NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
593188 | 2myp | 17074 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H MET 1 H1 MET 1 2.619 -0.031 1.998 2 HA MET 1 HA MET 1 3.502 -0.445 -0.060 3 HB2 MET 1 HB2 MET 1 1.853 -2.020 -0.909 4 HB3 MET 1 HB3 MET 1 0.647 -0.739 -1.099 5 HG2 MET 1 HG2 MET 1 2.028 0.354 -2.808 6 HG3 MET 1 HG3 MET 1 3.316 -0.822 -2.568 7 HE1 MET 1 HE1 MET 1 3.511 -3.067 -3.699 8 HE2 MET 1 HE2 MET 1 2.194 -3.666 -2.657 9 HE3 MET 1 HE3 MET 1 2.148 -3.963 -4.409 10 H LYS 2 H LYS 2 4.432 1.380 -0.699 11 HA LYS 2 HA LYS 2 2.753 3.691 -1.627 12 HB2 LYS 2 HB2 LYS 2 5.292 3.805 0.057 13 HB3 LYS 2 HB3 LYS 2 4.605 5.187 -0.781 14 HG2 LYS 2 HG2 LYS 2 2.488 4.948 0.464 15 HG3 LYS 2 HG3 LYS 2 3.147 3.564 1.345 16 HD2 LYS 2 HD2 LYS 2 4.877 4.972 2.360 17 HD3 LYS 2 HD3 LYS 2 4.311 6.380 1.431 18 HE2 LYS 2 HE2 LYS 2 2.126 6.281 2.529 19 HE3 LYS 2 HE3 LYS 2 2.569 4.798 3.387 20 HZ1 LYS 2 HZ1 LYS 2 4.005 7.389 3.726 21 HZ2 LYS 2 HZ2 LYS 2 2.813 6.876 4.735 22 HZ3 LYS 2 HZ3 LYS 2 4.217 6.040 4.634 23 H LYS 3 H LYS 3 4.013 5.140 -3.121 24 HA LYS 3 HA LYS 3 5.484 3.402 -5.071 25 HB2 LYS 3 HB2 LYS 3 3.874 5.913 -5.671 26 HB3 LYS 3 HB3 LYS 3 4.694 4.900 -6.829 27 HG2 LYS 3 HG2 LYS 3 2.597 4.053 -7.077 28 HG3 LYS 3 HG3 LYS 3 3.228 2.948 -5.866 29 HD2 LYS 3 HD2 LYS 3 0.940 3.558 -5.309 30 HD3 LYS 3 HD3 LYS 3 2.018 4.207 -4.085 31 HE2 LYS 3 HE2 LYS 3 2.009 6.352 -5.669 32 HE3 LYS 3 HE3 LYS 3 0.506 5.652 -6.278 33 HZ1 LYS 3 HZ1 LYS 3 0.141 7.207 -4.457 34 HZ2 LYS 3 HZ2 LYS 3 -0.310 5.712 -3.936 35 HZ3 LYS 3 HZ3 LYS 3 1.138 6.371 -3.458 36 H VAL 4 H VAL 4 7.300 4.020 -6.066 37 HA VAL 4 HA VAL 4 8.628 6.557 -5.173 38 HB VAL 4 HB VAL 4 10.180 3.992 -5.546 39 HG11 VAL 4 HG11 VAL 4 10.967 6.701 -4.419 40 HG12 VAL 4 HG12 VAL 4 11.991 5.245 -4.482 41 HG13 VAL 4 HG13 VAL 4 11.492 6.015 -5.977 42 HG21 VAL 4 HG21 VAL 4 8.843 3.676 -3.555 43 HG22 VAL 4 HG22 VAL 4 10.518 4.002 -3.103 44 HG23 VAL 4 HG23 VAL 4 9.289 5.274 -2.941 45 H MET 5 H MET 5 9.706 7.700 -6.725 46 HA MET 5 HA MET 5 9.787 6.581 -9.493 47 HB2 MET 5 HB2 MET 5 7.795 7.867 -9.480 48 HB3 MET 5 HB3 MET 5 8.556 9.189 -8.592 49 HG2 MET 5 HG2 MET 5 8.246 9.796 -10.915 50 HG3 MET 5 HG3 MET 5 9.956 9.737 -10.519 51 HE1 MET 5 HE1 MET 5 8.088 8.058 -14.146 52 HE2 MET 5 HE2 MET 5 7.057 8.346 -12.730 53 HE3 MET 5 HE3 MET 5 8.084 9.645 -13.382 54 H PHE 6 H PHE 6 11.592 6.915 -10.522 55 HA PHE 6 HA PHE 6 13.722 8.555 -9.189 56 HB2 PHE 6 HB2 PHE 6 14.055 6.315 -11.207 57 HB3 PHE 6 HB3 PHE 6 15.299 7.061 -10.209 58 HD1 PHE 6 HD1 PHE 6 15.219 6.707 -7.656 59 HD2 PHE 6 HD2 PHE 6 12.802 4.480 -10.438 60 HE1 PHE 6 HE1 PHE 6 14.662 5.088 -5.857 61 HE2 PHE 6 HE2 PHE 6 12.208 2.880 -8.620 62 HZ PHE 6 HZ PHE 6 13.103 3.219 -6.316 63 H VAL 7 H VAL 7 14.547 10.305 -10.132 64 HA VAL 7 HA VAL 7 14.141 10.827 -13.044 65 HB VAL 7 HB VAL 7 14.139 12.660 -10.657 66 HG11 VAL 7 HG11 VAL 7 15.191 13.529 -13.384 67 HG12 VAL 7 HG12 VAL 7 14.628 14.610 -12.103 68 HG13 VAL 7 HG13 VAL 7 16.044 13.623 -11.816 69 HG21 VAL 7 HG21 VAL 7 12.425 13.767 -11.953 70 HG22 VAL 7 HG22 VAL 7 12.791 12.791 -13.391 71 HG23 VAL 7 HG23 VAL 7 12.079 12.046 -11.920 72 H CYS 8 H CYS 8 15.876 10.825 -14.331 73 HA CYS 8 HA CYS 8 18.569 11.505 -13.203 74 HB2 CYS 8 HB2 CYS 8 18.437 9.097 -13.404 75 HB3 CYS 8 HB3 CYS 8 17.838 9.193 -15.069 76 HG CYS 8 HG CYS 8 20.331 8.279 -14.983 77 H LYS 9 H LYS 9 20.071 12.125 -15.217 78 HA LYS 9 HA LYS 9 18.816 14.513 -16.154 79 HB2 LYS 9 HB2 LYS 9 21.307 14.035 -15.657 80 HB3 LYS 9 HB3 LYS 9 21.415 13.430 -17.309 81 HG2 LYS 9 HG2 LYS 9 20.481 15.698 -18.068 82 HG3 LYS 9 HG3 LYS 9 20.520 16.204 -16.373 83 HD2 LYS 9 HD2 LYS 9 22.443 17.115 -17.430 84 HD3 LYS 9 HD3 LYS 9 22.993 15.844 -16.338 85 HE2 LYS 9 HE2 LYS 9 23.272 14.292 -18.261 86 HE3 LYS 9 HE3 LYS 9 22.593 15.506 -19.357 87 HZ1 LYS 9 HZ1 LYS 9 25.031 15.520 -19.422 88 HZ2 LYS 9 HZ2 LYS 9 24.510 16.949 -18.837 89 HZ3 LYS 9 HZ3 LYS 9 25.135 15.824 -17.824 90 H ARG 10 H ARG 10 19.783 11.678 -18.120 91 HA ARG 10 HA ARG 10 17.575 12.391 -20.021 92 HB2 ARG 10 HB2 ARG 10 18.756 11.834 -21.936 93 HB3 ARG 10 HB3 ARG 10 19.678 13.006 -21.042 94 HG2 ARG 10 HG2 ARG 10 20.342 10.032 -21.050 95 HG3 ARG 10 HG3 ARG 10 20.949 11.188 -22.220 96 HD2 ARG 10 HD2 ARG 10 21.597 12.397 -19.794 97 HD3 ARG 10 HD3 ARG 10 21.847 10.687 -19.454 98 HE ARG 10 HE ARG 10 23.352 12.435 -21.281 99 HH11 ARG 10 HH11 ARG 10 22.791 8.983 -20.651 100 HH12 ARG 10 HH12 ARG 10 24.383 8.616 -21.349 101 HH21 ARG 10 HH21 ARG 10 25.316 11.693 -22.138 102 HH22 ARG 10 HH22 ARG 10 25.622 9.955 -22.088 103 H ASN 11 H ASN 11 17.643 10.551 -17.772 104 HA ASN 11 HA ASN 11 17.112 8.486 -17.051 105 HB2 ASN 11 HB2 ASN 11 15.049 9.572 -17.930 106 HB3 ASN 11 HB3 ASN 11 15.195 8.619 -19.384 107 HD21 ASN 11 HD22 ASN 11 15.706 7.389 -15.906 108 HD22 ASN 11 HD21 ASN 11 14.320 6.374 -16.036 109 H SER 12 H SER 12 19.366 8.350 -18.974 110 HA SER 12 HA SER 12 19.064 5.826 -20.372 111 HB2 SER 12 HB2 SER 12 21.518 6.326 -20.890 112 HB3 SER 12 HB3 SER 12 20.341 7.559 -21.364 113 HG SER 12 HG SER 12 22.011 7.603 -19.019 114 H CYS 13 H CYS 13 20.369 6.788 -17.228 115 HA CYS 13 HA CYS 13 21.006 3.990 -16.513 116 HB2 CYS 13 HB2 CYS 13 23.006 5.032 -17.720 117 HB3 CYS 13 HB3 CYS 13 23.152 6.181 -16.379 118 HG CYS 13 HG CYS 13 24.968 4.248 -16.218 119 H ARG 14 H ARG 14 22.127 4.249 -14.115 120 HA ARG 14 HA ARG 14 21.574 4.398 -11.903 121 HB2 ARG 14 HB2 ARG 14 21.206 7.335 -12.668 122 HB3 ARG 14 HB3 ARG 14 21.236 6.733 -10.998 123 HG2 ARG 14 HG2 ARG 14 23.469 5.719 -11.467 124 HG3 ARG 14 HG3 ARG 14 23.486 6.534 -13.039 125 HD2 ARG 14 HD2 ARG 14 23.297 7.891 -10.307 126 HD3 ARG 14 HD3 ARG 14 24.761 7.762 -11.277 127 HE ARG 14 HE ARG 14 22.376 9.481 -11.818 128 HH11 ARG 14 HH11 ARG 14 25.738 8.860 -12.670 129 HH12 ARG 14 HH12 ARG 14 25.594 9.892 -14.101 130 HH21 ARG 14 HH21 ARG 14 22.438 10.922 -13.464 131 HH22 ARG 14 HH22 ARG 14 23.910 11.115 -14.413 132 H SER 15 H SER 15 19.074 6.656 -12.898 133 HA SER 15 HA SER 15 16.937 5.841 -11.300 134 HB2 SER 15 HB2 SER 15 15.483 6.744 -13.176 135 HB3 SER 15 HB3 SER 15 16.827 7.787 -12.764 136 HG SER 15 HG SER 15 18.004 6.827 -14.635 137 H GLN 16 H GLN 16 17.764 4.429 -14.445 138 HA GLN 16 HA GLN 16 15.626 2.485 -14.517 139 HB2 GLN 16 HB2 GLN 16 18.354 2.480 -15.900 140 HB3 GLN 16 HB3 GLN 16 16.968 1.515 -16.388 141 HG2 GLN 16 HG2 GLN 16 16.923 4.589 -16.360 142 HG3 GLN 16 HG3 GLN 16 17.440 3.637 -17.722 143 HE21 GLN 16 HE22 GLN 16 15.619 5.005 -18.629 144 HE22 GLN 16 HE21 GLN 16 14.012 4.272 -18.605 145 H MET 17 H MET 17 18.966 2.234 -13.236 146 HA MET 17 HA MET 17 18.757 -0.575 -12.422 147 HB2 MET 17 HB2 MET 17 20.537 1.684 -11.386 148 HB3 MET 17 HB3 MET 17 20.689 -0.012 -10.949 149 HG2 MET 17 HG2 MET 17 21.243 -0.576 -13.297 150 HG3 MET 17 HG3 MET 17 21.147 1.140 -13.725 151 HE1 MET 17 HE1 MET 17 25.016 -0.009 -13.605 152 HE2 MET 17 HE2 MET 17 23.602 -1.011 -14.016 153 HE3 MET 17 HE3 MET 17 23.751 0.643 -14.683 154 H ALA 18 H ALA 18 17.971 2.567 -10.896 155 HA ALA 18 HA ALA 18 17.456 1.539 -8.266 156 HB1 ALA 18 HB1 ALA 18 17.819 3.971 -8.966 157 HB2 ALA 18 HB2 ALA 18 16.158 3.964 -9.579 158 HB3 ALA 18 HB3 ALA 18 16.469 3.689 -7.852 159 H GLU 19 H GLU 19 15.231 2.089 -11.056 160 HA GLU 19 HA GLU 19 12.971 0.804 -9.831 161 HB2 GLU 19 HB2 GLU 19 13.085 2.167 -12.027 162 HB3 GLU 19 HB3 GLU 19 13.586 0.653 -12.795 163 HG2 GLU 19 HG2 GLU 19 11.437 -0.325 -11.563 164 HG3 GLU 19 HG3 GLU 19 10.968 1.368 -11.438 165 H GLY 20 H GLY 20 15.645 -0.608 -11.786 166 HA2 GLY 20 HA2 GLY 20 14.886 -3.303 -11.831 167 HA3 GLY 20 HA3 GLY 20 16.549 -2.722 -11.746 168 H PHE 21 H PHE 21 16.854 -1.754 -9.192 169 HA PHE 21 HA PHE 21 16.763 -4.182 -7.586 170 HB2 PHE 21 HB2 PHE 21 17.514 -1.296 -6.975 171 HB3 PHE 21 HB3 PHE 21 17.564 -2.580 -5.758 172 HD1 PHE 21 HD2 PHE 21 18.736 -4.847 -6.577 173 HD2 PHE 21 HD1 PHE 21 19.552 -0.893 -8.105 174 HE1 PHE 21 HE2 PHE 21 20.960 -5.606 -7.346 175 HE2 PHE 21 HE1 PHE 21 21.770 -1.644 -8.864 176 HZ PHE 21 HZ PHE 21 22.478 -4.038 -8.497 177 H ALA 22 H ALA 22 14.870 -1.119 -7.426 178 HA ALA 22 HA ALA 22 13.398 -1.938 -5.130 179 HB1 ALA 22 HB1 ALA 22 13.609 0.394 -5.968 180 HB2 ALA 22 HB2 ALA 22 12.610 -0.027 -7.362 181 HB3 ALA 22 HB3 ALA 22 11.924 -0.077 -5.703 182 H LYS 23 H LYS 23 12.587 -2.505 -8.596 183 HA LYS 23 HA LYS 23 9.990 -3.642 -8.007 184 HB2 LYS 23 HB2 LYS 23 9.876 -4.211 -10.291 185 HB3 LYS 23 HB3 LYS 23 10.755 -2.682 -10.184 186 HG2 LYS 23 HG2 LYS 23 12.884 -4.160 -10.296 187 HG3 LYS 23 HG3 LYS 23 11.830 -5.436 -10.882 188 HD2 LYS 23 HD2 LYS 23 12.176 -2.671 -12.140 189 HD3 LYS 23 HD3 LYS 23 12.980 -4.138 -12.692 190 HE2 LYS 23 HE2 LYS 23 10.948 -5.144 -13.420 191 HE3 LYS 23 HE3 LYS 23 9.953 -3.917 -12.616 192 HZ1 LYS 23 HZ1 LYS 23 10.198 -3.507 -15.036 193 HZ2 LYS 23 HZ2 LYS 23 10.780 -2.242 -14.159 194 HZ3 LYS 23 HZ3 LYS 23 11.822 -3.275 -14.857 195 H THR 24 H THR 24 13.141 -4.986 -8.000 196 HA THR 24 HA THR 24 12.288 -7.793 -7.709 197 HB THR 24 HB THR 24 15.035 -6.586 -7.281 198 HG1 THR 24 HG1 THR 24 14.682 -6.166 -9.357 199 HG21 THR 24 HG21 THR 24 15.825 -8.859 -7.889 200 HG22 THR 24 HG22 THR 24 14.834 -8.904 -6.427 201 HG23 THR 24 HG23 THR 24 14.144 -9.421 -7.977 202 H LEU 25 H LEU 25 13.975 -5.457 -5.535 203 HA LEU 25 HA LEU 25 13.863 -7.285 -3.258 204 HB2 LEU 25 HB2 LEU 25 14.744 -4.362 -3.418 205 HB3 LEU 25 HB3 LEU 25 15.112 -5.460 -2.102 206 HG LEU 25 HG LEU 25 16.123 -5.750 -4.977 207 HD11 LEU 25 HD11 LEU 25 17.634 -5.106 -2.450 208 HD12 LEU 25 HD12 LEU 25 18.236 -5.037 -4.118 209 HD13 LEU 25 HD13 LEU 25 17.037 -3.849 -3.558 210 HD21 LEU 25 HD21 LEU 25 17.628 -7.480 -4.031 211 HD22 LEU 25 HD22 LEU 25 16.760 -7.374 -2.483 212 HD23 LEU 25 HD23 LEU 25 15.932 -7.966 -3.945 213 H GLY 26 H GLY 26 12.029 -4.484 -4.321 214 HA2 GLY 26 HA2 GLY 26 10.386 -4.376 -1.860 215 HA3 GLY 26 HA3 GLY 26 10.433 -3.223 -3.197 216 H ALA 27 H ALA 27 10.252 -6.429 -4.408 217 HA ALA 27 HA ALA 27 7.776 -6.157 -5.651 218 HB1 ALA 27 HB1 ALA 27 9.124 -8.724 -4.689 219 HB2 ALA 27 HB2 ALA 27 7.886 -8.607 -5.954 220 HB3 ALA 27 HB3 ALA 27 9.474 -7.872 -6.203 221 H GLY 28 H GLY 28 5.841 -5.709 -4.731 222 HA2 GLY 28 HA2 GLY 28 3.827 -6.335 -3.668 223 HA3 GLY 28 HA3 GLY 28 4.676 -7.545 -2.711 224 H LYS 29 H LYS 29 6.717 -5.201 -2.169 225 HA LYS 29 HA LYS 29 5.343 -3.927 0.155 226 HB2 LYS 29 HB2 LYS 29 8.217 -3.950 -0.874 227 HB3 LYS 29 HB3 LYS 29 7.683 -2.907 0.439 228 HG2 LYS 29 HG2 LYS 29 7.274 -4.675 1.898 229 HG3 LYS 29 HG3 LYS 29 7.081 -5.853 0.602 230 HD2 LYS 29 HD2 LYS 29 9.118 -6.385 1.703 231 HD3 LYS 29 HD3 LYS 29 9.492 -5.767 0.108 232 HE2 LYS 29 HE2 LYS 29 11.112 -4.898 1.631 233 HE3 LYS 29 HE3 LYS 29 10.086 -3.542 1.145 234 HZ1 LYS 29 HZ1 LYS 29 8.993 -3.591 3.250 235 HZ2 LYS 29 HZ2 LYS 29 9.608 -5.067 3.669 236 HZ3 LYS 29 HZ3 LYS 29 10.572 -3.752 3.617 237 H ILE 30 H ILE 30 6.746 -3.059 -3.007 238 HA ILE 30 HA ILE 30 5.329 -0.444 -2.906 239 HB ILE 30 HB ILE 30 7.344 0.734 -3.674 240 HG12 ILE 30 HG12 ILE 30 9.573 -0.141 -3.433 241 HG13 ILE 30 HG13 ILE 30 8.967 -1.728 -2.965 242 HG21 ILE 30 HG21 ILE 30 8.550 0.793 -1.576 243 HG22 ILE 30 HG22 ILE 30 6.802 0.695 -1.271 244 HG23 ILE 30 HG23 ILE 30 7.855 -0.729 -1.052 245 HD11 ILE 30 HD11 ILE 30 8.376 -2.254 -5.210 246 HD12 ILE 30 HD12 ILE 30 8.389 -0.538 -5.700 247 HD13 ILE 30 HD13 ILE 30 9.898 -1.375 -5.345 248 H ALA 31 H ALA 31 5.589 0.789 -4.986 249 HA ALA 31 HA ALA 31 5.858 -0.925 -7.389 250 HB1 ALA 31 HB1 ALA 31 3.938 0.198 -8.456 251 HB2 ALA 31 HB2 ALA 31 3.442 -0.682 -6.996 252 HB3 ALA 31 HB3 ALA 31 3.606 1.083 -6.956 253 H VAL 32 H VAL 32 6.983 0.129 -9.122 254 HA VAL 32 HA VAL 32 8.053 2.833 -8.521 255 HB VAL 32 HB VAL 32 10.230 1.697 -9.371 256 HG11 VAL 32 HG11 VAL 32 9.211 1.456 -6.527 257 HG12 VAL 32 HG12 VAL 32 10.918 1.437 -7.031 258 HG13 VAL 32 HG13 VAL 32 9.958 2.868 -7.316 259 HG21 VAL 32 HG21 VAL 32 9.061 -0.727 -7.991 260 HG22 VAL 32 HG22 VAL 32 9.294 -0.567 -9.751 261 HG23 VAL 32 HG23 VAL 32 10.687 -0.524 -8.662 262 H THR 33 H THR 33 8.924 3.998 -10.052 263 HA THR 33 HA THR 33 8.693 3.173 -12.909 264 HB THR 33 HB THR 33 7.683 5.822 -11.806 265 HG1 THR 33 HG1 THR 33 5.602 4.973 -12.097 266 HG21 THR 33 HG21 THR 33 7.175 4.436 -14.485 267 HG22 THR 33 HG22 THR 33 6.533 6.015 -13.966 268 HG23 THR 33 HG23 THR 33 8.267 5.821 -14.246 269 H SER 34 H SER 34 10.273 4.108 -14.246 270 HA SER 34 HA SER 34 12.247 5.976 -13.010 271 HB2 SER 34 HB2 SER 34 13.070 3.717 -13.581 272 HB3 SER 34 HB3 SER 34 12.617 3.994 -15.282 273 HG SER 34 HG SER 34 14.852 4.543 -14.683 274 H CYS 35 H CYS 35 12.763 7.855 -14.024 275 HA CYS 35 HA CYS 35 11.960 8.429 -16.782 276 HB2 CYS 35 HB2 CYS 35 10.509 10.236 -16.294 277 HB3 CYS 35 HB3 CYS 35 9.949 8.852 -15.341 278 HG CYS 35 HG CYS 35 11.353 9.586 -13.160 279 H GLY 36 H GLY 36 12.512 10.919 -17.218 280 HA2 GLY 36 HA2 GLY 36 14.588 12.013 -15.425 281 HA3 GLY 36 HA3 GLY 36 15.123 11.643 -17.074 282 H LEU 37 H LEU 37 15.271 14.217 -16.040 283 HA LEU 37 HA LEU 37 12.921 15.719 -16.818 284 HB2 LEU 37 HB2 LEU 37 14.227 17.736 -16.608 285 HB3 LEU 37 HB3 LEU 37 14.160 16.759 -15.162 286 HG LEU 37 HG LEU 37 16.546 16.371 -16.997 287 HD11 LEU 37 HD11 LEU 37 17.734 18.234 -15.894 288 HD12 LEU 37 HD12 LEU 37 16.346 18.832 -16.819 289 HD13 LEU 37 HD13 LEU 37 16.239 18.702 -15.049 290 HD21 LEU 37 HD21 LEU 37 16.127 16.423 -13.981 291 HD22 LEU 37 HD22 LEU 37 16.330 14.978 -14.968 292 HD23 LEU 37 HD23 LEU 37 17.679 16.090 -14.793 293 H GLU 38 H GLU 38 15.364 14.304 -18.562 294 HA GLU 38 HA GLU 38 14.249 15.322 -21.107 295 HB2 GLU 38 HB2 GLU 38 17.249 14.903 -20.719 296 HB3 GLU 38 HB3 GLU 38 16.411 15.346 -22.198 297 HG2 GLU 38 HG2 GLU 38 15.663 17.474 -21.116 298 HG3 GLU 38 HG3 GLU 38 16.640 17.064 -19.696 299 H SER 39 H SER 39 14.762 13.691 -22.884 300 HA SER 39 HA SER 39 15.065 10.917 -21.800 301 HB2 SER 39 HB2 SER 39 12.667 11.481 -22.221 302 HB3 SER 39 HB3 SER 39 13.080 11.724 -23.935 303 HG SER 39 HG SER 39 12.498 9.578 -23.748 304 H SER 40 H SER 40 16.129 9.502 -22.994 305 HA SER 40 HA SER 40 17.080 10.169 -25.730 306 HB2 SER 40 HB2 SER 40 19.381 9.511 -25.190 307 HB3 SER 40 HB3 SER 40 18.868 10.948 -24.295 308 HG SER 40 HG SER 40 18.513 9.606 -22.457 309 H ARG 41 H ARG 41 18.461 7.529 -23.987 310 HA ARG 41 HA ARG 41 16.464 5.521 -24.543 311 HB2 ARG 41 HB2 ARG 41 17.681 4.099 -26.025 312 HB3 ARG 41 HB3 ARG 41 17.539 5.659 -26.798 313 HG2 ARG 41 HG2 ARG 41 20.027 4.504 -25.457 314 HG3 ARG 41 HG3 ARG 41 19.721 4.592 -27.176 315 HD2 ARG 41 HD2 ARG 41 20.191 6.973 -25.331 316 HD3 ARG 41 HD3 ARG 41 21.330 6.263 -26.473 317 HE ARG 41 HE ARG 41 18.956 6.978 -27.897 318 HH11 ARG 41 HH21 ARG 41 21.775 8.528 -26.496 319 HH12 ARG 41 HH22 ARG 41 21.700 9.870 -27.599 320 HH21 ARG 41 HH11 ARG 41 18.901 8.725 -29.259 321 HH22 ARG 41 HH12 ARG 41 20.097 9.974 -29.123 322 H VAL 42 H VAL 42 16.966 3.506 -23.435 323 HA VAL 42 HA VAL 42 18.679 3.769 -21.127 324 HB VAL 42 HB VAL 42 16.944 1.670 -22.228 325 HG11 VAL 42 HG11 VAL 42 19.361 0.726 -20.631 326 HG12 VAL 42 HG12 VAL 42 17.878 -0.187 -20.938 327 HG13 VAL 42 HG13 VAL 42 18.932 0.242 -22.291 328 HG21 VAL 42 HG21 VAL 42 17.962 2.246 -19.427 329 HG22 VAL 42 HG22 VAL 42 16.631 3.167 -20.192 330 HG23 VAL 42 HG23 VAL 42 16.449 1.421 -19.862 331 H HIS 43 H HIS 43 20.712 3.256 -20.669 332 HA HIS 43 HA HIS 43 22.596 2.948 -22.866 333 HB2 HIS 43 HB2 HIS 43 22.882 4.237 -20.640 334 HB3 HIS 43 HB3 HIS 43 23.178 2.673 -19.888 335 HD2 HIS 43 HD2 HIS 43 24.774 5.383 -21.944 336 HE1 HIS 43 HE1 HIS 43 27.683 2.279 -21.811 337 HE2 HIS 43 HE2 HIS 43 27.249 4.733 -22.440 338 HA PRO 44 HA PRO 44 21.880 -1.342 -22.896 339 HB2 PRO 44 HB2 PRO 44 23.818 -2.318 -24.597 340 HB3 PRO 44 HB3 PRO 44 22.475 -1.257 -25.132 341 HG2 PRO 44 HG2 PRO 44 25.300 -0.415 -24.414 342 HG3 PRO 44 HG3 PRO 44 24.362 -0.011 -25.888 343 HD2 PRO 44 HD2 PRO 44 24.472 1.679 -23.755 344 HD3 PRO 44 HD3 PRO 44 22.967 1.480 -24.716 345 H THR 45 H THR 45 25.117 -0.245 -21.894 346 HA THR 45 HA THR 45 25.950 -2.719 -20.667 347 HB THR 45 HB THR 45 26.761 0.103 -19.903 348 HG1 THR 45 HG1 THR 45 27.889 -1.624 -21.879 349 HG21 THR 45 HG21 THR 45 27.647 -1.501 -18.319 350 HG22 THR 45 HG22 THR 45 28.154 -2.600 -19.622 351 HG23 THR 45 HG23 THR 45 28.957 -1.019 -19.403 352 H ALA 46 H ALA 46 23.705 -0.196 -19.577 353 HA ALA 46 HA ALA 46 23.755 -0.770 -16.791 354 HB1 ALA 46 HB1 ALA 46 21.536 0.298 -16.786 355 HB2 ALA 46 HB2 ALA 46 22.578 1.169 -17.932 356 HB3 ALA 46 HB3 ALA 46 21.358 0.016 -18.533 357 H ILE 47 H ILE 47 21.845 -2.250 -19.415 358 HA ILE 47 HA ILE 47 20.391 -4.145 -17.805 359 HB ILE 47 HB ILE 47 21.252 -4.160 -20.723 360 HG12 ILE 47 HG12 ILE 47 18.381 -3.809 -19.971 361 HG13 ILE 47 HG13 ILE 47 19.419 -2.469 -19.491 362 HG21 ILE 47 HG21 ILE 47 19.429 -5.845 -21.072 363 HG22 ILE 47 HG22 ILE 47 20.781 -6.471 -20.131 364 HG23 ILE 47 HG23 ILE 47 19.282 -6.005 -19.305 365 HD11 ILE 47 HD11 ILE 47 20.138 -2.027 -21.667 366 HD12 ILE 47 HD12 ILE 47 19.468 -3.556 -22.317 367 HD13 ILE 47 HD13 ILE 47 18.381 -2.266 -21.782 368 H ALA 48 H ALA 48 23.560 -4.389 -19.507 369 HA ALA 48 HA ALA 48 24.084 -7.120 -18.846 370 HB1 ALA 48 HB1 ALA 48 25.294 -5.819 -20.554 371 HB2 ALA 48 HB2 ALA 48 26.020 -4.815 -19.274 372 HB3 ALA 48 HB3 ALA 48 26.399 -6.551 -19.369 373 H MET 49 H MET 49 24.763 -4.122 -17.088 374 HA MET 49 HA MET 49 26.182 -5.360 -14.888 375 HB2 MET 49 HB2 MET 49 24.926 -2.621 -15.237 376 HB3 MET 49 HB3 MET 49 25.969 -3.072 -13.875 377 HG2 MET 49 HG2 MET 49 26.956 -3.423 -16.723 378 HG3 MET 49 HG3 MET 49 26.957 -1.856 -15.948 379 HE1 MET 49 HE1 MET 49 29.925 -5.261 -15.321 380 HE2 MET 49 HE2 MET 49 28.206 -5.677 -15.328 381 HE3 MET 49 HE3 MET 49 28.928 -4.886 -16.743 382 H MET 50 H MET 50 22.738 -4.595 -15.392 383 HA MET 50 HA MET 50 22.048 -5.470 -12.664 384 HB2 MET 50 HB2 MET 50 20.344 -5.003 -15.147 385 HB3 MET 50 HB3 MET 50 19.715 -5.416 -13.548 386 HG2 MET 50 HG2 MET 50 21.224 -2.899 -14.317 387 HG3 MET 50 HG3 MET 50 19.529 -3.039 -13.875 388 HE1 MET 50 HE1 MET 50 18.766 -3.977 -11.567 389 HE2 MET 50 HE2 MET 50 20.068 -5.116 -11.127 390 HE3 MET 50 HE3 MET 50 19.658 -3.764 -10.052 391 H GLU 51 H GLU 51 22.352 -7.051 -15.864 392 HA GLU 51 HA GLU 51 21.229 -9.539 -14.984 393 HB2 GLU 51 HB2 GLU 51 23.020 -8.707 -17.279 394 HB3 GLU 51 HB3 GLU 51 22.674 -10.409 -16.998 395 HG2 GLU 51 HG2 GLU 51 20.403 -8.407 -17.215 396 HG3 GLU 51 HG3 GLU 51 21.183 -9.073 -18.644 397 H GLU 52 H GLU 52 24.479 -8.178 -14.445 398 HA GLU 52 HA GLU 52 25.788 -10.592 -13.638 399 HB2 GLU 52 HB2 GLU 52 26.014 -7.823 -12.418 400 HB3 GLU 52 HB3 GLU 52 27.102 -9.169 -12.104 401 HG2 GLU 52 HG2 GLU 52 27.516 -9.146 -14.684 402 HG3 GLU 52 HG3 GLU 52 26.841 -7.511 -14.609 403 H VAL 53 H VAL 53 23.305 -8.697 -12.010 404 HA VAL 53 HA VAL 53 23.417 -10.474 -9.611 405 HB VAL 53 HB VAL 53 22.109 -8.764 -8.422 406 HG11 VAL 53 HG11 VAL 53 23.933 -7.179 -8.094 407 HG12 VAL 53 HG12 VAL 53 24.574 -8.824 -8.255 408 HG13 VAL 53 HG13 VAL 53 24.698 -7.690 -9.613 409 HG21 VAL 53 HG21 VAL 53 21.871 -6.504 -9.290 410 HG22 VAL 53 HG22 VAL 53 22.646 -6.950 -10.810 411 HG23 VAL 53 HG23 VAL 53 21.053 -7.632 -10.380 412 H GLY 54 H GLY 54 22.069 -10.748 -12.432 413 HA2 GLY 54 HA2 GLY 54 20.354 -12.038 -13.198 414 HA3 GLY 54 HA3 GLY 54 19.964 -12.458 -11.531 415 H ILE 55 H ILE 55 19.875 -9.077 -12.520 416 HA ILE 55 HA ILE 55 16.890 -9.071 -12.267 417 HB ILE 55 HB ILE 55 18.958 -6.948 -11.659 418 HG12 ILE 55 HG12 ILE 55 16.937 -8.436 -9.923 419 HG13 ILE 55 HG13 ILE 55 18.680 -8.684 -9.919 420 HG21 ILE 55 HG21 ILE 55 16.994 -5.857 -12.715 421 HG22 ILE 55 HG22 ILE 55 15.917 -6.690 -11.560 422 HG23 ILE 55 HG23 ILE 55 17.089 -5.482 -11.008 423 HD11 ILE 55 HD11 ILE 55 18.974 -6.310 -9.127 424 HD12 ILE 55 HD12 ILE 55 17.207 -6.227 -8.909 425 HD13 ILE 55 HD13 ILE 55 18.156 -7.393 -7.990 426 H ASP 56 H ASP 56 15.655 -8.349 -13.916 427 HA ASP 56 HA ASP 56 17.045 -7.552 -16.426 428 HB2 ASP 56 HB2 ASP 56 15.711 -9.544 -16.604 429 HB3 ASP 56 HB3 ASP 56 14.303 -8.716 -15.933 430 H ILE 57 H ILE 57 17.007 -5.561 -17.095 431 HA ILE 57 HA ILE 57 14.617 -3.849 -16.597 432 HB ILE 57 HB ILE 57 15.979 -1.845 -16.503 433 HG12 ILE 57 HG12 ILE 57 18.444 -3.616 -16.221 434 HG13 ILE 57 HG13 ILE 57 17.973 -2.844 -17.735 435 HG21 ILE 57 HG21 ILE 57 15.256 -3.047 -14.419 436 HG22 ILE 57 HG22 ILE 57 16.856 -3.824 -14.353 437 HG23 ILE 57 HG23 ILE 57 16.698 -2.057 -14.205 438 HD11 ILE 57 HD11 ILE 57 18.634 -1.337 -15.175 439 HD12 ILE 57 HD12 ILE 57 19.670 -1.515 -16.599 440 HD13 ILE 57 HD13 ILE 57 18.147 -0.616 -16.724 441 H SER 58 H SER 58 15.724 -5.641 -18.944 442 HA SER 58 HA SER 58 16.351 -3.834 -21.095 443 HB2 SER 58 HB2 SER 58 16.913 -6.294 -20.914 444 HB3 SER 58 HB3 SER 58 15.218 -6.647 -21.307 445 HG SER 58 HG SER 58 16.564 -6.632 -23.186 446 H GLY 59 H GLY 59 13.271 -4.953 -19.804 447 HA2 GLY 59 HA2 GLY 59 11.589 -4.025 -21.966 448 HA3 GLY 59 HA3 GLY 59 11.090 -4.406 -20.316 449 H GLN 60 H GLN 60 13.551 -2.107 -20.069 450 HA GLN 60 HA GLN 60 11.644 0.192 -19.944 451 HB2 GLN 60 HB2 GLN 60 14.212 -0.332 -18.400 452 HB3 GLN 60 HB3 GLN 60 13.272 1.147 -18.331 453 HG2 GLN 60 HG2 GLN 60 11.575 0.233 -17.051 454 HG3 GLN 60 HG3 GLN 60 11.876 -1.420 -17.610 455 HE21 GLN 60 HE22 GLN 60 14.013 1.082 -16.013 456 HE22 GLN 60 HE21 GLN 60 14.560 -0.068 -14.782 457 H THR 61 H THR 61 12.421 2.232 -20.666 458 HA THR 61 HA THR 61 15.062 2.590 -21.653 459 HB THR 61 HB THR 61 14.046 1.630 -23.676 460 HG1 THR 61 HG1 THR 61 14.851 3.308 -24.958 461 HG21 THR 61 HG21 THR 61 12.479 2.941 -25.004 462 HG22 THR 61 HG22 THR 61 11.726 2.520 -23.456 463 HG23 THR 61 HG23 THR 61 12.352 4.167 -23.725 464 H SER 62 H SER 62 14.849 5.002 -22.680 465 HA SER 62 HA SER 62 14.355 6.537 -20.309 466 HB2 SER 62 HB2 SER 62 14.979 7.293 -23.122 467 HB3 SER 62 HB3 SER 62 14.939 8.448 -21.746 468 HG SER 62 HG SER 62 17.022 7.816 -21.574 469 H ASP 63 H ASP 63 12.641 7.746 -19.687 470 HA ASP 63 HA ASP 63 10.697 8.756 -21.693 471 HB2 ASP 63 HB2 ASP 63 9.982 7.221 -19.184 472 HB3 ASP 63 HB3 ASP 63 8.870 8.361 -19.945 473 HA PRO 64 HA PRO 64 11.447 12.460 -19.510 474 HB2 PRO 64 HB2 PRO 64 9.733 14.200 -20.680 475 HB3 PRO 64 HB3 PRO 64 11.003 13.346 -21.606 476 HG2 PRO 64 HG2 PRO 64 8.077 12.569 -21.331 477 HG3 PRO 64 HG3 PRO 64 9.042 12.724 -22.835 478 HD2 PRO 64 HD2 PRO 64 8.651 10.321 -21.558 479 HD3 PRO 64 HD3 PRO 64 10.158 10.713 -22.440 480 H ILE 65 H ILE 65 10.965 13.643 -17.753 481 HA ILE 65 HA ILE 65 9.061 13.021 -15.815 482 HB ILE 65 HB ILE 65 11.269 14.329 -15.710 483 HG12 ILE 65 HG12 ILE 65 8.944 15.416 -14.148 484 HG13 ILE 65 HG13 ILE 65 9.855 13.932 -13.789 485 HG21 ILE 65 HG21 ILE 65 9.516 16.791 -16.180 486 HG22 ILE 65 HG22 ILE 65 11.237 16.766 -15.820 487 HG23 ILE 65 HG23 ILE 65 10.683 16.143 -17.375 488 HD11 ILE 65 HD11 ILE 65 10.810 16.805 -13.593 489 HD12 ILE 65 HD12 ILE 65 10.742 15.575 -12.325 490 HD13 ILE 65 HD13 ILE 65 11.940 15.429 -13.622 491 H GLU 66 H GLU 66 8.827 15.395 -18.429 492 HA GLU 66 HA GLU 66 6.527 16.798 -17.622 493 HB2 GLU 66 HB2 GLU 66 7.453 16.173 -20.455 494 HB3 GLU 66 HB3 GLU 66 6.307 17.440 -19.995 495 HG2 GLU 66 HG2 GLU 66 8.118 18.468 -18.556 496 HG3 GLU 66 HG3 GLU 66 9.251 17.297 -19.234 497 H ASN 67 H ASN 67 6.586 13.543 -19.010 498 HA ASN 67 HA ASN 67 3.684 13.660 -19.590 499 HB2 ASN 67 HB2 ASN 67 3.993 11.961 -20.984 500 HB3 ASN 67 HB3 ASN 67 5.700 12.339 -20.881 501 HD21 ASN 67 HD22 ASN 67 6.837 11.124 -18.869 502 HD22 ASN 67 HD21 ASN 67 6.225 9.523 -18.541 503 H PHE 68 H PHE 68 5.523 13.091 -16.815 504 HA PHE 68 HA PHE 68 3.761 10.955 -15.736 505 HB2 PHE 68 HB2 PHE 68 6.535 11.945 -15.060 506 HB3 PHE 68 HB3 PHE 68 5.657 10.843 -14.022 507 HD1 PHE 68 HD2 PHE 68 4.473 8.791 -15.560 508 HD2 PHE 68 HD1 PHE 68 8.193 10.847 -16.283 509 HE1 PHE 68 HE2 PHE 68 5.297 6.842 -16.834 510 HE2 PHE 68 HE1 PHE 68 9.013 8.883 -17.573 511 HZ PHE 68 HZ PHE 68 7.574 6.874 -17.836 512 H ASN 69 H ASN 69 3.552 11.025 -13.289 513 HA ASN 69 HA ASN 69 2.324 13.659 -12.545 514 HB2 ASN 69 HB2 ASN 69 0.470 12.239 -11.561 515 HB3 ASN 69 HB3 ASN 69 0.566 12.353 -13.311 516 HD21 ASN 69 HD22 ASN 69 1.828 10.178 -10.710 517 HD22 ASN 69 HD21 ASN 69 1.409 8.703 -11.574 518 H ALA 70 H ALA 70 4.152 14.224 -11.282 519 HA ALA 70 HA ALA 70 5.322 12.725 -9.249 520 HB1 ALA 70 HB1 ALA 70 6.544 14.554 -8.966 521 HB2 ALA 70 HB2 ALA 70 5.569 15.329 -10.234 522 HB3 ALA 70 HB3 ALA 70 5.147 15.550 -8.537 523 H ASP 71 H ASP 71 2.295 14.496 -9.143 524 HA ASP 71 HA ASP 71 1.801 14.732 -6.395 525 HB2 ASP 71 HB2 ASP 71 0.474 15.725 -8.252 526 HB3 ASP 71 HB3 ASP 71 -0.122 14.113 -8.676 527 H ASP 72 H ASP 72 1.512 11.822 -8.396 528 HA ASP 72 HA ASP 72 0.081 10.363 -6.252 529 HB2 ASP 72 HB2 ASP 72 -0.628 10.153 -8.640 530 HB3 ASP 72 HB3 ASP 72 0.940 9.414 -8.985 531 H TYR 73 H TYR 73 3.363 10.523 -7.576 532 HA TYR 73 HA TYR 73 4.241 8.031 -6.362 533 HB2 TYR 73 HB2 TYR 73 5.981 10.364 -7.160 534 HB3 TYR 73 HB3 TYR 73 6.433 8.669 -7.055 535 HD1 TYR 73 HD1 TYR 73 4.204 7.363 -8.627 536 HD2 TYR 73 HD2 TYR 73 6.483 10.957 -9.345 537 HE1 TYR 73 HE1 TYR 73 3.627 7.252 -11.042 538 HE2 TYR 73 HE2 TYR 73 5.875 10.860 -11.750 539 HH TYR 73 HH TYR 73 3.790 8.264 -13.094 540 H ASP 74 H ASP 74 4.063 7.839 -4.167 541 HA ASP 74 HA ASP 74 3.964 9.911 -2.286 542 HB2 ASP 74 HB2 ASP 74 5.061 7.098 -1.913 543 HB3 ASP 74 HB3 ASP 74 4.479 8.154 -0.625 544 H VAL 75 H VAL 75 6.778 8.375 -3.723 545 HA VAL 75 HA VAL 75 8.555 10.349 -2.354 546 HB VAL 75 HB VAL 75 9.251 7.468 -2.971 547 HG11 VAL 75 HG11 VAL 75 11.296 7.987 -1.617 548 HG12 VAL 75 HG12 VAL 75 11.221 8.850 -3.151 549 HG13 VAL 75 HG13 VAL 75 10.837 9.693 -1.640 550 HG21 VAL 75 HG21 VAL 75 9.413 7.269 -0.452 551 HG22 VAL 75 HG22 VAL 75 8.542 8.815 -0.342 552 HG23 VAL 75 HG23 VAL 75 7.771 7.404 -1.098 553 H VAL 76 H VAL 76 10.024 11.370 -3.691 554 HA VAL 76 HA VAL 76 10.450 10.305 -6.460 555 HB VAL 76 HB VAL 76 9.895 13.156 -5.655 556 HG11 VAL 76 HG11 VAL 76 10.491 13.867 -7.913 557 HG12 VAL 76 HG12 VAL 76 11.913 13.227 -7.118 558 HG13 VAL 76 HG13 VAL 76 11.069 12.224 -8.318 559 HG21 VAL 76 HG21 VAL 76 8.262 13.068 -7.457 560 HG22 VAL 76 HG22 VAL 76 8.809 11.448 -7.935 561 HG23 VAL 76 HG23 VAL 76 7.975 11.677 -6.388 562 H ILE 77 H ILE 77 12.520 10.186 -7.104 563 HA ILE 77 HA ILE 77 14.643 11.230 -5.256 564 HB ILE 77 HB ILE 77 14.712 8.733 -6.949 565 HG12 ILE 77 HG12 ILE 77 13.035 8.309 -5.247 566 HG13 ILE 77 HG13 ILE 77 14.476 7.351 -4.974 567 HG21 ILE 77 HG21 ILE 77 16.686 8.150 -5.617 568 HG22 ILE 77 HG22 ILE 77 16.936 9.665 -6.472 569 HG23 ILE 77 HG23 ILE 77 16.578 9.692 -4.740 570 HD11 ILE 77 HD11 ILE 77 13.867 9.911 -3.438 571 HD12 ILE 77 HD12 ILE 77 13.467 8.277 -2.903 572 HD13 ILE 77 HD13 ILE 77 15.158 8.728 -3.111 573 H SER 78 H SER 78 16.222 12.450 -6.200 574 HA SER 78 HA SER 78 16.395 12.518 -9.205 575 HB2 SER 78 HB2 SER 78 16.031 14.699 -8.146 576 HB3 SER 78 HB3 SER 78 17.539 14.497 -7.218 577 HG SER 78 HG SER 78 17.912 15.648 -9.185 578 H LEU 79 H LEU 79 18.152 11.831 -10.236 579 HA LEU 79 HA LEU 79 20.646 11.092 -8.758 580 HB2 LEU 79 HB2 LEU 79 19.320 9.310 -10.859 581 HB3 LEU 79 HB3 LEU 79 20.742 8.980 -9.881 582 HG LEU 79 HG LEU 79 19.038 9.114 -7.842 583 HD11 LEU 79 HD11 LEU 79 17.251 8.374 -10.212 584 HD12 LEU 79 HD12 LEU 79 16.834 8.128 -8.495 585 HD13 LEU 79 HD13 LEU 79 17.016 9.755 -9.141 586 HD21 LEU 79 HD21 LEU 79 20.301 7.096 -8.513 587 HD22 LEU 79 HD22 LEU 79 18.622 6.690 -8.102 588 HD23 LEU 79 HD23 LEU 79 19.108 6.775 -9.802 589 H CYS 80 H CYS 80 20.512 13.459 -10.038 590 HA CYS 80 HA CYS 80 21.184 13.098 -12.906 591 HB2 CYS 80 HB2 CYS 80 20.566 15.601 -11.300 592 HB3 CYS 80 HB3 CYS 80 20.785 15.501 -13.058 593 HG CYS 80 HG CYS 80 18.434 14.283 -11.085 594 H GLY 81 H GLY 81 23.033 13.807 -10.006 595 HA2 GLY 81 HA2 GLY 81 25.344 14.116 -9.829 596 HA3 GLY 81 HA3 GLY 81 25.505 14.125 -11.588 597 H CYS 82 H CYS 82 23.692 16.067 -9.214 598 HA CYS 82 HA CYS 82 23.262 18.279 -8.944 599 HB2 CYS 82 HB2 CYS 82 26.124 18.622 -9.918 600 HB3 CYS 82 HB3 CYS 82 25.182 19.847 -9.055 601 HG CYS 82 HG CYS 82 24.770 18.490 -6.871 602 H GLY 83 H GLY 83 23.561 20.621 -10.167 603 HA2 GLY 83 HA2 GLY 83 22.946 21.910 -11.992 604 HA3 GLY 83 HA3 GLY 83 23.063 20.490 -13.033 605 H VAL 84 H VAL 84 20.993 19.816 -10.429 606 HA VAL 84 HA VAL 84 18.502 20.500 -11.934 607 HB VAL 84 HB VAL 84 19.286 17.701 -11.030 608 HG11 VAL 84 HG11 VAL 84 17.209 16.963 -12.081 609 HG12 VAL 84 HG12 VAL 84 16.844 18.089 -10.796 610 HG13 VAL 84 HG13 VAL 84 16.776 18.638 -12.496 611 HG21 VAL 84 HG21 VAL 84 19.005 18.893 -13.816 612 HG22 VAL 84 HG22 VAL 84 20.479 18.213 -13.075 613 HG23 VAL 84 HG23 VAL 84 19.139 17.158 -13.473 614 H ASN 85 H ASN 85 16.949 21.201 -10.594 615 HA ASN 85 HA ASN 85 16.978 20.368 -7.711 616 HB2 ASN 85 HB2 ASN 85 16.426 23.119 -8.898 617 HB3 ASN 85 HB3 ASN 85 16.324 22.707 -7.188 618 HD21 ASN 85 HD22 ASN 85 18.394 21.905 -6.124 619 HD22 ASN 85 HD21 ASN 85 19.902 22.548 -6.750 620 H LEU 86 H LEU 86 15.045 20.183 -10.457 621 HA LEU 86 HA LEU 86 12.779 20.049 -10.902 622 HB2 LEU 86 HB2 LEU 86 12.868 18.398 -8.363 623 HB3 LEU 86 HB3 LEU 86 11.683 18.309 -9.666 624 HG LEU 86 HG LEU 86 14.551 17.410 -9.767 625 HD11 LEU 86 HD11 LEU 86 12.017 15.843 -10.278 626 HD12 LEU 86 HD12 LEU 86 13.626 15.245 -9.839 627 HD13 LEU 86 HD13 LEU 86 12.624 16.083 -8.623 628 HD21 LEU 86 HD21 LEU 86 14.002 18.384 -11.964 629 HD22 LEU 86 HD22 LEU 86 13.884 16.633 -12.097 630 HD23 LEU 86 HD23 LEU 86 12.404 17.598 -11.930 631 HA PRO 87 HA PRO 87 11.498 23.518 -8.032 632 HB2 PRO 87 HB2 PRO 87 10.649 24.517 -10.756 633 HB3 PRO 87 HB3 PRO 87 11.203 25.454 -9.332 634 HG2 PRO 87 HG2 PRO 87 12.942 24.931 -11.319 635 HG3 PRO 87 HG3 PRO 87 13.459 24.689 -9.617 636 HD2 PRO 87 HD2 PRO 87 12.518 22.604 -11.602 637 HD3 PRO 87 HD3 PRO 87 13.919 22.571 -10.490 638 HA PRO 88 HA PRO 88 7.003 22.859 -9.489 639 HB2 PRO 88 HB2 PRO 88 6.940 20.253 -10.948 640 HB3 PRO 88 HB3 PRO 88 6.181 21.808 -11.386 641 HG2 PRO 88 HG2 PRO 88 8.345 20.792 -12.684 642 HG3 PRO 88 HG3 PRO 88 8.168 22.564 -12.393 643 HD2 PRO 88 HD2 PRO 88 9.777 20.536 -10.804 644 HD3 PRO 88 HD3 PRO 88 10.243 22.156 -11.407 645 H GLU 89 H GLU 89 5.289 20.621 -9.391 646 HA GLU 89 HA GLU 89 5.185 19.740 -6.725 647 HB2 GLU 89 HB2 GLU 89 3.648 18.001 -7.583 648 HB3 GLU 89 HB3 GLU 89 3.279 19.619 -8.186 649 HG2 GLU 89 HG2 GLU 89 4.271 19.099 -10.360 650 HG3 GLU 89 HG3 GLU 89 4.841 17.544 -9.781 651 H TRP 90 H TRP 90 7.470 18.679 -9.044 652 HA TRP 90 HA TRP 90 7.996 16.003 -8.131 653 HB2 TRP 90 HB2 TRP 90 9.549 18.023 -9.732 654 HB3 TRP 90 HB3 TRP 90 10.112 16.379 -9.379 655 HD1 TRP 90 HD1 TRP 90 7.575 18.256 -11.525 656 HE1 TRP 90 HE1 TRP 90 6.322 16.606 -13.044 657 HE3 TRP 90 HE3 TRP 90 9.790 13.941 -9.986 658 HZ2 TRP 90 HZ2 TRP 90 6.337 13.758 -13.560 659 HZ3 TRP 90 HZ3 TRP 90 9.330 11.810 -11.155 660 HH2 TRP 90 HH2 TRP 90 7.616 11.702 -12.929 661 H VAL 91 H VAL 91 8.229 18.556 -6.220 662 HA VAL 91 HA VAL 91 10.160 17.143 -4.498 663 HB VAL 91 HB VAL 91 11.206 19.173 -3.668 664 HG11 VAL 91 HG11 VAL 91 11.600 18.788 -6.612 665 HG12 VAL 91 HG12 VAL 91 12.706 19.636 -5.517 666 HG13 VAL 91 HG13 VAL 91 12.395 17.904 -5.297 667 HG21 VAL 91 HG21 VAL 91 11.049 21.316 -4.836 668 HG22 VAL 91 HG22 VAL 91 9.881 20.649 -5.987 669 HG23 VAL 91 HG23 VAL 91 9.440 20.845 -4.280 670 H THR 92 H THR 92 7.071 17.810 -4.755 671 HA THR 92 HA THR 92 6.671 18.865 -1.985 672 HB THR 92 HB THR 92 4.421 19.422 -2.568 673 HG1 THR 92 HG1 THR 92 3.563 19.010 -4.534 674 HG21 THR 92 HG21 THR 92 4.801 21.205 -4.192 675 HG22 THR 92 HG22 THR 92 6.204 21.081 -3.117 676 HG23 THR 92 HG23 THR 92 6.290 20.425 -4.769 677 H GLN 93 H GLN 93 7.220 16.042 -3.174 678 HA GLN 93 HA GLN 93 5.214 14.211 -2.496 679 HB2 GLN 93 HB2 GLN 93 8.271 14.121 -2.604 680 HB3 GLN 93 HB3 GLN 93 7.329 12.694 -2.210 681 HG2 GLN 93 HG2 GLN 93 7.719 12.568 -4.493 682 HG3 GLN 93 HG3 GLN 93 6.009 12.973 -4.288 683 HE21 GLN 93 HE22 GLN 93 5.606 13.987 -6.247 684 HE22 GLN 93 HE21 GLN 93 6.321 15.580 -6.524 685 H GLU 94 H GLU 94 5.730 12.411 -0.852 686 HA GLU 94 HA GLU 94 5.623 13.523 1.893 687 HB2 GLU 94 HB2 GLU 94 4.272 11.563 1.351 688 HB3 GLU 94 HB3 GLU 94 5.721 10.637 0.922 689 HG2 GLU 94 HG2 GLU 94 6.565 10.728 3.159 690 HG3 GLU 94 HG3 GLU 94 5.265 11.823 3.669 691 H ILE 95 H ILE 95 7.981 11.798 -0.166 692 HA ILE 95 HA ILE 95 10.157 12.989 1.469 693 HB ILE 95 HB ILE 95 10.275 10.111 0.488 694 HG12 ILE 95 HG12 ILE 95 9.837 11.096 3.331 695 HG13 ILE 95 HG13 ILE 95 8.703 10.180 2.338 696 HG21 ILE 95 HG21 ILE 95 12.469 11.250 0.550 697 HG22 ILE 95 HG22 ILE 95 12.198 