.503 6.667 163 HD3 LYS 20 HD1 LYS 20 9.422 -9.146 6.892 164 HE2 LYS 20 HE2 LYS 20 8.913 -7.152 8.103 165 HE3 LYS 20 HE1 LYS 20 7.198 -7.299 7.718 166 HZ1 LYS 20 HZ1 LYS 20 7.566 -8.051 9.942 167 HZ2 LYS 20 HZ2 LYS 20 8.779 -9.123 9.445 168 HZ3 LYS 20 HZ3 LYS 20 7.180 -9.392 8.985 169 H LEU 21 HN LEU 21 10.014 -12.090 4.904 170 HA LEU 21 HA LEU 21 8.346 -13.644 3.214 171 HB2 LEU 21 HB2 LEU 21 9.768 -12.875 1.476 172 HB3 LEU 21 HB1 LEU 21 11.214 -13.146 2.437 173 HG LEU 21 HG LEU 21 10.994 -15.538 2.196 174 HD11 LEU 21 HD11 LEU 21 8.695 -15.970 2.233 175 HD12 LEU 21 HD12 LEU 21 9.220 -16.420 0.608 176 HD13 LEU 21 HD13 LEU 21 8.378 -14.892 0.869 177 HD21 LEU 21 HD21 LEU 21 11.344 -15.728 -0.206 178 HD22 LEU 21 HD22 LEU 21 12.148 -14.300 0.443 179 HD23 LEU 21 HD23 LEU 21 10.635 -14.132 -0.445 180 H ARG 22 HN ARG 22 8.276 -15.757 3.973 181 HA ARG 22 HA ARG 22 10.014 -16.769 5.919 182 HB2 ARG 22 HB2 ARG 22 8.520 -18.407 5.863 183 HB3 ARG 22 HB1 ARG 22 7.781 -17.730 4.413 184 HG2 ARG 22 HG2 ARG 22 8.302 -19.812 3.656 185 HG3 ARG 22 HG1 ARG 22 9.836 -18.992 3.309 186 HD2 ARG 22 HD2 ARG 22 10.378 -21.008 4.422 187 HD3 ARG 22 HD1 ARG 22 10.618 -19.665 5.537 188 HE ARG 22 HE ARG 22 8.024 -20.646 5.909 189 HH11 ARG 22 HH11 ARG 22 11.321 -21.765 6.396 190 HH12 ARG 22 HH12 ARG 22 10.905 -22.783 7.734 191 HH21 ARG 22 HH21 ARG 22 7.495 -21.998 7.663 192 HH22 ARG 22 HH22 ARG 22 8.748 -22.892 8.475 193 H GLN 23 HN GLN 23 12.085 -17.053 5.704 194 HA GLN 23 HA GLN 23 13.135 -18.304 3.339 195 HB2 GLN 23 HB2 GLN 23 15.117 -16.541 3.692 196 HB3 GLN 23 HB1 GLN 23 13.793 -16.293 2.566 197 HG2 GLN 23 HG2 GLN 23 12.597 -15.067 4.384 198 HG3 GLN 23 HG1 GLN 23 14.078 -15.165 5.330 199 HE21 GLN 23 HE21 GLN 23 12.572 -12.890 4.222 200 HE22 GLN 23 HE22 GLN 23 13.719 -11.992 3.280 201 H GLY 24 HN GLY 24 12.723 -19.678 5.407 202 HA2 GLY 24 HA2 GLY 24 13.868 -21.426 6.356 203 HA3 GLY 24 HA1 GLY 24 15.336 -20.759 5.647 204 H GLU 25 HN GLU 25 16.597 -19.409 6.769 205 HA GLU 25 HA GLU 25 16.626 -19.732 9.598 206 HB2 GLU 25 HB2 GLU 25 18.188 -17.929 7.740 207 HB3 GLU 25 HB1 GLU 25 18.500 -18.098 9.457 208 HG2 GLU 25 HG2 GLU 25 20.097 -19.431 8.345 209 HG3 GLU 25 HG1 GLU 25 18.917 -20.542 9.034 210 H ASN 26 HN ASN 26 14.975 -17.809 7.478 211 HA ASN 26 HA ASN 26 14.607 -15.681 9.434 212 HB2 ASN 26 HB2 ASN 26 14.544 -15.452 6.446 213 HB3 ASN 26 HB1 ASN 26 14.329 -14.162 7.598 214 HD21 ASN 26 HD21 ASN 26 16.428 -16.419 6.256 215 HD22 ASN 26 HD22 ASN 26 17.913 -15.549 6.530 216 H LEU 27 HN LEU 27 12.684 -15.373 9.843 217 HA LEU 27 HA LEU 27 10.634 -15.865 7.828 218 HB2 LEU 27 HB2 LEU 27 10.815 -17.169 10.386 219 HB3 LEU 27 HB1 LEU 27 9.408 -16.125 10.343 220 HG LEU 27 HG LEU 27 8.887 -18.440 9.665 221 HD11 LEU 27 HD11 LEU 27 7.606 -17.882 7.701 222 HD12 LEU 27 HD12 LEU 27 8.604 -16.461 7.412 223 HD13 LEU 27 HD13 LEU 27 7.567 -16.533 8.834 224 HD21 LEU 27 HD21 LEU 27 9.671 -19.053 7.290 225 HD22 LEU 27 HD22 LEU 27 10.816 -19.250 8.620 226 HD23 LEU 27 HD23 LEU 27 10.947 -17.854 7.550 227 H ILE 28 HN ILE 28 10.171 -13.951 7.285 228 HA ILE 28 HA ILE 28 9.536 -11.949 9.340 229 HB ILE 28 HB ILE 28 9.815 -10.580 6.937 230 HG12 ILE 28 HG12 ILE 28 11.100 -12.696 6.152 231 HG13 ILE 28 HG11 ILE 28 11.855 -11.132 5.902 232 HG21 ILE 28 HG21 ILE 28 10.375 -9.784 9.149 233 HG22 ILE 28 HG22 ILE 28 11.711 -9.526 8.027 234 HG23 ILE 28 HG23 ILE 28 11.777 -10.851 9.189 235 HD11 ILE 28 HD11 ILE 28 13.312 -11.513 7.819 236 HD12 ILE 28 HD12 ILE 28 13.452 -12.847 6.669 237 HD13 ILE 28 HD13 ILE 28 12.508 -13.045 8.144 238 H LEU 29 HN LEU 29 7.573 -11.471 9.482 239 HA LEU 29 HA LEU 29 5.642 -11.673 7.392 240 HB2 LEU 29 HB2 LEU 29 6.018 -14.056 7.905 241 HB3 LEU 29 HB1 LEU 29 5.672 -13.751 9.595 242 HG LEU 29 HG LEU 29 3.354 -13.099 8.948 243 HD11 LEU 29 HD11 LEU 29 4.190 -14.137 6.242 244 HD12 LEU 29 HD12 LEU 29 3.799 -12.462 6.634 245 HD13 LEU 29 HD13 LEU 29 2.550 -13.706 6.720 246 HD21 LEU 29 HD21 LEU 29 3.847 -15.343 9.765 247 HD22 LEU 29 HD22 LEU 29 4.248 -15.865 8.130 248 HD23 LEU 29 HD23 LEU 29 2.595 -15.397 8.522 249 H GLY 30 HN GLY 30 5.596 -9.449 8.338 250 HA2 GLY 30 HA2 GLY 30 3.336 -9.173 9.991 251 HA3 GLY 30 HA1 GLY 30 4.736 -9.067 11.030 252 H PHE 31 HN PHE 31 4.813 -7.674 7.762 253 HA PHE 31 HA PHE 31 4.338 -5.059 9.040 254 HB2 PHE 31 HB2 PHE 31 5.935 -4.089 7.795 255 HB3 PHE 31 HB1 PHE 31 6.549 -5.697 7.603 256 HD1 PHE 31 HD1 PHE 31 4.776 -2.953 5.998 257 HD2 PHE 31 HD2 PHE 31 6.471 -6.809 5.500 258 HE1 PHE 31 HE1 PHE 31 4.532 -2.739 3.573 259 HE2 PHE 31 HE2 PHE 31 6.252 -6.597 3.069 260 HZ PHE 31 HZ PHE 31 5.596 -4.403 2.090 261 H SER 32 HN SER 32 2.831 -3.587 7.906 262 HA SER 32 HA SER 32 0.759 -5.453 6.928 263 HB2 SER 32 HB2 SER 32 0.370 -4.744 9.255 264 HB3 SER 32 HB1 SER 32 0.343 -3.057 8.729 265 HG SER 32 HG SER 32 -1.742 -3.535 8.619 266 H ILE 33 HN ILE 33 -0.449 -4.957 5.265 267 HA ILE 33 HA ILE 33 -0.601 -2.337 4.146 268 HB ILE 33 HB ILE 33 1.434 -2.569 3.103 269 HG12 ILE 33 HG12 ILE 33 -0.513 -2.471 1.390 270 HG13 ILE 33 HG11 ILE 33 1.105 -2.817 0.800 271 HG21 ILE 33 HG21 ILE 33 2.366 -4.678 2.283 272 HG22 ILE 33 HG22 ILE 33 0.917 -5.504 2.860 273 HG23 ILE 33 HG23 ILE 33 1.984 -4.692 4.009 274 HD11 ILE 33 HD11 ILE 33 -1.050 -4.881 1.292 275 HD12 ILE 33 HD12 ILE 33 0.548 -5.183 0.609 276 HD13 ILE 33 HD13 ILE 33 -0.617 -4.205 -0.281 277 H GLY 34 HN GLY 34 -2.234 -2.230 2.627 278 HA2 GLY 34 HA2 GLY 34 -3.425 -4.588 1.586 279 HA3 GLY 34 HA1 GLY 34 -4.301 -4.041 3.010 280 H GLY 35 HN GLY 35 -5.685 -4.199 0.763 281 HA2 GLY 35 HA2 GLY 35 -6.094 -1.609 -0.344 282 HA3 GLY 35 HA1 GLY 35 -7.274 -2.930 -0.287 283 H GLY 36 HN GLY 36 -7.466 -0.013 0.491 284 HA2 GLY 36 HA2 GLY 36 -6.703 0.190 3.229 285 HA3 GLY 36 HA1 GLY 36 -7.577 1.407 2.299 286 H ILE 37 HN ILE 37 -9.564 -0.687 1.604 287 HA ILE 37 HA ILE 37 -10.991 -0.768 4.155 288 HB ILE 37 HB ILE 37 -12.944 0.124 2.490 289 HG12 ILE 37 HG12 ILE 37 -10.558 1.846 1.868 290 HG13 ILE 37 HG11 ILE 37 -10.962 0.478 0.842 291 HG21 ILE 37 HG21 ILE 37 -12.461 0.877 4.769 292 HG22 ILE 37 HG22 ILE 37 -12.697 2.248 3.684 293 HG23 ILE 37 HG23 ILE 37 -11.067 1.775 4.171 294 HD11 ILE 37 HD11 ILE 37 -13.133 1.449 0.405 295 HD12 ILE 37 HD12 ILE 37 -11.816 2.529 -0.048 296 HD13 ILE 37 HD13 ILE 37 -12.728 2.824 1.433 297 H ASP 38 HN ASP 38 -13.321 -0.996 2.171 298 HA ASP 38 HA ASP 38 -13.120 -3.900 1.778 299 HB2 ASP 38 HB2 ASP 38 -15.327 -4.229 2.773 300 HB3 ASP 38 HB1 ASP 38 -14.205 -3.581 3.962 301 H GLN 39 HN GLN 39 -13.176 -1.343 0.356 302 HA GLN 39 HA GLN 39 -15.319 -1.151 -1.397 303 HB2 GLN 39 HB2 GLN 39 -13.439 -0.177 -2.897 304 HB3 GLN 39 HB1 GLN 39 -13.768 0.602 -1.364 305 HG2 GLN 39 HG2 GLN 39 -11.347 0.308 -1.837 306 HG3 GLN 39 HG1 GLN 39 -11.872 -0.403 -0.346 307 HE21 GLN 39 HE21 GLN 39 -12.001 -2.605 -0.117 308 HE22 GLN 39 HE22 GLN 39 -11.238 -3.697 -1.192 309 H ASP 40 HN ASP 40 -13.236 -1.541 -3.687 310 HA ASP 40 HA ASP 40 -12.703 -4.051 -4.414 311 HB2 ASP 40 HB2 ASP 40 -14.903 -4.707 -3.747 312 HB3 ASP 40 HB1 ASP 40 -15.603 -3.569 -4.843 313 HA PRO 41 HA PRO 41 -13.726 -1.988 -8.646 314 HB2 PRO 41 HB2 PRO 41 -15.355 0.145 -8.780 315 HB3 PRO 41 HB1 PRO 41 -16.027 -1.492 -8.712 316 HG2 PRO 41 HG2 PRO 41 -15.599 0.454 -6.459 317 HG3 PRO 41 HG1 PRO 41 -17.064 -0.429 -6.883 318 HD2 PRO 41 HD2 PRO 41 -15.462 -1.316 -4.956 319 HD3 PRO 41 HD1 PRO 41 -16.255 -2.448 -6.073 320 H SER 42 HN SER 42 -13.130 -0.618 -5.787 321 HA SER 42 HA SER 42 -12.229 2.029 -6.418 322 HB2 SER 42 HB2 SER 42 -12.949 1.404 -4.156 323 HB3 SER 42 HB1 SER 42 -11.628 0.239 -4.044 324 HG SER 42 HG SER 42 -11.552 3.056 -3.957 325 H GLN 43 HN GLN 43 -10.662 -1.096 -6.134 326 HA GLN 43 HA GLN 43 -8.005 -0.016 -6.199 327 HB2 GLN 43 HB2 GLN 43 -7.359 -2.332 -5.972 328 HB3 GLN 43 HB1 GLN 43 -8.638 -1.949 -4.832 329 HG2 GLN 43 HG2 GLN 43 -10.167 -2.862 -6.746 330 HG3 GLN 43 HG1 GLN 43 -8.687 -3.672 -7.248 331 HE21 GLN 43 HE21 GLN 43 -11.299 -3.603 -5.014 332 HE22 GLN 43 HE22 GLN 43 -10.850 -5.028 -4.111 333 H ASN 44 HN ASN 44 -10.265 -0.474 -8.444 334 HA ASN 44 HA ASN 44 -9.744 -1.453 -10.731 335 HB2 ASN 44 HB2 ASN 44 -11.229 0.557 -10.181 336 HB3 ASN 44 HB1 ASN 44 -9.839 1.548 -10.630 337 HD21 ASN 44 HD21 ASN 44 -12.388 -0.491 -11.743 338 HD22 ASN 44 HD22 ASN 44 -12.157 -0.213 -13.432 339 HA PRO 45 HA PRO 45 -5.576 -1.090 -12.148 340 HB2 PRO 45 HB2 PRO 45 -6.245 -1.353 -14.837 341 HB3 PRO 45 HB1 PRO 45 -5.943 -2.688 -13.712 342 HG2 PRO 45 HG2 PRO 45 -8.524 -1.548 -14.664 343 HG3 PRO 45 HG1 PRO 45 -8.113 -3.225 -14.258 344 HD2 PRO 45 HD2 PRO 45 -9.573 -1.629 -12.607 345 HD3 PRO 45 HD1 PRO 45 -8.495 -2.889 -11.997 346 H PHE 46 HN PHE 46 -8.176 0.947 -13.245 347 HA PHE 46 HA PHE 46 -6.311 2.949 -14.290 348 HB2 PHE 46 HB2 PHE 46 -8.490 2.589 -15.439 349 HB3 PHE 46 HB1 PHE 46 -9.325 3.070 -13.964 350 HD1 PHE 46 HD1 PHE 46 -6.985 4.295 -16.569 351 HD2 PHE 46 HD2 PHE 46 -9.795 5.314 -13.541 352 HE1 PHE 46 HE1 PHE 46 -6.930 6.642 -17.309 353 HE2 PHE 46 HE2 PHE 46 -9.744 7.661 -14.272 354 HZ PHE 46 HZ PHE 46 -8.291 8.335 -16.134 355 H SER 47 HN SER 47 -7.996 2.035 -11.500 356 HA SER 47 HA SER 47 -7.974 2.694 -9.372 357 HB2 SER 47 HB2 SER 47 -5.624 3.291 -9.660 358 HB3 SER 47 HB1 SER 47 -6.091 4.861 -10.311 359 HG SER 47 HG SER 47 -5.503 4.696 -7.968 360 H GLU 48 HN GLU 48 -9.199 3.967 -8.080 361 HA GLU 48 HA GLU 48 -11.384 5.168 -9.247 362 HB2 GLU 48 HB2 GLU 48 -10.608 4.439 -6.708 363 HB3 GLU 48 HB1 GLU 48 -10.905 6.169 -6.588 364 HG2 GLU 48 HG2 GLU 48 -12.867 4.207 -7.744 365 HG3 GLU 48 HG1 GLU 48 -12.872 4.732 -6.062 366 H ASP 49 HN ASP 49 -8.434 6.654 -8.056 367 HA ASP 49 HA ASP 49 -8.762 8.812 -9.901 368 HB2 ASP 49 HB2 ASP 49 -10.152 9.526 -7.876 369 HB3 ASP 49 HB1 ASP 49 -8.628 9.636 -6.999 370 H LYS 50 HN LYS 50 -6.969 6.793 -9.626 371 HA LYS 50 HA LYS 50 -4.753 6.349 -9.739 372 HB2 LYS 50 HB2 LYS 50 -4.564 9.343 -9.486 373 HB3 LYS 50 HB1 LYS 50 -3.134 8.329 -9.568 374 HG2 LYS 50 HG2 LYS 50 -3.607 9.248 -11.737 375 HG3 LYS 50 HG1 LYS 50 -3.872 7.506 -11.766 376 HD2 LYS 50 HD2 LYS 50 -6.187 7.738 -11.859 377 HD3 LYS 50 HD1 LYS 50 -6.139 9.398 -11.264 378 HE2 LYS 50 HE2 LYS 50 -5.022 8.536 -13.924 379 HE3 LYS 50 HE1 LYS 50 -6.659 9.153 -13.701 380 HZ1 LYS 50 HZ1 LYS 50 -4.185 10.639 -12.987 381 HZ2 LYS 50 HZ2 LYS 50 -5.774 11.226 -12.912 382 HZ3 LYS 50 HZ3 LYS 50 -5.070 10.873 -14.414 383 H THR 51 HN THR 51 -4.529 9.068 -7.506 384 HA THR 51 HA THR 51 -3.271 7.309 -5.546 385 HB THR 51 HB THR 51 -2.146 9.433 -6.155 386 HG1 THR 51 HG1 THR 51 -1.789 10.146 -3.992 387 HG21 THR 51 HG21 THR 51 -4.551 10.755 -4.905 388 HG22 THR 51 HG22 THR 51 -4.072 10.837 -6.599 389 HG23 THR 51 HG23 THR 51 -3.056 11.577 -5.364 390 H ASP 52 HN ASP 52 -5.963 6.851 -5.966 391 HA ASP 52 HA ASP 52 -7.587 8.292 -4.095 392 HB2 ASP 52 HB2 ASP 52 -8.367 7.294 -6.235 393 HB3 ASP 52 HB1 ASP 52 -8.303 5.714 -5.491 394 H LYS 53 HN LYS 53 -5.280 6.289 -3.545 395 HA LYS 53 HA LYS 53 -4.499 5.393 -1.584 396 HB2 LYS 53 HB2 LYS 53 -7.147 6.338 -0.478 397 HB3 LYS 53 HB1 LYS 53 -5.927 5.537 0.498 398 HG2 LYS 53 HG2 LYS 53 -5.537 7.750 0.950 399 HG3 LYS 53 HG1 LYS 53 -4.370 7.428 -0.329 400 HD2 LYS 53 HD2 LYS 53 -5.530 9.567 -0.666 401 HD3 LYS 53 HD1 LYS 53 -5.854 8.430 -1.976 402 HE2 LYS 53 HE2 LYS 53 -7.918 9.504 -1.418 403 HE3 LYS 53 HE1 LYS 53 -8.001 7.846 -0.831 404 HZ1 LYS 53 HZ1 LYS 53 -7.345 8.730 1.388 405 HZ2 LYS 53 HZ2 LYS 53 -8.861 9.260 0.843 406 HZ3 LYS 53 HZ3 LYS 53 -7.520 10.299 0.767 407 H GLY 54 HN GLY 54 -6.662 4.189 -3.490 408 HA2 GLY 54 HA2 GLY 54 -8.091 2.149 -2.449 409 HA3 GLY 54 HA1 GLY 54 -7.177 1.974 -3.941 410 H ILE 55 HN ILE 55 -4.589 1.874 -3.085 411 HA ILE 55 HA ILE 55 -4.492 -0.339 -1.142 412 HB ILE 55 HB ILE 55 -3.018 -0.160 -3.778 413 HG12 ILE 55 HG12 ILE 55 -5.320 -1.004 -3.934 414 HG13 ILE 55 HG11 ILE 55 -4.147 -2.274 -4.273 415 HG21 ILE 55 HG21 ILE 55 -1.474 -0.979 -2.119 416 HG22 ILE 55 HG22 ILE 55 -1.987 -2.329 -3.136 417 HG23 ILE 55 HG23 ILE 55 -2.669 -2.129 -1.520 418 HD11 ILE 55 HD11 ILE 55 -5.711 -1.871 -1.719 419 HD12 ILE 55 HD12 ILE 55 -4.402 -3.054 -1.938 420 HD13 ILE 55 HD13 ILE 55 -5.871 -3.182 -2.905 421 H TYR 56 HN TYR 56 -2.905 -0.141 0.393 422 HA TYR 56 HA TYR 56 -0.512 1.343 -0.085 423 HB2 TYR 56 HB2 TYR 56 -0.843 3.214 1.342 424 HB3 TYR 56 HB1 TYR 56 -2.244 3.159 0.280 425 HD1 TYR 56 HD1 TYR 56 -4.240 1.651 1.318 426 HD2 TYR 56 HD2 TYR 56 -1.241 3.692 3.531 427 HE1 TYR 56 HE1 TYR 56 -5.723 1.679 3.288 428 HE2 TYR 56 HE2 TYR 56 -2.704 3.721 5.508 429 HH TYR 56 HH TYR 56 -5.507 1.834 5.759 430 H VAL 57 HN VAL 57 0.926 1.356 1.802 431 HA VAL 57 HA VAL 57 0.579 -0.910 3.497 432 HB VAL 57 HB VAL 57 2.717 -0.044 2.396 433 HG11 VAL 57 HG11 VAL 57 3.996 1.330 4.233 434 HG12 VAL 57 HG12 VAL 57 2.370 1.985 4.453 435 HG13 VAL 57 HG13 VAL 57 3.159 2.064 2.873 436 HG21 VAL 57 HG21 VAL 57 2.633 -1.900 3.901 437 HG22 VAL 57 HG22 VAL 57 2.743 -0.798 5.274 438 HG23 VAL 57 HG23 VAL 57 4.095 -0.949 4.152 439 H THR 58 HN THR 58 0.255 -0.875 5.641 440 HA THR 58 HA THR 58 -0.741 1.683 6.702 441 HB THR 58 HB THR 58 -2.696 0.623 6.784 442 HG1 THR 58 HG1 THR 58 -2.871 -0.985 8.608 443 HG21 THR 58 HG21 THR 58 -3.023 -1.772 6.504 444 HG22 THR 58 HG22 THR 58 -1.281 -2.031 6.664 445 HG23 THR 58 HG23 THR 58 -1.922 -1.122 5.291 446 H ARG 59 HN ARG 59 1.554 -0.760 7.118 447 HA ARG 59 HA ARG 59 2.732 0.579 9.307 448 HB2 ARG 59 HB2 ARG 59 2.094 -0.495 11.164 449 HB3 ARG 59 HB1 ARG 59 0.746 -1.045 10.211 450 HG2 ARG 59 HG2 ARG 59 1.963 -3.097 9.664 451 HG3 ARG 59 HG1 ARG 59 3.284 -2.550 10.698 452 HD2 ARG 59 HD2 ARG 59 0.459 -2.949 11.634 453 HD3 ARG 59 HD1 ARG 59 1.713 -4.173 11.765 454 HE ARG 59 HE ARG 59 2.025 -1.535 13.057 455 HH11 ARG 59 HH11 ARG 59 1.872 -5.038 13.221 456 HH12 ARG 59 HH12 ARG 59 2.330 -5.115 14.895 457 HH21 ARG 59 HH21 ARG 59 2.640 -1.646 15.287 458 HH22 ARG 59 HH22 ARG 59 2.733 -3.202 16.059 459 H VAL 60 HN VAL 60 4.460 -0.826 10.331 460 HA VAL 60 HA VAL 60 5.662 -2.634 8.432 461 HB VAL 60 HB VAL 60 6.964 -0.071 9.341 462 HG11 VAL 60 HG11 VAL 60 8.949 -0.873 8.146 463 HG12 VAL 60 HG12 VAL 60 8.128 -2.410 7.852 464 HG13 VAL 60 HG13 VAL 60 8.509 -1.914 9.499 465 HG21 VAL 60 HG21 VAL 60 7.236 0.284 6.895 466 HG22 VAL 60 HG22 VAL 60 5.557 0.277 7.434 467 HG23 VAL 60 HG23 VAL 60 6.232 -1.148 6.626 468 H SER 61 HN SER 61 6.776 -4.243 9.489 469 HA SER 61 HA SER 61 7.193 -4.231 12.298 470 HB2 SER 61 HB2 SER 61 8.995 -5.749 10.457 471 HB3 SER 61 HB1 SER 61 8.336 -6.240 12.022 472 HG SER 61 HG SER 61 6.234 -6.240 10.903 473 H GLU 62 HN GLU 62 8.415 -2.729 13.194 474 HA GLU 62 HA GLU 62 10.177 -1.099 11.859 475 HB2 GLU 62 HB2 GLU 62 9.627 -1.591 14.740 476 HB3 GLU 62 HB1 GLU 62 10.754 -0.396 14.191 477 HG2 GLU 62 HG2 GLU 62 9.146 0.915 13.222 478 HG3 GLU 62 HG1 GLU 62 7.992 -0.412 13.137 479 H GLY 63 HN GLY 63 12.136 -0.953 11.775 480 HA2 GLY 63 HA2 GLY 63 14.371 -1.528 11.666 481 HA3 GLY 63 HA1 GLY 63 14.132 -2.343 13.214 482 H GLY 64 HN GLY 64 12.385 -3.086 10.254 483 HA2 GLY 64 HA2 GLY 64 13.604 -5.754 10.406 484 HA3 GLY 64 HA1 GLY 64 11.984 -5.406 9.812 485 HA PRO 65 HA PRO 65 14.278 -5.587 5.989 486 HB2 PRO 65 HB2 PRO 65 12.140 -6.596 4.647 487 HB3 PRO 65 HB1 PRO 65 13.317 -7.554 5.526 488 HG2 PRO 65 HG2 PRO 65 10.548 -7.180 6.133 489 HG3 PRO 65 HG1 PRO 65 11.733 -8.151 7.017 490 HD2 PRO 65 HD2 PRO 65 10.718 -5.442 7.603 491 HD3 PRO 65 HD1 PRO 65 11.506 -6.628 8.675 492 H ALA 66 HN ALA 66 11.026 -4.253 6.382 493 HA ALA 66 HA ALA 66 10.794 -3.576 3.588 494 HB1 ALA 66 HB1 ALA 66 8.725 -2.368 4.311 495 HB2 ALA 66 HB2 ALA 66 9.109 -2.793 5.982 496 HB3 ALA 66 HB3 ALA 66 8.770 -4.064 4.806 497 H GLU 67 HN GLU 67 11.711 -1.969 6.536 498 HA GLU 67 HA GLU 67 11.140 0.615 5.380 499 HB2 GLU 67 HB2 GLU 67 11.969 1.284 7.713 500 HB3 GLU 67 HB1 GLU 67 10.442 0.409 7.606 501 HG2 GLU 67 HG2 GLU 67 11.263 -1.422 8.606 502 HG3 GLU 67 HG1 GLU 67 12.811 -1.258 7.789 503 H ILE 68 HN ILE 68 13.695 -1.603 6.014 504 HA ILE 68 HA ILE 68 15.713 0.365 6.004 505 HB ILE 68 HB ILE 68 17.203 -1.537 5.837 506 HG12 ILE 68 HG12 ILE 68 14.812 -3.257 6.299 507 HG13 ILE 68 HG11 ILE 68 15.492 -2.995 4.694 508 HG21 ILE 68 HG21 ILE 68 15.186 -1.550 8.044 509 HG22 ILE 68 HG22 ILE 68 16.669 -0.596 7.988 510 HG23 ILE 68 HG23 ILE 68 16.754 -2.353 8.141 511 HD11 ILE 68 HD11 ILE 68 16.276 -5.063 5.701 512 HD12 ILE 68 HD12 ILE 68 16.953 -4.139 7.044 513 HD13 ILE 68 HD13 ILE 68 17.592 -3.926 5.417 514 H ALA 69 HN ALA 69 14.094 -1.798 3.959 515 HA ALA 69 HA ALA 69 15.668 -1.478 1.647 516 HB1 ALA 69 HB1 ALA 69 14.070 -3.278 1.758 517 HB2 ALA 69 HB2 ALA 69 13.611 -2.208 0.432 518 HB3 ALA 69 HB3 ALA 69 12.740 -2.140 1.963 519 H GLY 70 HN GLY 70 13.411 0.411 3.365 520 HA2 GLY 70 HA2 GLY 70 13.528 2.835 3.000 521 HA3 GLY 70 HA1 GLY 70 13.590 2.511 1.265 522 H LEU 71 HN LEU 71 11.515 1.051 3.699 523 HA LEU 71 HA LEU 71 9.165 2.146 2.347 524 HB2 LEU 71 HB2 LEU 71 9.665 -0.324 2.160 525 HB3 LEU 71 HB1 LEU 71 9.488 -0.429 3.899 526 HG LEU 71 HG LEU 71 7.593 -1.197 2.378 527 HD11 LEU 71 HD11 LEU 71 7.422 -1.095 4.761 528 HD12 LEU 71 HD12 LEU 71 5.919 -0.531 4.027 529 HD13 LEU 71 HD13 LEU 71 7.075 0.630 4.689 530 HD21 LEU 71 HD21 LEU 71 7.132 1.770 2.286 531 HD22 LEU 71 HD22 LEU 71 5.919 0.554 1.893 532 HD23 LEU 71 HD23 LEU 71 7.386 0.682 0.922 533 H GLN 72 HN GLN 72 7.312 2.252 4.002 534 HA GLN 72 HA GLN 72 7.968 2.804 6.691 535 HB2 GLN 72 HB2 GLN 72 7.142 5.227 5.111 536 HB3 GLN 72 HB1 GLN 72 7.570 5.158 6.797 537 HG2 GLN 72 HG2 GLN 72 9.409 6.157 5.925 538 HG3 GLN 72 HG1 GLN 72 9.907 4.466 5.875 539 HE21 GLN 72 HE21 GLN 72 7.544 5.837 3.689 540 HE22 GLN 72 HE22 GLN 72 8.514 5.691 2.283 541 H ILE 73 HN ILE 73 5.978 4.368 7.369 542 HA ILE 73 HA ILE 73 3.706 2.670 6.935 543 HB ILE 73 HB ILE 73 3.646 5.105 8.657 544 HG12 ILE 73 HG12 ILE 73 5.801 4.230 9.259 545 HG13 ILE 73 HG11 ILE 73 4.669 3.754 10.519 546 HG21 ILE 73 HG21 ILE 73 2.612 2.319 8.984 547 HG22 ILE 73 HG22 ILE 73 1.693 3.704 8.404 548 HG23 ILE 73 HG23 ILE 73 2.298 3.675 10.060 549 HD11 ILE 73 HD11 ILE 73 4.520 1.519 9.490 550 HD12 ILE 73 HD12 ILE 73 6.153 1.931 10.011 551 HD13 ILE 73 HD13 ILE 73 5.726 2.016 8.293 552 H GLY 74 HN GLY 74 2.526 3.121 5.127 553 HA2 GLY 74 HA2 GLY 74 0.407 4.282 4.815 554 HA3 GLY 74 HA1 GLY 74 1.194 5.761 5.347 555 H ASP 75 HN ASP 75 1.845 3.283 2.851 556 HA ASP 75 HA ASP 75 2.023 5.473 0.900 557 HB2 ASP 75 HB2 ASP 75 4.150 3.463 1.524 558 HB3 ASP 75 HB1 ASP 75 4.047 4.249 -0.036 559 H LYS 76 HN LYS 76 1.744 4.785 -1.273 560 HA LYS 76 HA LYS 76 -0.252 2.672 -1.199 561 HB2 LYS 76 HB2 LYS 76 0.236 4.752 -3.329 562 HB3 LYS 76 HB1 LYS 76 -1.141 3.664 -3.233 563 HG2 LYS 76 HG2 LYS 76 -2.223 5.039 -1.875 564 HG3 LYS 76 HG1 LYS 76 -0.839 5.128 -0.780 565 HD2 LYS 76 HD2 LYS 76 0.162 6.737 -2.525 566 HD3 LYS 76 HD1 LYS 76 -1.490 6.850 -3.145 567 HE2 LYS 76 HE2 LYS 76 -1.009 8.645 -1.556 568 HE3 LYS 76 HE1 LYS 76 -2.276 7.574 -0.956 569 HZ1 LYS 76 HZ1 LYS 76 -0.761 6.556 0.533 570 HZ2 LYS 76 HZ2 LYS 76 -0.525 8.226 0.700 571 HZ3 LYS 76 HZ3 LYS 76 0.577 7.300 -0.185 572 H ILE 77 HN ILE 77 0.469 0.797 -1.638 573 HA ILE 77 HA ILE 77 2.641 0.186 -3.380 574 HB ILE 77 HB ILE 77 0.504 -1.684 -2.349 575 HG12 ILE 77 HG12 ILE 77 1.580 -0.443 -0.506 576 HG13 ILE 77 HG11 ILE 77 1.971 -2.159 -0.471 577 HG21 ILE 77 HG21 ILE 77 1.802 -2.648 -4.143 578 HG22 ILE 77 HG22 ILE 77 2.245 -3.409 -2.615 579 HG23 ILE 77 HG23 ILE 77 3.306 -2.200 -3.336 580 HD11 ILE 77 HD11 ILE 77 4.145 -1.691 -1.448 581 HD12 ILE 77 HD12 ILE 77 3.902 -0.780 0.044 582 HD13 ILE 77 HD13 ILE 77 3.749 0.028 -1.516 583 H MET 78 HN MET 78 2.456 0.436 -5.551 584 HA MET 78 HA MET 78 -0.191 0.127 -6.744 585 HB2 MET 78 HB2 MET 78 2.354 1.146 -8.007 586 HB3 MET 78 HB1 MET 78 0.735 1.242 -8.682 587 HG2 MET 78 HG2 MET 78 1.435 2.545 -6.085 588 HG3 MET 78 HG1 MET 78 1.753 3.332 -7.626 589 HE1 MET 78 HE1 MET 78 -2.361 2.634 -5.683 590 HE2 MET 78 HE2 MET 78 -0.786 2.362 -4.938 591 HE3 MET 78 HE3 MET 78 -1.400 1.231 -6.142 592 H GLN 79 HN GLN 79 3.093 -1.183 -6.910 593 HA GLN 79 HA GLN 79 2.036 -3.500 -8.290 594 HB2 GLN 79 HB2 GLN 79 4.472 -2.089 -9.346 595 HB3 GLN 79 HB1 GLN 79 3.579 -3.405 -10.069 596 HG2 GLN 79 HG2 GLN 79 1.674 -1.927 -10.361 597 HG3 GLN 79 HG1 GLN 79 2.608 -0.589 -9.711 598 HE21 GLN 79 HE21 GLN 79 4.990 -1.777 -11.113 599 HE22 GLN 79 HE22 GLN 79 4.774 -1.321 -12.769 600 H VAL 80 HN VAL 80 3.141 -5.300 -8.090 601 HA VAL 80 HA VAL 80 5.461 -5.365 -6.259 602 HB VAL 80 HB VAL 80 3.813 -6.704 -5.283 603 HG11 VAL 80 HG11 VAL 80 3.212 -7.846 -8.009 604 HG12 VAL 80 HG12 VAL 80 2.245 -6.633 -7.164 605 HG13 VAL 80 HG13 VAL 80 2.394 -8.264 -6.504 606 HG21 VAL 80 HG21 VAL 80 4.586 -9.011 -5.515 607 HG22 VAL 80 HG22 VAL 80 5.968 -7.912 -5.555 608 HG23 VAL 80 HG23 VAL 80 5.357 -8.616 -7.060 609 H ASN 81 HN ASN 81 7.394 -5.828 -7.172 610 HA ASN 81 HA ASN 81 8.989 -6.507 -8.645 611 HB2 ASN 81 HB2 ASN 81 7.082 -8.816 -8.598 612 HB3 ASN 81 HB1 ASN 81 8.462 -8.846 -9.700 613 HD21 ASN 81 HD21 ASN 81 7.386 -9.287 -6.490 614 HD22 ASN 81 HD22 ASN 81 8.932 -9.649 -5.784 615 H GLY 82 HN GLY 82 6.414 -5.171 -9.720 616 HA2 GLY 82 HA2 GLY 82 6.497 -4.052 -11.880 617 HA3 GLY 82 HA1 GLY 82 7.081 -5.570 -12.560 618 H TRP 83 HN TRP 83 4.663 -6.230 -10.316 619 HA TRP 83 HA TRP 83 2.742 -6.598 -12.456 620 HB2 TRP 83 HB2 TRP 83 2.689 -7.725 -9.671 621 HB3 TRP 83 HB1 TRP 83 1.631 -8.156 -10.997 622 HD1 TRP 83 HD1 TRP 83 5.348 -7.833 -10.678 623 HE1 TRP 83 HE1 TRP 83 6.446 -9.941 -11.431 624 HE3 TRP 83 HE3 TRP 83 1.205 -10.531 -11.913 625 HZ2 TRP 83 HZ2 TRP 83 5.776 -12.451 -12.482 626 HZ3 TRP 83 HZ3 TRP 83 1.540 -12.804 -12.815 627 HH2 TRP 83 HH2 TRP 83 3.794 -13.719 -13.084 628 H ASP 84 HN ASP 84 1.770 -4.703 -12.561 629 HA ASP 84 HA ASP 84 0.896 -2.949 -10.667 630 HB2 ASP 84 HB2 ASP 84 0.614 -2.693 -13.131 631 HB3 ASP 84 HB1 ASP 84 -0.714 -3.845 -13.072 632 H MET 85 HN MET 85 0.022 -3.408 -8.821 633 HA MET 85 HA MET 85 -1.425 -5.700 -8.113 634 HB2 MET 85 HB2 MET 85 -1.539 -3.006 -6.740 635 HB3 MET 85 HB1 MET 85 -1.891 -4.566 -6.013 636 HG2 MET 85 HG2 MET 85 0.804 -3.899 -7.147 637 HG3 MET 85 HG1 MET 85 0.353 -3.516 -5.490 638 HE1 MET 85 HE1 MET 85 -0.722 -5.511 -3.869 639 HE2 MET 85 HE2 MET 85 0.968 -5.064 -3.593 640 HE3 MET 85 HE3 MET 85 0.498 -6.774 -3.631 641 H THR 86 HN THR 86 -2.510 -2.795 -9.633 642 HA THR 86 HA THR 86 -5.061 -2.689 -8.360 643 HB THR 86 HB THR 86 -5.576 -0.882 -9.929 644 HG1 THR 86 HG1 THR 86 -2.991 -1.271 -11.072 645 HG21 THR 86 HG21 THR 86 -2.768 -0.729 -8.833 646 HG22 THR 86 HG22 THR 86 -4.245 -0.394 -7.934 647 HG23 THR 86 HG23 THR 86 -3.777 0.644 -9.279 648 H MET 87 HN MET 87 -3.866 -4.366 -11.114 649 HA MET 87 HA MET 87 -6.576 -4.737 -12.171 650 HB2 MET 87 HB2 MET 87 -5.487 -5.821 -14.088 651 HB3 MET 87 HB1 MET 87 -4.893 -4.189 -13.825 652 HG2 MET 87 HG2 MET 87 -2.887 -5.083 -12.778 653 HG3 MET 87 HG1 MET 87 -3.491 -6.724 -13.007 654 HE1 MET 87 HE1 MET 