11.694 2.253 698 HG23 ILE 95 HG23 ILE 95 12.389 9.999 1.758 699 HD11 ILE 95 HD11 ILE 95 10.412 8.298 2.267 700 HD12 ILE 95 HD12 ILE 95 11.269 9.166 3.567 701 HD13 ILE 95 HD13 ILE 95 9.607 8.605 3.818 702 H PHE 96 H PHE 96 11.786 13.833 0.272 703 HA PHE 96 HA PHE 96 12.141 12.969 -2.523 704 HB2 PHE 96 HB2 PHE 96 11.012 15.058 -2.847 705 HB3 PHE 96 HB3 PHE 96 12.022 15.859 -1.650 706 HD1 PHE 96 HD1 PHE 96 14.398 16.361 -2.097 707 HD2 PHE 96 HD2 PHE 96 11.854 14.760 -5.216 708 HE1 PHE 96 HE1 PHE 96 16.124 16.891 -3.787 709 HE2 PHE 96 HE2 PHE 96 13.627 15.204 -6.860 710 HZ PHE 96 HZ PHE 96 15.752 16.300 -6.172 711 H GLU 97 H GLU 97 14.228 12.581 -3.078 712 HA GLU 97 HA GLU 97 16.416 13.446 -1.259 713 HB2 GLU 97 HB2 GLU 97 16.112 10.584 -2.241 714 HB3 GLU 97 HB3 GLU 97 17.489 11.268 -1.387 715 HG2 GLU 97 HG2 GLU 97 16.036 11.678 0.601 716 HG3 GLU 97 HG3 GLU 97 14.698 10.893 -0.249 717 H ASP 98 H ASP 98 18.505 13.495 -2.268 718 HA ASP 98 HA ASP 98 18.526 13.049 -5.197 719 HB2 ASP 98 HB2 ASP 98 19.653 15.013 -5.665 720 HB3 ASP 98 HB3 ASP 98 18.231 15.439 -4.739 721 H TRP 99 H TRP 99 19.849 11.512 -5.708 722 HA TRP 99 HA TRP 99 22.157 10.797 -3.946 723 HB2 TRP 99 HB2 TRP 99 20.757 9.136 -6.055 724 HB3 TRP 99 HB3 TRP 99 21.964 8.583 -4.911 725 HD1 TRP 99 HD1 TRP 99 20.116 10.299 -2.518 726 HE1 TRP 99 HE1 TRP 99 18.104 9.030 -1.552 727 HE3 TRP 99 HE3 TRP 99 19.742 6.598 -6.022 728 HZ2 TRP 99 HZ2 TRP 99 16.478 6.773 -2.268 729 HZ3 TRP 99 HZ3 TRP 99 17.934 4.899 -5.874 730 HH2 TRP 99 HH2 TRP 99 16.298 4.969 -3.989 731 H GLN 100 H GLN 100 23.704 12.201 -4.667 732 HA GLN 100 HA GLN 100 24.189 12.552 -7.541 733 HB2 GLN 100 HB2 GLN 100 25.657 13.752 -5.170 734 HB3 GLN 100 HB3 GLN 100 25.722 14.295 -6.851 735 HG2 GLN 100 HG2 GLN 100 23.332 14.443 -4.956 736 HG3 GLN 100 HG3 GLN 100 24.339 15.774 -5.478 737 HE21 GLN 100 HE22 GLN 100 21.714 16.145 -5.778 738 HE22 GLN 100 HE21 GLN 100 21.287 16.034 -7.492 739 H LEU 101 H LEU 101 24.809 10.465 -8.142 740 HA LEU 101 HA LEU 101 27.309 9.258 -7.032 741 HB2 LEU 101 HB2 LEU 101 25.264 8.109 -8.947 742 HB3 LEU 101 HB3 LEU 101 26.585 7.253 -8.167 743 HG LEU 101 HG LEU 101 24.070 8.305 -6.817 744 HD11 LEU 101 HD11 LEU 101 23.679 5.929 -6.389 745 HD12 LEU 101 HD12 LEU 101 23.797 6.281 -8.124 746 HD13 LEU 101 HD13 LEU 101 25.168 5.517 -7.285 747 HD21 LEU 101 HD21 LEU 101 25.930 8.579 -5.233 748 HD22 LEU 101 HD22 LEU 101 24.933 7.195 -4.770 749 HD23 LEU 101 HD23 LEU 101 26.490 6.934 -5.595 750 H GLU 102 H GLU 102 28.579 8.036 -8.736 751 HA GLU 102 HA GLU 102 29.749 9.832 -10.620 752 HB2 GLU 102 HB2 GLU 102 29.887 6.808 -10.281 753 HB3 GLU 102 HB3 GLU 102 30.948 7.739 -11.325 754 HG2 GLU 102 HG2 GLU 102 32.141 7.181 -9.379 755 HG3 GLU 102 HG3 GLU 102 31.840 8.919 -9.344 756 H ASP 103 H ASP 103 30.057 9.138 -12.918 757 HA ASP 103 HA ASP 103 27.408 8.569 -14.206 758 HB2 ASP 103 HB2 ASP 103 28.190 10.963 -14.030 759 HB3 ASP 103 HB3 ASP 103 29.449 10.563 -15.191 760 HA PRO 104 HA PRO 104 30.259 5.333 -15.578 761 HB2 PRO 104 HB2 PRO 104 27.701 3.937 -16.225 762 HB3 PRO 104 HB3 PRO 104 29.162 3.335 -15.364 763 HG2 PRO 104 HG2 PRO 104 26.955 3.988 -13.968 764 HG3 PRO 104 HG3 PRO 104 28.569 4.542 -13.399 765 HD2 PRO 104 HD2 PRO 104 26.553 6.079 -15.093 766 HD3 PRO 104 HD3 PRO 104 27.337 6.577 -13.571 767 H ASP 105 H ASP 105 27.914 6.879 -17.652 768 HA ASP 105 HA ASP 105 28.134 5.294 -19.999 769 HB2 ASP 105 HB2 ASP 105 26.365 6.921 -19.559 770 HB3 ASP 105 HB3 ASP 105 27.521 8.253 -19.633 771 H GLY 106 H GLY 106 30.073 4.735 -20.814 772 HA2 GLY 106 HA2 GLY 106 31.863 5.083 -22.302 773 HA3 GLY 106 HA3 GLY 106 31.839 6.817 -21.964 774 H GLN 107 H GLN 107 31.743 4.902 -19.109 775 HA GLN 107 HA GLN 107 34.592 5.475 -18.496 776 HB2 GLN 107 HB2 GLN 107 32.407 4.458 -16.664 777 HB3 GLN 107 HB3 GLN 107 34.007 5.025 -16.187 778 HG2 GLN 107 HG2 GLN 107 31.856 6.767 -17.452 779 HG3 GLN 107 HG3 GLN 107 32.099 6.527 -15.730 780 HE21 GLN 107 HE22 GLN 107 32.100 8.930 -15.996 781 HE22 GLN 107 HE21 GLN 107 33.696 9.678 -16.135 782 H SER 108 H SER 108 33.326 2.885 -16.728 783 HA SER 108 HA SER 108 34.367 0.665 -18.346 784 HB2 SER 108 HB2 SER 108 35.651 1.374 -15.655 785 HB3 SER 108 HB3 SER 108 36.014 -0.051 -16.637 786 HG SER 108 HG SER 108 36.842 1.376 -18.259 787 H LEU 109 H LEU 109 33.874 -1.433 -17.296 788 HA LEU 109 HA LEU 109 31.266 -1.322 -16.099 789 HB2 LEU 109 HB2 LEU 109 33.194 -3.558 -16.743 790 HB3 LEU 109 HB3 LEU 109 31.712 -3.857 -15.827 791 HG LEU 109 HG LEU 109 30.312 -3.042 -17.605 792 HD11 LEU 109 HD11 LEU 109 32.830 -2.488 -19.203 793 HD12 LEU 109 HD12 LEU 109 31.182 -2.520 -19.866 794 HD13 LEU 109 HD13 LEU 109 31.603 -1.303 -18.666 795 HD21 LEU 109 HD21 LEU 109 30.713 -4.801 -19.243 796 HD22 LEU 109 HD22 LEU 109 32.407 -4.948 -18.723 797 HD23 LEU 109 HD23 LEU 109 31.095 -5.420 -17.627 798 H GLU 110 H GLU 110 34.439 -1.590 -14.585 799 HA GLU 110 HA GLU 110 33.505 -2.165 -11.927 800 HB2 GLU 110 HB2 GLU 110 35.865 -2.284 -12.686 801 HB3 GLU 110 HB3 GLU 110 35.902 -0.522 -12.839 802 HG2 GLU 110 HG2 GLU 110 35.521 -0.273 -10.423 803 HG3 GLU 110 HG3 GLU 110 35.324 -2.017 -10.246 804 H VAL 111 H VAL 111 33.585 0.874 -13.769 805 HA VAL 111 HA VAL 111 32.765 2.535 -11.490 806 HB VAL 111 HB VAL 111 32.851 3.100 -14.459 807 HG11 VAL 111 HG11 VAL 111 31.211 4.604 -13.486 808 HG12 VAL 111 HG12 VAL 111 32.313 4.989 -12.137 809 HG13 VAL 111 HG13 VAL 111 32.705 5.492 -13.798 810 HG21 VAL 111 HG21 VAL 111 34.665 3.948 -12.159 811 HG22 VAL 111 HG22 VAL 111 35.082 2.769 -13.417 812 HG23 VAL 111 HG23 VAL 111 34.840 4.464 -13.853 813 H PHE 112 H PHE 112 31.081 0.890 -14.237 814 HA PHE 112 HA PHE 112 28.425 1.768 -13.469 815 HB2 PHE 112 HB2 PHE 112 29.498 -0.650 -14.936 816 HB3 PHE 112 HB3 PHE 112 27.825 -0.582 -14.416 817 HD1 PHE 112 HD1 PHE 112 26.202 0.907 -15.391 818 HD2 PHE 112 HD2 PHE 112 30.280 0.839 -16.787 819 HE1 PHE 112 HE1 PHE 112 25.507 2.079 -17.478 820 HE2 PHE 112 HE2 PHE 112 29.592 2.052 -18.837 821 HZ PHE 112 HZ PHE 112 27.216 2.693 -19.163 822 H ARG 113 H ARG 113 30.315 -1.128 -12.440 823 HA ARG 113 HA ARG 113 28.414 -2.141 -10.542 824 HB2 ARG 113 HB2 ARG 113 31.448 -2.341 -10.756 825 HB3 ARG 113 HB3 ARG 113 30.527 -3.225 -9.537 826 HG2 ARG 113 HG2 ARG 113 29.352 -4.512 -11.154 827 HG3 ARG 113 HG3 ARG 113 29.811 -3.453 -12.475 828 HD2 ARG 113 HD2 ARG 113 31.049 -5.532 -12.626 829 HD3 ARG 113 HD3 ARG 113 32.131 -4.184 -12.346 830 HE ARG 113 HE ARG 113 32.627 -4.954 -10.179 831 HH11 ARG 113 HH21 ARG 113 30.223 -7.134 -11.593 832 HH12 ARG 113 HH22 ARG 113 30.658 -8.412 -10.485 833 HH21 ARG 113 HH11 ARG 113 33.037 -6.613 -8.784 834 HH22 ARG 113 HH12 ARG 113 32.154 -8.101 -8.906 835 H THR 114 H THR 114 31.039 0.212 -10.079 836 HA THR 114 HA THR 114 30.690 0.681 -7.279 837 HB THR 114 HB THR 114 31.654 2.539 -9.489 838 HG1 THR 114 HG1 THR 114 32.978 0.784 -9.235 839 HG21 THR 114 HG21 THR 114 31.855 2.845 -6.470 840 HG22 THR 114 HG22 THR 114 32.835 3.748 -7.646 841 HG23 THR 114 HG23 THR 114 31.083 3.961 -7.627 842 H VAL 115 H VAL 115 29.107 2.336 -10.067 843 HA VAL 115 HA VAL 115 27.357 3.943 -8.396 844 HB VAL 115 HB VAL 115 27.311 3.146 -11.322 845 HG11 VAL 115 HG11 VAL 115 25.391 5.042 -9.896 846 HG12 VAL 115 HG12 VAL 115 25.588 4.870 -11.660 847 HG13 VAL 115 HG13 VAL 115 24.945 3.520 -10.729 848 HG21 VAL 115 HG21 VAL 115 27.864 5.708 -9.757 849 HG22 VAL 115 HG22 VAL 115 29.049 4.715 -10.646 850 HG23 VAL 115 HG23 VAL 115 27.806 5.620 -11.517 851 H ARG 116 H ARG 116 26.782 0.842 -10.080 852 HA ARG 116 HA ARG 116 24.095 0.436 -9.449 853 HB2 ARG 116 HB2 ARG 116 25.563 -0.918 -10.997 854 HB3 ARG 116 HB3 ARG 116 26.319 -1.662 -9.587 855 HG2 ARG 116 HG2 ARG 116 23.977 -2.463 -8.918 856 HG3 ARG 116 HG3 ARG 116 23.433 -1.898 -10.513 857 HD2 ARG 116 HD2 ARG 116 23.849 -4.257 -10.667 858 HD3 ARG 116 HD3 ARG 116 25.145 -3.414 -11.540 859 HE ARG 116 HE ARG 116 25.678 -4.099 -8.686 860 HH11 ARG 116 HH11 ARG 116 25.930 -5.411 -11.896 861 HH12 ARG 116 HH12 ARG 116 27.514 -6.108 -11.635 862 HH21 ARG 116 HH21 ARG 116 27.554 -5.275 -8.264 863 HH22 ARG 116 HH22 ARG 116 28.223 -6.266 -9.526 864 H GLY 117 H GLY 117 26.880 -0.557 -7.408 865 HA2 GLY 117 HA2 GLY 117 25.384 -1.748 -5.299 866 HA3 GLY 117 HA3 GLY 117 26.999 -1.049 -5.149 867 H GLN 118 H GLN 118 26.337 1.686 -5.763 868 HA GLN 118 HA GLN 118 25.259 2.547 -3.197 869 HB2 GLN 118 HB2 GLN 118 26.020 4.096 -5.703 870 HB3 GLN 118 HB3 GLN 118 25.540 4.841 -4.176 871 HG2 GLN 118 HG2 GLN 118 27.480 3.948 -3.032 872 HG3 GLN 118 HG3 GLN 118 27.929 2.963 -4.425 873 HE21 GLN 118 HE22 GLN 118 28.696 4.050 -6.382 874 HE22 GLN 118 HE21 GLN 118 29.242 5.735 -6.352 875 H VAL 119 H VAL 119 23.972 2.718 -6.588 876 HA VAL 119 HA VAL 119 21.427 3.811 -5.911 877 HB VAL 119 HB VAL 119 22.049 1.783 -8.111 878 HG11 VAL 119 HG11 VAL 119 20.046 2.817 -9.219 879 HG12 VAL 119 HG12 VAL 119 19.653 1.867 -7.783 880 HG13 VAL 119 HG13 VAL 119 19.687 3.647 -7.681 881 HG21 VAL 119 HG21 VAL 119 21.857 4.822 -8.213 882 HG22 VAL 119 HG22 VAL 119 23.368 3.891 -8.332 883 HG23 VAL 119 HG23 VAL 119 22.153 3.737 -9.594 884 H LYS 120 H LYS 120 22.424 0.353 -5.947 885 HA LYS 120 HA LYS 120 19.960 -0.788 -5.093 886 HB2 LYS 120 HB2 LYS 120 21.994 -2.035 -5.912 887 HB3 LYS 120 HB3 LYS 120 22.807 -1.687 -4.396 888 HG2 LYS 120 HG2 LYS 120 20.959 -2.876 -3.167 889 HG3 LYS 120 HG3 LYS 120 20.225 -3.267 -4.718 890 HD2 LYS 120 HD2 LYS 120 22.406 -4.467 -5.326 891 HD3 LYS 120 HD3 LYS 120 22.953 -4.141 -3.667 892 HE2 LYS 120 HE2 LYS 120 20.803 -5.278 -2.862 893 HE3 LYS 120 HE3 LYS 120 20.522 -5.779 -4.534 894 HZ1 LYS 120 HZ1 LYS 120 22.691 -6.979 -4.432 895 HZ2 LYS 120 HZ2 LYS 120 22.890 -6.527 -2.870 896 HZ3 LYS 120 HZ3 LYS 120 21.674 -7.530 -3.278 897 H GLU 121 H GLU 121 22.761 0.242 -3.018 898 HA GLU 121 HA GLU 121 21.357 -0.384 -0.604 899 HB2 GLU 121 HB2 GLU 121 23.194 0.234 0.537 900 HB3 GLU 121 HB3 GLU 121 23.929 -0.034 -1.039 901 HG2 GLU 121 HG2 GLU 121 23.854 2.427 -1.455 902 HG3 GLU 121 HG3 GLU 121 23.175 2.669 0.154 903 H ARG 122 H ARG 122 21.426 2.726 -2.367 904 HA ARG 122 HA ARG 122 19.911 4.057 -0.270 905 HB2 ARG 122 HB2 ARG 122 20.033 4.645 -3.271 906 HB3 ARG 122 HB3 ARG 122 19.304 5.664 -2.035 907 HG2 ARG 122 HG2 ARG 122 22.248 5.026 -2.299 908 HG3 ARG 122 HG3 ARG 122 21.465 6.552 -2.673 909 HD2 ARG 122 HD2 ARG 122 21.816 5.276 0.059 910 HD3 ARG 122 HD3 ARG 122 22.661 6.687 -0.577 911 HE ARG 122 HE ARG 122 19.975 7.416 -0.695 912 HH11 ARG 122 HH11 ARG 122 22.227 6.603 1.867 913 HH12 ARG 122 HH12 ARG 122 21.329 7.480 3.067 914 HH21 ARG 122 HH21 ARG 122 18.812 8.503 0.932 915 HH22 ARG 122 HH22 ARG 122 19.488 8.541 2.532 916 H VAL 123 H VAL 123 18.780 2.295 -3.228 917 HA VAL 123 HA VAL 123 16.032 2.558 -2.553 918 HB VAL 123 HB VAL 123 17.592 0.563 -4.230 919 HG11 VAL 123 HG11 VAL 123 15.524 -0.413 -5.028 920 HG12 VAL 123 HG12 VAL 123 15.785 -0.806 -3.340 921 HG13 VAL 123 HG13 VAL 123 14.600 0.456 -3.763 922 HG21 VAL 123 HG21 VAL 123 17.234 2.806 -5.118 923 HG22 VAL 123 HG22 VAL 123 16.326 1.600 -6.044 924 HG23 VAL 123 HG23 VAL 123 15.469 2.636 -4.885 925 H GLU 124 H GLU 124 18.218 -0.186 -1.548 926 HA GLU 124 HA GLU 124 16.112 -1.493 -0.092 927 HB2 GLU 124 HB2 GLU 124 19.098 -1.511 0.497 928 HB3 GLU 124 HB3 GLU 124 17.864 -2.607 1.175 929 HG2 GLU 124 HG2 GLU 124 17.315 -3.411 -1.046 930 HG3 GLU 124 HG3 GLU 124 18.626 -2.459 -1.743 931 H ASN 125 H ASN 125 18.256 1.141 0.911 932 HA ASN 125 HA ASN 125 17.220 1.030 3.580 933 HB2 ASN 125 HB2 ASN 125 19.020 2.269 3.991 934 HB3 ASN 125 HB3 ASN 125 19.345 2.362 2.271 935 HD21 ASN 125 HD22 ASN 125 18.220 4.130 1.045 936 HD22 ASN 125 HD21 ASN 125 18.076 5.672 1.892 937 H LEU 126 H LEU 126 16.118 2.665 0.692 938 HA LEU 126 HA LEU 126 14.223 4.394 2.077 939 HB2 LEU 126 HB2 LEU 126 15.184 5.078 -0.040 940 HB3 LEU 126 HB3 LEU 126 14.675 3.585 -0.827 941 HG LEU 126 HG LEU 126 12.311 4.242 -0.642 942 HD11 LEU 126 HD11 LEU 126 12.402 5.647 1.414 943 HD12 LEU 126 HD12 LEU 126 13.355 6.857 0.528 944 HD13 LEU 126 HD13 LEU 126 11.676 6.509 0.062 945 HD21 LEU 126 HD21 LEU 126 12.402 6.080 -2.269 946 HD22 LEU 126 HD22 LEU 126 14.110 6.374 -1.844 947 HD23 LEU 126 HD23 LEU 126 13.633 4.848 -2.621 948 H ILE 127 H ILE 127 13.858 1.319 0.164 949 HA ILE 127 HA ILE 127 11.011 1.355 0.472 950 HB ILE 127 HB ILE 127 10.992 -0.991 -0.163 951 HG12 ILE 127 HG12 ILE 127 13.996 -0.912 0.220 952 HG13 ILE 127 HG13 ILE 127 12.808 -2.052 0.861 953 HG21 ILE 127 HG21 ILE 127 12.932 0.648 -1.869 954 HG22 ILE 127 HG22 ILE 127 11.794 -0.599 -2.437 955 HG23 ILE 127 HG23 ILE 127 11.179 0.926 -1.795 956 HD11 ILE 127 HD11 ILE 127 14.113 -3.138 -0.829 957 HD12 ILE 127 HD12 ILE 127 12.469 -2.912 -1.463 958 HD13 ILE 127 HD13 ILE 127 13.794 -1.846 -2.002 959 H ALA 128 H ALA 128 13.459 0.077 2.704 960 HA ALA 128 HA ALA 128 11.555 -1.231 4.366 961 HB1 ALA 128 HB1 ALA 128 13.991 -1.665 4.412 962 HB2 ALA 128 HB2 ALA 128 14.282 -0.025 5.044 963 HB3 ALA 128 HB3 ALA 128 13.408 -1.220 6.024 964 H LYS 129 H LYS 129 12.279 2.190 4.027 965 HA LYS 129 HA LYS 129 10.972 2.999 6.553 966 HB2 LYS 129 HB2 LYS 129 11.952 4.625 4.168 967 HB3 LYS 129 HB3 LYS 129 11.294 5.296 5.657 968 HG2 LYS 129 HG2 LYS 129 13.122 4.345 6.970 969 HG3 LYS 129 HG3 LYS 129 13.775 3.535 5.540 970 HD2 LYS 129 HD2 LYS 129 14.071 5.770 4.442 971 HD3 LYS 129 HD3 LYS 129 13.560 6.558 5.937 972 HE2 LYS 129 HE2 LYS 129 15.961 4.682 5.642 973 HE3 LYS 129 HE3 LYS 129 16.055 6.439 5.568 974 HZ1 LYS 129 HZ1 LYS 129 15.214 6.529 7.872 975 HZ2 LYS 129 HZ2 LYS 129 15.169 4.891 7.961 976 HZ3 LYS 129 HZ3 LYS 129 16.592 5.667 7.797 977 H ILE 130 H ILE 130 10.147 2.910 3.093 978 HA ILE 130 HA ILE 130 7.472 4.032 3.752 979 HB ILE 130 HB ILE 130 7.300 4.815 1.471 980 HG12 ILE 130 HG12 ILE 130 9.392 5.022 0.098 981 HG13 ILE 130 HG13 ILE 130 10.157 3.824 1.131 982 HG21 ILE 130 HG21 ILE 130 8.225 6.171 3.361 983 HG22 ILE 130 HG22 ILE 130 9.866 5.733 2.824 984 HG23 ILE 130 HG23 ILE 130 8.789 6.669 1.768 985 HD11 ILE 130 HD11 ILE 130 9.341 2.924 -1.016 986 HD12 ILE 130 HD12 ILE 130 8.602 2.116 0.379 987 HD13 ILE 130 HD13 ILE 130 7.673 3.330 -0.548 988 H SER 131 H SER 131 8.505 0.971 3.311 989 HA SER 131 HA SER 131 6.583 -0.333 1.689 990 HB2 SER 131 HB2 SER 131 7.861 -1.057 4.334 991 HB3 SER 131 HB3 SER 131 6.745 -2.150 3.466 992 HG SER 131 HG SER 131 9.115 -0.979 2.384 Start of MODEL 2 1 H MET 1 H1 MET 1 2.611 0.261 1.835 2 HA MET 1 HA MET 1 3.358 -0.292 -0.259 3 HB2 MET 1 HB2 MET 1 1.370 -1.725 -0.834 4 HB3 MET 1 HB3 MET 1 0.485 -0.259 -1.272 5 HG2 MET 1 HG2 MET 1 2.219 0.246 -2.998 6 HG3 MET 1 HG3 MET 1 3.123 -1.185 -2.489 7 HE1 MET 1 HE1 MET 1 2.043 -2.592 -5.865 8 HE2 MET 1 HE2 MET 1 2.836 -1.082 -5.368 9 HE3 MET 1 HE3 MET 1 3.288 -2.628 -4.604 10 H LYS 2 H LYS 2 4.336 1.441 -1.062 11 HA LYS 2 HA LYS 2 2.782 3.899 -1.811 12 HB2 LYS 2 HB2 LYS 2 5.310 3.712 -0.131 13 HB3 LYS 2 HB3 LYS 2 4.988 5.137 -1.109 14 HG2 LYS 2 HG2 LYS 2 2.780 5.424 -0.019 15 HG3 LYS 2 HG3 LYS 2 3.132 4.045 1.033 16 HD2 LYS 2 HD2 LYS 2 4.985 5.230 2.082 17 HD3 LYS 2 HD3 LYS 2 4.899 6.525 0.888 18 HE2 LYS 2 HE2 LYS 2 3.915 7.362 2.889 19 HE3 LYS 2 HE3 LYS 2 2.627 7.149 1.705 20 HZ1 LYS 2 HZ1 LYS 2 1.983 5.091 2.873 21 HZ2 LYS 2 HZ2 LYS 2 3.227 5.248 3.936 22 HZ3 LYS 2 HZ3 LYS 2 2.005 6.327 3.931 23 H LYS 3 H LYS 3 3.981 5.293 -3.339 24 HA LYS 3 HA LYS 3 5.354 3.590 -5.388 25 HB2 LYS 3 HB2 LYS 3 3.790 6.160 -5.840 26 HB3 LYS 3 HB3 LYS 3 4.606 5.223 -7.070 27 HG2 LYS 3 HG2 LYS 3 2.466 4.500 -7.368 28 HG3 LYS 3 HG3 LYS 3 3.150 3.232 -6.361 29 HD2 LYS 3 HD2 LYS 3 0.869 3.730 -5.672 30 HD3 LYS 3 HD3 LYS 3 1.981 4.148 -4.378 31 HE2 LYS 3 HE2 LYS 3 1.948 6.547 -5.400 32 HE3 LYS 3 HE3 LYS 3 0.537 5.999 -6.310 33 HZ1 LYS 3 HZ1 LYS 3 0.883 6.177 -3.362 34 HZ2 LYS 3 HZ2 LYS 3 -0.189 7.027 -4.263 35 HZ3 LYS 3 HZ3 LYS 3 -0.435 5.424 -4.042 36 H VAL 4 H VAL 4 7.202 4.172 -6.320 37 HA VAL 4 HA VAL 4 8.610 6.601 -5.276 38 HB VAL 4 HB VAL 4 10.049 3.978 -5.637 39 HG11 VAL 4 HG11 VAL 4 11.478 5.946 -5.950 40 HG12 VAL 4 HG12 VAL 4 10.909 6.617 -4.405 41 HG13 VAL 4 HG13 VAL 4 11.858 5.114 -4.455 42 HG21 VAL 4 HG21 VAL 4 8.593 3.666 -3.737 43 HG22 VAL 4 HG22 VAL 4 10.245 3.937 -3.167 44 HG23 VAL 4 HG23 VAL 4 9.047 5.244 -3.071 45 H MET 5 H MET 5 9.848 7.727 -6.719 46 HA MET 5 HA MET 5 10.023 6.717 -9.521 47 HB2 MET 5 HB2 