87 -2.474 -3.896 -16.508 655 HE2 MET 87 HE2 MET 87 -2.215 -3.457 -14.821 656 HE3 MET 87 HE3 MET 87 -3.852 -3.686 -15.431 657 H VAL 88 HN VAL 88 -4.527 -6.235 -10.020 658 HA VAL 88 HA VAL 88 -5.613 -8.905 -10.589 659 HB VAL 88 HB VAL 88 -3.622 -8.765 -8.458 660 HG11 VAL 88 HG11 VAL 88 -4.283 -10.846 -9.432 661 HG12 VAL 88 HG12 VAL 88 -2.592 -10.542 -9.838 662 HG13 VAL 88 HG13 VAL 88 -3.849 -10.274 -11.048 663 HG21 VAL 88 HG21 VAL 88 -2.775 -7.892 -11.222 664 HG22 VAL 88 HG22 VAL 88 -1.691 -8.329 -9.904 665 HG23 VAL 88 HG23 VAL 88 -2.727 -6.912 -9.757 666 H THR 89 HN THR 89 -5.705 -10.192 -8.217 667 HA THR 89 HA THR 89 -7.582 -8.589 -6.670 668 HB THR 89 HB THR 89 -6.957 -11.527 -6.903 669 HG1 THR 89 HG1 THR 89 -8.596 -9.979 -8.200 670 HG21 THR 89 HG21 THR 89 -8.892 -10.268 -5.002 671 HG22 THR 89 HG22 THR 89 -7.386 -11.088 -4.591 672 HG23 THR 89 HG23 THR 89 -8.713 -11.994 -5.311 673 H HIS 90 HN HIS 90 -7.260 -8.598 -4.316 674 HA HIS 90 HA HIS 90 -4.648 -7.897 -3.621 675 HB2 HIS 90 HB2 HIS 90 -6.782 -7.270 -2.405 676 HB3 HIS 90 HB1 HIS 90 -6.747 -8.877 -1.682 677 HD1 HIS 90 HD1 HIS 90 -3.669 -8.951 -1.079 678 HD2 HIS 90 HD2 HIS 90 -6.246 -5.834 -0.162 679 HE1 HIS 90 HE1 HIS 90 -2.611 -7.759 0.867 680 HE2 HIS 90 HE2 HIS 90 -4.364 -6.100 1.589 681 H ASP 91 HN ASP 91 -6.371 -10.936 -3.133 682 HA ASP 91 HA ASP 91 -4.395 -12.429 -1.889 683 HB2 ASP 91 HB2 ASP 91 -6.653 -13.315 -2.227 684 HB3 ASP 91 HB1 ASP 91 -6.399 -13.324 -3.977 685 H GLN 92 HN GLN 92 -4.946 -11.862 -5.341 686 HA GLN 92 HA GLN 92 -2.912 -13.544 -6.307 687 HB2 GLN 92 HB2 GLN 92 -3.449 -11.069 -7.809 688 HB3 GLN 92 HB1 GLN 92 -3.276 -12.712 -8.386 689 HG2 GLN 92 HG2 GLN 92 -5.694 -11.821 -6.886 690 HG3 GLN 92 HG1 GLN 92 -5.517 -11.562 -8.606 691 HE21 GLN 92 HE21 GLN 92 -4.321 -14.370 -6.930 692 HE22 GLN 92 HE22 GLN 92 -5.422 -15.444 -7.692 693 H ALA 93 HN ALA 93 -3.029 -10.153 -5.496 694 HA ALA 93 HA ALA 93 -0.420 -9.447 -6.228 695 HB1 ALA 93 HB1 ALA 93 -2.259 -7.865 -5.793 696 HB2 ALA 93 HB2 ALA 93 -0.825 -7.492 -4.840 697 HB3 ALA 93 HB3 ALA 93 -2.202 -8.291 -4.083 698 H ARG 94 HN ARG 94 -1.885 -10.788 -3.345 699 HA ARG 94 HA ARG 94 0.387 -10.650 -1.715 700 HB2 ARG 94 HB2 ARG 94 -2.215 -12.107 -1.592 701 HB3 ARG 94 HB1 ARG 94 -0.919 -12.606 -0.504 702 HG2 ARG 94 HG2 ARG 94 -2.264 -9.916 -0.670 703 HG3 ARG 94 HG1 ARG 94 -2.280 -11.065 0.675 704 HD2 ARG 94 HD2 ARG 94 0.169 -10.781 0.900 705 HD3 ARG 94 HD1 ARG 94 0.107 -9.541 -0.358 706 HE ARG 94 HE ARG 94 -1.678 -8.916 1.756 707 HH11 ARG 94 HH11 ARG 94 1.723 -8.965 0.938 708 HH12 ARG 94 HH12 ARG 94 2.155 -7.728 2.070 709 HH21 ARG 94 HH21 ARG 94 -1.101 -7.225 3.232 710 HH22 ARG 94 HH22 ARG 94 0.555 -6.739 3.358 711 H LYS 95 HN LYS 95 -0.696 -12.893 -4.110 712 HA LYS 95 HA LYS 95 1.091 -14.997 -3.349 713 HB2 LYS 95 HB2 LYS 95 -0.467 -14.596 -5.910 714 HB3 LYS 95 HB1 LYS 95 0.363 -16.076 -5.439 715 HG2 LYS 95 HG2 LYS 95 -1.967 -14.802 -4.015 716 HG3 LYS 95 HG1 LYS 95 -2.012 -16.263 -5.004 717 HD2 LYS 95 HD2 LYS 95 -0.712 -17.473 -3.435 718 HD3 LYS 95 HD1 LYS 95 -0.274 -16.007 -2.562 719 HE2 LYS 95 HE2 LYS 95 -1.950 -17.308 -1.348 720 HE3 LYS 95 HE1 LYS 95 -2.573 -15.732 -1.827 721 HZ1 LYS 95 HZ1 LYS 95 -3.922 -16.668 -3.456 722 HZ2 LYS 95 HZ2 LYS 95 -4.059 -17.761 -2.161 723 HZ3 LYS 95 HZ3 LYS 95 -3.063 -18.133 -3.476 724 H ARG 96 HN ARG 96 1.367 -12.150 -5.332 725 HA ARG 96 HA ARG 96 3.742 -13.044 -6.654 726 HB2 ARG 96 HB2 ARG 96 2.487 -10.322 -6.377 727 HB3 ARG 96 HB1 ARG 96 3.911 -10.658 -7.353 728 HG2 ARG 96 HG2 ARG 96 1.168 -11.827 -7.735 729 HG3 ARG 96 HG1 ARG 96 1.943 -10.594 -8.735 730 HD2 ARG 96 HD2 ARG 96 2.294 -12.557 -9.914 731 HD3 ARG 96 HD1 ARG 96 3.809 -12.295 -9.064 732 HE ARG 96 HE ARG 96 2.575 -13.926 -7.369 733 HH11 ARG 96 HH11 ARG 96 2.819 -14.133 -10.859 734 HH12 ARG 96 HH12 ARG 96 2.873 -15.869 -10.888 735 HH21 ARG 96 HH21 ARG 96 2.663 -16.220 -7.401 736 HH22 ARG 96 HH22 ARG 96 2.810 -17.052 -8.919 737 H LEU 97 HN LEU 97 3.064 -10.987 -3.866 738 HA LEU 97 HA LEU 97 5.761 -10.200 -3.535 739 HB2 LEU 97 HB2 LEU 97 4.906 -9.638 -1.142 740 HB3 LEU 97 HB1 LEU 97 4.482 -8.668 -2.536 741 HG LEU 97 HG LEU 97 2.410 -10.374 -2.526 742 HD11 LEU 97 HD11 LEU 97 3.055 -9.969 0.374 743 HD12 LEU 97 HD12 LEU 97 3.230 -11.497 -0.493 744 HD13 LEU 97 HD13 LEU 97 1.634 -10.762 -0.316 745 HD21 LEU 97 HD21 LEU 97 2.604 -7.924 -0.835 746 HD22 LEU 97 HD22 LEU 97 1.175 -8.573 -1.647 747 HD23 LEU 97 HD23 LEU 97 2.518 -7.923 -2.594 748 H THR 98 HN THR 98 3.838 -12.761 -2.056 749 HA THR 98 HA THR 98 6.388 -13.842 -1.050 750 HB THR 98 HB THR 98 5.199 -13.099 0.895 751 HG1 THR 98 HG1 THR 98 5.077 -15.914 0.511 752 HG21 THR 98 HG21 THR 98 2.971 -13.904 1.499 753 HG22 THR 98 HG22 THR 98 2.867 -14.782 -0.028 754 HG23 THR 98 HG23 THR 98 2.929 -13.019 -0.026 755 H LYS 99 HN LYS 99 5.957 -14.632 -3.433 756 HA LYS 99 HA LYS 99 4.343 -17.027 -3.544 757 HB2 LYS 99 HB2 LYS 99 5.349 -17.299 -5.814 758 HB3 LYS 99 HB1 LYS 99 4.551 -15.747 -5.583 759 HG2 LYS 99 HG2 LYS 99 6.795 -14.782 -5.060 760 HG3 LYS 99 HG1 LYS 99 7.500 -16.320 -5.556 761 HD2 LYS 99 HD2 LYS 99 6.453 -16.042 -7.773 762 HD3 LYS 99 HD1 LYS 99 5.854 -14.460 -7.250 763 HE2 LYS 99 HE2 LYS 99 8.053 -13.608 -6.996 764 HE3 LYS 99 HE1 LYS 99 8.764 -15.212 -7.175 765 HZ1 LYS 99 HZ1 LYS 99 9.101 -14.153 -9.216 766 HZ2 LYS 99 HZ2 LYS 99 7.538 -13.514 -9.268 767 HZ3 LYS 99 HZ3 LYS 99 7.780 -15.175 -9.497 768 H ARG 100 HN ARG 100 7.255 -16.292 -2.311 769 HA ARG 100 HA ARG 100 8.994 -17.464 -1.412 770 HB2 ARG 100 HB2 ARG 100 7.110 -18.935 -0.600 771 HB3 ARG 100 HB1 ARG 100 7.399 -19.965 -1.991 772 HG2 ARG 100 HG2 ARG 100 8.424 -20.819 0.082 773 HG3 ARG 100 HG1 ARG 100 9.603 -20.517 -1.192 774 HD2 ARG 100 HD2 ARG 100 9.033 -18.446 0.907 775 HD3 ARG 100 HD1 ARG 100 10.156 -19.765 1.232 776 HE ARG 100 HE ARG 100 10.496 -17.753 -0.910 777 HH11 ARG 100 HH11 ARG 100 11.835 -20.016 1.412 778 HH12 ARG 100 HH12 ARG 100 13.485 -19.556 1.088 779 HH21 ARG 100 HH21 ARG 100 12.672 -17.141 -1.330 780 HH22 ARG 100 HH22 ARG 100 13.954 -17.946 -0.478 781 H SER 101 HN SER 101 8.484 -17.072 -4.323 782 HA SER 101 HA SER 101 10.449 -18.957 -5.436 783 HB2 SER 101 HB2 SER 101 8.241 -18.872 -6.592 784 HB3 SER 101 HB1 SER 101 8.477 -17.151 -6.885 785 HG SER 101 HG SER 101 10.518 -18.832 -7.745 786 H GLU 102 HN GLU 102 10.447 -16.235 -3.869 787 HA GLU 102 HA GLU 102 12.530 -14.964 -5.453 788 HB2 GLU 102 HB2 GLU 102 11.707 -12.802 -4.845 789 HB3 GLU 102 HB1 GLU 102 10.373 -13.693 -5.551 790 HG2 GLU 102 HG2 GLU 102 10.822 -13.214 -2.607 791 HG3 GLU 102 HG1 GLU 102 9.659 -12.380 -3.636 792 H GLU 103 HN GLU 103 13.461 -13.249 -3.837 793 HA GLU 103 HA GLU 103 14.003 -14.504 -1.237 794 HB2 GLU 103 HB2 GLU 103 15.983 -12.972 -2.922 795 HB3 GLU 103 HB1 GLU 103 16.311 -13.740 -1.375 796 HG2 GLU 103 HG2 GLU 103 16.056 -15.917 -2.330 797 HG3 GLU 103 HG1 GLU 103 15.493 -15.226 -3.855 798 H VAL 104 HN VAL 104 12.408 -12.353 -2.717 799 HA VAL 104 HA VAL 104 12.242 -10.341 -0.818 800 HB VAL 104 HB VAL 104 14.612 -10.036 -1.335 801 HG11 VAL 104 HG11 VAL 104 15.273 -9.095 -3.545 802 HG12 VAL 104 HG12 VAL 104 13.652 -9.472 -4.137 803 HG13 VAL 104 HG13 VAL 104 14.725 -10.768 -3.606 804 HG21 VAL 104 HG21 VAL 104 13.189 -8.104 -0.683 805 HG22 VAL 104 HG22 VAL 104 12.962 -7.737 -2.391 806 HG23 VAL 104 HG23 VAL 104 14.571 -7.635 -1.672 807 H VAL 105 HN VAL 105 10.700 -8.806 -1.434 808 HA VAL 105 HA VAL 105 9.596 -9.348 -4.107 809 HB VAL 105 HB VAL 105 7.907 -9.953 -2.548 810 HG11 VAL 105 HG11 VAL 105 8.297 -7.277 -1.215 811 HG12 VAL 105 HG12 VAL 105 8.756 -8.842 -0.549 812 HG13 VAL 105 HG13 VAL 105 7.054 -8.457 -0.807 813 HG21 VAL 105 HG21 VAL 105 7.323 -7.175 -3.552 814 HG22 VAL 105 HG22 VAL 105 6.125 -8.383 -3.083 815 HG23 VAL 105 HG23 VAL 105 7.166 -8.665 -4.480 816 H ARG 106 HN ARG 106 9.696 -7.802 -5.538 817 HA ARG 106 HA ARG 106 10.747 -5.276 -4.749 818 HB2 ARG 106 HB2 ARG 106 11.147 -6.717 -6.946 819 HB3 ARG 106 HB1 ARG 106 9.750 -5.788 -7.487 820 HG2 ARG 106 HG2 ARG 106 10.819 -3.755 -7.139 821 HG3 ARG 106 HG1 ARG 106 12.143 -4.539 -6.270 822 HD2 ARG 106 HD2 ARG 106 12.696 -5.753 -8.396 823 HD3 ARG 106 HD1 ARG 106 11.519 -4.716 -9.209 824 HE ARG 106 HE ARG 106 13.438 -3.212 -7.713 825 HH11 ARG 106 HH11 ARG 106 12.998 -4.957 -10.734 826 HH12 ARG 106 HH12 ARG 106 14.119 -3.958 -11.607 827 HH21 ARG 106 HH21 ARG 106 14.938 -1.938 -8.856 828 HH22 ARG 106 HH22 ARG 106 15.236 -2.259 -10.548 829 H LEU 107 HN LEU 107 9.714 -3.337 -5.030 830 HA LEU 107 HA LEU 107 6.802 -3.517 -5.258 831 HB2 LEU 107 HB2 LEU 107 8.489 -2.546 -3.073 832 HB3 LEU 107 HB1 LEU 107 7.168 -1.488 -3.516 833 HG LEU 107 HG LEU 107 5.566 -3.299 -3.105 834 HD11 LEU 107 HD11 LEU 107 7.973 -4.863 -2.172 835 HD12 LEU 107 HD12 LEU 107 7.023 -5.212 -3.617 836 HD13 LEU 107 HD13 LEU 107 6.287 -5.355 -2.020 837 HD21 LEU 107 HD21 LEU 107 6.244 -1.713 -1.404 838 HD22 LEU 107 HD22 LEU 107 7.514 -2.835 -0.886 839 HD23 LEU 107 HD23 LEU 107 5.812 -3.283 -0.718 840 H LEU 108 HN LEU 108 5.743 -1.732 -5.897 841 HA LEU 108 HA LEU 108 7.294 0.621 -6.679 842 HB2 LEU 108 HB2 LEU 108 5.566 -1.081 -8.373 843 HB3 LEU 108 HB1 LEU 108 5.351 0.658 -8.544 844 HG LEU 108 HG LEU 108 8.069 -0.620 -8.696 845 HD11 LEU 108 HD11 LEU 108 6.736 -1.667 -10.430 846 HD12 LEU 108 HD12 LEU 108 7.874 -0.518 -11.137 847 HD13 LEU 108 HD13 LEU 108 6.171 -0.086 -10.971 848 HD21 LEU 108 HD21 LEU 108 6.937 1.963 -9.720 849 HD22 LEU 108 HD22 LEU 108 8.616 1.434 -9.853 850 HD23 LEU 108 HD23 LEU 108 7.915 1.769 -8.265 851 H VAL 109 HN VAL 109 6.540 2.237 -5.536 852 HA VAL 109 HA VAL 109 3.860 2.151 -4.473 853 HB VAL 109 HB VAL 109 5.296 0.931 -2.912 854 HG11 VAL 109 HG11 VAL 109 7.139 2.073 -1.739 855 HG12 VAL 109 HG12 VAL 109 6.946 3.445 -2.831 856 HG13 VAL 109 HG13 VAL 109 7.447 1.877 -3.467 857 HG21 VAL 109 HG21 VAL 109 4.548 3.635 -1.875 858 HG22 VAL 109 HG22 VAL 109 4.886 2.217 -0.886 859 HG23 VAL 109 HG23 VAL 109 3.497 2.224 -1.975 860 H THR 110 HN THR 110 3.526 4.121 -3.228 861 HA THR 110 HA THR 110 4.842 6.386 -4.551 862 HB THR 110 HB THR 110 2.545 7.516 -4.467 863 HG1 THR 110 HG1 THR 110 1.617 4.835 -4.479 864 HG21 THR 110 HG21 THR 110 2.892 5.173 -6.339 865 HG22 THR 110 HG22 THR 110 3.656 6.749 -6.540 866 HG23 THR 110 HG23 THR 110 1.901 6.603 -6.616 867 H ARG 111 HN ARG 111 5.624 7.832 -3.215 868 HA ARG 111 HA ARG 111 4.866 7.733 -0.394 869 HB2 ARG 111 HB2 ARG 111 6.987 9.489 -1.644 870 HB3 ARG 111 HB1 ARG 111 6.757 9.161 0.061 871 HG2 ARG 111 HG2 ARG 111 7.699 7.210 -2.009 872 HG3 ARG 111 HG1 ARG 111 8.680 8.024 -0.797 873 HD2 ARG 111 HD2 ARG 111 7.653 6.834 0.964 874 HD3 ARG 111 HD1 ARG 111 6.387 6.224 -0.105 875 HE ARG 111 HE ARG 111 9.000 5.462 -0.976 876 HH11 ARG 111 HH11 ARG 111 6.540 4.650 1.386 877 HH12 ARG 111 HH12 ARG 111 6.950 2.963 1.386 878 HH21 ARG 111 HH21 ARG 111 9.555 3.255 -0.940 879 HH22 ARG 111 HH22 ARG 111 8.677 2.176 0.098 880 H GLN 112 HN GLN 112 4.596 9.881 0.676 881 HA GLN 112 HA GLN 112 3.024 11.671 -0.973 882 HB2 GLN 112 HB2 GLN 112 3.689 11.957 1.929 883 HB3 GLN 112 HB1 GLN 112 2.352 12.674 1.067 884 HG2 GLN 112 HG2 GLN 112 2.729 9.790 1.797 885 HG3 GLN 112 HG1 GLN 112 1.542 10.902 2.459 886 HE21 GLN 112 HE21 GLN 112 2.508 10.067 -0.865 887 HE22 GLN 112 HE22 GLN 112 0.925 9.639 -1.404 888 H SER 113 HN SER 113 5.916 11.533 0.808 889 HA SER 113 HA SER 113 7.257 13.482 -0.761 890 HB2 SER 113 HB2 SER 113 5.710 14.834 0.779 891 HB3 SER 113 HB1 SER 113 6.780 14.312 2.081 892 HG SER 113 HG SER 113 7.128 16.298 0.297 893 H LEU 114 HN LEU 114 7.459 10.826 0.541 894 HA LEU 114 HA LEU 114 9.698 11.146 2.357 895 HB2 LEU 114 HB2 LEU 114 7.462 9.590 2.368 896 HB3 LEU 114 HB1 LEU 114 8.691 8.478 1.794 897 HG LEU 114 HG LEU 114 8.688 8.167 4.119 898 HD11 LEU 114 HD11 LEU 114 10.825 9.296 4.871 899 HD12 LEU 114 HD12 LEU 114 10.815 10.113 3.297 900 HD13 LEU 114 HD13 LEU 114 10.918 8.353 3.381 901 HD21 LEU 114 HD21 LEU 114 8.655 11.170 4.403 902 HD22 LEU 114 HD22 LEU 114 8.709 10.008 5.731 903 HD23 LEU 114 HD23 LEU 114 7.289 10.092 4.684 904 H GLN 115 HN GLN 115 10.127 11.740 -0.204 905 HA GLN 115 HA GLN 115 11.379 9.577 -1.621 906 HB2 GLN 115 HB2 GLN 115 11.922 11.318 -3.267 907 HB3 GLN 115 HB1 GLN 115 10.215 11.308 -2.869 908 HG2 GLN 115 HG2 GLN 115 10.571 13.205 -1.367 909 HG3 GLN 115 HG1 GLN 115 12.279 13.223 -1.802 910 HE21 GLN 115 HE21 GLN 115 10.274 15.302 -2.127 911 HE22 GLN 115 HE22 GLN 115 10.222 15.670 -3.819 912 H LYS 116 HN LYS 116 13.630 9.736 -2.347 913 HA LYS 116 HA LYS 116 15.367 10.966 -0.313 914 HB2 LYS 116 HB2 LYS 116 15.530 8.340 -1.746 915 HB3 LYS 116 HB1 LYS 116 17.007 9.127 -1.218 916 HG2 LYS 116 HG2 LYS 116 16.285 9.059 1.077 917 HG3 LYS 116 HG1 LYS 116 14.714 8.412 0.598 918 HD2 LYS 116 HD2 LYS 116 15.589 6.338 0.051 919 HD3 LYS 116 HD1 LYS 116 17.217 6.973 -0.183 920 HE2 LYS 116 HE2 LYS 116 17.071 5.616 1.843 921 HE3 LYS 116 HE1 LYS 116 17.454 7.293 2.218 922 HZ1 LYS 116 HZ1 LYS 116 15.182 7.661 2.871 923 HZ2 LYS 116 HZ2 LYS 116 15.807 6.332 3.721 924 HZ3 LYS 116 HZ3 LYS 116 14.746 6.083 2.419 925 H ALA 117 HN ALA 117 17.039 12.231 -0.986 926 HA ALA 117 HA ALA 117 17.794 12.200 -3.810 927 HB1 ALA 117 HB1 ALA 117 17.720 14.641 -3.964 928 HB2 ALA 117 HB2 ALA 117 17.076 14.726 -2.325 929 HB3 ALA 117 HB3 ALA 117 16.116 13.992 -3.609 930 H VAL 118 HN VAL 118 18.842 11.244 -1.385 931 HA VAL 118 HA VAL 118 21.325 12.771 -1.132 932 HB VAL 118 HB VAL 118 19.749 11.582 1.166 933 HG11 VAL 118 HG11 VAL 118 22.356 13.088 1.184 934 HG12 VAL 118 HG12 VAL 118 22.162 11.359 1.466 935 HG13 VAL 118 HG13 VAL 118 21.472 12.519 2.599 936 HG21 VAL 118 HG21 VAL 118 19.527 13.894 1.941 937 HG22 VAL 118 HG22 VAL 118 18.780 13.669 0.360 938 HG23 VAL 118 HG23 VAL 118 20.350 14.459 0.487 939 H GLN 119 HN GLN 119 22.354 11.303 -2.419 940 HA GLN 119 HA GLN 119 22.362 8.503 -1.558 941 HB2 GLN 119 HB2 GLN 119 23.302 9.806 -4.114 942 HB3 GLN 119 HB1 GLN 119 23.498 8.096 -3.752 943 HG2 GLN 119 HG2 GLN 119 21.105 7.801 -3.658 944 HG3 GLN 119 HG1 GLN 119 20.853 9.529 -3.893 945 HE21 GLN 119 HE21 GLN 119 22.943 9.798 -5.841 946 HE22 GLN 119 HE22 GLN 119 22.337 9.085 -7.300 947 H GLN 120 HN GLN 120 24.066 7.612 -0.625 948 HA GLN 120 HA GLN 120 26.318 9.286 0.065 949 HB2 GLN 120 HB2 GLN 120 25.233 7.775 1.703 950 HB3 GLN 120 HB1 GLN 120 25.725 6.395 0.737 951 HG2 GLN 120 HG2 GLN 120 28.031 6.824 1.187 952 HG3 GLN 120 HG1 GLN 120 27.637 8.340 1.999 953 HE21 GLN 120 HE21 GLN 120 26.779 8.298 4.052 954 HE22 GLN 120 HE22 GLN 120 26.744 6.872 5.032 955 H SER 121 HN SER 121 25.475 7.196 -2.391 956 HA SER 121 HA SER 121 26.510 6.168 -4.094 957 HB2 SER 121 HB2 SER 121 28.502 7.410 -5.050 958 HB3 SER 121 HB1 SER 121 27.034 8.357 -4.830 959 HG SER 121 HG SER 121 28.489 8.495 -2.595 960 H MET 122 HN MET 122 26.846 4.402 -2.533 961 HA MET 122 HA MET 122 29.704 3.818 -2.176 962 HB2 MET 122 HB2 MET 122 27.234 2.616 -0.919 963 HB3 MET 122 HB1 MET 122 28.817 1.865 -0.795 964 HG2 MET 122 HG2 MET 122 28.107 4.620 0.180 965 HG3 MET 122 HG1 MET 122 28.263 3.181 1.183 966 HE1 MET 122 HE1 MET 122 30.004 4.362 2.795 967 HE2 MET 122 HE2 MET 122 29.810 5.844 1.857 968 HE3 MET 122 HE3 MET 122 31.425 5.239 2.222 969 H LEU 123 HN LEU 123 30.340 1.544 -2.683 970 HA LEU 123 HA LEU 123 29.535 1.033 -5.384 971 HB2 LEU 123 HB2 LEU 123 31.573 -0.216 -3.568 972 HB3 LEU 123 HB1 LEU 123 31.190 -0.927 -5.122 973 HG LEU 123 HG LEU 123 33.172 0.399 -5.357 974 HD11 LEU 123 HD11 LEU 123 32.490 1.964 -7.105 975 HD12 LEU 123 HD12 LEU 123 30.813 1.830 -6.573 976 HD13 LEU 123 HD13 LEU 123 31.640 0.424 -7.242 977 HD21 LEU 123 HD21 LEU 123 31.583 2.738 -4.298 978 HD22 LEU 123 HD22 LEU 123 33.240 2.790 -4.903 979 HD23 LEU 123 HD23 LEU 123 32.864 1.885 -3.437 980 H SER 124 HN SER 124 27.839 0.359 -2.824 981 HA SER 124 HA SER 124 27.251 -2.425 -3.205 982 HB2 SER 124 HB2 SER 124 25.237 -1.748 -1.726 983 HB3 SER 124 HB1 SER 124 26.852 -1.650 -1.021 984 HG SER 124 HG SER 124 25.454 0.245 -0.713 985 H1 LYS 161 HN LYS 161 -11.857 -8.722 -7.593 986 HA LYS 161 HA LYS 161 -9.622 -6.812 -7.501 987 HB2 LYS 161 HB2 LYS 161 -12.556 -6.249 -7.076 988 HB3 LYS 161 HB1 LYS 161 -11.313 -5.213 -6.408 989 HG2 LYS 161 HG2 LYS 161 -11.991 -4.127 -8.328 990 HG3 LYS 161 HG1 LYS 161 -10.497 -4.943 -8.810 991 HD2 LYS 161 HD2 LYS 161 -12.072 -5.261 -10.569 992 HD3 LYS 161 HD1 LYS 161 -11.912 -6.804 -9.737 993 HE2 LYS 161 HE2 LYS 161 -14.105 -4.845 -9.101 994 HE3 LYS 161 HE1 LYS 161 -14.268 -6.056 -10.367 995 HZ1 LYS 161 HZ1 LYS 161 -15.249 -6.857 -8.346 996 HZ2 LYS 161 HZ2 LYS 161 -13.832 -6.572 -7.466 997 HZ3 LYS 161 HZ3 LYS 161 -13.862 -7.772 -8.666 998 H GLU 162 HN GLU 162 -12.025 -6.361 -5.162 999 HA GLU 162 HA GLU 162 -12.231 -6.728 -2.940 1000 HB2 GLU 162 HB2 GLU 162 -10.744 -9.215 -3.633 1001 HB3 GLU 162 HB1 GLU 162 -11.507 -8.950 -2.075 1002 HG2 GLU 162 HG2 GLU 162 -12.935 -9.035 -4.731 1003 HG3 GLU 162 HG1 GLU 162 -12.850 -10.366 -3.576 1004 H ASN 163 HN ASN 163 -11.224 -6.294 -0.968 1005 HA ASN 163 HA ASN 163 -8.311 -6.347 -0.869 1006 HB2 ASN 163 HB2 ASN 163 -9.892 -3.850 -1.097 1007 HB3 ASN 163 HB1 ASN 163 -8.543 -3.850 0.037 1008 HD21 ASN 163 HD21 ASN 163 -9.029 -2.549 -2.633 1009 HD22 ASN 163 HD22 ASN 163 -7.621 -2.973 -3.568 1010 H LEU 164 HN LEU 164 -7.768 -4.875 1.372 1011 HA LEU 164 HA LEU 164 -8.933 -5.352 3.731 1012 HB2 LEU 164 HB2 LEU 164 -8.627 -7.602 4.416 1013 HB3 LEU 164 HB1 LEU 164 -9.384 -7.711 2.838 1014 HG LEU 164 HG LEU 164 -6.403 -7.846 3.032 1015 HD11 LEU 164 HD11 LEU 164 -7.227 -9.436 4.703 1016 HD12 LEU 164 HD12 LEU 164 -6.503 -10.257 3.322 1017 HD13 LEU 164 HD13 LEU 164 -8.259 -10.184 3.485 1018 HD21 LEU 164 HD21 LEU 164 -6.650 -9.292 1.080 1019 HD22 LEU 164 HD22 LEU 164 -7.409 -7.721 0.827 1020 HD23 LEU 164 HD23 LEU 164 -8.405 -9.137 1.183 1021 H GLU 165 HN GLU 165 -7.284 -5.560 5.513 1022 HA GLU 165 HA GLU 165 -4.605 -4.928 4.574 1023 HB2 GLU 165 HB2 GLU 165 -5.911 -4.924 7.269 1024 HB3 GLU 165 HB1 GLU 165 -4.154 -4.992 7.148 1025 HG2 GLU 165 HG2 GLU 165 -4.061 -2.916 6.022 1026 HG3 GLU 165 HG1 GLU 165 -5.817 -2.872 5.820 1027 H SER 166 HN SER 166 -2.741 -6.094 5.356 1028 HA SER 166 HA SER 166 -3.117 -8.815 6.269 1029 HB2 SER 166 HB2 SER 166 -1.656 -8.402 3.662 1030 HB3 SER 166 HB1 SER 166 -2.221 -9.914 4.369 1031 HG SER 166 HG SER 166 -4.406 -8.926 4.069 1032 H MET 167 HN MET 167 -1.054 -9.783 6.878 1033 HA MET 167 HA MET 167 1.113 -7.798 7.089 1034 HB2 MET 167 HB2 MET 167 1.662 -8.724 9.302 1035 HB3 MET 167 HB1 MET 167 0.046 -8.031 9.261 1036 HG2 MET 167 HG2 MET 167 -0.768 -10.419 8.839 1037 HG3 MET 167 HG1 MET 167 0.845 -10.923 9.340 1038 HE1 MET 167 HE1 MET 167 0.877 -9.187 12.962 1039 HE2 MET 167 HE2 MET 167 1.247 -8.364 11.446 1040 HE3 MET 167 HE3 MET 167 1.888 -9.980 11.755 1041 H VAL 168 HN VAL 168 2.889 -8.397 6.130 1042 HA VAL 168 HA VAL 168 3.654 -11.224 6.153 1043 HB VAL 168 HB VAL 168 4.519 -11.108 3.880 1044 HG11 VAL 168 HG11 VAL 168 1.619 -10.292 3.991 1045 HG12 VAL 168 HG12 VAL 168 2.245 -11.929 4.188 1046 HG13 VAL 168 HG13 VAL 168 2.418 -11.100 2.642 1047 HG21 VAL 168 HG21 VAL 168 3.272 -8.369 3.718 1048 HG22 VAL 168 HG22 VAL 168 4.103 -9.224 2.417 1049 HG23 VAL 168 HG23 VAL 168 4.998 -8.700 3.846 Start of MODEL 20 1 H1 MET 1 HT1 MET 1 -9.424 35.344 2.499 2 H2 MET 1 HT2 MET 1 -9.735 34.554 1.032 3 H3 MET 1 HT3 MET 1 -8.291 35.424 1.236 4 HA MET 1 HA MET 1 -7.848 33.091 1.408 5 HB2 MET 1 HB2 MET 1 -7.761 34.527 4.073 6 HB3 MET 1 HB1 MET 1 -6.894 33.042 3.716 7 HG2 MET 1 HG2 MET 1 -5.651 34.219 1.948 8 HG3 MET 1 HG1 MET 1 -6.491 35.706 2.384 9 HE1 MET 1 HE1 MET 1 -2.819 36.261 3.694 10 HE2 MET 1 HE2 MET 1 -4.124 36.967 2.742 11 HE3 MET 1 HE3 MET 1 -3.361 35.466 2.215 12 H SER 2 HN SER 2 -8.328 31.068 2.204 13 HA SER 2 HA SER 2 -10.265 30.657 4.264 14 HB2 SER 2 HB2 SER 2 -11.697 31.285 2.265 15 HB3 SER 2 HB1 SER 2 -11.111 29.817 1.481 16 HG SER 2 HG SER 2 -12.636 28.828 2.525 17 H TYR 3 HN TYR 3 -10.172 28.587 5.049 18 HA TYR 3 HA TYR 3 -8.129 26.853 3.939 19 HB2 TYR 3 HB2 TYR 3 -8.125 27.049 6.325 20 HB3 TYR 3 HB1 TYR 3 -9.849 26.725 6.423 21 HD1 TYR 3 HD1 TYR 3 -6.763 25.068 5.133 22 HD2 TYR 3 HD2 TYR 3 -10.454 24.633 7.195 23 HE1 TYR 3 HE1 TYR 3 -6.262 22.694 5.509 24 HE2 TYR 3 HE2 TYR 3 -9.964 22.251 7.574 25 HH TYR 3 HH TYR 3 -6.845 20.893 6.914 26 H ILE 4 HN ILE 4 -8.488 24.831 3.074 27 HA ILE 4 HA ILE 4 -11.276 24.288 2.299 28 HB ILE 4 HB ILE 4 -8.801 23.588 0.706 29 HG12 ILE 4 HG12 ILE 4 -10.836 25.780 0.209 30 HG13 ILE 4 HG11 ILE 4 -9.186 26.035 0.771 31 HG21 ILE 4 HG21 ILE 4 -11.730 23.424 0.004 32 HG22 ILE 4 HG22 ILE 4 -10.672 22.061 0.366 33 HG23 ILE 4 HG23 ILE 4 -10.388 23.038 -1.074 34 HD11 ILE 4 HD11 ILE 4 -9.392 26.494 -1.603 35 HD12 ILE 4 HD12 ILE 4 -9.988 24.856 -1.879 36 HD13 ILE 4 HD13 ILE 4 -8.336 25.110 -1.319 37 HA PRO 5 HA PRO 5 -10.128 20.643 4.734 38 HB2 PRO 5 HB2 PRO 5 -13.046 20.348 4.934 39 HB3 PRO 5 HB1 PRO 5 -11.857 20.568 6.223 40 HG2 PRO 5 HG2 PRO 5 -13.591 22.517 5.589 41 HG3 PRO 5 HG1 PRO 5 -11.917 22.880 6.063 42 HD2 PRO 5 HD2 PRO 5 -13.083 22.717 3.303 43 HD3 PRO 5 HD1 PRO 5 -12.056 23.985 4.013 44 H GLY 6 HN GLY 6 -9.480 19.051 3.461 45 HA2 GLY 6 HA2 GLY 6 -10.083 16.968 2.413 46 HA3 GLY 6 HA1 GLY 6 -11.455 17.787 1.663 47 H GLN 7 HN GLN 7 -8.286 19.179 1.878 48 HA GLN 7 HA GLN 7 -7.992 19.265 -0.982 49 HB2 GLN 7 HB2 GLN 7 -5.749 20.317 -0.319 50 HB3 GLN 7 HB1 GLN 7 -7.208 21.185 0.137 51 HG2 GLN 7 HG2 GLN 7 -7.043 20.392 2.395 52 HG3 GLN 7 HG1 GLN 7 -5.689 19.349 1.971 53 HE21 GLN 7 HE21 GLN 7 -5.880 21.512 3.942 54 HE22 GLN 7 HE22 GLN 7 -4.619 22.638 3.534 55 HA PRO 8 HA PRO 8 -5.753 15.397 -0.868 56 HB2 PRO 8 HB2 PRO 8 -6.021 14.778 -3.437 57 HB3 PRO 8 HB1 PRO 8 -7.420 14.798 -2.357 58 HG2 PRO 8 HG2 PRO 8 -6.599 16.774 -4.426 59 HG3 PRO 8 HG1 PRO 8 -8.224 16.289 -3.916 60 HD2 PRO 8 HD2 PRO 8 -6.793 18.584 -3.076 61 HD3 PRO 8 HD1 PRO 8 -8.311 17.964 -2.391 62 H VAL 9 HN VAL 9 -4.217 14.415 -2.760 63 HA VAL 9 HA VAL 9 -2.260 16.341 -3.703 64 HB VAL 9 HB VAL 9 -1.740 15.464 -1.242 65 HG11 VAL 9 HG11 VAL 9 -1.941 13.084 -1.794 66 HG12 VAL 9 HG12 VAL 9 -0.328 13.486 -1.211 67 HG13 VAL 9 HG13 VAL 9 -0.602 13.238 -2.942 68 HG21 VAL 9 HG21 VAL 9 0.315 15.613 -3.436 69 HG22 VAL 9 HG22 VAL 9 0.662 15.691 -1.710 70 HG23 VAL 9 HG23 VAL 9 -0.303 16.956 -2.474 71 H THR 10 HN THR 10 -0.382 14.905 -4.637 72 HA THR 10 HA THR 10 -1.670 13.149 -6.529 73 HB THR 10 HB THR 10 0.358 13.470 -7.842 74 HG1 THR 10 HG1 THR 10 1.765 15.268 -6.782 75 HG21 THR 10 HG21 THR 10 -0.911 15.938 -6.650 76 HG22 THR 10 HG22 THR 10 -1.331 15.116 -8.162 77 HG23 THR 10 HG23 THR 10 0.193 15.995 -8.034 78 H ALA 11 HN ALA 11 1.401 12.431 -6.570 79 HA ALA 11 HA ALA 11 1.822 10.662 -4.434 80 HB1 ALA 11 HB1 ALA 11 0.029 9.359 -5.443 81 HB2 ALA 11 HB2 ALA 11 1.566 8.502 -5.550 82 HB3 ALA 11 HB3 ALA 11 0.907 9.313 -6.972 83 H VAL 12 HN VAL 12 3.846 10.668 -4.220 84 HA VAL 12 HA VAL 12 5.612 