MET 5 8.068 8.053 -9.602 48 HB3 MET 5 HB3 MET 5 8.783 9.304 -8.584 49 HG2 MET 5 HG2 MET 5 8.657 10.075 -10.856 50 HG3 MET 5 HG3 MET 5 10.332 9.936 -10.358 51 HE1 MET 5 HE1 MET 5 7.450 8.279 -12.589 52 HE2 MET 5 HE2 MET 5 8.167 9.793 -13.189 53 HE3 MET 5 HE3 MET 5 8.426 8.292 -14.076 54 H PHE 6 H PHE 6 11.886 7.050 -10.455 55 HA PHE 6 HA PHE 6 14.009 8.588 -8.970 56 HB2 PHE 6 HB2 PHE 6 14.367 6.333 -10.957 57 HB3 PHE 6 HB3 PHE 6 15.579 7.007 -9.873 58 HD1 PHE 6 HD1 PHE 6 15.236 6.685 -7.336 59 HD2 PHE 6 HD2 PHE 6 13.078 4.501 -10.359 60 HE1 PHE 6 HE1 PHE 6 14.543 5.027 -5.620 61 HE2 PHE 6 HE2 PHE 6 12.372 2.842 -8.640 62 HZ PHE 6 HZ PHE 6 13.066 3.138 -6.258 63 H VAL 7 H VAL 7 14.643 10.477 -9.884 64 HA VAL 7 HA VAL 7 14.322 10.843 -12.789 65 HB VAL 7 HB VAL 7 13.813 12.618 -10.618 66 HG11 VAL 7 HG11 VAL 7 15.742 13.799 -12.664 67 HG12 VAL 7 HG12 VAL 7 14.828 14.671 -11.430 68 HG13 VAL 7 HG13 VAL 7 16.087 13.553 -10.928 69 HG21 VAL 7 HG21 VAL 7 12.398 12.192 -12.625 70 HG22 VAL 7 HG22 VAL 7 12.748 13.908 -12.382 71 HG23 VAL 7 HG23 VAL 7 13.617 13.006 -13.648 72 H CYS 8 H CYS 8 15.953 11.250 -14.173 73 HA CYS 8 HA CYS 8 18.790 11.466 -13.218 74 HB2 CYS 8 HB2 CYS 8 18.131 9.155 -13.907 75 HB3 CYS 8 HB3 CYS 8 17.607 9.751 -15.457 76 HG CYS 8 HG CYS 8 20.055 8.313 -15.162 77 H LYS 9 H LYS 9 20.180 12.153 -15.337 78 HA LYS 9 HA LYS 9 19.036 14.657 -16.304 79 HB2 LYS 9 HB2 LYS 9 21.560 13.797 -15.845 80 HB3 LYS 9 HB3 LYS 9 21.557 13.570 -17.580 81 HG2 LYS 9 HG2 LYS 9 20.567 16.217 -16.476 82 HG3 LYS 9 HG3 LYS 9 22.248 15.822 -16.244 83 HD2 LYS 9 HD2 LYS 9 22.181 17.147 -18.149 84 HD3 LYS 9 HD3 LYS 9 22.542 15.516 -18.710 85 HE2 LYS 9 HE2 LYS 9 20.243 15.250 -19.547 86 HE3 LYS 9 HE3 LYS 9 19.746 16.758 -18.766 87 HZ1 LYS 9 HZ1 LYS 9 20.172 17.108 -21.127 88 HZ2 LYS 9 HZ2 LYS 9 21.261 17.962 -20.264 89 HZ3 LYS 9 HZ3 LYS 9 21.722 16.571 -20.997 90 H ARG 10 H ARG 10 19.917 11.692 -18.041 91 HA ARG 10 HA ARG 10 17.769 12.288 -20.061 92 HB2 ARG 10 HB2 ARG 10 19.067 12.045 -21.873 93 HB3 ARG 10 HB3 ARG 10 20.150 12.865 -20.776 94 HG2 ARG 10 HG2 ARG 10 20.200 9.942 -21.603 95 HG3 ARG 10 HG3 ARG 10 21.327 11.193 -22.084 96 HD2 ARG 10 HD2 ARG 10 21.054 10.192 -19.224 97 HD3 ARG 10 HD3 ARG 10 22.134 9.517 -20.462 98 HE ARG 10 HE ARG 10 22.749 12.244 -20.327 99 HH11 ARG 10 HH21 ARG 10 23.076 9.354 -18.294 100 HH12 ARG 10 HH22 ARG 10 24.582 9.935 -17.604 101 HH21 ARG 10 HH11 ARG 10 24.794 12.774 -19.456 102 HH22 ARG 10 HH12 ARG 10 25.573 11.625 -18.382 103 H ASN 11 H ASN 11 18.019 10.384 -17.757 104 HA ASN 11 HA ASN 11 17.758 8.292 -17.049 105 HB2 ASN 11 HB2 ASN 11 15.457 9.208 -18.007 106 HB3 ASN 11 HB3 ASN 11 15.532 7.674 -18.859 107 HD21 ASN 11 HD22 ASN 11 14.390 6.129 -17.537 108 HD22 ASN 11 HD21 ASN 11 14.605 6.119 -15.769 109 H SER 12 H SER 12 19.955 8.129 -18.732 110 HA SER 12 HA SER 12 19.705 5.617 -20.225 111 HB2 SER 12 HB2 SER 12 22.138 5.971 -20.595 112 HB3 SER 12 HB3 SER 12 21.179 7.403 -20.979 113 HG SER 12 HG SER 12 23.195 7.451 -19.435 114 H CYS 13 H CYS 13 21.515 6.623 -17.324 115 HA CYS 13 HA CYS 13 21.458 3.817 -16.258 116 HB2 CYS 13 HB2 CYS 13 23.584 4.570 -17.467 117 HB3 CYS 13 HB3 CYS 13 23.857 5.716 -16.150 118 HG CYS 13 HG CYS 13 25.335 3.447 -15.987 119 H ARG 14 H ARG 14 22.673 4.217 -13.850 120 HA ARG 14 HA ARG 14 22.047 4.491 -11.668 121 HB2 ARG 14 HB2 ARG 14 21.470 7.354 -12.566 122 HB3 ARG 14 HB3 ARG 14 21.448 6.804 -10.887 123 HG2 ARG 14 HG2 ARG 14 23.806 6.089 -11.100 124 HG3 ARG 14 HG3 ARG 14 23.857 6.724 -12.749 125 HD2 ARG 14 HD2 ARG 14 23.321 8.296 -10.187 126 HD3 ARG 14 HD3 ARG 14 24.835 8.307 -11.081 127 HE ARG 14 HE ARG 14 22.396 9.800 -11.687 128 HH11 ARG 14 HH21 ARG 14 25.451 8.791 -13.094 129 HH12 ARG 14 HH22 ARG 14 25.097 9.610 -14.615 130 HH21 ARG 14 HH11 ARG 14 22.202 11.043 -13.414 131 HH22 ARG 14 HH12 ARG 14 23.423 11.045 -14.685 132 H SER 15 H SER 15 19.448 6.600 -12.799 133 HA SER 15 HA SER 15 17.582 5.554 -10.996 134 HB2 SER 15 HB2 SER 15 17.103 7.057 -13.586 135 HB3 SER 15 HB3 SER 15 16.039 7.040 -12.160 136 HG SER 15 HG SER 15 17.400 8.819 -11.931 137 H GLN 16 H GLN 16 18.173 4.496 -14.345 138 HA GLN 16 HA GLN 16 15.856 2.752 -14.509 139 HB2 GLN 16 HB2 GLN 16 18.575 2.651 -15.909 140 HB3 GLN 16 HB3 GLN 16 17.199 1.647 -16.356 141 HG2 GLN 16 HG2 GLN 16 17.056 4.701 -16.403 142 HG3 GLN 16 HG3 GLN 16 17.661 3.750 -17.742 143 HE21 GLN 16 HE22 GLN 16 15.854 4.812 -18.979 144 HE22 GLN 16 HE21 GLN 16 14.269 4.033 -18.861 145 H MET 17 H MET 17 19.153 2.260 -13.179 146 HA MET 17 HA MET 17 18.780 -0.570 -12.500 147 HB2 MET 17 HB2 MET 17 20.704 1.504 -11.335 148 HB3 MET 17 HB3 MET 17 20.730 -0.217 -11.006 149 HG2 MET 17 HG2 MET 17 21.291 -0.692 -13.351 150 HG3 MET 17 HG3 MET 17 21.255 1.037 -13.724 151 HE1 MET 17 HE1 MET 17 25.072 -0.319 -13.621 152 HE2 MET 17 HE2 MET 17 23.623 -1.278 -13.997 153 HE3 MET 17 HE3 MET 17 23.824 0.341 -14.715 154 H ALA 18 H ALA 18 18.147 2.554 -10.864 155 HA ALA 18 HA ALA 18 17.540 1.474 -8.285 156 HB1 ALA 18 HB1 ALA 18 16.537 3.625 -7.851 157 HB2 ALA 18 HB2 ALA 18 17.953 3.917 -8.879 158 HB3 ALA 18 HB3 ALA 18 16.326 3.958 -9.575 159 H GLU 19 H GLU 19 15.405 2.093 -11.120 160 HA GLU 19 HA GLU 19 13.083 0.873 -9.958 161 HB2 GLU 19 HB2 GLU 19 13.315 2.240 -12.151 162 HB3 GLU 19 HB3 GLU 19 13.743 0.701 -12.905 163 HG2 GLU 19 HG2 GLU 19 11.533 -0.159 -11.689 164 HG3 GLU 19 HG3 GLU 19 11.156 1.550 -11.570 165 H GLY 20 H GLY 20 15.764 -0.614 -11.838 166 HA2 GLY 20 HA2 GLY 20 14.899 -3.285 -11.925 167 HA3 GLY 20 HA3 GLY 20 16.580 -2.766 -11.813 168 H PHE 21 H PHE 21 16.865 -1.794 -9.254 169 HA PHE 21 HA PHE 21 16.675 -4.212 -7.641 170 HB2 PHE 21 HB2 PHE 21 17.462 -1.340 -7.001 171 HB3 PHE 21 HB3 PHE 21 17.475 -2.630 -5.796 172 HD1 PHE 21 HD2 PHE 21 18.651 -4.898 -6.593 173 HD2 PHE 21 HD1 PHE 21 19.496 -0.967 -8.156 174 HE1 PHE 21 HE2 PHE 21 20.867 -5.677 -7.333 175 HE2 PHE 21 HE1 PHE 21 21.707 -1.746 -8.918 176 HZ PHE 21 HZ PHE 21 22.403 -4.136 -8.509 177 H ALA 22 H ALA 22 14.848 -1.121 -7.554 178 HA ALA 22 HA ALA 22 13.315 -1.873 -5.275 179 HB1 ALA 22 HB1 ALA 22 11.925 0.033 -5.868 180 HB2 ALA 22 HB2 ALA 22 13.618 0.446 -6.148 181 HB3 ALA 22 HB3 ALA 22 12.605 0.040 -7.530 182 H LYS 23 H LYS 23 12.549 -2.449 -8.756 183 HA LYS 23 HA LYS 23 9.910 -3.491 -8.203 184 HB2 LYS 23 HB2 LYS 23 9.830 -4.086 -10.491 185 HB3 LYS 23 HB3 LYS 23 10.732 -2.574 -10.371 186 HG2 LYS 23 HG2 LYS 23 12.841 -4.110 -10.427 187 HG3 LYS 23 HG3 LYS 23 11.756 -5.347 -11.054 188 HD2 LYS 23 HD2 LYS 23 12.217 -2.577 -12.266 189 HD3 LYS 23 HD3 LYS 23 12.990 -4.065 -12.815 190 HE2 LYS 23 HE2 LYS 23 10.969 -4.996 -13.618 191 HE3 LYS 23 HE3 LYS 23 9.967 -3.776 -12.810 192 HZ1 LYS 23 HZ1 LYS 23 10.294 -3.299 -15.217 193 HZ2 LYS 23 HZ2 LYS 23 10.865 -2.068 -14.285 194 HZ3 LYS 23 HZ3 LYS 23 11.920 -3.105 -14.969 195 H THR 24 H THR 24 13.013 -4.938 -8.138 196 HA THR 24 HA THR 24 12.064 -7.708 -7.815 197 HB THR 24 HB THR 24 14.839 -6.604 -7.328 198 HG1 THR 24 HG1 THR 24 14.551 -6.171 -9.412 199 HG21 THR 24 HG21 THR 24 14.524 -8.906 -6.469 200 HG22 THR 24 HG22 THR 24 13.863 -9.403 -8.045 201 HG23 THR 24 HG23 THR 24 15.560 -8.900 -7.900 202 H LEU 25 H LEU 25 13.799 -5.406 -5.632 203 HA LEU 25 HA LEU 25 13.565 -7.219 -3.346 204 HB2 LEU 25 HB2 LEU 25 14.613 -4.352 -3.513 205 HB3 LEU 25 HB3 LEU 25 14.897 -5.460 -2.185 206 HG LEU 25 HG LEU 25 15.926 -5.823 -5.043 207 HD11 LEU 25 HD11 LEU 25 18.071 -5.241 -4.148 208 HD12 LEU 25 HD12 LEU 25 16.936 -3.965 -3.648 209 HD13 LEU 25 HD13 LEU 25 17.423 -5.228 -2.496 210 HD21 LEU 25 HD21 LEU 25 17.320 -7.631 -4.054 211 HD22 LEU 25 HD22 LEU 25 16.430 -7.463 -2.524 212 HD23 LEU 25 HD23 LEU 25 15.597 -8.022 -3.995 213 H GLY 26 H GLY 26 11.889 -4.339 -4.456 214 HA2 GLY 26 HA2 GLY 26 10.240 -4.104 -2.009 215 HA3 GLY 26 HA3 GLY 26 10.320 -2.987 -3.375 216 H ALA 27 H ALA 27 10.030 -6.229 -4.473 217 HA ALA 27 HA ALA 27 7.625 -5.817 -5.816 218 HB1 ALA 27 HB1 ALA 27 9.212 -7.648 -6.296 219 HB2 ALA 27 HB2 ALA 27 8.769 -8.454 -4.780 220 HB3 ALA 27 HB3 ALA 27 7.572 -8.279 -6.079 221 H GLY 28 H GLY 28 5.665 -5.305 -5.053 222 HA2 GLY 28 HA2 GLY 28 3.603 -5.649 -4.017 223 HA3 GLY 28 HA3 GLY 28 4.291 -6.928 -3.010 224 H LYS 29 H LYS 29 6.539 -4.918 -2.282 225 HA LYS 29 HA LYS 29 5.236 -3.536 -0.010 226 HB2 LYS 29 HB2 LYS 29 8.107 -3.582 -1.070 227 HB3 LYS 29 HB3 LYS 29 7.591 -2.672 0.337 228 HG2 LYS 29 HG2 LYS 29 6.976 -4.677 1.532 229 HG3 LYS 29 HG3 LYS 29 7.191 -5.673 0.092 230 HD2 LYS 29 HD2 LYS 29 9.097 -6.065 1.479 231 HD3 LYS 29 HD3 LYS 29 9.614 -5.166 0.066 232 HE2 LYS 29 HE2 LYS 29 10.779 -4.205 1.890 233 HE3 LYS 29 HE3 LYS 29 9.528 -3.037 1.478 234 HZ1 LYS 29 HZ1 LYS 29 9.603 -3.369 3.892 235 HZ2 LYS 29 HZ2 LYS 29 8.203 -4.015 3.394 236 HZ3 LYS 29 HZ3 LYS 29 9.468 -4.991 3.751 237 H ILE 30 H ILE 30 6.612 -2.725 -3.187 238 HA ILE 30 HA ILE 30 5.215 -0.114 -3.140 239 HB ILE 30 HB ILE 30 7.278 1.055 -3.940 240 HG12 ILE 30 HG12 ILE 30 9.490 0.241 -3.460 241 HG13 ILE 30 HG13 ILE 30 8.879 -1.316 -2.912 242 HG21 ILE 30 HG21 ILE 30 7.680 -0.175 -1.188 243 HG22 ILE 30 HG22 ILE 30 8.296 1.367 -1.811 244 HG23 ILE 30 HG23 ILE 30 6.557 1.160 -1.555 245 HD11 ILE 30 HD11 ILE 30 8.543 -0.322 -5.766 246 HD12 ILE 30 HD12 ILE 30 9.968 -1.201 -5.199 247 HD13 ILE 30 HD13 ILE 30 8.400 -1.997 -5.147 248 H ALA 31 H ALA 31 5.430 1.059 -5.216 249 HA ALA 31 HA ALA 31 5.843 -0.690 -7.602 250 HB1 ALA 31 HB1 ALA 31 4.014 0.579 -8.758 251 HB2 ALA 31 HB2 ALA 31 3.446 -0.463 -7.442 252 HB3 ALA 31 HB3 ALA 31 3.573 1.288 -7.193 253 H VAL 32 H VAL 32 6.985 0.349 -9.354 254 HA VAL 32 HA VAL 32 8.125 3.010 -8.713 255 HB VAL 32 HB VAL 32 10.291 1.792 -9.548 256 HG11 VAL 32 HG11 VAL 32 10.909 1.524 -7.159 257 HG12 VAL 32 HG12 VAL 32 10.090 3.025 -7.535 258 HG13 VAL 32 HG13 VAL 32 9.199 1.714 -6.719 259 HG21 VAL 32 HG21 VAL 32 9.025 -0.547 -8.105 260 HG22 VAL 32 HG22 VAL 32 9.263 -0.452 -9.870 261 HG23 VAL 32 HG23 VAL 32 10.653 -0.425 -8.787 262 H THR 33 H THR 33 9.018 4.194 -10.186 263 HA THR 33 HA THR 33 8.939 3.391 -13.058 264 HB THR 33 HB THR 33 7.909 6.064 -12.044 265 HG1 THR 33 HG1 THR 33 5.831 5.241 -12.472 266 HG21 THR 33 HG21 THR 33 8.613 6.049 -14.440 267 HG22 THR 33 HG22 THR 33 7.576 4.634 -14.726 268 HG23 THR 33 HG23 THR 33 6.864 6.204 -14.289 269 H SER 34 H SER 34 10.522 4.443 -14.354 270 HA SER 34 HA SER 34 12.504 6.167 -12.944 271 HB2 SER 34 HB2 SER 34 13.128 3.788 -13.708 272 HB3 SER 34 HB3 SER 34 13.041 4.432 -15.362 273 HG SER 34 HG SER 34 14.761 5.073 -13.214 274 H CYS 35 H CYS 35 13.310 7.995 -13.992 275 HA CYS 35 HA CYS 35 12.121 8.894 -16.550 276 HB2 CYS 35 HB2 CYS 35 10.418 9.392 -14.834 277 HB3 CYS 35 HB3 CYS 35 11.654 10.017 -13.728 278 HG CYS 35 HG CYS 35 12.342 12.087 -15.282 279 H GLY 36 H GLY 36 13.031 10.805 -17.410 280 HA2 GLY 36 HA2 GLY 36 15.443 11.817 -15.967 281 HA3 GLY 36 HA3 GLY 36 15.476 11.587 -17.713 282 H LEU 37 H LEU 37 15.956 14.180 -16.560 283 HA LEU 37 HA LEU 37 13.507 15.764 -16.808 284 HB2 LEU 37 HB2 LEU 37 16.183 16.858 -17.642 285 HB3 LEU 37 HB3 LEU 37 14.795 17.677 -16.916 286 HG LEU 37 HG LEU 37 16.735 15.776 -15.553 287 HD11 LEU 37 HD11 LEU 37 17.676 17.995 -16.075 288 HD12 LEU 37 HD12 LEU 37 16.314 18.777 -15.235 289 HD13 LEU 37 HD13 LEU 37 17.472 17.778 -14.332 290 HD21 LEU 37 HD21 LEU 37 15.634 16.442 -13.421 291 HD22 LEU 37 HD22 LEU 37 14.423 17.370 -14.336 292 HD23 LEU 37 HD23 LEU 37 14.503 15.597 -14.485 293 H GLU 38 H GLU 38 15.988 14.592 -18.885 294 HA GLU 38 HA GLU 38 14.330 14.967 -21.361 295 HB2 GLU 38 HB2 GLU 38 17.369 14.770 -21.179 296 HB3 GLU 38 HB3 GLU 38 16.404 14.930 -22.655 297 HG2 GLU 38 HG2 GLU 38 15.516 17.128 -21.700 298 HG3 GLU 38 HG3 GLU 38 16.766 16.983 -20.454 299 H SER 39 H SER 39 14.949 13.149 -23.017 300 HA SER 39 HA SER 39 15.552 10.541 -21.701 301 HB2 SER 39 HB2 SER 39 13.487 9.584 -22.763 302 HB3 SER 39 HB3 SER 39 13.245 10.664 -21.378 303 HG SER 39 HG SER 39 12.933 11.401 -24.132 304 H SER 40 H SER 40 16.638 9.161 -22.983 305 HA SER 40 HA SER 40 16.298 9.407 -25.953 306 HB2 SER 40 HB2 SER 40 18.636 8.891 -26.321 307 HB3 SER 40 HB3 SER 40 18.432 10.404 -25.426 308 HG SER 40 HG SER 40 19.123 9.442 -23.577 309 H ARG 41 H ARG 41 18.017 7.117 -23.831 310 HA ARG 41 HA ARG 41 16.122 4.918 -24.253 311 HB2 ARG 41 HB2 ARG 41 17.521 3.480 -25.567 312 HB3 ARG 41 HB3 ARG 41 17.355 4.983 -26.438 313 HG2 ARG 41 HG2 ARG 41 19.823 3.982 -24.956 314 HG3 ARG 41 HG3 ARG 41 19.586 4.151 -26.694 315 HD2 ARG 41 HD2 ARG 41 19.390 6.647 -26.351 316 HD3 ARG 41 HD3 ARG 41 19.851 6.373 -24.652 317 HE ARG 41 HE ARG 41 21.746 5.201 -26.497 318 HH11 ARG 41 HH11 ARG 41 20.887 8.280 -25.001 319 HH12 ARG 41 HH12 ARG 41 22.493 8.918 -25.222 320 HH21 ARG 41 HH21 ARG 41 23.778 6.082 -26.698 321 HH22 ARG 41 HH22 ARG 41 24.087 7.699 -26.137 322 H VAL 42 H VAL 42 16.678 3.008 -22.975 323 HA VAL 42 HA VAL 42 18.283 3.487 -20.599 324 HB VAL 42 HB VAL 42 17.736 0.685 -21.696 325 HG11 VAL 42 HG11 VAL 42 17.772 0.106 -19.299 326 HG12 VAL 42 HG12 VAL 42 19.300 0.826 -19.778 327 HG13 VAL 42 HG13 VAL 42 18.117 1.802 -18.880 328 HG21 VAL 42 HG21 VAL 42 15.771 0.737 -20.130 329 HG22 VAL 42 HG22 VAL 42 15.857 2.524 -20.214 330 HG23 VAL 42 HG23 VAL 42 15.597 1.564 -21.688 331 H HIS 43 H HIS 43 20.488 3.121 -20.215 332 HA HIS 43 HA HIS 43 22.261 2.862 -22.482 333 HB2 HIS 43 HB2 HIS 43 22.767 3.927 -20.182 334 HB3 HIS 43 HB3 HIS 43 23.031 2.294 -19.593 335 HD2 HIS 43 HD2 HIS 43 24.545 5.054 -21.722 336 HE1 HIS 43 HE1 HIS 43 27.338 1.844 -21.885 337 HE2 HIS 43 HE2 HIS 43 26.923 4.304 -22.495 338 HA PRO 44 HA PRO 44 21.461 -1.390 -22.854 339 HB2 PRO 44 HB2 PRO 44 23.284 -2.225 -24.755 340 HB3 PRO 44 HB3 PRO 44 21.915 -1.117 -25.110 341 HG2 PRO 44 HG2 PRO 44 24.791 -0.354 -24.498 342 HG3 PRO 44 HG3 PRO 44 23.777 0.174 -25.879 343 HD2 PRO 44 HD2 PRO 44 24.023 1.684 -23.632 344 HD3 PRO 44 HD3 PRO 44 22.455 1.570 -24.494 345 H THR 45 H THR 45 24.754 -0.354 -21.942 346 HA THR 45 HA THR 45 25.647 -2.929 -20.941 347 HB THR 45 HB THR 45 26.601 -0.131 -20.246 348 HG1 THR 45 HG1 THR 45 28.184 -0.653 -21.849 349 HG21 THR 45 HG21 THR 45 28.758 -1.325 -19.772 350 HG22 THR 45 HG22 THR 45 27.476 -1.684 -18.620 351 HG23 THR 45 HG23 THR 45 27.871 -2.874 -19.879 352 H ALA 46 H ALA 46 23.573 -0.382 -19.574 353 HA ALA 46 HA ALA 46 23.788 -1.202 -16.836 354 HB1 ALA 46 HB1 ALA 46 21.689 -0.007 -16.534 355 HB2 ALA 46 HB2 ALA 46 22.744 0.924 -17.619 356 HB3 ALA 46 HB3 ALA 46 21.383 -0.026 -18.281 357 H ILE 47 H ILE 47 21.753 -2.434 -19.525 358 HA ILE 47 HA ILE 47 20.213 -4.340 -18.022 359 HB ILE 47 HB ILE 47 21.174 -4.345 -20.910 360 HG12 ILE 47 HG12 ILE 47 18.795 -4.059 -21.470 361 HG13 ILE 47 HG13 ILE 47 18.365 -4.046 -19.772 362 HG21 ILE 47 HG21 ILE 47 19.569 -6.217 -21.304 363 HG22 ILE 47 HG22 ILE 47 20.938 -6.691 -20.308 364 HG23 ILE 47 HG23 ILE 47 19.363 -6.375 -19.550 365 HD11 ILE 47 HD11 ILE 47 18.356 -1.809 -20.872 366 HD12 ILE 47 HD12 ILE 47 19.463 -1.862 -19.493 367 HD13 ILE 47 HD13 ILE 47 20.098 -1.950 -21.151 368 H ALA 48 H ALA 48 23.455 -4.590 -19.531 369 HA ALA 48 HA ALA 48 23.851 -7.363 -18.852 370 HB1 ALA 48 HB1 ALA 48 25.080 -6.191 -20.650 371 HB2 ALA 48 HB2 ALA 48 25.915 -5.200 -19.425 372 HB3 ALA 48 HB3 ALA 48 26.167 -6.956 -19.472 373 H MET 49 H MET 49 24.692 -4.342 -17.195 374 HA MET 49 HA MET 49 26.082 -5.571 -14.994 375 HB2 MET 49 HB2 MET 49 24.969 -2.832 -15.612 376 HB3 MET 49 HB3 MET 49 25.609 -3.192 -14.014 377 HG2 MET 49 HG2 MET 49 27.120 -2.148 -15.779 378 HG3 MET 49 HG3 MET 49 27.744 -3.403 -14.691 379 HE1 MET 49 HE1 MET 49 29.387 -5.845 -16.899 380 HE2 MET 49 HE2 MET 49 29.466 -4.813 -15.452 381 HE3 MET 49 HE3 MET 49 28.169 -6.021 -15.622 382 H MET 50 H MET 50 22.628 -4.818 -15.481 383 HA MET 50 HA MET 50 21.975 -5.603 -12.723 384 HB2 MET 50 HB2 MET 50 20.254 -5.220 -15.206 385 HB3 MET 50 HB3 MET 50 19.626 -5.610 -13.607 386 HG2 MET 50 HG2 MET 50 21.102 -3.082 -14.416 387 HG3 MET 50 HG3 MET 50 19.412 -3.238 -13.968 388 HE1 MET 50 HE1 MET 50 20.069 -5.263 -11.170 389 HE2 MET 50 HE2 MET 50 19.629 -3.908 -10.112 390 HE3 MET 50 HE3 MET 50 18.713 -4.179 -11.609 391 H GLU 51 H GLU 51 22.248 -7.284 -15.888 392 HA GLU 51 HA GLU 51 21.210 -9.772 -14.906 393 HB2 GLU 51 HB2 GLU 51 23.083 -9.094 -17.199 394 HB3 GLU 51 HB3 GLU 51 22.628 -10.750 -16.805 395 HG2 GLU 51 HG2 GLU 51 20.227 -10.157 -17.022 396 HG3 GLU 51 HG3 GLU 51 20.677 -8.543 -17.561 397 H GLU 52 H GLU 52 24.381 -8.272 -14.293 398 HA GLU 52 HA GLU 52 25.733 -10.695 -13.479 399 HB2 GLU 52 HB2 GLU 52 26.029 -7.890 -12.362 400 HB3 GLU 52 HB3 GLU 52 27.124 -9.239 -12.079 401 HG2 GLU 52 HG2 GLU 52 27.439 -9.300 -14.648 402 HG3 GLU 52 HG3 GLU 52 26.726 -7.678 -14.630 403 H VAL 53 H VAL 53 23.258 -8.765 -11.907 404 HA VAL 53 HA VAL 53 23.464 -10.384 -9.405 405 HB VAL 53 HB VAL 53 22.123 -8.639 -8.313 406 HG11 VAL 53 HG11 VAL 53 23.894 -6.964 -8.141 407 HG12 VAL 53 HG12 VAL 53 24.585 -8.596 -8.179 408 HG13 VAL 53 HG13 VAL 53 24.652 -7.568 -9.628 409 HG21 VAL 53 HG21 VAL 53 21.000 -7.684 -10.333 410 HG22 VAL 53 HG22 VAL 53 21.787 -6.453 -9.338 411 HG23 VAL 53 HG23 VAL 53 22.558 -6.978 -10.835 412 H GLY 54 H GLY 54 22.088 -10.879 -12.181 413 HA2 GLY 54 HA2 GLY 54 20.373 -12.225 -12.852 414 HA3 GLY 54 HA3 GLY 54 20.020 -12.568 -11.156 415 H ILE 55 H ILE 55 19.867 -9.248 -12.352 416 HA ILE 55 HA ILE 55 16.875 -9.262 -12.151 417 HB ILE 55 HB ILE 55 18.916 -7.109 -11.528 418 HG12 ILE 55 HG12 ILE 55 16.839 -8.550 -9.819 419 HG13 ILE 55 HG13 ILE 55 18.582 -8.792 -9.756 420 HG21 ILE 55 HG21 ILE 55 15.871 -6.849 -11.564 421 HG22 ILE 55 HG22 ILE 55 17.013 -5.628 -10.978 422 HG23 ILE 55 HG23 ILE 55 17.005 -6.030 -12.675 423 HD11 ILE 55 HD11 ILE 55 17.069 -6.315 -8.859 424 HD12 ILE 55 HD12 ILE 55 18.025 -7.442 -7.886 425 HD13 ILE 55 HD13 ILE 55 18.839 -6.378 -9.050 426 H ASP 56 H ASP 56 15.696 -8.235 -13.766 427 HA ASP 56 HA ASP 56 17.221 -7.597 -16.266 428 HB2 ASP 56 HB2 ASP 56 15.944 -9.652 -16.480 429 HB3 ASP 56 HB3 ASP 56 14.470 -8.832 -15.953 430 H ILE 57 H ILE 57 17.091 -5.654 -17.051 431 HA ILE 57 HA ILE 57 14.659 -3.994 -16.568 432 HB ILE 57 HB ILE 57 15.931 -1.961 -16.610 433 HG12 ILE 57 HG12 ILE 57 18.524 -3.529 -16.369 434 HG13 ILE 57 HG13 ILE 57 17.913 -2.922 -17.909 435 HG21 ILE 57 HG21 ILE 57 15.394 -3.090 -14.440 436 HG22 ILE 57 HG22 ILE 57 17.012 -3.803 -14.433 437 HG23 ILE 57 HG23 ILE 57 16.803 -2.037 -14.340 438 HD11 ILE 57 HD11 ILE 57 17.915 -0.614 -17.081 439 HD12 ILE 57 HD12 ILE 57 18.575 -1.167 -15.516 440 HD13 ILE 57 HD13 ILE 57 19.526 -1.352 -16.999 441 H SER 58 H SER 58 15.748 -5.877 -18.862 442 HA SER 58 HA SER 58 16.218 -4.254 -21.152 443 HB2 SER 58 HB2 SER 58 14.853 -6.973 -21.159 444 HB3 SER 58 HB3 SER 58 15.789 -6.219 -22.460 445 HG SER 58 HG SER 58 16.633 -7.268 -19.986 446 H GLY 59 H GLY 59 13.187 -5.182 -19.617 447 HA2 GLY 59 HA2 GLY 59 11.429 -4.312 -21.759 448 HA3 GLY 59 HA3 GLY 59 10.981 -4.718 -20.103 449 H GLN 60 H GLN 60 13.410 -2.351 -19.839 450 HA GLN 60 HA GLN 60 11.382 -0.215 -19.454 451 HB2 GLN 60 HB2 GLN 60 14.224 -0.598 -18.478 452 HB3 GLN 60 HB3 GLN 60 13.462 0.984 -18.471 453 HG2 GLN 60 HG2 GLN 60 11.872 0.438 -16.891 454 HG3 GLN 60 HG3 GLN 60 11.906 -1.286 -17.270 455 HE21 GLN 60 HE21 GLN 60 14.336 1.165 -16.070 456 HE22 GLN 60 HE22 GLN 60 14.941 0.066 -14.823 457 H THR 61 H THR 61 12.008 1.947 -20.092 458 HA THR 61 HA THR 61 13.501 2.355 -22.563 459 HB THR 61 HB THR 61 11.507 3.613 -23.504 460 HG1 THR 61 HG1 THR 61 9.470 3.073 -22.719 461 HG21 THR 61 HG21 THR 61 12.136 1.355 -24.371 462 HG22 THR 61 HG22 THR 61 10.996 0.617 -23.225 463 HG23 THR 61 HG23 THR 61 10.405 1.696 -24.501 464 H SER 62 H SER 62 13.562 4.804 -22.881 465 HA SER 62 HA SER 62 13.541 6.135 -20.201 466 HB2 SER 62 HB2 SER 62 15.100 6.630 -22.695 467 HB3 SER 62 HB3 SER 62 15.103 7.714 -21.261 468 HG SER 62 HG SER 62 16.746 6.158 -20.972 469 H ASP 63 H ASP 63 12.435 7.859 -19.745 470 HA ASP 63 HA ASP 63 10.834 9.287 -21.803 471 HB2 ASP 63 HB2 ASP 63 9.750 7.667 -19.503 472 HB3 ASP 63 HB3 ASP 63 8.866 9.074 -20.078 473 HA PRO 64 HA PRO 64 11.893 12.684 -19.293 474 HB2 PRO 64 HB2 PRO 64 10.693 14.718 -20.558 475 HB3 PRO 64 HB3 PRO 64 11.795 13.605 -21.430 476 HG2 PRO 64 HG2 PRO 64 8.762 13.539 -21.340 477 HG3 PRO 64 HG3 PRO 64 9.831 13.411 -22.771 478 HD2 PRO 64 HD2 PRO 64 8.770 11.226 -21.396 479 HD3 PRO 64 HD3 PRO 64 10.263 11.185 -22.368 480 H ILE 65 H ILE 65 11.389 14.103 -17.642 481 HA ILE 65 HA ILE 65 9.292 13.583 -15.902 482 HB ILE 65 HB ILE 65 11.547 14.635 -15.505 483 HG12 ILE 65 HG12 ILE 65 9.125 15.859 -14.178 484 HG13 ILE 65 HG13 ILE 65 9.995 14.373 -13.744 485 HG21 ILE 65 HG21 ILE 65 11.849 17.041 -15.616 486 HG22 ILE 65 HG22 ILE 65 11.299 16.524 -17.217 487 HG23 ILE 65 HG23 ILE 65 10.164 17.296 -16.079 488 HD11 ILE 65 HD11 ILE 65 10.928 17.231 -13.447 489 HD12 ILE 65 HD12 ILE 65 10.742 15.999 -12.199 490 HD13 ILE 65 HD13 ILE 65 12.054 15.853 -13.382 491 H GLU 66 H GLU 66 9.367 15.951 -18.477 492 HA GLU 66 HA GLU 66 7.018 17.428 -17.890 493 HB2 GLU 66 HB2 GLU 66 8.137 16.651 -20.617 494 HB3 GLU 66 HB3 GLU 66 6.968 17.942 -20.303 495 HG2 GLU 66 HG2 GLU 66 8.681 19.035 -18.799 496 HG3 GLU 66 HG3 GLU 66 9.857 17.838 -19.349 497 H ASN 67 H ASN 67 7.174 14.098 -19.020 498 HA ASN 67 HA ASN 67 4.313 14.144 -19.827 499 HB2 ASN 67 HB2 ASN 67 4.787 12.521 -21.249 500 HB3 ASN 67 HB3 ASN 67 6.481 12.885 -20.975 501 HD21 ASN 67 HD22 ASN 67 7.432 11.619 -18.924 502 HD22 ASN 67 HD21 ASN 67 6.848 9.982 -18.743 503 H PHE 68 H PHE 68 6.044 13.519 -16.977 504 HA PHE 68 HA PHE 68 4.284 11.311 -16.061 505 HB2 PHE 68 HB2 PHE 68 6.980 12.386 -15.231 506 HB3 PHE 68 HB3 PHE 68 6.087 11.293 -14.202 507 HD1 PHE 68 HD1 PHE 68 5.036 9.147 -15.699 508 HD2 PHE 68 HD2 PHE 68 8.667 11.335 -16.417 509 HE1 PHE 68 HE1 PHE 68 6.024 7.150 -16.780 510 HE2 PHE 68 HE2 PHE 68 9.682 9.321 -17.448 511 HZ PHE 68 HZ PHE 68 8.358 7.215 -17.626 512 H ASN 69 H ASN 69 3.974 11.299 -13.577 513 HA ASN 69 HA ASN 69 2.580 13.846 -12.827 514 HB2 ASN 69 HB2 ASN 69 0.722 12.295 -12.036 515 HB3 ASN 69 HB3 ASN 69 0.916 12.531 -13.763 516 HD21 ASN 69 HD22 ASN 69 2.146 10.202 -11.255 517 HD22 ASN 69 HD21 ASN 69 1.780 8.790 -12.236 518 H ALA 70 H ALA 70 4.192 14.478 -11.314 519 HA ALA 70 HA ALA 70 5.356 12.963 -9.324 520 HB1 ALA 70 HB1 ALA 70 5.946 15.294 -9.771 521 HB2 ALA 70 HB2 ALA 70 4.378 15.834 -9.121 522 HB3 ALA 70 HB3 ALA 70 5.565 15.071 -8.050 523 H ASP 71 H ASP 71 2.070 14.271 -9.299 524 HA ASP 71 HA ASP 71 1.431 14.120 -6.565 525 HB2 ASP 71 HB2 ASP 71 0.153 15.265 -8.391 526 HB3 ASP 71 HB3 ASP 71 -0.365 13.682 -8.982 527 H ASP 72 H ASP 72 1.679 11.474 -8.856 528 HA ASP 72 HA ASP 72 0.356 9.611 -6.937 529 HB2 ASP 72 HB2 ASP 72 -0.425 9.752 -9.377 530 HB3 ASP 72 HB3 ASP 72 1.100 8.956 -9.773 531 H TYR 73 H TYR 73 3.356 10.754 -7.220 532 HA TYR 73 HA TYR 73 4.648 8.119 -6.617 533 HB2 TYR 73 HB2 TYR 73 6.115 10.649 -7.324 534 HB3 TYR 73 HB3 TYR 73 6.737 9.006 -7.235 535 HD1 TYR 73 HD2 TYR 73 4.597 7.582 -8.921 536 HD2 TYR 73 HD1 TYR 73 6.730 11.293 -9.467 537 HE1 TYR 73 HE2 TYR 73 4.115 7.505 -11.352 538 HE2 TYR 73 HE1 TYR 73 6.225 11.222 -11.898 539 HH TYR 73 HH TYR 73 4.296 8.581 -13.373 540 H ASP 74 H ASP 74 4.177 7.905 -4.440 541 HA ASP 74 HA ASP 74 3.979 9.997 -2.542 542 HB2 ASP 74 HB2 ASP 74 4.931 7.136 -2.108 543 HB3 ASP 74 HB3 ASP 74 4.344 8.228 -0.855 544 H VAL 75 H VAL 75 6.840 8.280 -3.734 545 HA VAL 75 HA VAL 75 8.555 10.311 -2.362 546 HB VAL 75 HB VAL 75 9.310 7.425 -2.869 547 HG11 VAL 75 HG11 VAL 75 11.246 8.902 -2.963 548 HG12 VAL 75 HG12 VAL 75 10.781 9.675 -1.440 549 HG13 VAL 75 HG13 VAL 75 11.284 7.981 -1.467 550 HG21 VAL 75 HG21 VAL 75 8.389 8.841 -0.342 551 HG22 VAL 75 HG22 VAL 75 7.745 7.352 -1.077 552 HG23 VAL 75 HG23 VAL 75 9.340 7.345 -0.310 553 H VAL 76 H VAL 76 10.032 11.328 -3.592 554 HA VAL 76 HA VAL 76 10.560 10.329 -6.367 555 HB VAL 76 HB VAL 76 9.953 13.149 -5.493 556 HG11 VAL 76 HG11 VAL 76 11.124 12.261 -8.176 557 HG12 VAL 76 HG12 VAL 76 10.549 13.896 -7.747 558 HG13 VAL 76 HG13 VAL 76 11.969 13.251 -6.959 559 HG21 VAL 76 HG21 VAL 76 8.326 13.042 -7.356 560 HG22 VAL 76 HG22 VAL 76 8.841 11.374 -7.712 561 HG23 VAL 76 HG23 VAL 76 8.022 11.757 -6.177 562 H ILE 77 H ILE 77 12.647 10.213 -6.913 563 HA ILE 77 HA ILE 77 14.691 11.321 -5.020 564 HB ILE 77 HB ILE 77 14.996 8.900 -6.798 565 HG12 ILE 77 HG12 ILE 77 13.203 8.269 -5.287 566 HG13 ILE 77 HG13 ILE 77 14.675 7.394 -4.936 567 HG21 ILE 77 HG21 ILE 77 16.861 8.369 -5.311 568 HG22 ILE 77 HG22 ILE 77 17.101 9.947 -6.045 569 HG23 ILE 77 HG23 ILE 77 16.576 9.841 -4.361 570 HD11 ILE 77 HD11 ILE 77 13.755 9.811 -3.321 571 HD12 ILE 77 HD12 ILE 77 13.421 8.116 -2.921 572 HD13 ILE 77 HD13 ILE 77 15.091 8.699 -2.943 573 H SER 78 H SER 78 16.372 12.506 -5.918 574 HA SER 78 HA SER 78 16.494 12.675 -8.923 575 HB2 SER 78 HB2 SER 78 16.086 14.839 -7.845 576 HB3 SER 78 HB3 SER 78 17.621 14.668 -6.955 577 HG SER 78 HG SER 78 17.933 15.828 -8.924 578 H LEU 79 H LEU 79 18.179 11.970 -9.996 579 HA LEU 79 HA LEU 79 20.734 11.270 -8.609 580 HB2 LEU 79 HB2 LEU 79 19.286 9.579 -10.696 581 HB3 LEU 79 HB3 LEU 79 20.787 9.218 -9.870 582 HG LEU 79 HG LEU 79 19.346 9.220 -7.683 583 HD11 LEU 79 HD11 LEU 79 17.082 8.301 -7.977 584 HD12 LEU 79 HD12 LEU 79 17.167 9.956 -8.586 585 HD13 LEU 79 HD13 LEU 79 17.174 8.621 -9.715 586 HD21 LEU 79 HD21 LEU 79 18.854 6.814 -8.035 587 HD22 LEU 79 HD22 LEU 79 19.145 7.038 -9.777 588 HD23 LEU 79 HD23 LEU 79 20.473 7.255 -8.603 589 H CYS 80 H CYS 80 20.572 13.681 -9.777 590 HA CYS 80 HA CYS 80 21.581 13.399 -12.597 591 HB2 CYS 80 HB2 CYS 80 20.216 15.817 -11.404 592 HB3 CYS 80 HB3 CYS 80 20.457 15.413 -13.113 593 HG CYS 80 HG CYS 80 18.354 14.313 -10.838 594 H GLY 81 H GLY 81 22.815 14.290 -9.579 595 HA2 GLY 81 HA2 GLY 81 24.838 15.349 -9.065 596 HA3 GLY 81 HA3 GLY 81 24.977 15.973 -10.707 597 H CYS 82 H CYS 82 25.574 17.811 -9.033 598 HA CYS 82 HA CYS 82 23.565 19.083 -7.497 599 HB2 CYS 82 HB2 CYS 82 26.192 20.156 -8.607 600 HB3 CYS 82 HB3 CYS 82 25.260 20.879 -7.279 601 HG CYS 82 HG CYS 82 27.338 19.621 -6.272 602 H GLY 83 H GLY 83 23.988 19.383 -10.915 603 HA2 GLY 83 HA2 GLY 83 23.158 22.107 -11.294 604 HA3 GLY 83 HA3 GLY 83 23.171 20.815 -12.502 605 H VAL 84 H VAL 84 21.233 19.712 -10.011 606 HA VAL 84 HA VAL 84 18.710 20.652 -11.331 607 HB VAL 84 HB VAL 84 19.449 17.784 -10.628 608 HG11 VAL 84 HG11 VAL 84 17.444 17.183 -11.927 609 HG12 VAL 84 HG12 VAL 84 17.021 18.148 -10.522 610 HG13 VAL 84 HG13 VAL 84 17.052 18.910 -12.140 611 HG21 VAL 84 HG21 VAL 84 20.802 18.399 -12.519 612 HG22 VAL 84 HG22 VAL 84 19.440 17.467 -13.147 613 HG23 VAL 84 HG23 VAL 84 19.436 19.231 -13.306 614 H ASN 85 H ASN 85 17.035 21.092 -10.022 615 HA ASN 85 HA ASN 85 17.056 20.030 -7.222 616 HB2 ASN 85 HB2 ASN 85 17.991 22.453 -7.676 617 HB3 ASN 85 HB3 ASN 85 16.298 22.901 -7.845 618 HD21 ASN 85 HD22 ASN 85 18.562 21.147 -5.656 619 HD22 ASN 85 HD21 ASN 85 17.788 21.704 -4.178 620 H LEU 86 H LEU 86 15.172 20.081 -9.970 621 HA LEU 86 HA LEU 86 12.911 20.033 -10.464 622 HB2 LEU 86 HB2 LEU 86 12.898 18.283 -7.990 623 HB3 LEU 86 HB3 LEU 86 11.729 18.288 -9.320 624 HG LEU 86 HG LEU 86 14.584 17.305 -9.481 625 HD11 LEU 86 HD11 LEU 86 12.660 15.978 -8.285 626 HD12 LEU 86 HD12 LEU 86 11.986 15.809 -9.926 627 HD13 LEU 86 HD13 LEU 86 13.592 15.157 -9.558 628 HD21 LEU 86 HD21 LEU 86 13.712 16.558 -11.774 629 HD22 LEU 86 HD22 LEU 86 12.357 17.681 -11.512 630 HD23 LEU 86 HD23 LEU 86 14.024 18.295 -11.620 631 HA PRO 87 HA PRO 87 11.645 23.431 -7.515 632 HB2 PRO 87 HB2 PRO 87 10.832 24.497 -10.224 633 HB3 PRO 87 HB3 PRO 87 11.390 25.395 -8.779 634 HG2 PRO 87 HG2 PRO 87 13.129 24.885 -10.776 635 HG3 PRO 87 HG3 PRO 87 13.638 24.622 -9.071 636 HD2 PRO 87 HD2 PRO 87 12.697 22.574 -11.098 637 HD3 PRO 87 HD3 PRO 87 14.076 22.504 -9.965 638 HA PRO 88 HA PRO 88 7.146 22.851 -9.025 639 HB2 PRO 88 HB2 PRO 88 7.041 20.298 -10.536 640 HB3 PRO 88 HB3 PRO 88 6.357 21.893 -10.957 641 HG2 PRO 88 HG2 PRO 88 8.511 20.793 -12.230 642 HG3 PRO 88 HG3 PRO 88 8.354 22.569 -11.969 643 HD2 PRO 88 HD2 PRO 88 9.940 20.553 -10.364 644 HD3 PRO 88 HD3 PRO 88 10.396 22.183 -10.942 645 H GLU 89 H GLU 89 5.399 20.633 -8.946 646 HA GLU 89 HA GLU 89 5.434 19.827 -6.225 647 HB2 GLU 89 HB2 GLU 89 3.640 18.233 -6.906 648 HB3 GLU 89 HB3 GLU 89 3.348 19.910 -7.322 649 HG2 GLU 89 HG2 GLU 89 4.619 18.204 -9.448 650 HG3 GLU 89 HG3 GLU 89 2.957 17.826 -9.003 651 H TRP 90 H TRP 90 7.452 18.616 -8.597 652 HA TRP 90 HA TRP 90 7.822 15.863 -7.883 653 HB2 TRP 90 HB2 TRP 90 9.585 17.969 -9.117 654 HB3 TRP 90 HB3 TRP 90 10.104 16.300 -8.829 655 HD1 TRP 90 HD1 TRP 90 7.662 18.323 -10.986 656 HE1 TRP 90 HE1 TRP 90 6.596 16.823 -12.763 657 HE3 TRP 90 HE3 TRP 90 10.049 13.976 -9.861 658 HZ2 TRP 90 HZ2 TRP 90 6.712 14.050 -13.552 659 HZ3 TRP 90 HZ3 TRP 90 9.755 11.985 -11.297 660 HH2 TRP 90 HH2 TRP 90 8.089 11.994 -13.125 661 H VAL 91 H VAL 91 8.585 18.722 -6.048 662 HA VAL 91 HA VAL 91 10.088 17.005 -4.098 663 HB VAL 91 HB VAL 91 11.252 18.952 -3.284 664 HG11 VAL 91 HG11 VAL 91 12.734 19.334 -5.177 665 HG12 VAL 91 HG12 VAL 91 12.326 17.627 -4.968 666 HG13 VAL 91 HG13 VAL 91 11.551 18.561 -6.254 667 HG21 VAL 91 HG21 VAL 91 9.973 20.529 -5.560 668 HG22 VAL 91 HG22 VAL 91 9.592 20.731 -3.839 669 HG23 VAL 91 HG23 VAL 91 11.213 21.104 -4.442 670 H THR 92 H THR 92 7.045 18.112 -4.471 671 HA THR 92 HA THR 92 6.662 18.908 -1.626 672 HB THR 92 HB THR 92 4.475 19.654 -2.236 673 HG1 THR 92 HG1 THR 92 3.615 19.323 -4.188 674 HG21 THR 92 HG21 THR 92 4.991 21.457 -3.785 675 HG22 THR 92 HG22 THR 92 6.363 21.217 -2.696 676 HG23 THR 92 HG23 THR 92 6.444 20.618 -4.367 677 H GLN 93 H GLN 93 6.944 16.045 -3.046 678 HA GLN 93 HA GLN 93 4.541 14.667 -2.142 679 HB2 GLN 93 HB2 GLN 93 7.172 13.546 -3.170 680 HB3 GLN 93 HB3 GLN 93 5.634 12.687 -2.998 681 HG2 GLN 93 HG2 GLN 93 6.306 14.908 -4.950 682 HG3 GLN 93 HG3 GLN 93 5.859 13.263 -5.319 683 HE21 GLN 93 HE22 GLN 93 4.666 16.290 -5.555 684 HE22 GLN 93 HE21 GLN 93 2.956 15.974 -5.269 685 H GLU 94 H GLU 94 5.394 12.342 -0.899 686 HA GLU 94 HA GLU 94 5.405 13.316 1.806 687 HB2 GLU 94 HB2 GLU 94 6.053 10.468 0.951 688 HB3 GLU 94 HB3 GLU 94 5.494 11.010 2.517 689 HG2 GLU 94 HG2 GLU 94 3.876 11.047 -0.061 690 HG3 GLU 94 HG3 GLU 94 3.737 9.891 1.255 691 H ILE 95 H ILE 95 7.966 11.850 -0.180 692 HA ILE 95 HA ILE 95 10.034 13.019 1.590 693 HB ILE 95 HB ILE 95 10.101 10.113 0.686 694 HG12 ILE 95 HG12 ILE 95 9.748 11.269 3.480 695 HG13 ILE 95 HG13 ILE 95 8.568 10.337 2.554 696 HG21 ILE 95 HG21 ILE 95 12.231 9.961 1.948 697 HG22 ILE 95 HG22 ILE 95 12.360 11.119 0.653 698 HG23 ILE 95 HG23 ILE 95 12.136 11.691 2.324 699 HD11 ILE 95 HD11 ILE 95 9.426 8.817 4.106 700 HD12 ILE 95 HD12 ILE 95 10.252 8.409 2.583 701 HD13 ILE 95 HD13 ILE 95 11.104 9.322 3.850 702 H PHE 96 H PHE 96 11.767 13.799 0.488 703 HA PHE 96 HA PHE 96 12.224 12.962 -2.299 704 HB2 PHE 96 HB2 PHE 96 11.144 15.087 -2.588 705 HB3 PHE 96 HB3 PHE 96 12.173 15.839 -1.369 706 HD1 PHE 96 HD1 PHE 96 12.065 14.569 -4.881 707 HD2 PHE 96 HD2 PHE 96 14.498 16.435 -1.834 708 HE1 PHE 96 HE1 PHE 96 13.830 15.032 -6.552 709 HE2 PHE 96 HE2 PHE 96 16.228 16.945 -3.539 710 HZ PHE 96 HZ PHE 96 15.892 16.261 -5.896 711 H GLU 97 H GLU 97 14.303 12.502 -2.767 712 HA GLU 97 HA GLU 97 16.468 13.346 -0.908 713 HB2 GLU 97 HB2 GLU 97 16.053 10.489 -1.885 714 HB3 GLU 97 HB3 GLU 97 17.479 11.114 -1.057 715 HG2 GLU 97 HG2 GLU 97 16.068 11.630 0.939 716 HG3 GLU 97 HG3 GLU 97 14.679 10.906 0.115 717 H ASP 98 H ASP 98 18.579 13.365 -1.898 718 HA ASP 98 HA ASP 98 18.586 12.968 -4.838 719 HB2 ASP 98 HB2 ASP 98 19.765 14.874 -5.284 720 HB3 ASP 98 HB3 ASP 98 18.434 15.361 -4.263 721 H TRP 99 H TRP 99 19.786 11.348 -5.386 722 HA TRP 99 HA TRP 99 22.034 10.436 -3.629 723 HB2 TRP 99 HB2 TRP 99 20.398 8.854 -5.632 724 HB3 TRP 99 HB3 TRP 99 21.638 8.227 -4.569 725 HD1 TRP 99 HD1 TRP 99 20.077 10.081 -2.068 726 HE1 TRP 99 HE1 TRP 99 18.095 8.895 -0.930 727 HE3 TRP 99 HE3 TRP 99 19.190 6.463 -5.579 728 HZ2 TRP 99 HZ2 TRP 99 16.348 6.686 -1.491 729 HZ3 TRP 99 HZ3 TRP 99 17.319 4.860 -5.277 730 HH2 TRP 99 HH2 TRP 99 15.905 4.943 -3.233 731 H GLN 100 H GLN 100 23.581 11.793 -4.461 732 HA GLN 100 HA GLN 100 23.980 11.964 -7.352 733 HB2 GLN 100 HB2 GLN 100 25.623 13.206 -5.135 734 HB3 GLN 100 HB3 GLN 100 25.556 13.709 -6.829 735 HG2 GLN 100 HG2 GLN 100 23.355 13.983 -4.719 736 HG3 GLN 100 HG3 GLN 100 24.345 15.256 -5.385 737 HE21 GLN 100 HE22 GLN 100 21.912 15.979 -5.561 738 HE22 GLN 100 HE21 GLN 100 21.309 15.809 -7.220 739 H LEU 101 H LEU 101 25.186 10.693 -8.518 740 HA LEU 101 HA LEU 101 27.578 9.252 -7.471 741 HB2 LEU 101 HB2 LEU 101 25.150 7.983 -8.798 742 