10.133 -6.506 85 HB VAL 12 HB VAL 12 6.144 12.086 -4.309 86 HG11 VAL 12 HG11 VAL 12 7.961 11.339 -6.600 87 HG12 VAL 12 HG12 VAL 12 8.026 10.557 -5.013 88 HG13 VAL 12 HG13 VAL 12 8.370 12.296 -5.172 89 HG21 VAL 12 HG21 VAL 12 4.755 13.137 -5.962 90 HG22 VAL 12 HG22 VAL 12 5.770 12.527 -7.270 91 HG23 VAL 12 HG23 VAL 12 6.396 13.748 -6.164 92 H VAL 13 HN VAL 13 6.150 8.102 -5.854 93 HA VAL 13 HA VAL 13 8.361 8.287 -4.212 94 HB VAL 13 HB VAL 13 6.115 7.238 -2.819 95 HG11 VAL 13 HG11 VAL 13 7.148 5.041 -3.670 96 HG12 VAL 13 HG12 VAL 13 6.812 5.229 -1.952 97 HG13 VAL 13 HG13 VAL 13 8.458 5.418 -2.545 98 HG21 VAL 13 HG21 VAL 13 8.997 7.681 -2.094 99 HG22 VAL 13 HG22 VAL 13 7.679 7.442 -0.948 100 HG23 VAL 13 HG23 VAL 13 7.691 8.863 -1.991 101 H GLN 14 HN GLN 14 9.255 5.987 -3.953 102 HA GLN 14 HA GLN 14 10.117 5.607 -6.672 103 HB2 GLN 14 HB2 GLN 14 11.437 5.657 -3.981 104 HB3 GLN 14 HB1 GLN 14 12.240 4.931 -5.353 105 HG2 GLN 14 HG2 GLN 14 13.050 7.157 -5.117 106 HG3 GLN 14 HG1 GLN 14 12.057 7.075 -6.557 107 HE21 GLN 14 HE21 GLN 14 10.546 7.194 -3.448 108 HE22 GLN 14 HE22 GLN 14 9.985 8.810 -3.581 109 H ARG 15 HN ARG 15 11.528 3.450 -6.646 110 HA ARG 15 HA ARG 15 9.649 1.333 -6.086 111 HB2 ARG 15 HB2 ARG 15 12.176 0.855 -7.548 112 HB3 ARG 15 HB1 ARG 15 10.557 0.276 -7.871 113 HG2 ARG 15 HG2 ARG 15 9.922 2.344 -8.859 114 HG3 ARG 15 HG1 ARG 15 11.471 3.074 -8.411 115 HD2 ARG 15 HD2 ARG 15 12.523 1.171 -9.747 116 HD3 ARG 15 HD1 ARG 15 10.905 0.897 -10.394 117 HE ARG 15 HE ARG 15 11.120 3.438 -10.973 118 HH11 ARG 15 HH11 ARG 15 13.655 1.001 -11.209 119 HH12 ARG 15 HH12 ARG 15 14.499 1.840 -12.473 120 HH21 ARG 15 HH21 ARG 15 12.261 4.541 -12.619 121 HH22 ARG 15 HH22 ARG 15 13.711 3.843 -13.271 122 H VAL 16 HN VAL 16 10.218 -0.328 -4.728 123 HA VAL 16 HA VAL 16 12.873 -0.200 -3.607 124 HB VAL 16 HB VAL 16 11.866 1.157 -2.017 125 HG11 VAL 16 HG11 VAL 16 9.464 -0.635 -2.043 126 HG12 VAL 16 HG12 VAL 16 9.599 0.963 -2.786 127 HG13 VAL 16 HG13 VAL 16 9.673 0.793 -1.028 128 HG21 VAL 16 HG21 VAL 16 11.510 -1.605 -0.857 129 HG22 VAL 16 HG22 VAL 16 11.644 -0.104 0.073 130 HG23 VAL 16 HG23 VAL 16 13.011 -0.681 -0.890 131 H GLU 17 HN GLU 17 13.600 -2.148 -2.816 132 HA GLU 17 HA GLU 17 11.910 -4.468 -3.288 133 HB2 GLU 17 HB2 GLU 17 14.141 -5.705 -3.487 134 HB3 GLU 17 HB1 GLU 17 13.656 -4.665 -4.816 135 HG2 GLU 17 HG2 GLU 17 15.147 -2.907 -3.962 136 HG3 GLU 17 HG1 GLU 17 15.666 -4.001 -2.678 137 H ILE 18 HN ILE 18 11.214 -5.306 -1.557 138 HA ILE 18 HA ILE 18 12.447 -4.855 1.019 139 HB ILE 18 HB ILE 18 9.716 -5.813 0.194 140 HG12 ILE 18 HG12 ILE 18 10.436 -3.276 1.640 141 HG13 ILE 18 HG11 ILE 18 10.285 -3.388 -0.115 142 HG21 ILE 18 HG21 ILE 18 9.116 -5.671 2.578 143 HG22 ILE 18 HG22 ILE 18 10.810 -5.370 2.964 144 HG23 ILE 18 HG23 ILE 18 10.327 -6.909 2.250 145 HD11 ILE 18 HD11 ILE 18 8.168 -3.909 1.932 146 HD12 ILE 18 HD12 ILE 18 8.004 -4.272 0.211 147 HD13 ILE 18 HD13 ILE 18 8.228 -2.600 0.746 148 H HIS 19 HN HIS 19 13.936 -6.343 1.188 149 HA HIS 19 HA HIS 19 13.623 -9.044 0.391 150 HB2 HIS 19 HB2 HIS 19 15.632 -7.725 0.244 151 HB3 HIS 19 HB1 HIS 19 15.650 -7.544 1.978 152 HD1 HIS 19 HD1 HIS 19 15.961 -9.966 3.318 153 HD2 HIS 19 HD2 HIS 19 17.140 -9.705 -0.643 154 HE1 HIS 19 HE1 HIS 19 17.553 -11.886 2.976 155 HE2 HIS 19 HE2 HIS 19 18.435 -11.559 0.626 156 H LYS 20 HN LYS 20 11.764 -9.590 1.589 157 HA LYS 20 HA LYS 20 11.430 -9.511 4.355 158 HB2 LYS 20 HB2 LYS 20 9.740 -11.249 3.987 159 HB3 LYS 20 HB1 LYS 20 9.600 -9.931 2.841 160 HG2 LYS 20 HG2 LYS 20 10.471 -11.247 1.075 161 HG3 LYS 20 HG1 LYS 20 10.978 -12.522 2.192 162 HD2 LYS 20 HD2 LYS 20 8.670 -13.034 2.725 163 HD3 LYS 20 HD1 LYS 20 8.112 -11.673 1.747 164 HE2 LYS 20 HE2 LYS 20 9.690 -13.973 0.606 165 HE3 LYS 20 HE1 LYS 20 7.928 -13.959 0.683 166 HZ1 LYS 20 HZ1 LYS 20 7.939 -11.917 -0.630 167 HZ2 LYS 20 HZ2 LYS 20 8.672 -13.195 -1.463 168 HZ3 LYS 20 HZ3 LYS 20 9.624 -11.990 -0.746 169 H LEU 21 HN LEU 21 11.327 -11.564 5.804 170 HA LEU 21 HA LEU 21 13.876 -12.971 5.355 171 HB2 LEU 21 HB2 LEU 21 14.278 -10.885 6.638 172 HB3 LEU 21 HB1 LEU 21 13.186 -11.470 7.883 173 HG LEU 21 HG LEU 21 14.712 -13.387 8.276 174 HD11 LEU 21 HD11 LEU 21 15.725 -13.463 6.055 175 HD12 LEU 21 HD12 LEU 21 16.943 -13.359 7.326 176 HD13 LEU 21 HD13 LEU 21 16.536 -11.929 6.376 177 HD21 LEU 21 HD21 LEU 21 15.953 -10.655 8.509 178 HD22 LEU 21 HD22 LEU 21 16.459 -12.090 9.402 179 HD23 LEU 21 HD23 LEU 21 14.853 -11.406 9.665 180 H ARG 22 HN ARG 22 13.596 -15.051 5.664 181 HA ARG 22 HA ARG 22 11.588 -16.210 7.249 182 HB2 ARG 22 HB2 ARG 22 13.957 -17.173 5.729 183 HB3 ARG 22 HB1 ARG 22 13.300 -18.201 6.973 184 HG2 ARG 22 HG2 ARG 22 12.393 -18.687 4.753 185 HG3 ARG 22 HG1 ARG 22 11.155 -18.217 5.930 186 HD2 ARG 22 HD2 ARG 22 10.527 -16.701 4.448 187 HD3 ARG 22 HD1 ARG 22 11.979 -15.847 4.950 188 HE ARG 22 HE ARG 22 12.009 -17.695 2.646 189 HH11 ARG 22 HH11 ARG 22 12.639 -14.540 4.015 190 HH12 ARG 22 HH12 ARG 22 13.648 -14.023 2.705 191 HH21 ARG 22 HH21 ARG 22 13.321 -17.006 0.900 192 HH22 ARG 22 HH22 ARG 22 14.038 -15.422 0.936 193 H GLN 23 HN GLN 23 11.602 -16.850 9.235 194 HA GLN 23 HA GLN 23 14.142 -16.962 10.689 195 HB2 GLN 23 HB2 GLN 23 11.972 -16.179 12.425 196 HB3 GLN 23 HB1 GLN 23 13.554 -15.460 12.201 197 HG2 GLN 23 HG2 GLN 23 12.632 -14.401 10.104 198 HG3 GLN 23 HG1 GLN 23 11.040 -14.904 10.679 199 HE21 GLN 23 HE21 GLN 23 12.116 -12.256 10.218 200 HE22 GLN 23 HE22 GLN 23 11.980 -11.399 11.727 201 H GLY 24 HN GLY 24 13.546 -19.138 9.797 202 HA2 GLY 24 HA2 GLY 24 12.555 -21.270 10.103 203 HA3 GLY 24 HA1 GLY 24 13.735 -21.108 11.380 204 H GLU 25 HN GLU 25 10.408 -20.609 10.603 205 HA GLU 25 HA GLU 25 8.793 -21.640 12.305 206 HB2 GLU 25 HB2 GLU 25 10.369 -20.996 14.208 207 HB3 GLU 25 HB1 GLU 25 9.976 -19.319 13.868 208 HG2 GLU 25 HG2 GLU 25 7.585 -19.878 14.308 209 HG3 GLU 25 HG1 GLU 25 8.123 -21.465 14.858 210 H ASN 26 HN ASN 26 10.208 -18.891 10.976 211 HA ASN 26 HA ASN 26 7.634 -17.554 10.682 212 HB2 ASN 26 HB2 ASN 26 10.296 -16.316 11.264 213 HB3 ASN 26 HB1 ASN 26 8.846 -15.444 10.875 214 HD21 ASN 26 HD21 ASN 26 10.206 -17.705 13.065 215 HD22 ASN 26 HD22 ASN 26 9.314 -17.225 14.476 216 H LEU 27 HN LEU 27 7.206 -17.113 8.873 217 HA LEU 27 HA LEU 27 9.190 -16.490 6.776 218 HB2 LEU 27 HB2 LEU 27 6.360 -17.578 6.738 219 HB3 LEU 27 HB1 LEU 27 6.977 -16.693 5.375 220 HG LEU 27 HG LEU 27 7.006 -19.230 5.232 221 HD11 LEU 27 HD11 LEU 27 8.208 -17.804 3.685 222 HD12 LEU 27 HD12 LEU 27 9.102 -19.285 4.026 223 HD13 LEU 27 HD13 LEU 27 9.590 -17.765 4.779 224 HD21 LEU 27 HD21 LEU 27 9.092 -20.268 6.190 225 HD22 LEU 27 HD22 LEU 27 7.820 -19.887 7.348 226 HD23 LEU 27 HD23 LEU 27 9.233 -18.840 7.222 227 H ILE 28 HN ILE 28 9.409 -14.306 6.914 228 HA ILE 28 HA ILE 28 7.064 -12.726 7.706 229 HB ILE 28 HB ILE 28 9.895 -11.757 7.611 230 HG12 ILE 28 HG12 ILE 28 9.840 -13.776 9.015 231 HG13 ILE 28 HG11 ILE 28 10.209 -12.323 9.926 232 HG21 ILE 28 HG21 ILE 28 7.440 -10.868 9.040 233 HG22 ILE 28 HG22 ILE 28 8.359 -10.032 7.781 234 HG23 ILE 28 HG23 ILE 28 9.054 -10.250 9.387 235 HD11 ILE 28 HD11 ILE 28 7.527 -13.693 9.828 236 HD12 ILE 28 HD12 ILE 28 7.932 -12.270 10.788 237 HD13 ILE 28 HD13 ILE 28 8.701 -13.824 11.140 238 H LEU 29 HN LEU 29 6.156 -11.421 6.217 239 HA LEU 29 HA LEU 29 7.674 -10.587 3.873 240 HB2 LEU 29 HB2 LEU 29 5.321 -10.984 3.522 241 HB3 LEU 29 HB1 LEU 29 4.891 -9.944 4.866 242 HG LEU 29 HG LEU 29 5.465 -7.976 3.658 243 HD11 LEU 29 HD11 LEU 29 6.489 -8.025 1.453 244 HD12 LEU 29 HD12 LEU 29 6.581 -9.786 1.525 245 HD13 LEU 29 HD13 LEU 29 7.515 -8.805 2.658 246 HD21 LEU 29 HD21 LEU 29 3.306 -8.969 3.082 247 HD22 LEU 29 HD22 LEU 29 4.070 -9.876 1.777 248 HD23 LEU 29 HD23 LEU 29 4.011 -8.115 1.710 249 H GLY 30 HN GLY 30 6.130 -9.164 6.700 250 HA2 GLY 30 HA2 GLY 30 7.618 -8.078 8.274 251 HA3 GLY 30 HA1 GLY 30 8.502 -7.429 6.911 252 H PHE 31 HN PHE 31 5.104 -7.192 6.515 253 HA PHE 31 HA PHE 31 4.692 -4.926 8.153 254 HB2 PHE 31 HB2 PHE 31 4.449 -3.193 6.435 255 HB3 PHE 31 HB1 PHE 31 6.103 -3.770 6.593 256 HD1 PHE 31 HD2 PHE 31 6.924 -5.476 4.912 257 HD2 PHE 31 HD1 PHE 31 3.382 -3.198 4.426 258 HE1 PHE 31 HE2 PHE 31 6.988 -5.908 2.519 259 HE2 PHE 31 HE1 PHE 31 3.425 -3.605 2.033 260 HZ PHE 31 HZ PHE 31 5.235 -4.975 1.036 261 H SER 32 HN SER 32 2.647 -3.602 7.132 262 HA SER 32 HA SER 32 0.702 -5.665 6.306 263 HB2 SER 32 HB2 SER 32 0.390 -5.217 8.695 264 HB3 SER 32 HB1 SER 32 0.297 -3.486 8.383 265 HG SER 32 HG SER 32 -1.489 -5.224 7.077 266 H ILE 33 HN ILE 33 -0.831 -4.983 4.748 267 HA ILE 33 HA ILE 33 -0.521 -2.166 3.946 268 HB ILE 33 HB ILE 33 -0.876 -2.898 1.576 269 HG12 ILE 33 HG12 ILE 33 -0.044 -5.631 2.552 270 HG13 ILE 33 HG11 ILE 33 -1.732 -5.204 2.292 271 HG21 ILE 33 HG21 ILE 33 1.300 -2.239 2.311 272 HG22 ILE 33 HG22 ILE 33 1.473 -3.655 1.275 273 HG23 ILE 33 HG23 ILE 33 1.593 -3.824 3.029 274 HD11 ILE 33 HD11 ILE 33 -1.272 -4.755 -0.059 275 HD12 ILE 33 HD12 ILE 33 -0.819 -6.401 0.399 276 HD13 ILE 33 HD13 ILE 33 0.431 -5.168 0.198 277 H GLY 34 HN GLY 34 -2.366 -1.391 2.671 278 HA2 GLY 34 HA2 GLY 34 -4.791 -2.973 3.051 279 HA3 GLY 34 HA1 GLY 34 -4.751 -1.384 3.814 280 H GLY 35 HN GLY 35 -5.879 -2.929 1.132 281 HA2 GLY 35 HA2 GLY 35 -5.941 -0.406 -0.334 282 HA3 GLY 35 HA1 GLY 35 -5.159 -1.762 -1.128 283 H GLY 36 HN GLY 36 -8.019 -0.126 -0.658 284 HA2 GLY 36 HA2 GLY 36 -9.541 -0.983 -2.550 285 HA3 GLY 36 HA1 GLY 36 -9.655 -2.426 -1.538 286 H ILE 37 HN ILE 37 -9.325 -0.418 0.706 287 HA ILE 37 HA ILE 37 -11.886 -1.008 1.644 288 HB ILE 37 HB ILE 37 -11.261 0.682 3.486 289 HG12 ILE 37 HG12 ILE 37 -8.491 0.418 2.417 290 HG13 ILE 37 HG11 ILE 37 -9.524 1.646 1.698 291 HG21 ILE 37 HG21 ILE 37 -9.622 -0.914 4.397 292 HG22 ILE 37 HG22 ILE 37 -9.520 -1.677 2.808 293 HG23 ILE 37 HG23 ILE 37 -11.035 -1.711 3.711 294 HD11 ILE 37 HD11 ILE 37 -9.853 2.652 3.861 295 HD12 ILE 37 HD12 ILE 37 -8.140 2.548 3.455 296 HD13 ILE 37 HD13 ILE 37 -8.845 1.411 4.606 297 H ASP 38 HN ASP 38 -10.609 2.191 0.769 298 HA ASP 38 HA ASP 38 -13.397 3.161 0.851 299 HB2 ASP 38 HB2 ASP 38 -11.819 3.944 2.715 300 HB3 ASP 38 HB1 ASP 38 -10.985 4.861 1.468 301 H GLN 39 HN GLN 39 -11.329 2.178 -1.167 302 HA GLN 39 HA GLN 39 -11.508 4.491 -2.987 303 HB2 GLN 39 HB2 GLN 39 -9.819 2.938 -4.308 304 HB3 GLN 39 HB1 GLN 39 -9.292 4.043 -3.048 305 HG2 GLN 39 HG2 GLN 39 -10.053 1.281 -2.292 306 HG3 GLN 39 HG1 GLN 39 -8.515 1.545 -3.087 307 HE21 GLN 39 HE21 GLN 39 -8.370 4.263 -1.831 308 HE22 GLN 39 HE22 GLN 39 -7.873 3.952 -0.210 309 H ASP 40 HN ASP 40 -12.748 1.384 -2.499 310 HA ASP 40 HA ASP 40 -13.298 0.647 -5.149 311 HB2 ASP 40 HB2 ASP 40 -13.965 -0.357 -2.528 312 HB3 ASP 40 HB1 ASP 40 -15.392 -0.359 -3.556 313 HA PRO 41 HA PRO 41 -15.826 3.993 -6.211 314 HB2 PRO 41 HB2 PRO 41 -17.076 2.846 -8.363 315 HB3 PRO 41 HB1 PRO 41 -15.412 3.445 -8.382 316 HG2 PRO 41 HG2 PRO 41 -16.402 0.646 -7.944 317 HG3 PRO 41 HG1 PRO 41 -15.101 1.208 -8.993 318 HD2 PRO 41 HD2 PRO 41 -14.534 0.145 -6.638 319 HD3 PRO 41 HD1 PRO 41 -13.636 1.575 -7.190 320 H SER 42 HN SER 42 -17.243 0.887 -5.580 321 HA SER 42 HA SER 42 -19.951 1.863 -5.598 322 HB2 SER 42 HB2 SER 42 -19.379 -0.538 -6.003 323 HB3 SER 42 HB1 SER 42 -18.945 -0.676 -4.297 324 HG SER 42 HG SER 42 -21.234 0.268 -4.050 325 H GLN 43 HN GLN 43 -17.426 1.466 -3.134 326 HA GLN 43 HA GLN 43 -19.320 2.296 -1.083 327 HB2 GLN 43 HB2 GLN 43 -16.448 1.370 -0.893 328 HB3 GLN 43 HB1 GLN 43 -17.587 1.565 0.434 329 HG2 GLN 43 HG2 GLN 43 -18.922 -0.210 -0.321 330 HG3 GLN 43 HG1 GLN 43 -18.106 -0.257 -1.870 331 HE21 GLN 43 HE21 GLN 43 -16.083 -1.134 -2.031 332 HE22 GLN 43 HE22 GLN 43 -15.492 -2.268 -0.850 333 H ASN 44 HN ASN 44 -17.068 3.472 -3.240 334 HA ASN 44 HA ASN 44 -17.330 6.127 -2.069 335 HB2 ASN 44 HB2 ASN 44 -15.147 5.004 -1.280 336 HB3 ASN 44 HB1 ASN 44 -14.597 5.259 -2.941 337 HD21 ASN 44 HD21 ASN 44 -13.613 6.442 -0.462 338 HD22 ASN 44 HD22 ASN 44 -13.760 8.154 -0.650 339 HA PRO 45 HA PRO 45 -17.749 6.391 -6.608 340 HB2 PRO 45 HB2 PRO 45 -19.935 8.201 -6.063 341 HB3 PRO 45 HB1 PRO 45 -19.990 6.621 -6.859 342 HG2 PRO 45 HG2 PRO 45 -21.085 7.161 -4.401 343 HG3 PRO 45 HG1 PRO 45 -20.585 5.548 -4.943 344 HD2 PRO 45 HD2 PRO 45 -19.188 7.456 -3.115 345 HD3 PRO 45 HD1 PRO 45 -19.264 5.684 -3.055 346 H PHE 46 HN PHE 46 -16.914 8.318 -4.037 347 HA PHE 46 HA PHE 46 -16.712 10.786 -5.585 348 HB2 PHE 46 HB2 PHE 46 -16.178 10.196 -2.668 349 HB3 PHE 46 HB1 PHE 46 -15.955 11.779 -3.420 350 HD1 PHE 46 HD2 PHE 46 -17.938 12.969 -4.358 351 HD2 PHE 46 HD1 PHE 46 -18.305 9.457 -1.984 352 HE1 PHE 46 HE2 PHE 46 -20.304 13.497 -3.957 353 HE2 PHE 46 HE1 PHE 46 -20.680 9.974 -1.581 354 HZ PHE 46 HZ PHE 46 -21.678 11.995 -2.568 355 H SER 47 HN SER 47 -14.759 8.152 -4.430 356 HA SER 47 HA SER 47 -12.418 9.529 -5.507 357 HB2 SER 47 HB2 SER 47 -12.246 7.315 -3.510 358 HB3 SER 47 HB1 SER 47 -11.070 8.559 -3.888 359 HG SER 47 HG SER 47 -13.571 9.059 -2.656 360 H GLU 48 HN GLU 48 -10.886 8.128 -6.420 361 HA GLU 48 HA GLU 48 -10.886 5.561 -7.203 362 HB2 GLU 48 HB2 GLU 48 -12.098 5.406 -9.322 363 HB3 GLU 48 HB1 GLU 48 -13.202 5.870 -8.035 364 HG2 GLU 48 HG2 GLU 48 -13.270 8.121 -8.789 365 HG3 GLU 48 HG1 GLU 48 -11.956 7.840 -9.931 366 H ASP 49 HN ASP 49 -10.495 8.860 -7.935 367 HA ASP 49 HA ASP 49 -8.066 8.298 -9.481 368 HB2 ASP 49 HB2 ASP 49 -9.906 8.703 -11.095 369 HB3 ASP 49 HB1 ASP 49 -10.197 10.268 -10.348 370 H LYS 50 HN LYS 50 -6.413 9.389 -8.668 371 HA LYS 50 HA LYS 50 -5.161 10.791 -7.400 372 HB2 LYS 50 HB2 LYS 50 -7.469 12.660 -7.892 373 HB3 LYS 50 HB1 LYS 50 -6.105 13.125 -6.889 374 HG2 LYS 50 HG2 LYS 50 -5.645 13.997 -9.017 375 HG3 LYS 50 HG1 LYS 50 -4.633 12.556 -8.883 376 HD2 LYS 50 HD2 LYS 50 -6.542 11.328 -10.037 377 HD3 LYS 50 HD1 LYS 50 -7.178 12.928 -10.425 378 HE2 LYS 50 HE2 LYS 50 -5.124 13.480 -11.602 379 HE3 LYS 50 HE1 LYS 50 -4.431 11.919 -11.161 380 HZ1 LYS 50 HZ1 LYS 50 -6.652 12.480 -13.021 381 HZ2 LYS 50 HZ2 LYS 50 -6.443 10.945 -12.338 382 HZ3 LYS 50 HZ3 LYS 50 -5.222 11.618 -13.308 383 H THR 51 HN THR 51 -8.538 11.098 -6.327 384 HA THR 51 HA THR 51 -7.816 11.169 -3.546 385 HB THR 51 HB THR 51 -10.324 10.934 -3.231 386 HG1 THR 51 HG1 THR 51 -11.551 11.228 -5.182 387 HG21 THR 51 HG21 THR 51 -9.343 13.133 -5.047 388 HG22 THR 51 HG22 THR 51 -9.230 13.114 -3.287 389 HG23 THR 51 HG23 THR 51 -10.811 13.187 -4.068 390 H ASP 52 HN ASP 52 -7.920 8.802 -5.805 391 HA ASP 52 HA ASP 52 -9.213 6.593 -4.808 392 HB2 ASP 52 HB2 ASP 52 -8.094 6.713 -7.016 393 HB3 ASP 52 HB1 ASP 52 -6.539 6.640 -6.197 394 H LYS 53 HN LYS 53 -5.693 6.894 -4.557 395 HA LYS 53 HA LYS 53 -4.173 6.113 -3.053 396 HB2 LYS 53 HB2 LYS 53 -6.381 6.296 -0.985 397 HB3 LYS 53 HB1 LYS 53 -4.649 6.281 -0.689 398 HG2 LYS 53 HG2 LYS 53 -6.250 8.478 -1.983 399 HG3 LYS 53 HG1 LYS 53 -5.497 8.505 -0.390 400 HD2 LYS 53 HD2 LYS 53 -3.286 8.217 -1.546 401 HD3 LYS 53 HD1 LYS 53 -4.134 8.462 -3.075 402 HE2 LYS 53 HE2 LYS 53 -3.948 10.402 -0.774 403 HE3 LYS 53 HE1 LYS 53 -3.153 10.552 -2.338 404 HZ1 LYS 53 HZ1 LYS 53 -5.370 10.688 -3.373 405 HZ2 LYS 53 HZ2 LYS 53 -5.093 11.938 -2.270 406 HZ3 LYS 53 HZ3 LYS 53 -6.086 10.641 -1.831 407 H GLY 54 HN GLY 54 -5.824 4.393 -4.579 408 HA2 GLY 54 HA2 GLY 54 -7.380 2.530 -3.523 409 HA3 GLY 54 HA1 GLY 54 -6.296 2.189 -4.858 410 H ILE 55 HN ILE 55 -4.003 1.678 -4.131 411 HA ILE 55 HA ILE 55 -4.113 -0.190 -1.861 412 HB ILE 55 HB ILE 55 -2.455 -0.327 -4.389 413 HG12 ILE 55 HG12 ILE 55 -4.823 -0.923 -4.715 414 HG13 ILE 55 HG11 ILE 55 -3.764 -2.309 -4.929 415 HG21 ILE 55 HG21 ILE 55 -1.775 -2.570 -3.538 416 HG22 ILE 55 HG22 ILE 55 -2.503 -2.140 -1.988 417 HG23 ILE 55 HG23 ILE 55 -1.141 -1.206 -2.616 418 HD11 ILE 55 HD11 ILE 55 -5.665 -3.039 -3.707 419 HD12 ILE 55 HD12 ILE 55 -5.535 -1.693 -2.567 420 HD13 ILE 55 HD13 ILE 55 -4.308 -2.978 -2.575 421 H TYR 56 HN TYR 56 -2.827 0.313 -0.191 422 HA TYR 56 HA TYR 56 -0.201 1.408 -0.667 423 HB2 TYR 56 HB2 TYR 56 -0.436 3.400 0.649 424 HB3 TYR 56 HB1 TYR 56 -1.671 3.424 -0.602 425 HD1 TYR 56 HD1 TYR 56 -4.036 2.606 0.101 426 HD2 TYR 56 HD2 TYR 56 -1.014 3.757 2.854 427 HE1 TYR 56 HE1 TYR 56 -5.758 2.985 1.823 428 HE2 TYR 56 HE2 TYR 56 -2.719 4.134 4.590 429 HH TYR 56 HH TYR 56 -5.913 3.051 4.289 430 H VAL 57 HN VAL 57 1.105 1.497 1.306 431 HA VAL 57 HA VAL 57 0.568 -0.690 3.025 432 HB VAL 57 HB VAL 57 2.795 0.264 2.091 433 HG11 VAL 57 HG11 VAL 57 3.978 1.486 4.014 434 HG12 VAL 57 HG12 VAL 57 2.342 2.012 4.415 435 HG13 VAL 57 HG13 VAL 57 3.028 2.378 2.832 436 HG21 VAL 57 HG21 VAL 57 2.514 -1.709 3.500 437 HG22 VAL 57 HG22 VAL 57 2.668 -0.667 4.920 438 HG23 VAL 57 HG23 VAL 57 4.018 -0.843 3.800 439 H THR 58 HN THR 58 -0.091 -0.660 5.079 440 HA THR 58 HA THR 58 -0.866 1.945 6.185 441 HB THR 58 HB THR 58 -2.810 0.555 5.807 442 HG1 THR 58 HG1 THR 58 -1.992 1.240 8.351 443 HG21 THR 58 HG21 THR 58 -3.100 -1.601 6.983 444 HG22 THR 58 HG22 THR 58 -1.414 -1.522 7.499 445 HG23 THR 58 HG23 THR 58 -1.808 -1.648 5.785 446 H ARG 59 HN ARG 59 1.308 -0.647 6.532 447 HA ARG 59 HA ARG 59 2.463 0.641 8.790 448 HB2 ARG 59 HB2 ARG 59 1.836 -0.589 10.558 449 HB3 ARG 59 HB1 ARG 59 0.533 -1.124 9.540 450 HG2 ARG 59 HG2 ARG 59 1.699 -3.114 8.926 451 HG3 ARG 59 HG1 ARG 59 3.133 -2.567 9.792 452 HD2 ARG 59 HD2 ARG 59 0.463 -3.097 11.075 453 HD3 ARG 59 HD1 ARG 59 1.795 -4.253 11.038 454 HE ARG 59 HE ARG 59 2.341 -1.633 12.202 455 HH11 ARG 59 HH11 ARG 59 1.612 -5.016 12.713 456 HH12 ARG 59 HH12 ARG 59 2.136 -5.019 14.371 457 HH21 ARG 59 HH21 ARG 59 2.995 -1.613 14.398 458 HH22 ARG 59 HH22 ARG 59 2.938 -3.082 15.330 459 H VAL 60 HN VAL 60 4.228 -0.729 9.712 460 HA VAL 60 HA VAL 60 5.523 -2.455 7.758 461 HB VAL 60 HB VAL 60 6.690 0.128 8.822 462 HG11 VAL 60 HG11 VAL 60 8.818 -0.552 7.866 463 HG12 VAL 60 HG12 VAL 60 8.123 -2.109 7.416 464 HG13 VAL 60 HG13 VAL 60 8.280 -1.674 9.115 465 HG21 VAL 60 HG21 VAL 60 6.375 -0.913 6.011 466 HG22 VAL 60 HG22 VAL 60 7.123 0.621 6.470 467 HG23 VAL 60 HG23 VAL 60 5.406 0.355 6.769 468 H SER 61 HN SER 61 6.489 -4.138 8.845 469 HA SER 61 HA SER 61 6.589 -3.992 11.737 470 HB2 SER 61 HB2 SER 61 7.809 -6.086 9.957 471 HB3 SER 61 HB1 SER 61 7.486 -6.226 11.682 472 HG SER 61 HG SER 61 5.382 -6.445 11.307 473 H GLU 62 HN GLU 62 8.041 -2.791 12.615 474 HA GLU 62 HA GLU 62 10.143 -1.651 11.317 475 HB2 GLU 62 HB2 GLU 62 8.782 -0.592 13.029 476 HB3 GLU 62 HB1 GLU 62 9.397 -1.722 14.224 477 HG2 GLU 62 HG2 GLU 62 11.525 -0.839 14.100 478 HG3 GLU 62 HG1 GLU 62 11.143 0.054 12.638 479 H GLY 63 HN GLY 63 12.184 -1.723 11.693 480 HA2 GLY 63 HA2 GLY 63 14.259 -2.694 11.967 481 HA3 GLY 63 HA1 GLY 63 13.577 -3.610 13.319 482 H GLY 64 HN GLY 64 12.197 -3.713 10.100 483 HA2 GLY 64 HA2 GLY 64 12.997 -6.546 10.009 484 HA3 GLY 64 HA1 GLY 64 11.443 -5.924 9.456 485 HA PRO 65 HA PRO 65 13.781 -6.040 5.628 486 HB2 PRO 65 HB2 PRO 65 11.453 -6.691 4.259 487 HB3 PRO 65 HB1 PRO 65 12.656 -7.819 4.857 488 HG2 PRO 65 HG2 PRO 65 10.003 -7.615 5.728 489 HG3 PRO 65 HG1 PRO 65 11.304 -8.505 6.533 490 HD2 PRO 65 HD2 PRO 65 10.215 -5.789 7.137 491 HD3 PRO 65 HD1 PRO 65 10.881 -7.031 8.232 492 H ALA 66 HN ALA 66 10.717 -4.438 6.201 493 HA ALA 66 HA ALA 66 10.444 -3.577 3.467 494 HB1 ALA 66 HB1 ALA 66 8.892 -2.910 5.966 495 HB2 ALA 66 HB2 ALA 66 8.440 -4.044 4.690 496 HB3 ALA 66 HB3 ALA 66 8.484 -2.312 4.360 497 H GLU 67 HN GLU 67 11.512 -2.218 6.463 498 HA GLU 67 HA GLU 67 11.222 0.502 5.517 499 HB2 GLU 67 HB2 GLU 67 12.225 0.837 7.887 500 HB3 GLU 67 HB1 GLU 67 10.555 0.285 7.732 501 HG2 GLU 67 HG2 GLU 67 11.025 -1.785 8.500 502 HG3 GLU 67 HG1 GLU 67 12.604 -1.793 7.735 503 H ILE 68 HN ILE 68 13.534 -2.009 5.958 504 HA ILE 68 HA ILE 68 15.727 -0.225 5.955 505 HB ILE 68 HB ILE 68 17.036 -2.258 5.748 506 HG12 ILE 68 HG12 ILE 68 15.327 -4.232 6.600 507 HG13 ILE 68 HG11 ILE 68 14.455 -3.427 5.302 508 HG21 ILE 68 HG21 ILE 68 15.102 -1.991 7.999 509 HG22 ILE 68 HG22 ILE 68 16.731 -1.323 7.899 510 HG23 ILE 68 HG23 ILE 68 16.500 -3.066 8.065 511 HD11 ILE 68 HD11 ILE 68 17.225 -4.582 5.104 512 HD12 ILE 68 HD12 ILE 68 16.330 -3.801 3.799 513 HD13 ILE 68 HD13 ILE 68 15.748 -5.321 4.484 514 H ALA 69 HN ALA 69 13.857 -2.123 3.933 515 HA ALA 69 HA ALA 69 15.383 -1.930 1.559 516 HB1 ALA 69 HB1 ALA 69 13.525 -3.515 1.751 517 HB2 ALA 69 HB2 ALA 69 13.256 -2.410 0.402 518 HB3 ALA 69 HB3 ALA 69 12.390 -2.173 1.920 519 H GLY 70 HN GLY 70 13.270 0.035 3.393 520 HA2 GLY 70 HA2 GLY 70 13.611 2.468 3.207 521 HA3 GLY 70 HA1 GLY 70 13.680 2.256 1.459 522 H LEU 71 HN LEU 71 11.353 0.863 3.765 523 HA LEU 71 HA LEU 71 9.225 2.294 2.388 524 HB2 LEU 71 HB2 LEU 71 9.371 -0.237 2.164 525 HB3 LEU 71 HB1 LEU 71 9.071 -0.310 3.899 526 HG LEU 71 HG LEU 71 6.934 1.036 3.377 527 HD11 LEU 71 HD11 LEU 71 7.538 -0.108 0.657 528 HD12 LEU 71 HD12 LEU 71 7.452 1.601 1.075 529 HD13 LEU 71 HD13 LEU 71 6.004 0.598 1.154 530 HD21 LEU 71 HD21 LEU 71 5.774 -1.107 2.896 531 HD22 LEU 71 HD22 LEU 71 6.938 -1.181 4.221 532 HD23 LEU 71 HD23 LEU 71 7.362 -1.838 2.642 533 H GLN 72 HN GLN 72 7.280 2.269 4.018 534 HA GLN 72 HA GLN 72 7.885 2.803 6.690 535 HB2 GLN 72 HB2 GLN 72 7.626 5.295 6.523 536 HB3 GLN 72 HB1 GLN 72 9.113 4.647 5.832 537 HG2 GLN 72 HG2 GLN 72 8.550 6.073 4.197 538 HG3 GLN 72 HG1 GLN 72 7.697 4.629 3.642 539 HE21 GLN 72 HE21 GLN 72 6.152 5.808 2.518 540 HE22 GLN 72 HE22 GLN 72 4.937 6.724 3.357 541 H ILE 73 HN ILE 73 5.907 4.377 7.457 542 HA ILE 73 HA ILE 73 3.632 2.766 6.797 543 HB ILE 73 HB ILE 73 3.565 5.143 8.620 544 HG12 ILE 73 HG12 ILE 73 5.611 4.123 9.325 545 HG13 ILE 73 HG11 ILE 73 4.373 3.607 10.462 546 HG21 ILE 73 HG21 ILE 73 2.079 3.681 9.904 547 HG22 ILE 73 HG22 ILE 73 2.300 2.428 8.683 548 HG23 ILE 73 HG23 ILE 73 1.524 3.949 8.255 549 HD11 ILE 73 HD11 ILE 73 4.205 1.463 9.281 550 HD12 ILE 73 HD12 ILE 73 5.830 1.769 9.898 551 HD13 ILE 73 HD13 ILE 73 5.484 1.988 8.176 552 H GLY 74 HN GLY 74 2.553 3.273 4.984 553 HA2 GLY 74 HA2 GLY 74 0.610 4.555 4.308 554 HA3 GLY 74 HA1 GLY 74 1.405 5.999 4.933 555 H ASP 75 HN ASP 75 1.682 3.475 2.458 556 HA ASP 75 HA ASP 75 2.833 5.431 0.617 557 HB2 ASP 75 HB2 ASP 75 4.570 4.073 2.214 558 HB3 ASP 75 HB1 ASP 75 4.451 2.966 0.850 559 H LYS 76 HN LYS 76 2.298 4.897 -1.524 560 HA LYS 76 HA LYS 76 0.234 2.854 -1.643 561 HB2 LYS 76 HB2 LYS 76 1.150 4.671 -3.865 562 HB3 LYS 76 HB1 LYS 76 -0.380 3.823 -3.738 563 HG2 LYS 76 HG2 LYS 76 -1.256 5.337 -2.266 564 HG3 LYS 76 HG1 LYS 76 0.331 5.852 -1.679 565 HD2 LYS 76 HD2 LYS 76 -0.754 7.559 -3.112 566 HD3 LYS 76 HD1 LYS 76 0.788 6.984 -3.765 567 HE2 LYS 76 HE2 LYS 76 -1.012 7.209 -5.471 568 HE3 LYS 76 HE1 LYS 76 -0.328 5.590 -5.352 569 HZ1 LYS 76 HZ1 LYS 76 -2.230 4.902 -4.054 570 HZ2 LYS 76 HZ2 LYS 76 -2.742 5.536 -5.538 571 HZ3 LYS 76 HZ3 LYS 76 -2.886 6.458 -4.124 572 H ILE 77 HN ILE 77 1.002 0.844 -1.958 573 HA ILE 77 HA ILE 77 3.175 0.318 -3.774 574 HB ILE 77 HB ILE 77 1.266 -1.618 -2.458 575 HG12 ILE 77 HG12 ILE 77 4.078 -0.871 -1.633 576 HG13 ILE 77 HG11 ILE 77 2.643 -0.139 -0.925 577 HG21 ILE 77 HG21 ILE 77 3.028 -3.279 -2.918 578 HG22 ILE 77 HG22 ILE 77 3.939 -2.048 -3.792 579 HG23 ILE 77 HG23 ILE 77 2.373 -2.582 -4.400 580 HD11 ILE 77 HD11 ILE 77 3.328 -3.060 -0.859 581 HD12 ILE 77 HD12 ILE 77 1.919 -2.297 -0.118 582 HD13 ILE 77 HD13 ILE 77 3.540 -1.912 0.463 583 H MET 78 HN MET 78 2.853 0.584 -5.858 584 HA MET 78 HA MET 78 0.193 0.296 -6.998 585 HB2 MET 78 HB2 MET 78 2.757 1.067 -8.390 586 HB3 MET 78 HB1 MET 78 1.119 1.302 -8.980 587 HG2 MET 78 HG2 MET 78 2.152 2.595 -6.482 588 HG3 MET 78 HG1 MET 78 2.310 3.330 -8.075 589 HE1 MET 78 HE1 MET 78 -0.830 1.449 -6.181 590 HE2 MET 78 HE2 MET 78 -1.490 2.953 -5.539 591 HE3 MET 78 HE3 MET 78 0.148 2.457 -5.112 592 H GLN 79 HN GLN 79 3.241 -1.379 -6.998 593 HA GLN 79 HA GLN 79 2.123 -3.665 -8.212 594 HB2 GLN 79 HB2 GLN 79 4.130 -3.585 -9.911 595 HB3 GLN 79 HB1 GLN 79 2.503 -3.067 -10.314 596 HG2 GLN 79 HG2 GLN 79 3.328 -0.756 -9.604 597 HG3 GLN 79 HG1 GLN 79 4.927 -1.489 -9.775 598 HE21 GLN 79 HE21 GLN 79 5.632 -2.172 -11.725 599 HE22 GLN 79 HE22 GLN 79 4.941 -1.619 -13.228 600 H VAL 80 HN VAL 80 3.454 -5.392 -8.329 601 HA VAL 80 HA VAL 80 5.809 -5.150 -6.541 602 HB VAL 80 HB VAL 80 4.502 -6.200 -5.046 603 HG11 VAL 80 HG11 VAL 80 2.527 -5.862 -6.449 604 HG12 VAL 80 HG12 VAL 80 2.462 -7.389 -5.550 605 HG13 VAL 80 HG13 VAL 80 2.866 -7.396 -7.269 606 HG21 VAL 80 HG21 VAL 80 6.124 -7.925 -5.492 607 HG22 VAL 80 HG22 VAL 80 5.212 -8.499 -6.895 608 HG23 VAL 80 HG23 VAL 80 4.563 -8.713 -5.258 609 H ASN 81 HN ASN 81 7.601 -6.229 -7.182 610 HA ASN 81 HA ASN 81 9.055 -7.241 -8.596 611 HB2 ASN 81 HB2 ASN 81 6.799 -9.184 -8.387 612 HB3 ASN 81 HB1 ASN 81 8.063 -9.494 -9.580 613 HD21 ASN 81 HD21 ASN 81 7.306 -9.291 -6.184 614 HD22 ASN 81 HD22 ASN 81 8.788 -9.998 -5.619 615 H GLY 82 HN GLY 82 7.156 -5.303 -9.673 616 HA2 GLY 82 HA2 GLY 82 7.026 -4.297 -11.780 617 HA3 GLY 82 HA1 GLY 82 7.590 -5.799 -12.498 618 H TRP 83 HN TRP 83 4.942 -6.353 -10.376 619 HA TRP 83 HA TRP 83 3.218 -6.621 -12.709 620 HB2 TRP 83 HB2 TRP 83 2.872 -7.870 -10.008 621 HB3 TRP 83 HB1 TRP 83 2.016 -8.263 -11.476 622 HD1 TRP 83 HD1 TRP 83 5.585 -8.038 -10.405 623 HE1 TRP 83 HE1 TRP 83 6.827 -10.092 -11.111 624 HE3 TRP 83 HE3 TRP 83 1.817 -10.475 -12.803 625 HZ2 TRP 83 HZ2 TRP 83 6.384 -12.467 -12.535 626 HZ3 TRP 83 HZ3 TRP 83 2.328 -12.658 -13.834 627 HH2 TRP 83 HH2 TRP 83 4.579 -13.609 -13.686 628 H ASP 84 HN ASP 84 2.738 -4.343 -12.483 629 HA ASP 84 HA ASP 84 1.359 -2.832 -10.916 630 HB2 ASP 84 HB2 ASP 84 1.264 -2.572 -13.370 631 HB3 ASP 84 HB1 ASP 84 0.076 -3.864 -13.459 632 H MET 85 HN MET 85 0.373 -3.351 -9.122 633 HA MET 85 HA MET 85 -1.435 -5.566 -8.874 634 HB2 MET 85 HB2 MET 85 -1.200 -3.287 -6.918 635 HB3 MET 85 HB1 MET 85 -1.632 -4.959 -6.594 636 HG2 MET 85 HG2 MET 85 0.679 -5.621 -7.156 637 HG3 MET 85 HG1 MET 85 1.079 -3.922 -7.374 638 HE1 MET 85 HE1 MET 85 0.434 -6.816 -4.821 639 HE2 MET 85 HE2 MET 85 -1.083 -5.911 -4.743 640 HE3 MET 85 HE3 MET 85 0.012 -5.929 -3.359 641 H THR 86 HN THR 86 -2.430 -2.688 -7.384 642 HA THR 86 HA THR 86 -4.052 -1.188 -7.511 643 HB THR 86 HB THR 86 -4.834 -0.342 -9.660 644 HG1 THR 86 HG1 THR 86 -3.112 -2.109 -11.043 645 HG21 THR 86 HG21 THR 86 -2.649 0.407 -10.498 646 HG22 THR 86 HG22 THR 86 -1.860 -0.841 -9.531 647 HG23 THR 86 HG23 THR 86 -2.738 0.466 -8.737 648 H MET 87 HN MET 87 -4.868 -4.065 -9.351 649 HA MET 87 HA MET 87 -7.662 -3.747 -8.463 650 HB2 MET 87 HB2 MET 87 -6.638 -4.712 -11.136 651 HB3 MET 87 HB1 MET 87 -8.315 -4.794 -10.627 652 HG2 MET 87 HG2 MET 87 -8.386 -2.365 -10.456 653 HG3 MET 87 HG1 MET 87 -6.696 -2.282 -10.943 654 HE1 MET 87 HE1 MET 87 -8.965 -0.613 -12.387 655 HE2 MET 87 HE2 MET 87 -8.533 -0.851 -14.082 656 HE3 MET 87 HE3 MET 87 -7.272 -0.581 -12.881 657 H VAL 88 HN VAL 88 -5.262 -5.424 -7.525 658 HA VAL 88 HA VAL 88 -6.033 -8.123 -8.236 659 HB VAL 88 HB VAL 88 -4.222 -8.426 -6.190 660 HG11 VAL 88 HG11 VAL 88 -3.762 -8.218 -9.156 661 HG12 VAL 88 HG12 VAL 88 -4.212 -9.666 -8.234 662 HG13 VAL 88 HG13 VAL 88 -2.626 -8.917 -7.999 663 HG21 VAL 88 HG21 VAL 88 -3.809 -6.038 -6.063 664 HG22 VAL 88 HG22 VAL 88 -3.429 -6.002 -7.786 665 HG23 VAL 88 HG23 VAL 88 -2.390 -6.888 -6.674 666 H THR 89 HN THR 89 -5.998 -9.760 -6.456 667 HA THR 89 HA THR 89 -7.820 -8.937 -4.308 668 HB THR 89 HB THR 89 -7.568 -11.246 -6.101 669 HG1 THR 89 HG1 THR 89 -9.361 -9.703 -5.974 670 HG21 THR 89 HG21 THR 89 -8.701 -12.818 -4.515 671 HG22 THR 89 HG22 THR 89 -8.173 -11.746 -3.214 672 HG23 THR 89 HG23 THR 89 -6.981 -12.531 -4.259 673 H HIS 90 HN HIS 90 -7.474 -10.266 -2.286 674 HA HIS 90 HA HIS 90 -4.997 -9.814 -1.144 675 HB2 HIS 90 HB2 HIS 90 -7.117 -10.295 0.086 676 HB3 HIS 90 HB1 HIS 90 -7.003 -11.976 -0.417 677 HD1 HIS 90 HD1 HIS 90 -5.264 -13.471 0.808 678 HD2 HIS 90 HD2 HIS 90 -5.543 -9.572 2.243 679 HE1 HIS 90 HE1 HIS 90 -4.159 -13.491 3.066 680 HE2 HIS 90 HE2 HIS 90 -4.605 -11.205 4.015 681 H ASP 91 HN ASP 91 -6.262 -12.807 -2.433 682 HA ASP 91 HA ASP 91 -3.977 -14.387 -1.964 683 HB2 ASP 91 HB2 ASP 91 -6.074 -15.470 -2.377 684 HB3 ASP 91 HB1 ASP 91 -6.246 -14.653 -3.928 685 H GLN 92 HN GLN 92 -5.049 -12.491 -4.719 686 HA GLN 92 HA GLN 92 -3.065 -13.230 -6.554 687 HB2 GLN 92 HB2 GLN 92 -4.104 -10.438 -6.462 688 HB3 GLN 92 HB1 GLN 92 -3.770 -11.449 -7.858 689 HG2 GLN 92 HG2 GLN 92 -6.051 -11.804 -5.959 690 HG3 GLN 92 HG1 GLN 92 -6.154 -11.019 -7.525 691 HE21 GLN 92 HE21 GLN 92 -4.332 -12.880 -8.712 692 HE22 GLN 92 HE22 GLN 92 -5.238 -14.325 -8.936 693 H ALA 93 HN ALA 93 -3.284 -10.593 -4.193 694 HA ALA 93 HA ALA 93 -0.767 -9.440 -4.819 695 HB1 ALA 93 HB1 ALA 93 -0.994 -8.340 -2.608 696 HB2 ALA 93 HB2 ALA 93 -2.412 -9.339 -2.288 697 HB3 ALA 93 HB3 ALA 93 -2.438 -8.171 -3.608 698 H ARG 94 HN ARG 94 -1.893 -11.989 -2.716 699 HA ARG 94 HA ARG 94 0.523 -12.214 -1.289 700 HB2 ARG 94 HB2 ARG 94 -1.957 -13.878 -1.446 701 HB3 ARG 94 HB1 ARG 94 -0.522 -14.520 -0.635 702 HG2 ARG 94 HG2 ARG 94 -2.098 -12.052 0.039 703 HG3 ARG 94 HG1 ARG 94 -1.800 -13.472 1.056 704 HD2 ARG 94 HD2 ARG 94 0.453 -12.935 1.371 705 HD3 ARG 94 HD1 ARG 94 0.468 -11.811 0.013 706 HE ARG 94 HE ARG 94 0.009 -11.163 2.672 707 HH11 ARG 94 HH11 ARG 94 -1.676 -10.573 -0.356 708 HH12 ARG 94 HH12 ARG 94 -2.094 -8.937 0.067 709 HH21 ARG 94 HH21 ARG 94 -0.460 -8.987 3.141 710 HH22 ARG 94 HH22 ARG 94 -1.428 -8.057 2.026 711 H LYS 95 HN LYS 95 -0.626 -13.540 -4.270 712 HA LYS 95 HA LYS 95 1.378 -15.535 -4.497 713 HB2 LYS 95 HB2 LYS 95 -0.139 -14.084 -6.671 714 HB3 LYS 95 HB1 LYS 95 0.900 -15.470 -6.936 715 HG2 LYS 95 HG2 LYS 95 -0.657 -16.679 -5.277 716 HG3 LYS 95 HG1 LYS 95 -1.770 -15.348 -5.606 717 HD2 LYS 95 HD2 LYS 95 -1.309 -15.865 -8.090 718 HD3 LYS 95 HD1 LYS 95 -0.673 -17.398 -7.500 719 HE2 LYS 95 HE2 LYS 95 -3.474 -16.331 -7.198 720 HE3 LYS 95 HE1 LYS 95 -2.955 -17.729 -8.137 721 HZ1 LYS 95 HZ1 LYS 95 -2.234 -18.728 -5.958 722 HZ2 LYS 95 HZ2 LYS 95 -3.906 -18.540 -6.161 723 HZ3 LYS 95 HZ3 LYS 95 -3.052 -17.454 -5.188 724 H ARG 96 HN ARG 96 1.325 -12.064 -5.162 725 HA ARG 96 HA ARG 96 3.833 -12.245 -6.595 726 HB2 ARG 96 HB2 ARG 96 2.176 -9.872 -5.787 727 HB3 ARG 96 HB1 ARG 96 3.618 -9.800 -6.790 728 HG2 ARG 96 HG2 ARG 96 1.023 -11.177 -7.441 729 HG3 ARG 96 HG1 ARG 96 1.683 -9.731 -8.204 730 HD2 ARG 96 HD2 ARG 96 2.153 -11.498 -9.687 731 HD3 ARG 96 HD1 ARG 96 3.671 -11.147 -8.863 732 HE ARG 96 HE ARG 96 2.730 -13.118 -7.361 733 HH11 ARG 96 HH11 ARG 96 2.841 -12.886 -10.851 734 HH12 ARG 96 HH12 ARG 96 3.092 -14.587 -11.073 735 HH21 ARG 96 HH21 ARG 96 3.055 -15.345 -7.658 736 HH22 ARG 96 HH22 ARG 96 3.225 -15.982 -9.271 737 H LEU 97 HN LEU 97 2.721 -10.993 -3.511 738 HA LEU 97 HA LEU 97 5.135 -9.782 -2.692 739 HB2 LEU 97 HB2 LEU 97 3.003 -10.990 -0.943 740 HB3 LEU 97 HB1 LEU 97 4.121 -9.710 -0.517 741 HG LEU 97 HG LEU 97 1.999 -9.480 -2.630 742 HD11 LEU 97 HD11 LEU 97 0.873 -9.696 -0.579 743 HD12 LEU 97 HD12 LEU 97 0.937 -7.964 -0.915 744 HD13 LEU 97 HD13 LEU 97 2.036 -8.677 0.271 745 HD21 LEU 97 HD21 LEU 97 3.977 -8.112 -2.950 746 HD22 LEU 97 HD22 LEU 97 3.776 -7.433 -1.334 747 HD23 LEU 97 HD23 LEU 97 2.558 -7.129 -2.576 748 H THR 98 HN THR 98 3.684 -12.873 -2.076 749 HA THR 98 HA THR 98 6.236 -13.862 -0.983 750 HB THR 98 HB THR 98 4.712 -15.439 0.385 751 HG1 THR 98 HG1 THR 98 2.795 -14.650 -0.860 752 HG21 THR 98 HG21 THR 98 4.777 -12.481 1.035 753 HG22 THR 98 HG22 THR 98 6.032 -13.658 1.425 754 HG23 THR 98 HG23 THR 98 4.444 -13.775 2.185 755 H LYS 99 HN LYS 99 6.121 -14.185 -3.568 756 HA LYS 99 HA LYS 99 4.660 -16.484 -4.386 757 HB2 LYS 99 HB2 LYS 99 5.913 -16.321 -6.491 758 HB3 LYS 99 HB1 LYS 99 5.200 -14.786 -6.023 759 HG2 LYS 99 HG2 LYS 99 7.420 -14.136 -5.094 760 HG3 LYS 99 HG1 LYS 99 8.070 -15.614 -5.802 761 HD2 LYS 99 HD2 LYS 99 7.100 -14.805 -8.004 762 HD3 LYS 99 HD1 LYS 99 6.887 -13.246 -7.201 763 HE2 LYS 99 HE2 LYS 99 9.255 -13.120 -6.740 764 HE3 LYS 99 HE1 LYS 99 9.500 -14.731 -7.411 765 HZ1 LYS 99 HZ1 LYS 99 8.622 -13.804 -9.559 766 HZ2 LYS 99 HZ2 LYS 99 10.135 -13.219 -9.067 767 HZ3 LYS 99 HZ3 LYS 99 8.753 -12.264 -8.863 768 H ARG 100 HN ARG 100 7.456 -16.099 -2.711 769 HA ARG 100 HA ARG 100 8.959 -17.565 -1.796 770 HB2 ARG 100 HB2 ARG 100 6.657 -19.162 -2.450 771 HB3 ARG 100 HB1 ARG 100 8.127 -20.098 -2.684 772 HG2 ARG 100 HG2 ARG 100 7.352 -18.650 -0.158 773 HG3 ARG 100 HG1 ARG 100 7.211 -20.386 -0.442 774 HD2 ARG 100 HD2 ARG 100 9.724 -18.734 -0.240 775 HD3 ARG 100 HD1 ARG 100 9.206 -20.060 0.806 776 HE ARG 100 HE ARG 100 10.255 -20.308 -1.935 777 HH11 ARG 100 HH11 ARG 100 9.256 -21.802 1.074 778 HH12 ARG 100 HH12 ARG 100 9.976 -23.333 0.694 779 HH21 ARG 100 HH21 ARG 100 11.168 -22.340 -2.454 780 HH22 ARG 100 HH22 ARG 100 11.051 -23.646 -1.305 781 H SER 101 HN SER 101 8.884 -16.748 -4.760 782 HA SER 101 HA SER 101 10.965 -18.611 -5.697 783 HB2 SER 101 HB2 SER 101 8.865 -18.730 -7.027 784 HB3 SER 101 HB1 SER 101 9.004 -17.007 -7.370 785 HG SER 101 HG SER 101 10.894 -19.005 -8.117 786 H GLU 102 HN GLU 102 10.698 -15.783 -4.271 787 HA GLU 102 HA GLU 102 12.544 -14.364 -6.023 788 HB2 GLU 102 HB2 GLU 102 11.725 -12.316 -5.145 789 HB3 GLU 102 HB1 GLU 102 10.328 -13.275 -5.596 790 HG2 GLU 102 HG2 GLU 102 11.375 -13.033 -2.787 791 HG3 GLU 102 HG1 GLU 102 10.090 -12.039 -3.463 792 H GLU 103 HN GLU 103 13.753 -12.769 -4.632 793 HA GLU 103 HA GLU 103 14.956 -14.122 -2.315 794 HB2 GLU 103 HB2 GLU 103 16.310 -12.155 -4.159 795 HB3 GLU 103 HB1 GLU 103 17.066 -13.120 -2.899 796 HG2 GLU 103 HG2 GLU 103 16.784 -15.123 -4.165 797 HG3 GLU 103 HG1 GLU 103 15.785 -14.291 -5.356 798 H VAL 104 HN VAL 104 12.941 -11.864 -3.264 799 HA VAL 104 HA VAL 104 13.219 -10.034 -1.150 800 HB VAL 104 HB VAL 104 15.378 -9.686 -2.256 801 HG11 VAL 104 HG11 VAL 104 13.734 -8.798 -4.626 802 HG12 VAL 104 HG12 VAL 104 14.760 -10.229 -4.538 803 HG13 VAL 104 HG13 VAL 104 15.480 -8.620 -4.469 804 HG21 VAL 104 HG21 VAL 104 15.242 -7.236 -2.494 805 HG22 VAL 104 HG22 VAL 104 14.361 -7.811 -1.078 806 HG23 VAL 104 HG23 VAL 104 13.485 -7.354 -2.542 807 H VAL 105 HN VAL 105 11.628 -8.312 -1.296 808 HA VAL 105 HA VAL 105 9.630 -9.073 -3.339 809 HB VAL 105 HB VAL 105 9.085 -7.252 -1.006 810 HG11 VAL 105 HG11 VAL 105 6.795 -8.145 -1.282 811 HG12 VAL 105 HG12 VAL 105 7.353 -9.073 -2.674 812 HG13 VAL 105 HG13 VAL 105 7.389 -7.311 -2.718 813 HG21 VAL 105 HG21 VAL 105 8.305 -9.265 0.228 814 HG22 VAL 105 HG22 VAL 105 10.054 -9.186 -0.002 815 HG23 VAL 105 HG23 VAL 105 9.078 -10.264 -1.008 816 H ARG 