HB3 LEU 101 HB3 LEU 101 26.688 7.172 -8.586 743 HG LEU 101 HG LEU 101 24.872 8.072 -6.315 744 HD11 LEU 101 HD11 LEU 101 25.477 5.316 -7.427 745 HD12 LEU 101 HD12 LEU 101 24.437 5.704 -6.036 746 HD13 LEU 101 HD13 LEU 101 23.961 6.232 -7.656 747 HD21 LEU 101 HD21 LEU 101 26.359 6.675 -4.914 748 HD22 LEU 101 HD22 LEU 101 27.437 6.428 -6.314 749 HD23 LEU 101 HD23 LEU 101 27.239 8.039 -5.600 750 H GLU 102 H GLU 102 28.641 8.046 -9.289 751 HA GLU 102 HA GLU 102 29.557 9.801 -11.293 752 HB2 GLU 102 HB2 GLU 102 29.712 6.782 -10.952 753 HB3 GLU 102 HB3 GLU 102 30.652 7.672 -12.131 754 HG2 GLU 102 HG2 GLU 102 32.041 7.134 -10.286 755 HG3 GLU 102 HG3 GLU 102 31.818 8.882 -10.352 756 H ASP 103 H ASP 103 29.697 9.175 -13.591 757 HA ASP 103 HA ASP 103 27.050 8.397 -14.757 758 HB2 ASP 103 HB2 ASP 103 27.810 10.860 -14.765 759 HB3 ASP 103 HB3 ASP 103 28.946 10.388 -16.016 760 HA PRO 104 HA PRO 104 30.045 5.174 -15.892 761 HB2 PRO 104 HB2 PRO 104 27.515 3.687 -16.442 762 HB3 PRO 104 HB3 PRO 104 29.012 3.143 -15.603 763 HG2 PRO 104 HG2 PRO 104 26.867 3.821 -14.138 764 HG3 PRO 104 HG3 PRO 104 28.485 4.466 -13.679 765 HD2 PRO 104 HD2 PRO 104 26.333 5.824 -15.347 766 HD3 PRO 104 HD3 PRO 104 27.191 6.429 -13.905 767 H ASP 105 H ASP 105 27.719 6.559 -18.086 768 HA ASP 105 HA ASP 105 28.018 4.901 -20.352 769 HB2 ASP 105 HB2 ASP 105 26.282 6.559 -20.259 770 HB3 ASP 105 HB3 ASP 105 27.457 7.866 -20.108 771 H GLY 106 H GLY 106 29.899 4.253 -21.189 772 HA2 GLY 106 HA2 GLY 106 31.752 4.440 -22.591 773 HA3 GLY 106 HA3 GLY 106 31.720 6.201 -22.436 774 H GLN 107 H GLN 107 31.590 4.492 -19.435 775 HA GLN 107 HA GLN 107 34.402 5.237 -18.805 776 HB2 GLN 107 HB2 GLN 107 32.244 4.246 -16.924 777 HB3 GLN 107 HB3 GLN 107 33.815 4.912 -16.483 778 HG2 GLN 107 HG2 GLN 107 31.550 6.424 -17.847 779 HG3 GLN 107 HG3 GLN 107 31.891 6.405 -16.124 780 HE21 GLN 107 HE22 GLN 107 31.676 8.779 -16.949 781 HE22 GLN 107 HE21 GLN 107 33.235 9.579 -17.197 782 H SER 108 H SER 108 33.129 2.664 -16.975 783 HA SER 108 HA SER 108 34.392 0.402 -18.363 784 HB2 SER 108 HB2 SER 108 35.550 1.499 -15.741 785 HB3 SER 108 HB3 SER 108 35.938 -0.080 -16.443 786 HG SER 108 HG SER 108 37.518 1.505 -16.950 787 H LEU 109 H LEU 109 33.967 -1.601 -17.233 788 HA LEU 109 HA LEU 109 31.295 -1.558 -16.173 789 HB2 LEU 109 HB2 LEU 109 33.236 -3.903 -16.201 790 HB3 LEU 109 HB3 LEU 109 31.494 -3.952 -16.036 791 HG LEU 109 HG LEU 109 31.833 -4.611 -18.204 792 HD11 LEU 109 HD11 LEU 109 30.139 -2.806 -18.051 793 HD12 LEU 109 HD12 LEU 109 31.374 -1.634 -18.566 794 HD13 LEU 109 HD13 LEU 109 30.870 -2.940 -19.658 795 HD21 LEU 109 HD21 LEU 109 33.706 -2.348 -18.925 796 HD22 LEU 109 HD22 LEU 109 34.236 -3.979 -18.414 797 HD23 LEU 109 HD23 LEU 109 33.254 -3.767 -19.870 798 H GLU 110 H GLU 110 34.420 -1.709 -14.597 799 HA GLU 110 HA GLU 110 33.478 -2.209 -11.921 800 HB2 GLU 110 HB2 GLU 110 35.835 -2.346 -12.664 801 HB3 GLU 110 HB3 GLU 110 35.882 -0.595 -12.879 802 HG2 GLU 110 HG2 GLU 110 35.506 -0.263 -10.466 803 HG3 GLU 110 HG3 GLU 110 35.290 -2.000 -10.232 804 H VAL 111 H VAL 111 33.566 0.795 -13.841 805 HA VAL 111 HA VAL 111 32.735 2.516 -11.603 806 HB VAL 111 HB VAL 111 32.812 2.944 -14.601 807 HG11 VAL 111 HG11 VAL 111 32.129 4.954 -12.425 808 HG12 VAL 111 HG12 VAL 111 32.543 5.357 -14.109 809 HG13 VAL 111 HG13 VAL 111 31.085 4.431 -13.771 810 HG21 VAL 111 HG21 VAL 111 35.022 2.764 -13.482 811 HG22 VAL 111 HG22 VAL 111 34.721 4.414 -14.051 812 HG23 VAL 111 HG23 VAL 111 34.527 4.024 -12.330 813 H PHE 112 H PHE 112 31.059 0.808 -14.294 814 HA PHE 112 HA PHE 112 28.391 1.626 -13.570 815 HB2 PHE 112 HB2 PHE 112 29.519 -0.839 -14.931 816 HB3 PHE 112 HB3 PHE 112 27.855 -0.782 -14.402 817 HD1 PHE 112 HD2 PHE 112 26.187 0.634 -15.423 818 HD2 PHE 112 HD1 PHE 112 30.250 0.586 -16.868 819 HE1 PHE 112 HE2 PHE 112 25.441 1.666 -17.564 820 HE2 PHE 112 HE1 PHE 112 29.511 1.676 -18.961 821 HZ PHE 112 HZ PHE 112 27.124 2.249 -19.288 822 H ARG 113 H ARG 113 30.320 -1.194 -12.456 823 HA ARG 113 HA ARG 113 28.408 -2.205 -10.560 824 HB2 ARG 113 HB2 ARG 113 31.435 -2.435 -10.806 825 HB3 ARG 113 HB3 ARG 113 30.510 -3.320 -9.589 826 HG2 ARG 113 HG2 ARG 113 29.320 -4.583 -11.206 827 HG3 ARG 113 HG3 ARG 113 29.762 -3.518 -12.536 828 HD2 ARG 113 HD2 ARG 113 31.007 -5.593 -12.706 829 HD3 ARG 113 HD3 ARG 113 32.097 -4.256 -12.398 830 HE ARG 113 HE ARG 113 32.570 -5.064 -10.244 831 HH11 ARG 113 HH11 ARG 113 30.172 -7.195 -11.728 832 HH12 ARG 113 HH12 ARG 113 30.579 -8.500 -10.635 833 HH21 ARG 113 HH21 ARG 113 32.949 -6.752 -8.874 834 HH22 ARG 113 HH22 ARG 113 32.065 -8.234 -9.037 835 H THR 114 H THR 114 31.034 0.145 -10.130 836 HA THR 114 HA THR 114 30.741 0.623 -7.323 837 HB THR 114 HB THR 114 31.663 2.447 -9.572 838 HG1 THR 114 HG1 THR 114 32.999 0.721 -9.305 839 HG21 THR 114 HG21 THR 114 31.113 3.907 -7.735 840 HG22 THR 114 HG22 THR 114 31.895 2.816 -6.564 841 HG23 THR 114 HG23 THR 114 32.870 3.696 -7.768 842 H VAL 115 H VAL 115 29.091 2.201 -10.099 843 HA VAL 115 HA VAL 115 27.342 3.824 -8.446 844 HB VAL 115 HB VAL 115 27.275 2.917 -11.347 845 HG11 VAL 115 HG11 VAL 115 25.460 4.558 -11.717 846 HG12 VAL 115 HG12 VAL 115 24.908 3.188 -10.759 847 HG13 VAL 115 HG13 VAL 115 25.272 4.737 -9.945 848 HG21 VAL 115 HG21 VAL 115 27.747 5.567 -9.914 849 HG22 VAL 115 HG22 VAL 115 28.953 4.586 -10.768 850 HG23 VAL 115 HG23 VAL 115 27.653 5.387 -11.669 851 H ARG 116 H ARG 116 26.762 0.701 -10.101 852 HA ARG 116 HA ARG 116 24.097 0.298 -9.419 853 HB2 ARG 116 HB2 ARG 116 25.538 -1.045 -11.008 854 HB3 ARG 116 HB3 ARG 116 26.279 -1.834 -9.613 855 HG2 ARG 116 HG2 ARG 116 23.908 -2.577 -8.955 856 HG3 ARG 116 HG3 ARG 116 23.386 -1.979 -10.537 857 HD2 ARG 116 HD2 ARG 116 23.735 -4.359 -10.708 858 HD3 ARG 116 HD3 ARG 116 25.028 -3.533 -11.591 859 HE ARG 116 HE ARG 116 25.558 -4.292 -8.746 860 HH11 ARG 116 HH11 ARG 116 25.880 -5.457 -11.999 861 HH12 ARG 116 HH12 ARG 116 27.483 -6.114 -11.755 862 HH21 ARG 116 HH21 ARG 116 27.449 -5.436 -8.351 863 HH22 ARG 116 HH22 ARG 116 28.178 -6.337 -9.642 864 H GLY 117 H GLY 117 26.899 -0.726 -7.426 865 HA2 GLY 117 HA2 GLY 117 25.423 -2.043 -5.369 866 HA3 GLY 117 HA3 GLY 117 27.032 -1.335 -5.194 867 H GLN 118 H GLN 118 26.323 1.414 -5.688 868 HA GLN 118 HA GLN 118 25.237 2.123 -3.058 869 HB2 GLN 118 HB2 GLN 118 26.158 3.822 -5.413 870 HB3 GLN 118 HB3 GLN 118 25.643 4.462 -3.841 871 HG2 GLN 118 HG2 GLN 118 27.449 3.252 -2.699 872 HG3 GLN 118 HG3 GLN 118 27.938 2.471 -4.204 873 HE21 GLN 118 HE22 GLN 118 29.027 3.710 -5.848 874 HE22 GLN 118 HE21 GLN 118 29.730 5.283 -5.448 875 H VAL 119 H VAL 119 24.046 2.533 -6.458 876 HA VAL 119 HA VAL 119 21.502 3.623 -5.788 877 HB VAL 119 HB VAL 119 22.189 1.721 -8.078 878 HG11 VAL 119 HG11 VAL 119 19.788 1.764 -7.826 879 HG12 VAL 119 HG12 VAL 119 19.799 3.541 -7.620 880 HG13 VAL 119 HG13 VAL 119 20.216 2.800 -9.187 881 HG21 VAL 119 HG21 VAL 119 23.501 3.839 -8.124 882 HG22 VAL 119 HG22 VAL 119 22.332 3.765 -9.432 883 HG23 VAL 119 HG23 VAL 119 21.985 4.766 -7.996 884 H LYS 120 H LYS 120 22.444 0.147 -5.941 885 HA LYS 120 HA LYS 120 19.943 -0.989 -5.211 886 HB2 LYS 120 HB2 LYS 120 21.960 -2.277 -5.953 887 HB3 LYS 120 HB3 LYS 120 22.764 -1.911 -4.428 888 HG2 LYS 120 HG2 LYS 120 20.924 -3.078 -3.200 889 HG3 LYS 120 HG3 LYS 120 20.170 -3.478 -4.734 890 HD2 LYS 120 HD2 LYS 120 22.318 -4.731 -5.345 891 HD3 LYS 120 HD3 LYS 120 22.897 -4.376 -3.704 892 HE2 LYS 120 HE2 LYS 120 20.735 -5.428 -2.829 893 HE3 LYS 120 HE3 LYS 120 20.401 -5.955 -4.488 894 HZ1 LYS 120 HZ1 LYS 120 21.522 -7.715 -3.200 895 HZ2 LYS 120 HZ2 LYS 120 22.512 -7.247 -4.414 896 HZ3 LYS 120 HZ3 LYS 120 22.792 -6.748 -2.877 897 H GLU 121 H GLU 121 22.655 -0.110 -2.972 898 HA GLU 121 HA GLU 121 21.076 -0.750 -0.662 899 HB2 GLU 121 HB2 GLU 121 22.915 -0.427 0.532 900 HB3 GLU 121 HB3 GLU 121 23.715 -0.400 -1.019 901 HG2 GLU 121 HG2 GLU 121 24.670 1.411 0.015 902 HG3 GLU 121 HG3 GLU 121 23.389 2.205 -0.888 903 H ARG 122 H ARG 122 21.437 2.384 -2.336 904 HA ARG 122 HA ARG 122 19.973 3.837 -0.348 905 HB2 ARG 122 HB2 ARG 122 20.181 4.242 -3.369 906 HB3 ARG 122 HB3 ARG 122 19.444 5.386 -2.262 907 HG2 ARG 122 HG2 ARG 122 22.367 4.596 -1.989 908 HG3 ARG 122 HG3 ARG 122 21.810 5.874 -3.060 909 HD2 ARG 122 HD2 ARG 122 22.509 6.957 -1.122 910 HD3 ARG 122 HD3 ARG 122 20.739 6.997 -1.067 911 HE ARG 122 HE ARG 122 21.976 4.711 0.355 912 HH11 ARG 122 HH11 ARG 122 20.988 8.059 0.901 913 HH12 ARG 122 HH12 ARG 122 21.002 7.829 2.627 914 HH21 ARG 122 HH21 ARG 122 21.945 4.492 2.358 915 HH22 ARG 122 HH22 ARG 122 21.541 5.796 3.489 916 H VAL 123 H VAL 123 18.740 2.095 -3.252 917 HA VAL 123 HA VAL 123 15.981 2.487 -2.587 918 HB VAL 123 HB VAL 123 17.455 0.364 -4.198 919 HG11 VAL 123 HG11 VAL 123 15.492 -0.795 -3.301 920 HG12 VAL 123 HG12 VAL 123 14.446 0.545 -3.846 921 HG13 VAL 123 HG13 VAL 123 15.353 -0.470 -5.016 922 HG21 VAL 123 HG21 VAL 123 16.300 1.455 -6.078 923 HG22 VAL 123 HG22 VAL 123 15.563 2.616 -4.956 924 HG23 VAL 123 HG23 VAL 123 17.333 2.580 -5.187 925 H GLU 124 H GLU 124 18.093 -0.315 -1.592 926 HA GLU 124 HA GLU 124 15.978 -1.565 -0.099 927 HB2 GLU 124 HB2 GLU 124 18.963 -1.657 0.434 928 HB3 GLU 124 HB3 GLU 124 17.715 -2.717 1.138 929 HG2 GLU 124 HG2 GLU 124 17.108 -3.524 -1.076 930 HG3 GLU 124 HG3 GLU 124 18.428 -2.600 -1.794 931 H ASN 125 H ASN 125 18.197 1.008 0.858 932 HA ASN 125 HA ASN 125 17.221 0.958 3.539 933 HB2 ASN 125 HB2 ASN 125 19.100 2.130 3.876 934 HB3 ASN 125 HB3 ASN 125 19.367 2.218 2.149 935 HD21 ASN 125 HD22 ASN 125 18.278 3.996 0.954 936 HD22 ASN 125 HD21 ASN 125 18.216 5.553 1.785 937 H LEU 126 H LEU 126 16.029 2.492 0.670 938 HA LEU 126 HA LEU 126 14.182 4.285 2.080 939 HB2 LEU 126 HB2 LEU 126 15.102 4.980 -0.045 940 HB3 LEU 126 HB3 LEU 126 14.612 3.480 -0.820 941 HG LEU 126 HG LEU 126 12.237 4.087 -0.600 942 HD11 LEU 126 HD11 LEU 126 12.356 5.543 1.444 943 HD12 LEU 126 HD12 LEU 126 13.266 6.744 0.499 944 HD13 LEU 126 HD13 LEU 126 11.579 6.363 0.091 945 HD21 LEU 126 HD21 LEU 126 13.979 6.217 -1.861 946 HD22 LEU 126 HD22 LEU 126 13.458 4.688 -2.612 947 HD23 LEU 126 HD23 LEU 126 12.254 5.934 -2.222 948 H ILE 127 H ILE 127 13.799 1.194 0.203 949 HA ILE 127 HA ILE 127 10.944 1.218 0.613 950 HB ILE 127 HB ILE 127 10.923 -1.105 -0.089 951 HG12 ILE 127 HG12 ILE 127 13.928 -0.994 0.201 952 HG13 ILE 127 HG13 ILE 127 12.771 -2.148 0.878 953 HG21 ILE 127 HG21 ILE 127 12.806 0.557 -1.849 954 HG22 ILE 127 HG22 ILE 127 11.637 -0.672 -2.381 955 HG23 ILE 127 HG23 ILE 127 11.058 0.850 -1.695 956 HD11 ILE 127 HD11 ILE 127 14.044 -3.215 -0.859 957 HD12 ILE 127 HD12 ILE 127 12.368 -3.018 -1.420 958 HD13 ILE 127 HD13 ILE 127 13.653 -1.934 -2.021 959 H ALA 128 H ALA 128 13.483 0.087 2.765 960 HA ALA 128 HA ALA 128 11.656 -1.349 4.436 961 HB1 ALA 128 HB1 ALA 128 14.366 -0.070 5.067 962 HB2 ALA 128 HB2 ALA 128 13.541 -1.291 6.064 963 HB3 ALA 128 HB3 ALA 128 14.109 -1.711 4.438 964 H LYS 129 H LYS 129 12.220 2.070 4.024 965 HA LYS 129 HA LYS 129 10.994 2.861 6.607 966 HB2 LYS 129 HB2 LYS 129 11.965 4.511 4.232 967 HB3 LYS 129 HB3 LYS 129 11.341 5.163 5.746 968 HG2 LYS 129 HG2 LYS 129 13.186 4.175 7.006 969 HG3 LYS 129 HG3 LYS 129 13.817 3.396 5.544 970 HD2 LYS 129 HD2 LYS 129 14.054 5.659 4.478 971 HD3 LYS 129 HD3 LYS 129 13.573 6.411 5.998 972 HE2 LYS 129 HE2 LYS 129 16.001 4.595 5.584 973 HE3 LYS 129 HE3 LYS 129 16.051 6.354 5.561 974 HZ1 LYS 129 HZ1 LYS 129 15.295 4.707 7.933 975 HZ2 LYS 129 HZ2 LYS 129 16.684 5.544 7.740 976 HZ3 LYS 129 HZ3 LYS 129 15.275 6.345 7.896 977 H ILE 130 H ILE 130 10.154 2.960 3.132 978 HA ILE 130 HA ILE 130 7.517 4.086 3.889 979 HB ILE 130 HB ILE 130 7.315 4.890 1.567 980 HG12 ILE 130 HG12 ILE 130 9.329 5.205 0.226 981 HG13 ILE 130 HG13 ILE 130 10.261 4.197 1.310 982 HG21 ILE 130 HG21 ILE 130 8.035 6.266 3.496 983 HG22 ILE 130 HG22 ILE 130 9.735 5.907 3.099 984 HG23 ILE 130 HG23 ILE 130 8.701 6.803 1.959 985 HD11 ILE 130 HD11 ILE 130 8.910 2.230 0.650 986 HD12 ILE 130 HD12 ILE 130 7.892 3.285 -0.370 987 HD13 ILE 130 HD13 ILE 130 9.610 3.043 -0.762 988 H SER 131 H SER 131 8.363 0.957 3.293 989 HA SER 131 HA SER 131 6.233 0.144 1.563 990 HB2 SER 131 HB2 SER 131 6.532 -2.077 2.519 991 HB3 SER 131 HB3 SER 131 8.066 -1.318 2.046 992 HG SER 131 HG SER 131 7.103 -1.106 4.705 Start of MODEL 3 1 H MET 1 H1 MET 1 2.427 0.350 1.896 2 HA MET 1 HA MET 1 3.185 -0.209 -0.203 3 HB2 MET 1 HB2 MET 1 1.240 -1.621 -0.838 4 HB3 MET 1 HB3 MET 1 0.287 -0.170 -1.173 5 HG2 MET 1 HG2 MET 1 1.902 0.465 -2.959 6 HG3 MET 1 HG3 MET 1 2.906 -0.919 -2.537 7 HE1 MET 1 HE1 MET 1 1.892 -2.509 -5.782 8 HE2 MET 1 HE2 MET 1 2.687 -0.992 -5.317 9 HE3 MET 1 HE3 MET 1 3.086 -2.508 -4.469 10 H LYS 2 H LYS 2 4.239 1.516 -0.922 11 HA LYS 2 HA LYS 2 2.739 3.979 -1.753 12 HB2 LYS 2 HB2 LYS 2 5.229 3.811 -0.014 13 HB3 LYS 2 HB3 LYS 2 4.810 5.261 -0.913 14 HG2 LYS 2 HG2 LYS 2 2.563 5.287 0.160 15 HG3 LYS 2 HG3 LYS 2 3.032 3.914 1.163 16 HD2 LYS 2 HD2 LYS 2 4.681 5.173 2.335 17 HD3 LYS 2 HD3 LYS 2 4.589 6.541 1.218 18 HE2 LYS 2 HE2 LYS 2 2.114 5.580 2.702 19 HE3 LYS 2 HE3 LYS 2 3.297 6.583 3.543 20 HZ1 LYS 2 HZ1 LYS 2 1.455 7.844 2.407 21 HZ2 LYS 2 HZ2 LYS 2 2.974 8.343 2.067 22 HZ3 LYS 2 HZ3 LYS 2 2.139 7.479 0.942 23 H LYS 3 H LYS 3 4.044 5.382 -3.199 24 HA LYS 3 HA LYS 3 5.420 3.650 -5.223 25 HB2 LYS 3 HB2 LYS 3 3.827 6.189 -5.759 26 HB3 LYS 3 HB3 LYS 3 4.631 5.197 -6.948 27 HG2 LYS 3 HG2 LYS 3 2.508 4.407 -7.192 28 HG3 LYS 3 HG3 LYS 3 3.187 3.226 -6.085 29 HD2 LYS 3 HD2 LYS 3 0.908 3.777 -5.427 30 HD3 LYS 3 HD3 LYS 3 2.012 4.339 -4.181 31 HE2 LYS 3 HE2 LYS 3 1.970 6.567 -5.657 32 HE3 LYS 3 HE3 LYS 3 0.436 5.914 -6.227 33 HZ1 LYS 3 HZ1 LYS 3 1.201 6.535 -3.412 34 HZ2 LYS 3 HZ2 LYS 3 0.127 7.366 -4.319 35 HZ3 LYS 3 HZ3 LYS 3 -0.253 5.843 -3.826 36 H VAL 4 H VAL 4 7.260 4.243 -6.170 37 HA VAL 4 HA VAL 4 8.612 6.734 -5.200 38 HB VAL 4 HB VAL 4 10.114 4.137 -5.559 39 HG11 VAL 4 HG11 VAL 4 10.925 6.810 -4.368 40 HG12 VAL 4 HG12 VAL 4 11.906 5.333 -4.377 41 HG13 VAL 4 HG13 VAL 4 11.502 6.121 -5.897 42 HG21 VAL 4 HG21 VAL 4 8.698 3.792 -3.635 43 HG22 VAL 4 HG22 VAL 4 10.345 4.111 -3.087 44 HG23 VAL 4 HG23 VAL 4 9.113 5.390 -2.980 45 H MET 5 H MET 5 9.727 7.903 -6.701 46 HA MET 5 HA MET 5 9.877 6.828 -9.484 47 HB2 MET 5 HB2 MET 5 7.924 8.153 -9.535 48 HB3 MET 5 HB3 MET 5 8.659 9.428 -8.558 49 HG2 MET 5 HG2 MET 5 8.481 10.148 -10.851 50 HG3 MET 5 HG3 MET 5 10.164 10.026 -10.387 51 HE1 MET 5 HE1 MET 5 8.247 8.345 -14.058 52 HE2 MET 5 HE2 MET 5 7.262 8.435 -12.579 53 HE3 MET 5 HE3 MET 5 8.068 9.885 -13.223 54 H PHE 6 H PHE 6 11.667 7.181 -10.509 55 HA PHE 6 HA PHE 6 13.862 8.683 -9.113 56 HB2 PHE 6 HB2 PHE 6 14.125 6.388 -11.075 57 HB3 PHE 6 HB3 PHE 6 15.377 7.063 -10.050 58 HD1 PHE 6 HD2 PHE 6 15.186 6.753 -7.495 59 HD2 PHE 6 HD1 PHE 6 12.764 4.599 -10.339 60 HE1 PHE 6 HE2 PHE 6 14.530 5.149 -5.719 61 HE2 PHE 6 HE1 PHE 6 12.140 2.994 -8.572 62 HZ PHE 6 HZ PHE 6 12.938 3.318 -6.231 63 H VAL 7 H VAL 7 14.539 10.525 -10.025 64 HA VAL 7 HA VAL 7 14.308 10.990 -12.955 65 HB VAL 7 HB VAL 7 14.182 12.745 -10.563 66 HG11 VAL 7 HG11 VAL 7 15.634 13.834 -13.022 67 HG12 VAL 7 HG12 VAL 7 15.056 14.755 -11.625 68 HG13 VAL 7 HG13 VAL 7 16.362 13.611 -11.404 69 HG21 VAL 7 HG21 VAL 7 12.803 14.081 -12.070 70 HG22 VAL 7 HG22 VAL 7 13.277 13.081 -13.460 71 HG23 VAL 7 HG23 VAL 7 12.314 12.398 -12.100 72 H CYS 8 H CYS 8 16.039 11.466 -14.253 73 HA CYS 8 HA CYS 8 18.749 11.868 -13.174 74 HB2 CYS 8 HB2 CYS 8 18.519 9.433 -13.451 75 HB3 CYS 8 HB3 CYS 8 18.022 9.622 -15.143 76 HG CYS 8 HG CYS 8 20.484 8.639 -14.961 77 H LYS 9 H LYS 9 20.086 12.201 -15.652 78 HA LYS 9 HA LYS 9 18.766 14.571 -16.762 79 HB2 LYS 9 HB2 LYS 9 21.219 13.059 -17.736 80 HB3 LYS 9 HB3 LYS 9 20.580 14.554 -18.449 81 HG2 LYS 9 HG2 LYS 9 20.752 15.632 -16.148 82 HG3 LYS 9 HG3 LYS 9 21.631 14.205 -15.607 83 HD2 LYS 9 HD2 LYS 9 22.455 16.103 -17.847 84 HD3 LYS 9 HD3 LYS 9 23.120 16.068 -16.213 85 HE2 LYS 9 HE2 LYS 9 23.965 13.752 -16.594 86 HE3 LYS 9 HE3 LYS 9 23.339 13.802 -18.254 87 HZ1 LYS 9 HZ1 LYS 9 25.427 15.639 -17.163 88 HZ2 LYS 9 HZ2 LYS 9 25.708 14.392 -18.179 89 HZ3 LYS 9 HZ3 LYS 9 24.851 15.680 -18.695 90 H ARG 10 H ARG 10 19.538 11.617 -18.549 91 HA ARG 10 HA ARG 10 17.062 12.085 -20.195 92 HB2 ARG 10 HB2 ARG 10 18.249 11.344 -22.149 93 HB3 ARG 10 HB3 ARG 10 19.136 12.611 -21.322 94 HG2 ARG 10 