106 HN ARG 106 9.768 -7.864 -5.128 817 HA ARG 106 HA ARG 106 10.692 -5.142 -5.001 818 HB2 ARG 106 HB2 ARG 106 10.003 -7.120 -7.089 819 HB3 ARG 106 HB1 ARG 106 9.677 -5.441 -7.491 820 HG2 ARG 106 HG2 ARG 106 11.860 -6.299 -8.246 821 HG3 ARG 106 HG1 ARG 106 11.930 -4.851 -7.248 822 HD2 ARG 106 HD2 ARG 106 12.438 -6.321 -5.302 823 HD3 ARG 106 HD1 ARG 106 12.504 -7.692 -6.404 824 HE ARG 106 HE ARG 106 14.415 -5.453 -6.291 825 HH11 ARG 106 HH11 ARG 106 13.542 -8.611 -7.517 826 HH12 ARG 106 HH12 ARG 106 15.155 -9.007 -8.019 827 HH21 ARG 106 HH21 ARG 106 16.524 -5.957 -6.922 828 HH22 ARG 106 HH22 ARG 106 16.853 -7.487 -7.686 829 H LEU 107 HN LEU 107 9.351 -3.420 -4.739 830 HA LEU 107 HA LEU 107 6.835 -3.614 -6.132 831 HB2 LEU 107 HB2 LEU 107 5.917 -2.082 -4.154 832 HB3 LEU 107 HB1 LEU 107 5.642 -3.796 -4.303 833 HG LEU 107 HG LEU 107 6.165 -2.985 -2.010 834 HD11 LEU 107 HD11 LEU 107 7.740 -4.819 -1.529 835 HD12 LEU 107 HD12 LEU 107 7.987 -5.004 -3.270 836 HD13 LEU 107 HD13 LEU 107 6.397 -5.293 -2.571 837 HD21 LEU 107 HD21 LEU 107 8.712 -2.304 -3.383 838 HD22 LEU 107 HD22 LEU 107 8.715 -2.758 -1.671 839 HD23 LEU 107 HD23 LEU 107 7.772 -1.365 -2.221 840 H LEU 108 HN LEU 108 5.982 -1.874 -6.860 841 HA LEU 108 HA LEU 108 7.685 0.518 -6.959 842 HB2 LEU 108 HB2 LEU 108 5.320 -0.267 -8.664 843 HB3 LEU 108 HB1 LEU 108 6.238 1.215 -8.841 844 HG LEU 108 HG LEU 108 6.944 -1.567 -9.635 845 HD11 LEU 108 HD11 LEU 108 7.787 -0.391 -11.620 846 HD12 LEU 108 HD12 LEU 108 7.346 1.147 -10.882 847 HD13 LEU 108 HD13 LEU 108 6.094 -0.024 -11.291 848 HD21 LEU 108 HD21 LEU 108 9.315 -0.942 -9.833 849 HD22 LEU 108 HD22 LEU 108 8.770 -1.027 -8.157 850 HD23 LEU 108 HD23 LEU 108 8.979 0.541 -8.935 851 H VAL 109 HN VAL 109 7.148 2.028 -5.476 852 HA VAL 109 HA VAL 109 4.402 2.030 -4.493 853 HB VAL 109 HB VAL 109 5.973 0.899 -2.982 854 HG11 VAL 109 HG11 VAL 109 8.044 1.992 -3.351 855 HG12 VAL 109 HG12 VAL 109 7.598 2.288 -1.672 856 HG13 VAL 109 HG13 VAL 109 7.382 3.559 -2.881 857 HG21 VAL 109 HG21 VAL 109 4.864 3.444 -1.899 858 HG22 VAL 109 HG22 VAL 109 5.332 2.035 -0.945 859 HG23 VAL 109 HG23 VAL 109 4.002 1.921 -2.101 860 H THR 110 HN THR 110 4.026 4.097 -3.199 861 HA THR 110 HA THR 110 5.328 6.443 -4.286 862 HB THR 110 HB THR 110 3.043 7.316 -5.103 863 HG1 THR 110 HG1 THR 110 2.590 4.553 -4.813 864 HG21 THR 110 HG21 THR 110 4.147 5.098 -6.767 865 HG22 THR 110 HG22 THR 110 5.087 6.566 -6.471 866 HG23 THR 110 HG23 THR 110 3.519 6.662 -7.288 867 H ARG 111 HN ARG 111 5.350 8.023 -2.797 868 HA ARG 111 HA ARG 111 3.547 7.969 -0.562 869 HB2 ARG 111 HB2 ARG 111 6.238 8.810 -1.051 870 HB3 ARG 111 HB1 ARG 111 5.298 10.171 -0.454 871 HG2 ARG 111 HG2 ARG 111 4.493 8.553 1.325 872 HG3 ARG 111 HG1 ARG 111 5.879 7.568 0.864 873 HD2 ARG 111 HD2 ARG 111 7.399 9.277 1.391 874 HD3 ARG 111 HD1 ARG 111 6.126 10.476 1.465 875 HE ARG 111 HE ARG 111 5.382 9.024 3.493 876 HH11 ARG 111 HH11 ARG 111 8.697 9.684 2.567 877 HH12 ARG 111 HH12 ARG 111 9.278 9.686 4.204 878 HH21 ARG 111 HH21 ARG 111 6.145 9.056 5.653 879 HH22 ARG 111 HH22 ARG 111 7.826 9.345 5.963 880 H GLN 112 HN GLN 112 2.988 10.320 0.162 881 HA GLN 112 HA GLN 112 1.251 11.242 -1.913 882 HB2 GLN 112 HB2 GLN 112 1.639 12.480 0.803 883 HB3 GLN 112 HB1 GLN 112 0.208 12.552 -0.222 884 HG2 GLN 112 HG2 GLN 112 1.271 10.202 1.316 885 HG3 GLN 112 HG1 GLN 112 -0.272 11.023 1.492 886 HE21 GLN 112 HE21 GLN 112 1.596 8.806 -0.408 887 HE22 GLN 112 HE22 GLN 112 0.320 8.175 -1.383 888 H SER 113 HN SER 113 3.597 12.784 0.144 889 HA SER 113 HA SER 113 5.242 13.949 -1.679 890 HB2 SER 113 HB2 SER 113 3.066 15.149 -2.408 891 HB3 SER 113 HB1 SER 113 3.265 16.052 -0.901 892 HG SER 113 HG SER 113 5.417 16.589 -1.705 893 H LEU 114 HN LEU 114 3.448 14.271 1.154 894 HA LEU 114 HA LEU 114 5.260 15.991 2.521 895 HB2 LEU 114 HB2 LEU 114 3.004 14.294 3.498 896 HB3 LEU 114 HB1 LEU 114 3.987 15.293 4.546 897 HG LEU 114 HG LEU 114 2.056 16.567 4.155 898 HD11 LEU 114 HD11 LEU 114 4.182 17.452 2.214 899 HD12 LEU 114 HD12 LEU 114 4.017 17.921 3.908 900 HD13 LEU 114 HD13 LEU 114 2.818 18.448 2.725 901 HD21 LEU 114 HD21 LEU 114 1.102 15.250 2.343 902 HD22 LEU 114 HD22 LEU 114 2.306 15.887 1.224 903 HD23 LEU 114 HD23 LEU 114 1.102 16.964 1.930 904 H GLN 115 HN GLN 115 7.048 14.866 1.982 905 HA GLN 115 HA GLN 115 7.694 12.371 3.284 906 HB2 GLN 115 HB2 GLN 115 9.242 14.235 1.485 907 HB3 GLN 115 HB1 GLN 115 9.889 12.745 2.138 908 HG2 GLN 115 HG2 GLN 115 8.172 11.465 0.988 909 HG3 GLN 115 HG1 GLN 115 7.475 12.957 0.363 910 HE21 GLN 115 HE21 GLN 115 10.040 14.201 -0.148 911 HE22 GLN 115 HE22 GLN 115 10.686 13.417 -1.547 912 H LYS 116 HN LYS 116 10.388 12.785 3.866 913 HA LYS 116 HA LYS 116 10.251 14.696 6.102 914 HB2 LYS 116 HB2 LYS 116 10.775 11.846 6.135 915 HB3 LYS 116 HB1 LYS 116 12.128 12.743 6.806 916 HG2 LYS 116 HG2 LYS 116 10.637 12.137 8.578 917 HG3 LYS 116 HG1 LYS 116 10.558 13.885 8.343 918 HD2 LYS 116 HD2 LYS 116 8.512 13.556 6.984 919 HD3 LYS 116 HD1 LYS 116 8.573 11.834 7.367 920 HE2 LYS 116 HE2 LYS 116 7.012 12.965 8.838 921 HE3 LYS 116 HE1 LYS 116 8.395 12.379 9.761 922 HZ1 LYS 116 HZ1 LYS 116 7.781 14.626 10.406 923 HZ2 LYS 116 HZ2 LYS 116 8.006 15.174 8.816 924 HZ3 LYS 116 HZ3 LYS 116 9.329 14.611 9.716 925 H ALA 117 HN ALA 117 12.617 15.005 6.993 926 HA ALA 117 HA ALA 117 14.569 15.153 4.842 927 HB1 ALA 117 HB1 ALA 117 15.014 17.537 5.275 928 HB2 ALA 117 HB2 ALA 117 13.652 17.574 6.394 929 HB3 ALA 117 HB3 ALA 117 13.374 17.280 4.679 930 H VAL 118 HN VAL 118 14.127 13.739 7.312 931 HA VAL 118 HA VAL 118 16.422 14.625 8.893 932 HB VAL 118 HB VAL 118 13.793 13.721 10.081 933 HG11 VAL 118 HG11 VAL 118 15.698 13.095 11.438 934 HG12 VAL 118 HG12 VAL 118 14.797 14.397 12.215 935 HG13 VAL 118 HG13 VAL 118 16.309 14.748 11.379 936 HG21 VAL 118 HG21 VAL 118 13.567 15.942 9.120 937 HG22 VAL 118 HG22 VAL 118 15.008 16.479 9.983 938 HG23 VAL 118 HG23 VAL 118 13.559 16.033 10.882 939 H GLN 119 HN GLN 119 17.624 12.966 8.003 940 HA GLN 119 HA GLN 119 16.889 10.273 8.933 941 HB2 GLN 119 HB2 GLN 119 18.623 11.134 6.618 942 HB3 GLN 119 HB1 GLN 119 18.617 9.491 7.244 943 HG2 GLN 119 HG2 GLN 119 16.234 9.310 6.724 944 HG3 GLN 119 HG1 GLN 119 16.253 10.956 6.082 945 HE21 GLN 119 HE21 GLN 119 15.678 8.330 4.839 946 HE22 GLN 119 HE22 GLN 119 16.734 8.252 3.460 947 H GLN 120 HN GLN 120 17.720 10.496 10.991 948 HA GLN 120 HA GLN 120 20.390 11.543 11.379 949 HB2 GLN 120 HB2 GLN 120 18.514 10.289 13.395 950 HB3 GLN 120 HB1 GLN 120 19.971 11.200 13.757 951 HG2 GLN 120 HG2 GLN 120 17.449 12.265 12.503 952 HG3 GLN 120 HG1 GLN 120 18.011 12.557 14.148 953 HE21 GLN 120 HE21 GLN 120 19.846 13.879 14.466 954 HE22 GLN 120 HE22 GLN 120 20.367 15.009 13.252 955 H SER 121 HN SER 121 19.196 8.633 10.417 956 HA SER 121 HA SER 121 20.582 6.785 12.021 957 HB2 SER 121 HB2 SER 121 19.694 6.418 9.153 958 HB3 SER 121 HB1 SER 121 19.994 5.148 10.340 959 HG SER 121 HG SER 121 18.250 6.007 11.575 960 H MET 122 HN MET 122 21.314 7.217 8.551 961 HA MET 122 HA MET 122 24.167 7.339 9.239 962 HB2 MET 122 HB2 MET 122 22.918 5.283 7.415 963 HB3 MET 122 HB1 MET 122 24.642 5.614 7.476 964 HG2 MET 122 HG2 MET 122 22.975 4.646 9.788 965 HG3 MET 122 HG1 MET 122 24.010 3.637 8.780 966 HE1 MET 122 HE1 MET 122 25.931 3.801 12.211 967 HE2 MET 122 HE2 MET 122 25.229 2.737 10.993 968 HE3 MET 122 HE3 MET 122 24.184 3.766 11.970 969 H LEU 123 HN LEU 123 21.596 8.332 7.290 970 HA LEU 123 HA LEU 123 21.400 9.734 5.514 971 HB2 LEU 123 HB2 LEU 123 24.319 10.235 6.099 972 HB3 LEU 123 HB1 LEU 123 23.428 11.094 4.857 973 HG LEU 123 HG LEU 123 22.716 11.132 7.791 974 HD11 LEU 123 HD11 LEU 123 24.181 13.183 6.135 975 HD12 LEU 123 HD12 LEU 123 24.879 12.191 7.416 976 HD13 LEU 123 HD13 LEU 123 23.644 13.388 7.803 977 HD21 LEU 123 HD21 LEU 123 21.755 12.786 5.460 978 HD22 LEU 123 HD22 LEU 123 21.303 13.020 7.148 979 HD23 LEU 123 HD23 LEU 123 20.831 11.543 6.305 980 H SER 124 HN SER 124 23.049 10.267 3.351 981 HA SER 124 HA SER 124 23.437 7.573 2.234 982 HB2 SER 124 HB2 SER 124 22.611 10.130 0.834 983 HB3 SER 124 HB1 SER 124 22.938 8.596 0.025 984 HG SER 124 HG SER 124 21.017 8.881 2.086 985 H1 LYS 161 HN LYS 161 -16.486 -5.167 -6.853 986 HA LYS 161 HA LYS 161 -15.511 -3.494 -5.696 987 HB2 LYS 161 HB2 LYS 161 -18.404 -2.812 -5.420 988 HB3 LYS 161 HB1 LYS 161 -17.206 -1.869 -4.552 989 HG2 LYS 161 HG2 LYS 161 -17.457 -0.638 -6.448 990 HG3 LYS 161 HG1 LYS 161 -16.088 -1.655 -6.896 991 HD2 LYS 161 HD2 LYS 161 -17.507 -3.117 -8.166 992 HD3 LYS 161 HD1 LYS 161 -18.955 -2.300 -7.569 993 HE2 LYS 161 HE2 LYS 161 -18.142 -0.215 -8.655 994 HE3 LYS 161 HE1 LYS 161 -16.833 -1.152 -9.374 995 HZ1 LYS 161 HZ1 LYS 161 -18.502 -2.522 -10.486 996 HZ2 LYS 161 HZ2 LYS 161 -18.654 -0.889 -10.913 997 HZ3 LYS 161 HZ3 LYS 161 -19.745 -1.580 -9.815 998 H GLU 162 HN GLU 162 -14.596 -5.000 -4.222 999 HA GLU 162 HA GLU 162 -14.922 -4.199 -1.558 1000 HB2 GLU 162 HB2 GLU 162 -15.662 -6.362 -0.597 1001 HB3 GLU 162 HB1 GLU 162 -16.895 -5.520 -1.512 1002 HG2 GLU 162 HG2 GLU 162 -16.245 -7.004 -3.473 1003 HG3 GLU 162 HG1 GLU 162 -15.363 -7.977 -2.298 1004 H ASN 163 HN ASN 163 -12.749 -3.879 -2.042 1005 HA ASN 163 HA ASN 163 -11.049 -6.241 -2.203 1006 HB2 ASN 163 HB2 ASN 163 -10.431 -3.284 -2.282 1007 HB3 ASN 163 HB1 ASN 163 -9.181 -4.518 -2.250 1008 HD21 ASN 163 HD21 ASN 163 -9.779 -2.533 -4.284 1009 HD22 ASN 163 HD22 ASN 163 -10.085 -3.421 -5.747 1010 H LEU 164 HN LEU 164 -8.838 -5.101 -0.654 1011 HA LEU 164 HA LEU 164 -9.502 -4.939 2.057 1012 HB2 LEU 164 HB2 LEU 164 -8.979 -7.392 2.633 1013 HB3 LEU 164 HB1 LEU 164 -10.588 -7.011 2.062 1014 HG LEU 164 HG LEU 164 -9.987 -7.847 -0.177 1015 HD11 LEU 164 HD11 LEU 164 -7.604 -7.459 -0.205 1016 HD12 LEU 164 HD12 LEU 164 -7.931 -9.175 -0.479 1017 HD13 LEU 164 HD13 LEU 164 -7.372 -8.619 1.101 1018 HD21 LEU 164 HD21 LEU 164 -11.082 -9.327 1.365 1019 HD22 LEU 164 HD22 LEU 164 -9.536 -9.766 2.093 1020 HD23 LEU 164 HD23 LEU 164 -9.891 -10.232 0.430 1021 H GLU 165 HN GLU 165 -7.571 -6.642 3.156 1022 HA GLU 165 HA GLU 165 -5.327 -7.173 1.714 1023 HB2 GLU 165 HB2 GLU 165 -5.447 -4.395 2.243 1024 HB3 GLU 165 HB1 GLU 165 -4.105 -5.070 3.161 1025 HG2 GLU 165 HG2 GLU 165 -4.502 -4.885 0.237 1026 HG3 GLU 165 HG1 GLU 165 -3.031 -4.719 1.202 1027 H SER 166 HN SER 166 -3.345 -6.334 3.933 1028 HA SER 166 HA SER 166 -4.095 -8.324 5.911 1029 HB2 SER 166 HB2 SER 166 -3.620 -9.513 3.707 1030 HB3 SER 166 HB1 SER 166 -1.953 -8.975 3.904 1031 HG SER 166 HG SER 166 -3.387 -10.543 5.806 1032 H MET 167 HN MET 167 -2.144 -9.108 7.129 1033 HA MET 167 HA MET 167 0.157 -7.287 7.080 1034 HB2 MET 167 HB2 MET 167 -1.327 -6.931 9.114 1035 HB3 MET 167 HB1 MET 167 -0.956 -8.588 9.569 1036 HG2 MET 167 HG2 MET 167 1.414 -8.017 9.706 1037 HG3 MET 167 HG1 MET 167 1.023 -6.350 9.276 1038 HE1 MET 167 HE1 MET 167 -1.858 -6.252 10.889 1039 HE2 MET 167 HE2 MET 167 -0.757 -4.876 10.811 1040 HE3 MET 167 HE3 MET 167 -1.348 -5.448 12.372 1041 H VAL 168 HN VAL 168 2.045 -8.266 6.801 1042 HA VAL 168 HA VAL 168 2.110 -11.173 7.137 1043 HB VAL 168 HB VAL 168 3.398 -10.263 4.644 1044 HG11 VAL 168 HG11 VAL 168 2.361 -12.310 3.850 1045 HG12 VAL 168 HG12 VAL 168 1.488 -12.444 5.377 1046 HG13 VAL 168 HG13 VAL 168 3.250 -12.557 5.353 1047 HG21 VAL 168 HG21 VAL 168 0.384 -10.248 4.852 1048 HG22 VAL 168 HG22 VAL 168 1.324 -10.123 3.366 1049 HG23 VAL 168 HG23 VAL 168 1.402 -8.834 4.568
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