HG2 ARG 10 20.351 10.516 -20.151 95 HG3 ARG 10 HG3 ARG 10 19.843 9.711 -21.638 96 HD2 ARG 10 HD2 ARG 10 21.380 12.345 -21.535 97 HD3 ARG 10 HD3 ARG 10 22.142 10.754 -21.569 98 HE ARG 10 HE ARG 10 21.338 10.318 -23.754 99 HH11 ARG 10 HH21 ARG 10 20.585 13.744 -22.996 100 HH12 ARG 10 HH22 ARG 10 20.816 14.162 -24.660 101 HH21 ARG 10 HH11 ARG 10 21.376 10.994 -25.809 102 HH22 ARG 10 HH12 ARG 10 21.166 12.672 -26.202 103 H ASN 11 H ASN 11 17.429 10.341 -17.813 104 HA ASN 11 HA ASN 11 16.889 8.298 -16.984 105 HB2 ASN 11 HB2 ASN 11 14.768 9.240 -17.941 106 HB3 ASN 11 HB3 ASN 11 14.992 8.248 -19.351 107 HD21 ASN 11 HD22 ASN 11 15.581 7.015 -15.915 108 HD22 ASN 11 HD21 ASN 11 14.224 5.911 -16.094 109 H SER 12 H SER 12 19.207 8.287 -18.719 110 HA SER 12 HA SER 12 19.177 5.847 -20.296 111 HB2 SER 12 HB2 SER 12 21.645 6.478 -20.541 112 HB3 SER 12 HB3 SER 12 20.449 7.637 -21.148 113 HG SER 12 HG SER 12 22.182 8.520 -19.707 114 H CYS 13 H CYS 13 20.745 6.930 -17.288 115 HA CYS 13 HA CYS 13 21.163 4.099 -16.414 116 HB2 CYS 13 HB2 CYS 13 23.171 5.093 -17.657 117 HB3 CYS 13 HB3 CYS 13 23.346 6.251 -16.336 118 HG CYS 13 HG CYS 13 25.116 4.255 -16.166 119 H ARG 14 H ARG 14 22.185 4.296 -14.045 120 HA ARG 14 HA ARG 14 21.604 4.467 -11.842 121 HB2 ARG 14 HB2 ARG 14 21.260 7.422 -12.532 122 HB3 ARG 14 HB3 ARG 14 21.431 6.742 -10.899 123 HG2 ARG 14 HG2 ARG 14 23.630 5.756 -11.641 124 HG3 ARG 14 HG3 ARG 14 23.506 6.698 -13.131 125 HD2 ARG 14 HD2 ARG 14 23.536 7.854 -10.312 126 HD3 ARG 14 HD3 ARG 14 24.940 7.746 -11.378 127 HE ARG 14 HE ARG 14 22.473 9.423 -11.892 128 HH11 ARG 14 HH11 ARG 14 25.990 9.186 -12.193 129 HH12 ARG 14 HH12 ARG 14 26.054 10.712 -13.022 130 HH21 ARG 14 HH22 ARG 14 22.663 11.237 -13.005 131 HH22 ARG 14 HH21 ARG 14 24.217 11.817 -13.557 132 H SER 15 H SER 15 19.197 6.750 -13.080 133 HA SER 15 HA SER 15 17.039 6.068 -11.409 134 HB2 SER 15 HB2 SER 15 15.624 7.083 -13.197 135 HB3 SER 15 HB3 SER 15 17.056 8.027 -12.875 136 HG SER 15 HG SER 15 18.034 7.107 -14.805 137 H GLN 16 H GLN 16 17.885 4.555 -14.508 138 HA GLN 16 HA GLN 16 15.673 2.680 -14.544 139 HB2 GLN 16 HB2 GLN 16 18.406 2.596 -15.902 140 HB3 GLN 16 HB3 GLN 16 17.070 1.524 -16.301 141 HG2 GLN 16 HG2 GLN 16 16.819 4.569 -16.515 142 HG3 GLN 16 HG3 GLN 16 17.473 3.580 -17.798 143 HE21 GLN 16 HE22 GLN 16 15.546 4.805 -18.795 144 HE22 GLN 16 HE21 GLN 16 14.022 3.912 -18.821 145 H MET 17 H MET 17 19.026 2.413 -13.207 146 HA MET 17 HA MET 17 18.767 -0.385 -12.428 147 HB2 MET 17 HB2 MET 17 20.577 1.843 -11.365 148 HB3 MET 17 HB3 MET 17 20.667 0.156 -10.871 149 HG2 MET 17 HG2 MET 17 21.261 -0.526 -13.164 150 HG3 MET 17 HG3 MET 17 21.199 1.164 -13.687 151 HE1 MET 17 HE1 MET 17 23.617 -1.066 -13.804 152 HE2 MET 17 HE2 MET 17 23.804 0.533 -14.577 153 HE3 MET 17 HE3 MET 17 25.043 -0.061 -13.441 154 H ALA 18 H ALA 18 17.996 2.717 -10.819 155 HA ALA 18 HA ALA 18 17.352 1.605 -8.261 156 HB1 ALA 18 HB1 ALA 18 16.288 3.748 -7.866 157 HB2 ALA 18 HB2 ALA 18 17.770 4.026 -8.799 158 HB3 ALA 18 HB3 ALA 18 16.189 4.083 -9.607 159 H GLU 19 H GLU 19 15.252 2.219 -11.125 160 HA GLU 19 HA GLU 19 12.883 0.989 -10.049 161 HB2 GLU 19 HB2 GLU 19 13.007 2.448 -12.029 162 HB3 GLU 19 HB3 GLU 19 13.843 1.204 -12.942 163 HG2 GLU 19 HG2 GLU 19 11.073 0.865 -11.702 164 HG3 GLU 19 HG3 GLU 19 11.330 1.527 -13.309 165 H GLY 20 H GLY 20 15.607 -0.379 -11.911 166 HA2 GLY 20 HA2 GLY 20 15.105 -3.070 -12.047 167 HA3 GLY 20 HA3 GLY 20 16.685 -2.375 -11.697 168 H PHE 21 H PHE 21 16.936 -1.708 -9.200 169 HA PHE 21 HA PHE 21 16.643 -4.176 -7.736 170 HB2 PHE 21 HB2 PHE 21 17.432 -1.367 -6.857 171 HB3 PHE 21 HB3 PHE 21 17.409 -2.740 -5.748 172 HD1 PHE 21 HD1 PHE 21 18.595 -4.923 -6.515 173 HD2 PHE 21 HD2 PHE 21 19.435 -1.012 -8.129 174 HE1 PHE 21 HE1 PHE 21 20.789 -5.735 -7.327 175 HE2 PHE 21 HE2 PHE 21 21.621 -1.820 -8.937 176 HZ PHE 21 HZ PHE 21 22.296 -4.212 -8.552 177 H ALA 22 H ALA 22 14.719 -1.171 -7.587 178 HA ALA 22 HA ALA 22 13.181 -2.017 -5.331 179 HB1 ALA 22 HB1 ALA 22 11.733 -0.154 -5.912 180 HB2 ALA 22 HB2 ALA 22 13.420 0.331 -6.115 181 HB3 ALA 22 HB3 ALA 22 12.478 -0.057 -7.551 182 H LYS 23 H LYS 23 12.478 -2.553 -8.855 183 HA LYS 23 HA LYS 23 9.841 -3.565 -8.449 184 HB2 LYS 23 HB2 LYS 23 9.896 -4.238 -10.687 185 HB3 LYS 23 HB3 LYS 23 11.003 -2.878 -10.623 186 HG2 LYS 23 HG2 LYS 23 12.766 -4.909 -10.245 187 HG3 LYS 23 HG3 LYS 23 11.537 -5.808 -11.102 188 HD2 LYS 23 HD2 LYS 23 12.866 -3.250 -12.099 189 HD3 LYS 23 HD3 LYS 23 13.396 -4.882 -12.519 190 HE2 LYS 23 HE2 LYS 23 11.284 -5.337 -13.655 191 HE3 LYS 23 HE3 LYS 23 10.628 -3.774 -13.126 192 HZ1 LYS 23 HZ1 LYS 23 11.504 -3.600 -15.388 193 HZ2 LYS 23 HZ2 LYS 23 12.384 -2.670 -14.367 194 HZ3 LYS 23 HZ3 LYS 23 12.985 -4.126 -14.897 195 H THR 24 H THR 24 12.898 -5.195 -8.131 196 HA THR 24 HA THR 24 11.708 -7.852 -7.652 197 HB THR 24 HB THR 24 14.588 -6.948 -7.418 198 HG1 THR 24 HG1 THR 24 13.270 -8.186 -9.624 199 HG21 THR 24 HG21 THR 24 14.279 -9.129 -6.368 200 HG22 THR 24 HG22 THR 24 13.374 -9.723 -7.778 201 HG23 THR 24 HG23 THR 24 15.104 -9.338 -7.919 202 H LEU 25 H LEU 25 13.686 -5.541 -5.669 203 HA LEU 25 HA LEU 25 13.452 -7.221 -3.299 204 HB2 LEU 25 HB2 LEU 25 14.392 -4.336 -3.620 205 HB3 LEU 25 HB3 LEU 25 14.615 -5.331 -2.188 206 HG LEU 25 HG LEU 25 15.862 -5.879 -4.919 207 HD11 LEU 25 HD11 LEU 25 17.106 -4.956 -2.302 208 HD12 LEU 25 HD12 LEU 25 17.949 -5.220 -3.845 209 HD13 LEU 25 HD13 LEU 25 16.769 -3.899 -3.695 210 HD21 LEU 25 HD21 LEU 25 17.237 -7.547 -3.690 211 HD22 LEU 25 HD22 LEU 25 16.226 -7.300 -2.250 212 HD23 LEU 25 HD23 LEU 25 15.532 -7.998 -3.733 213 H GLY 26 H GLY 26 11.667 -4.432 -4.508 214 HA2 GLY 26 HA2 GLY 26 9.966 -4.242 -2.088 215 HA3 GLY 26 HA3 GLY 26 10.077 -3.131 -3.455 216 H ALA 27 H ALA 27 9.848 -6.357 -4.558 217 HA ALA 27 HA ALA 27 7.651 -5.937 -6.132 218 HB1 ALA 27 HB1 ALA 27 8.539 -8.586 -4.898 219 HB2 ALA 27 HB2 ALA 27 7.542 -8.401 -6.357 220 HB3 ALA 27 HB3 ALA 27 9.216 -7.834 -6.352 221 H GLY 28 H GLY 28 5.682 -5.190 -5.544 222 HA2 GLY 28 HA2 GLY 28 3.445 -5.555 -5.004 223 HA3 GLY 28 HA3 GLY 28 3.878 -6.980 -4.055 224 H LYS 29 H LYS 29 5.951 -5.151 -2.614 225 HA LYS 29 HA LYS 29 4.082 -3.850 -0.693 226 HB2 LYS 29 HB2 LYS 29 6.106 -3.379 0.636 227 HB3 LYS 29 HB3 LYS 29 5.661 -5.092 0.467 228 HG2 LYS 29 HG2 LYS 29 7.426 -5.238 -1.366 229 HG3 LYS 29 HG3 LYS 29 7.961 -3.623 -0.871 230 HD2 LYS 29 HD2 LYS 29 7.867 -6.152 0.850 231 HD3 LYS 29 HD3 LYS 29 9.308 -5.512 0.058 232 HE2 LYS 29 HE2 LYS 29 9.198 -3.453 1.412 233 HE3 LYS 29 HE3 LYS 29 7.702 -4.004 2.171 234 HZ1 LYS 29 HZ1 LYS 29 8.942 -5.896 3.121 235 HZ2 LYS 29 HZ2 LYS 29 10.334 -5.398 2.420 236 HZ3 LYS 29 HZ3 LYS 29 9.627 -4.493 3.587 237 H ILE 30 H ILE 30 6.302 -2.949 -3.230 238 HA ILE 30 HA ILE 30 5.111 -0.269 -2.987 239 HB ILE 30 HB ILE 30 7.222 0.866 -3.612 240 HG12 ILE 30 HG12 ILE 30 9.376 -0.111 -3.309 241 HG13 ILE 30 HG13 ILE 30 8.694 -1.678 -2.881 242 HG21 ILE 30 HG21 ILE 30 8.295 0.731 -1.418 243 HG22 ILE 30 HG22 ILE 30 6.528 0.729 -1.243 244 HG23 ILE 30 HG23 ILE 30 7.460 -0.779 -1.056 245 HD11 ILE 30 HD11 ILE 30 8.368 -0.421 -5.632 246 HD12 ILE 30 HD12 ILE 30 9.743 -1.439 -5.179 247 HD13 ILE 30 HD13 ILE 30 8.116 -2.127 -5.158 248 H ALA 31 H ALA 31 5.490 1.057 -5.061 249 HA ALA 31 HA ALA 31 5.812 -0.644 -7.477 250 HB1 ALA 31 HB1 ALA 31 3.532 1.325 -7.069 251 HB2 ALA 31 HB2 ALA 31 3.995 0.641 -8.637 252 HB3 ALA 31 HB3 ALA 31 3.419 -0.424 -7.346 253 H VAL 32 H VAL 32 6.894 0.418 -9.244 254 HA VAL 32 HA VAL 32 8.083 3.052 -8.596 255 HB VAL 32 HB VAL 32 10.218 1.825 -9.479 256 HG11 VAL 32 HG11 VAL 32 9.198 1.532 -6.623 257 HG12 VAL 32 HG12 VAL 32 10.900 1.546 -7.138 258 HG13 VAL 32 HG13 VAL 32 9.926 2.981 -7.348 259 HG21 VAL 32 HG21 VAL 32 8.955 -0.553 -8.089 260 HG22 VAL 32 HG22 VAL 32 9.159 -0.399 -9.854 261 HG23 VAL 32 HG23 VAL 32 10.575 -0.426 -8.800 262 H THR 33 H THR 33 8.988 4.218 -10.107 263 HA THR 33 HA THR 33 8.813 3.441 -12.980 264 HB THR 33 HB THR 33 7.748 6.082 -11.877 265 HG1 THR 33 HG1 THR 33 5.685 5.231 -12.232 266 HG21 THR 33 HG21 THR 33 8.379 6.103 -14.307 267 HG22 THR 33 HG22 THR 33 7.293 4.721 -14.575 268 HG23 THR 33 HG23 THR 33 6.642 6.287 -14.054 269 H SER 34 H SER 34 10.422 4.592 -14.292 270 HA SER 34 HA SER 34 12.032 6.621 -12.821 271 HB2 SER 34 HB2 SER 34 14.050 5.886 -13.706 272 HB3 SER 34 HB3 SER 34 13.287 4.456 -13.014 273 HG SER 34 HG SER 34 12.765 3.779 -15.139 274 H CYS 35 H CYS 35 12.953 8.295 -14.028 275 HA CYS 35 HA CYS 35 12.168 8.734 -16.801 276 HB2 CYS 35 HB2 CYS 35 10.746 10.610 -16.414 277 HB3 CYS 35 HB3 CYS 35 10.132 9.273 -15.426 278 HG CYS 35 HG CYS 35 11.255 10.011 -13.190 279 H GLY 36 H GLY 36 12.757 11.244 -17.272 280 HA2 GLY 36 HA2 GLY 36 14.873 12.285 -15.528 281 HA3 GLY 36 HA3 GLY 36 15.383 11.921 -17.194 282 H LEU 37 H LEU 37 15.624 14.518 -16.331 283 HA LEU 37 HA LEU 37 13.212 16.038 -16.910 284 HB2 LEU 37 HB2 LEU 37 14.633 18.025 -17.028 285 HB3 LEU 37 HB3 LEU 37 14.645 17.164 -15.511 286 HG LEU 37 HG LEU 37 16.808 16.328 -17.418 287 HD11 LEU 37 HD11 LEU 37 18.236 18.278 -16.889 288 HD12 LEU 37 HD12 LEU 37 16.819 18.765 -17.838 289 HD13 LEU 37 HD13 LEU 37 16.864 19.079 -16.088 290 HD21 LEU 37 HD21 LEU 37 18.114 16.306 -15.361 291 HD22 LEU 37 HD22 LEU 37 16.838 17.208 -14.507 292 HD23 LEU 37 HD23 LEU 37 16.541 15.547 -15.028 293 H GLU 38 H GLU 38 15.388 14.457 -18.873 294 HA GLU 38 HA GLU 38 13.954 15.340 -21.298 295 HB2 GLU 38 HB2 GLU 38 16.049 15.362 -22.640 296 HB3 GLU 38 HB3 GLU 38 15.916 16.692 -21.495 297 HG2 GLU 38 HG2 GLU 38 17.522 15.680 -19.995 298 HG3 GLU 38 HG3 GLU 38 17.511 14.181 -20.938 299 H SER 39 H SER 39 14.805 13.625 -23.154 300 HA SER 39 HA SER 39 14.959 10.916 -21.903 301 HB2 SER 39 HB2 SER 39 12.574 11.506 -22.305 302 HB3 SER 39 HB3 SER 39 12.942 11.629 -24.042 303 HG SER 39 HG SER 39 12.327 9.518 -23.718 304 H SER 40 H SER 40 15.965 9.398 -23.062 305 HA SER 40 HA SER 40 16.709 9.796 -25.896 306 HB2 SER 40 HB2 SER 40 18.550 10.865 -24.754 307 HB3 SER 40 HB3 SER 40 18.759 9.469 -23.688 308 HG SER 40 HG SER 40 19.190 9.541 -26.524 309 H ARG 41 H ARG 41 18.515 7.412 -24.185 310 HA ARG 41 HA ARG 41 16.473 5.295 -24.308 311 HB2 ARG 41 HB2 ARG 41 18.093 3.795 -25.618 312 HB3 ARG 41 HB3 ARG 41 17.191 5.004 -26.503 313 HG2 ARG 41 HG2 ARG 41 19.464 4.793 -27.325 314 HG3 ARG 41 HG3 ARG 41 19.113 6.421 -26.780 315 HD2 ARG 41 HD2 ARG 41 20.453 6.147 -24.793 316 HD3 ARG 41 HD3 ARG 41 20.621 4.409 -25.060 317 HE ARG 41 HE ARG 41 22.036 6.615 -26.421 318 HH11 ARG 41 HH11 ARG 41 21.428 3.157 -26.542 319 HH12 ARG 41 HH12 ARG 41 22.808 2.866 -27.564 320 HH21 ARG 41 HH21 ARG 41 23.781 6.166 -27.694 321 HH22 ARG 41 HH22 ARG 41 24.121 4.532 -28.179 322 H VAL 42 H VAL 42 17.189 3.274 -23.263 323 HA VAL 42 HA VAL 42 18.715 3.762 -20.844 324 HB VAL 42 HB VAL 42 18.109 0.971 -21.942 325 HG11 VAL 42 HG11 VAL 42 18.120 0.448 -19.507 326 HG12 VAL 42 HG12 VAL 42 19.694 1.043 -20.036 327 HG13 VAL 42 HG13 VAL 42 18.601 2.114 -19.142 328 HG21 VAL 42 HG21 VAL 42 16.361 2.836 -20.325 329 HG22 VAL 42 HG22 VAL 42 16.024 2.055 -21.894 330 HG23 VAL 42 HG23 VAL 42 16.147 1.063 -20.444 331 H HIS 43 H HIS 43 20.873 3.310 -20.352 332 HA HIS 43 HA HIS 43 22.755 3.035 -22.563 333 HB2 HIS 43 HB2 HIS 43 23.115 4.223 -20.298 334 HB3 HIS 43 HB3 HIS 43 23.369 2.620 -19.609 335 HD2 HIS 43 HD2 HIS 43 25.073 5.362 -21.497 336 HE1 HIS 43 HE1 HIS 43 27.780 2.087 -21.761 337 HE2 HIS 43 HE2 HIS 43 27.469 4.587 -22.198 338 HA PRO 44 HA PRO 44 21.849 -1.211 -22.792 339 HB2 PRO 44 HB2 PRO 44 23.733 -2.186 -24.547 340 HB3 PRO 44 HB3 PRO 44 22.431 -1.050 -25.025 341 HG2 PRO 44 HG2 PRO 44 25.285 -0.345 -24.280 342 HG3 PRO 44 HG3 PRO 44 24.370 0.147 -25.743 343 HD2 PRO 44 HD2 PRO 44 24.543 1.748 -23.557 344 HD3 PRO 44 HD3 PRO 44 23.018 1.644 -24.497 345 H THR 45 H THR 45 25.125 -0.253 -21.765 346 HA THR 45 HA THR 45 25.892 -2.802 -20.646 347 HB THR 45 HB THR 45 26.842 -0.018 -19.894 348 HG1 THR 45 HG1 THR 45 28.493 -0.520 -21.406 349 HG21 THR 45 HG21 THR 45 27.587 -1.621 -18.229 350 HG22 THR 45 HG22 THR 45 28.046 -2.792 -19.488 351 HG23 THR 45 HG23 THR 45 28.950 -1.262 -19.295 352 H ALA 46 H ALA 46 23.775 -0.213 -19.428 353 HA ALA 46 HA ALA 46 23.828 -1.013 -16.665 354 HB1 ALA 46 HB1 ALA 46 21.552 0.232 -18.259 355 HB2 ALA 46 HB2 ALA 46 21.761 0.271 -16.498 356 HB3 ALA 46 HB3 ALA 46 22.906 1.142 -17.547 357 H ILE 47 H ILE 47 21.875 -2.168 -19.447 358 HA ILE 47 HA ILE 47 20.215 -4.041 -18.003 359 HB ILE 47 HB ILE 47 21.305 -4.129 -20.860 360 HG12 ILE 47 HG12 ILE 47 19.037 -3.663 -21.590 361 HG13 ILE 47 HG13 ILE 47 18.457 -3.610 -19.928 362 HG21 ILE 47 HG21 ILE 47 20.835 -6.432 -20.216 363 HG22 ILE 47 HG22 ILE 47 19.265 -5.963 -19.531 364 HG23 ILE 47 HG23 ILE 47 19.562 -5.875 -21.283 365 HD11 ILE 47 HD11 ILE 47 20.443 -1.632 -21.118 366 HD12 ILE 47 HD12 ILE 47 18.688 -1.395 -21.041 367 HD13 ILE 47 HD13 ILE 47 19.620 -1.513 -19.542 368 H ALA 48 H ALA 48 23.474 -4.364 -19.483 369 HA ALA 48 HA ALA 48 23.794 -7.139 -18.853 370 HB1 ALA 48 HB1 ALA 48 25.925 -5.017 -19.287 371 HB2 ALA 48 HB2 ALA 48 26.134 -6.779 -19.384 372 HB3 ALA 48 HB3 ALA 48 25.095 -5.947 -20.563 373 H MET 49 H MET 49 24.679 -4.216 -17.031 374 HA MET 49 HA MET 49 25.981 -5.643 -14.873 375 HB2 MET 49 HB2 MET 49 24.924 -2.804 -14.995 376 HB3 MET 49 HB3 MET 49 26.038 -3.431 -13.767 377 HG2 MET 49 HG2 MET 49 26.837 -3.683 -16.661 378 HG3 MET 49 HG3 MET 49 26.853 -2.107 -15.900 379 HE1 MET 49 HE1 MET 49 28.683 -5.346 -16.575 380 HE2 MET 49 HE2 MET 49 29.809 -5.554 -15.217 381 HE3 MET 49 HE3 MET 49 28.083 -5.886 -14.988 382 H MET 50 H MET 50 22.599 -4.642 -15.397 383 HA MET 50 HA MET 50 21.801 -5.515 -12.700 384 HB2 MET 50 HB2 MET 50 20.192 -4.887 -15.209 385 HB3 MET 50 HB3 MET 50 19.491 -5.315 -13.648 386 HG2 MET 50 HG2 MET 50 21.173 -2.866 -14.265 387 HG3 MET 50 HG3 MET 50 19.456 -2.911 -13.936 388 HE1 MET 50 HE1 MET 50 19.749 -5.101 -11.198 389 HE2 MET 50 HE2 MET 50 19.370 -3.771 -10.090 390 HE3 MET 50 HE3 MET 50 18.512 -3.889 -11.640 391 H GLU 51 H GLU 51 22.072 -7.072 -15.931 392 HA GLU 51 HA GLU 51 20.766 -9.496 -15.118 393 HB2 GLU 51 HB2 GLU 51 22.793 -8.870 -17.291 394 HB3 GLU 51 HB3 GLU 51 22.212 -10.508 -17.000 395 HG2 GLU 51 HG2 GLU 51 19.870 -9.748 -17.283 396 HG3 GLU 51 HG3 GLU 51 20.445 -8.145 -17.726 397 H GLU 52 H GLU 52 24.097 -8.361 -14.453 398 HA GLU 52 HA GLU 52 25.214 -10.860 -13.645 399 HB2 GLU 52 HB2 GLU 52 25.657 -8.156 -12.331 400 HB3 GLU 52 HB3 GLU 52 26.672 -9.586 -12.148 401 HG2 GLU 52 HG2 GLU 52 26.946 -9.444 -14.748 402 HG3 GLU 52 HG3 GLU 52 26.395 -7.770 -14.529 403 H VAL 53 H VAL 53 22.904 -8.783 -11.977 404 HA VAL 53 HA VAL 53 22.924 -10.543 -9.566 405 HB VAL 53 HB VAL 53 21.642 -8.769 -8.436 406 HG11 VAL 53 HG11 VAL 53 24.103 -8.890 -8.245 407 HG12 VAL 53 HG12 VAL 53 24.272 -7.798 -9.636 408 HG13 VAL 53 HG13 VAL 53 23.507 -7.223 -8.137 409 HG21 VAL 53 HG21 VAL 53 22.251 -7.045 -10.881 410 HG22 VAL 53 HG22 VAL 53 20.642 -7.678 -10.454 411 HG23 VAL 53 HG23 VAL 53 21.468 -6.538 -9.384 412 H GLY 54 H GLY 54 21.553 -10.803 -12.412 413 HA2 GLY 54 HA2 GLY 54 19.793 -12.025 -13.169 414 HA3 GLY 54 HA3 GLY 54 19.398 -12.445 -11.499 415 H ILE 55 H ILE 55 19.437 -9.066 -12.582 416 HA ILE 55 HA ILE 55 16.460 -8.929 -12.253 417 HB ILE 55 HB ILE 55 18.642 -6.971 -11.523 418 HG12 ILE 55 HG12 ILE 55 16.533 -8.424 -9.856 419 HG13 ILE 55 HG13 ILE 55 18.246 -8.820 -9.907 420 HG21 ILE 55 HG21 ILE 55 16.745 -5.704 -12.492 421 HG22 ILE 55 HG22 ILE 55 15.628 -6.533 -11.368 422 HG23 ILE 55 HG23 ILE 55 16.889 -5.444 -10.765 423 HD11 ILE 55 HD11 ILE 55 18.753 -6.525 -8.982 424 HD12 ILE 55 HD12 ILE 55 17.002 -6.330 -8.704 425 HD13 ILE 55 HD13 ILE 55 17.884 -7.626 -7.890 426 H ASP 56 H ASP 56 15.246 -7.903 -13.763 427 HA ASP 56 HA ASP 56 16.609 -7.435 -16.342 428 HB2 ASP 56 HB2 ASP 56 14.583 -8.062 -17.384 429 HB3 ASP 56 HB3 ASP 56 15.019 -9.262 -16.180 430 H ILE 57 H ILE 57 16.849 -5.525 -17.195 431 HA ILE 57 HA ILE 57 14.576 -3.617 -17.102 432 HB ILE 57 HB ILE 57 15.986 -1.684 -16.943 433 HG12 ILE 57 HG12 ILE 57 18.406 -3.302 -16.117 434 HG13 ILE 57 HG13 ILE 57 18.114 -2.990 -17.821 435 HG21 ILE 57 HG21 ILE 57 16.545 -3.528 -14.590 436 HG22 ILE 57 HG22 ILE 57 16.554 -1.755 -14.572 437 HG23 ILE 57 HG23 ILE 57 15.042 -2.609 -14.858 438 HD11 ILE 57 HD11 ILE 57 17.998 -0.569 -17.420 439 HD12 ILE 57 HD12 ILE 57 18.384 -0.839 -15.700 440 HD13 ILE 57 HD13 ILE 57 19.567 -1.263 -16.954 441 H SER 58 H SER 58 15.536 -5.631 -19.100 442 HA SER 58 HA SER 58 16.690 -4.093 -21.318 443 HB2 SER 58 HB2 SER 58 17.140 -6.529 -20.829 444 HB3 SER 58 HB3 SER 58 15.486 -6.883 -21.364 445 HG SER 58 HG SER 58 17.011 -7.113 -23.072 446 H GLY 59 H GLY 59 13.453 -5.122 -20.360 447 HA2 GLY 59 HA2 GLY 59 12.180 -4.487 -22.890 448 HA3 GLY 59 HA3 GLY 59 11.407 -4.992 -21.394 449 H GLN 60 H GLN 60 13.481 -2.133 -21.083 450 HA GLN 60 HA GLN 60 11.089 -0.372 -21.325 451 HB2 GLN 60 HB2 GLN 60 11.542 0.698 -19.220 452 HB3 GLN 60 HB3 GLN 60 11.294 -1.028 -18.995 453 HG2 GLN 60 HG2 GLN 60 13.969 -1.084 -19.143 454 HG3 GLN 60 HG3 GLN 60 13.813 0.608 -18.688 455 HE21 GLN 60 HE22 GLN 60 13.944 0.870 -16.426 456 HE22 GLN 60 HE21 GLN 60 13.410 -0.383 -15.271 457 H THR 61 H THR 61 11.724 2.015 -21.273 458 HA THR 61 HA THR 61 14.144 2.538 -22.861 459 HB THR 61 HB THR 61 12.691 3.989 -24.301 460 HG1 THR 61 HG1 THR 61 10.460 3.562 -24.288 461 HG21 THR 61 HG21 THR 61 13.420 1.727 -25.064 462 HG22 THR 61 HG22 THR 61 11.913 1.044 -24.411 463 HG23 THR 61 HG23 THR 61 11.859 2.221 -25.739 464 H SER 62 H SER 62 14.180 5.081 -23.051 465 HA SER 62 HA SER 62 13.992 6.243 -20.390 466 HB2 SER 62 HB2 SER 62 14.625 7.215 -23.129 467 HB3 SER 62 HB3 SER 62 14.647 8.282 -21.685 468 HG SER 62 HG SER 62 16.670 7.549 -21.507 469 H ASP 63 H ASP 63 12.528 7.803 -19.691 470 HA ASP 63 HA ASP 63 10.560 8.925 -21.609 471 HB2 ASP 63 HB2 ASP 63 9.854 7.517 -19.028 472 HB3 ASP 63 HB3 ASP 63 8.800 8.721 -19.763 473 HA PRO 64 HA PRO 64 11.660 12.597 -19.417 474 HB2 PRO 64 HB2 PRO 64 10.135 14.462 -20.630 475 HB3 PRO 64 HB3 PRO 64 11.331 13.490 -21.536 476 HG2 PRO 64 HG2 PRO 64 8.339 12.999 -21.282 477 HG3 PRO 64 HG3 PRO 64 9.328 13.031 -22.779 478 HD2 PRO 64 HD2 PRO 64 8.684 10.705 -21.435 479 HD3 PRO 64 HD3 PRO 64 10.193 10.911 -22.362 480 H ILE 65 H ILE 65 11.171 13.957 -17.733 481 HA ILE 65 HA ILE 65 9.260 13.320 -15.813 482 HB ILE 65 HB ILE 65 11.476 14.574 -15.647 483 HG12 ILE 65 HG12 ILE 65 9.114 15.659 -14.122 484 HG13 ILE 65 HG13 ILE 65 10.047 14.188 -13.759 485 HG21 ILE 65 HG21 ILE 65 10.964 16.413 -17.310 486 HG22 ILE 65 HG22 ILE 65 9.817 17.091 -16.116 487 HG23 ILE 65 HG23 ILE 65 11.535 17.002 -15.742 488 HD11 ILE 65 HD11 ILE 65 12.097 15.742 -13.564 489 HD12 ILE 65 HD12 ILE 65 10.917 17.078 -13.517 490 HD13 ILE 65 HD13 ILE 65 10.885 15.823 -12.274 491 H GLU 66 H GLU 66 9.061 15.758 -18.365 492 HA GLU 66 HA GLU 66 6.763 17.160 -17.511 493 HB2 GLU 66 HB2 GLU 66 7.741 16.631 -20.344 494 HB3 GLU 66 HB3 GLU 66 6.548 17.854 -19.897 495 HG2 GLU 66 HG2 GLU 66 8.247 18.924 -18.395 496 HG3 GLU 66 HG3 GLU 66 9.456 17.787 -18.997 497 H ASN 67 H ASN 67 6.827 13.951 -18.954 498 HA ASN 67 HA ASN 67 3.937 14.055 -19.580 499 HB2 ASN 67 HB2 ASN 67 4.300 12.391 -20.986 500 HB3 ASN 67 HB3 ASN 67 6.009 12.721 -20.801 501 HD21 ASN 67 HD22 ASN 67 7.039 11.453 -18.784 502 HD22 ASN 67 HD21 ASN 67 6.381 9.856 -18.503 503 H PHE 68 H PHE 68 5.737 13.464 -16.758 504 HA PHE 68 HA PHE 68 3.934 11.342 -15.733 505 HB2 PHE 68 HB2 PHE 68 6.719 12.295 -15.043 506 HB3 PHE 68 HB3 PHE 68 5.821 11.260 -13.965 507 HD1 PHE 68 HD2 PHE 68 4.555 9.196 -15.461 508 HD2 PHE 68 HD1 PHE 68 8.344 11.105 -16.217 509 HE1 PHE 68 HE2 PHE 68 5.319 7.187 -16.692 510 HE2 PHE 68 HE1 PHE 68 9.100 9.087 -17.444 511 HZ PHE 68 HZ PHE 68 7.601 7.118 -17.671 512 H ASN 69 H ASN 69 3.700 11.391 -13.285 513 HA ASN 69 HA ASN 69 2.446 14.011 -12.540 514 HB2 ASN 69 HB2 ASN 69 0.571 12.553 -11.624 515 HB3 ASN 69 HB3 ASN 69 0.686 12.746 -13.365 516 HD21 ASN 69 HD22 ASN 69 1.960 10.449 -10.874 517 HD22 ASN 69 HD21 ASN 69 1.525 9.014 -11.803 518 H ALA 70 H ALA 70 4.208 14.574 -11.164 519 HA ALA 70 HA ALA 70 5.345 13.005 -9.182 520 HB1 ALA 70 HB1 ALA 70 5.970 15.055 -8.070 521 HB2 ALA 70 HB2 ALA 70 6.076 15.307 -9.826 522 HB3 ALA 70 HB3 ALA 70 4.699 15.953 -8.907 523 H ASP 71 H ASP 71 2.245 14.686 -9.067 524 HA ASP 71 HA ASP 71 1.623 14.693 -6.344 525 HB2 ASP 71 HB2 ASP 71 0.378 15.802 -8.198 526 HB3 ASP 71 HB3 ASP 71 -0.214 14.219 -8.720 527 H ASP 72 H ASP 72 1.628 11.908 -8.505 528 HA ASP 72 HA ASP 72 0.091 10.227 -6.626 529 HB2 ASP 72 HB2 ASP 72 -0.103 9.992 -9.136 530 HB3 ASP 72 HB3 ASP 72 1.580 9.433 -9.137 531 H TYR 73 H TYR 73 3.478 10.914 -7.366 532 HA TYR 73 HA TYR 73 4.425 8.383 -6.288 533 HB2 TYR 73 HB2 TYR 73 6.042 10.805 -7.051 534 HB3 TYR 73 HB3 TYR 73 6.594 9.135 -6.939 535 HD1 TYR 73 HD1 TYR 73 4.289 7.816 -8.535 536 HD2 TYR 73 HD2 TYR 73 6.710 11.325 -9.245 537 HE1 TYR 73 HE1 TYR 73 3.773 7.689 -10.952 538 HE2 TYR 73 HE2 TYR 73 6.170 11.201 -11.669 539 HH TYR 73 HH TYR 73 4.032 8.650 -13.013 540 H ASP 74 H ASP 74 4.027 8.197 -4.131 541 HA ASP 74 HA ASP 74 4.085 10.050 -2.066 542 HB2 ASP 74 HB2 ASP 74 5.180 7.201 -2.065 543 HB3 ASP 74 HB3 ASP 74 4.797 8.129 -0.622 544 H VAL 75 H VAL 75 6.870 8.507 -3.652 545 HA VAL 75 HA VAL 75 8.671 10.446 -2.270 546 HB VAL 75 HB VAL 75 9.393 7.578 -2.890 547 HG11 VAL 75 HG11 VAL 75 11.339 8.993 -2.992 548 HG12 VAL 75 HG12 VAL 75 10.896 9.828 -1.496 549 HG13 VAL 75 HG13 VAL 75 11.396 8.133 -1.457 550 HG21 VAL 75 HG21 VAL 75 8.576 8.868 -0.264 551 HG22 VAL 75 HG22 VAL 75 7.875 7.441 -1.058 552 HG23 VAL 75 HG23 VAL 75 9.504 7.350 -0.366 553 H VAL 76 H VAL 76 10.062 11.514 -3.583 554 HA VAL 76 HA VAL 76 10.533 10.476 -6.358 555 HB VAL 76 HB VAL 76 10.059 13.325 -5.487 556 HG11 VAL 76 HG11 VAL 76 12.043 13.338 -7.001 557 HG12 VAL 76 HG12 VAL 76 11.143 12.365 -8.187 558 HG13 VAL 76 HG13 VAL 76 10.632 14.023 -7.775 559 HG21 VAL 76 HG21 VAL 76 8.824 11.575 -7.654 560 HG22 VAL 76 HG22 VAL 76 8.050 12.045 -6.109 561 HG23 VAL 76 HG23 VAL 76 8.406 13.275 -7.336 562 H ILE 77 H ILE 77 12.581 10.317 -6.981 563 HA ILE 77 HA ILE 77 14.736 11.275 -5.125 564 HB ILE 77 HB ILE 77 14.730 8.822 -6.891 565 HG12 ILE 77 HG12 ILE 77 13.068 8.368 -5.190 566 HG13 ILE 77 HG13 ILE 77 14.498 7.397 -4.942 567 HG21 ILE 77 HG21 ILE 77 16.695 8.165 -5.589 568 HG22 ILE 77 HG22 ILE 77 16.980 9.685 -6.418 569 HG23 ILE 77 HG23 ILE 77 16.637 9.695 -4.682 570 HD11 ILE 77 HD11 ILE 77 13.544 8.256 -2.837 571 HD12 ILE 77 HD12 ILE 77 15.211 8.781 -3.067 572 HD13 ILE 77 HD13 ILE 77 13.875 9.915 -3.341 573 H SER 78 H SER 78 16.362 12.447 -6.065 574 HA SER 78 HA SER 78 16.505 12.513 -9.076 575 HB2 SER 78 HB2 SER 78 16.133 14.701 -7.975 576 HB3 SER 78 HB3 SER 78 17.710 14.512 -7.152 577 HG SER 78 HG SER 78 17.869 15.651 -9.187 578 H LEU 79 H LEU 79 18.191 11.662 -10.070 579 HA LEU 79 HA LEU 79 20.691 10.968 -8.568 580 HB2 LEU 79 HB2 LEU 79 19.400 9.293 -10.766 581 HB3 LEU 79 HB3 LEU 79 20.830 8.927 -9.805 582 HG LEU 79 HG LEU 79 19.149 8.988 -7.751 583 HD11 LEU 79 HD11 LEU 79 16.933 8.026 -8.407 584 HD12 LEU 79 HD12 LEU 79 17.099 9.680 -8.972 585 HD13 LEU 79 HD13 LEU 79 17.323 8.355 -10.120 586 HD21 LEU 79 HD21 LEU 79 20.383 6.984 -8.509 587 HD22 LEU 79 HD22 LEU 79 18.708 6.561 -8.114 588 HD23 LEU 79 HD23 LEU 79 19.186 6.732 -9.811 589 H CYS 80 H CYS 80 20.578 13.355 -9.588 590 HA CYS 80 HA CYS 80 21.013 13.527 -12.464 591 HB2 CYS 80 HB2 CYS 80 21.038 15.972 -11.919 592 HB3 CYS 80 HB3 CYS 80 19.599 15.095 -11.337 593 HG CYS 80 HG CYS 80 20.222 16.881 -9.514 594 H GLY 81 H GLY 81 23.201 13.868 -9.640 595 HA2 GLY 81 HA2 GLY 81 25.555 13.975 -9.645 596 HA3 GLY 81 HA3 GLY 81 25.578 13.997 -11.420 597 H CYS 82 H CYS 82 23.873 15.997 -9.031 598 HA CYS 82 HA CYS 82 23.426 18.212 -8.842 599 HB2 CYS 82 HB2 CYS 82 26.321 18.535 -9.712 600 HB3 CYS 82 HB3 CYS 82 25.334 19.779 -8.931 601 HG CYS 82 HG CYS 82 26.996 18.758 -7.177 602 H GLY 83 H GLY 83 23.714 20.516 -10.117 603 HA2 GLY 83 HA2 GLY 83 23.181 21.742 -12.017 604 HA3 GLY 83 HA3 GLY 83 23.346 20.289 -13.002 605 H VAL 84 H VAL 84 21.185 19.665 -10.481 606 HA VAL 84 HA VAL 84 18.725 20.438 -11.980 607 HB VAL 84 HB VAL 84 19.367 17.610 -11.058 608 HG11 VAL 84 HG11 VAL 84 16.919 18.671 -12.531 609 HG12 VAL 84 HG12 VAL 84 17.266 16.960 -12.180 610 HG13 VAL 84 HG13 VAL 84 16.965 18.065 -10.855 611 HG21 VAL 84 HG21 VAL 84 19.144 18.659 -13.898 612 HG22 VAL 84 HG22 VAL 84 20.617 18.043 -13.106 613 HG23 VAL 84 HG23 VAL 84 19.279 16.949 -13.426 614 H ASN 85 H ASN 85 17.129 21.090 -10.570 615 HA ASN 85 HA ASN 85 17.238 20.077 -7.755 616 HB2 ASN 85 HB2 ASN 85 18.264 22.479 -8.364 617 HB3 ASN 85 HB3 ASN 85 16.578 22.978 -8.281 618 HD21 ASN 85 HD22 ASN 85 19.095 21.130 -6.465 619 HD22 ASN 85 HD21 ASN 85 18.535 21.660 -4.886 620 H LEU 86 H LEU 86 15.258 20.165 -10.382 621 HA LEU 86 HA LEU 86 12.984 20.122 -10.781 622 HB2 LEU 86 HB2 LEU 86 13.061 18.470 -8.245 623 HB3 LEU 86 HB3 LEU 86 11.845 18.418 -9.529 624 HG LEU 86 HG LEU 86 14.688 17.425 -9.701 625 HD11 LEU 86 HD11 LEU 86 12.073 15.942 -10.097 626 HD12 LEU 86 HD12 LEU 86 13.679 15.274 -9.751 627 HD13 LEU 86 HD13 LEU 86 12.787 16.136 -8.474 628 HD21 LEU 86 HD21 LEU 86 13.865 16.620 -11.988 629 HD22 LEU 86 HD22 LEU 86 12.469 17.696 -11.764 630 HD23 LEU 86 HD23 LEU 86 14.111 18.367 -11.886 631 HA PRO 87 HA PRO 87 11.836 23.613 -7.888 632 HB2 PRO 87 HB2 PRO 87 10.948 24.622 -10.594 633 HB3 PRO 87 HB3 PRO 87 11.554 25.548 -9.187 634 HG2 PRO 87 HG2 PRO 87 13.225 24.981 -11.225 635 HG3 PRO 87 HG3 PRO 87 13.790 24.753 -9.535 636 HD2 PRO 87 HD2 PRO 87 12.785 22.662 -11.477 637 HD3 PRO 87 HD3 PRO 87 14.193 22.618 -10.380 638 HA PRO 88 HA PRO 88 7.292 23.060 -9.288 639 HB2 PRO 88 HB2 PRO 88 7.129 20.479 -10.757 640 HB3 PRO 88 HB3 PRO 88 6.442 22.066 -11.185 641 HG2 PRO 88 HG2 PRO 88 8.564 20.947 -12.485 642 HG3 PRO 88 HG3 PRO 88 8.443 22.727 -12.226 643 HD2 PRO 88 HD2 PRO 88 10.011 20.679 -10.633 644 HD3 PRO 88 HD3 PRO 88 10.501 22.289 -11.240 645 H GLU 89 H GLU 89 5.516 20.910 -9.170 646 HA GLU 89 HA GLU 89 5.393 20.033 -6.521 647 HB2 GLU 89 HB2 GLU 89 3.738 18.359 -7.407 648 HB3 GLU 89 HB3 GLU 89 3.452 20.037 -7.856 649 HG2 GLU 89 HG2 GLU 89 4.302 19.649 -10.108 650 HG3 GLU 89 HG3 GLU 89 4.821 18.026 -9.687 651 H TRP 90 H TRP 90 7.556 18.814 -8.833 652 HA TRP 90 HA TRP 90 7.970 16.111 -8.023 653 HB2 TRP 90 HB2 TRP 90 9.681 18.190 -9.357 654 HB3 TRP 90 HB3 TRP 90 10.218 16.531 -9.031 655 HD1 TRP 90 HD1 TRP 90 7.728 18.486 -11.207 656 HE1 TRP 90 HE1 TRP 90 6.567 16.913 -12.853 657 HE3 TRP 90 HE3 TRP 90 10.038 14.140 -9.889 658 HZ2 TRP 90 HZ2 TRP 90 6.582 14.080 -13.466 659 HZ3 TRP 90 HZ3 TRP 90 9.629 12.073 -11.175 660 HH2 TRP 90 HH2 TRP 90 7.901 12.021 -12.955 661 H VAL 91 H VAL 91 8.757 19.028 -6.288 662 HA VAL 91 HA VAL 91 10.254 17.350 -4.301 663 HB VAL 91 HB VAL 91 11.469 19.295 -3.556 664 HG11 VAL 91 HG11 VAL 91 12.501 17.894 -5.188 665 HG12 VAL 91 HG12 VAL 91 11.727 18.776 -6.509 666 HG13 VAL 91 HG13 VAL 91 12.944 19.575 -5.492 667 HG21 VAL 91 HG21 VAL 91 10.185 20.821 -5.859 668 HG22 VAL 91 HG22 VAL 91 9.854 21.095 -4.139 669 HG23 VAL 91 HG23 VAL 91 11.465 21.413 -4.794 670 H THR 92 H THR 92 7.227 18.541 -4.698 671 HA THR 92 HA THR 92 6.889 19.433 -1.882 672 HB THR 92 HB THR 92 4.663 20.098 -2.473 673 HG1 THR 92 HG1 THR 92 3.784 19.674 -4.415 674 HG21 THR 92 HG21 THR 92 6.503 21.682 -3.067 675 HG22 THR 92 HG22 THR 92 6.552 20.995 -4.704 676 HG23 THR 92 HG23 THR 92 5.097 21.829 -4.133 677 H GLN 93 H GLN 93 7.102 16.495 -3.270 678 HA GLN 93 HA GLN 93 4.771 15.176 -2.147 679 HB2 GLN 93 HB2 GLN 93 7.325 13.959 -3.276 680 HB3 GLN 93 HB3 GLN 93 5.806 13.127 -2.945 681 HG2 GLN 93 HG2 GLN 93 6.391 15.140 -5.121 682 HG3 GLN 93 HG3 GLN 93 5.809 13.494 -5.274 683 HE21 GLN 93 HE22 GLN 93 4.822 16.650 -5.588 684 HE22 GLN 93 HE21 GLN 93 3.122 16.468 -5.172 685 H GLU 94 H GLU 94 5.385 13.017 -0.875 686 HA GLU 94 HA GLU 94 5.736 14.078 1.771 687 HB2 GLU 94 HB2 GLU 94 4.175 12.314 1.309 688 HB3 GLU 94 HB3 GLU 94 5.464 11.217 0.809 689 HG2 GLU 94 HG2 GLU 94 6.344 11.072 3.026 690 HG3 GLU 94 HG3 GLU 94 5.326 12.412 3.591 691 H ILE 95 H ILE 95 7.965 12.191 -0.263 692 HA ILE 95 HA ILE 95 10.161 13.212 1.450 693 HB ILE 95 HB ILE 95 10.102 10.331 0.502 694 HG12 ILE 95 HG12 ILE 95 9.777 11.404 3.327 695 HG13 ILE 95 HG13 ILE 95 8.552 10.570 2.356 696 HG21 ILE 95 HG21 ILE 95 12.389 11.308 0.527 697 HG22 ILE 95 HG22 ILE 95 12.147 11.800 2.219 698 HG23 ILE 95 HG23 ILE 95 12.221 10.086 1.762 699 HD11 ILE 95 HD11 ILE 95 9.327 8.940 3.848 700 HD12 ILE 95 HD12 ILE 95 10.118 8.559 2.306 701 HD13 ILE 95 HD13 ILE 95 11.028 9.371 3.600 702 H PHE 96 H PHE 96 11.807 14.038 0.315 703 HA PHE 96 HA PHE 96 12.228 13.190 -2.484 704 HB2 PHE 96 HB2 PHE 96 11.200 15.336 -2.744 705 HB3 PHE 96 HB3 PHE 96 12.261 16.053 -1.532 706 HD1 PHE 96 HD1 PHE 96 12.098 14.788 -5.057 707 HD2 PHE 96 HD2 PHE 96 14.581 16.612 -2.024 708 HE1 PHE 96 HE1 PHE 96 13.872 15.185 -6.729 709 HE2 PHE 96 HE2 PHE 96 16.313 17.073 -3.730 710 HZ PHE 96 HZ PHE 96 15.964 16.368 -6.085 711 H GLU 97 H GLU 97 14.292 12.678 -2.975 712 HA GLU 97 HA GLU 97 16.481 13.470 -1.116 713 HB2 GLU 97 HB2 GLU 97 16.139 10.625 -2.131 714 HB3 GLU 97 HB3 GLU 97 17.490 11.278 -1.207 715 HG2 GLU 97 HG2 GLU 97 15.902 11.726 0.692 716 HG3 GLU 97 HG3 GLU 97 14.640 10.898 -0.230 717 H ASP 98 H ASP 98 18.567 13.532 -2.087 718 HA ASP 98 HA ASP 98 18.653 13.106 -5.021 719 HB2 ASP 98 HB2 ASP 98 19.889 15.026 -5.410 720 HB3 ASP 98 HB3 ASP 98 18.466 15.501 -4.506 721 H TRP 99 H TRP 99 19.920 11.526 -5.536 722 HA TRP 99 HA TRP 99 22.128 10.647 -3.722 723 HB2 TRP 99 HB2 TRP 99 20.704 9.127 -5.921 724 HB3 TRP 99 HB3 TRP 99 21.866 8.479 -4.773 725 HD1 TRP 99 HD1 TRP 99 20.011 10.209 -2.378 726 HE1 TRP 99 HE1 TRP 99 17.942 8.957 -1.493 727 HE3 TRP 99 HE3 TRP 99 19.657 6.606 -5.985 728 HZ2 TRP 99 HZ2 TRP 99 16.348 6.700 -2.265 729 HZ3 TRP 99 HZ3 TRP 99 17.844 4.906 -5.896 730 HH2 TRP 99 HH2 TRP 99 16.194 4.935 -4.028 731 H GLN 100 H GLN 100 23.747 12.032 -4.382 732 HA GLN 100 HA GLN 100 24.348 12.369 -7.230 733 HB2 GLN 100 HB2 GLN 100 25.869 13.368 -4.795 734 HB3 GLN 100 HB3 GLN 100 26.031 13.940 -6.458 735 HG2 GLN 100 HG2 GLN 100 23.632 14.288 -4.604 736 HG3 GLN 100 HG3 GLN 100 24.763 15.529 -5.108 737 HE21 GLN 100 HE22 GLN 100 22.062 15.975 -5.429 738 HE22 GLN 100 HE21 GLN 100 21.699 15.924 -7.170 739 H LEU 101 H LEU 101 25.171 10.625 -8.218 740 HA LEU 101 HA LEU 101 27.598 9.267 -7.094 741 HB2 LEU 101 HB2 LEU 101 25.426 8.079 -8.856 742 HB3 LEU 101 HB3 LEU 101 26.892 7.269 -8.349 743 HG LEU 101 HG LEU 101 24.535 8.014 -6.567 744 HD11 LEU 101 HD11 LEU 101 24.258 6.098 -8.034 745 HD12 LEU 101 HD12 LEU 101 25.735 5.354 -7.366 746 HD13 LEU 101 HD13 LEU 101 24.309 5.632 -6.324 747 HD21 LEU 101 HD21 LEU 101 26.602 8.301 -5.246 748 HD22 LEU 101 HD22 LEU 101 25.755 6.837 -4.762 749 HD23 LEU 101 HD23 LEU 101 27.191 6.730 -5.817 750 H GLU 102 H GLU 102 28.916 8.236 -8.915 751 HA GLU 102 HA GLU 102 29.555 10.272 -10.907 752 HB2 GLU 102 HB2 GLU 102 31.332 8.757 -11.575 753 HB3 GLU 102 HB3 GLU 102 31.385 9.136 -9.864 754 HG2 GLU 102 HG2 GLU 102 30.088 6.574 -10.817 755 HG3 GLU 102 HG3 GLU 102 31.831 6.712 -10.729 756 H ASP 103 H ASP 103 30.045 9.404 -13.159 757 HA ASP 103 HA ASP 103 27.487 8.402 -14.274 758 HB2 ASP 103 HB2 ASP 103 27.857 9.913 -16.085 759 HB3 ASP 103 HB3 ASP 103 27.872 10.744 -14.535 760 HA PRO 104 HA PRO 104 30.358 5.092 -15.400 761 HB2 PRO 104 HB2 PRO 104 27.794 3.725 -16.124 762 HB3 PRO 104 HB3 PRO 104 29.215 3.094 -15.214 763 HG2 PRO 104 HG2 PRO 104 27.015 3.844 -13.868 764 HG3 PRO 104 HG3 PRO 104 28.627 4.409 -13.294 765 HD2 PRO 104 HD2 PRO 104 26.649 5.895 -15.078 766 HD3 PRO 104 HD3 PRO 104 27.429 6.437 -13.565 767 H ASP 105 H ASP 105 28.257 6.631 -17.699 768 HA ASP 105 HA ASP 105 28.543 4.998 -19.968 769 HB2 ASP 105 HB2 ASP 105 26.966 6.798 -19.942 770 HB3 ASP 105 HB3 ASP 105 28.239 7.996 -19.686 771 H GLY 106 H GLY 106 30.332 4.227 -20.867 772 HA2 GLY 106 HA2 GLY 106 32.306 4.204 -22.061 773 HA3 GLY 106 HA3 GLY 106 32.388 5.967 -21.954 774 H GLN 107 H GLN 107 32.067 4.327 -18.915 775 HA GLN 107 HA GLN 107 34.859 5.068 -18.199 776 HB2 GLN 107 HB2 GLN 107 32.633 4.094 -16.392 777 HB3 GLN 107 HB3 GLN 107 34.198 4.742 -15.891 778 HG2 GLN 107 HG2 GLN 107 32.014 6.272 -17.347 779 HG3 GLN 107 HG3 GLN 107 32.273 6.235 -15.613 780 HE21 GLN 107 HE22 GLN 107 32.119 8.610 -16.360 781 HE22 GLN 107 HE21 GLN 107 33.681 9.408 -16.586 782 H SER 108 H SER 108 33.301 2.406 -16.582 783 HA SER 108 HA SER 108 34.424 0.261 -18.120 784 HB2 SER 108 HB2 SER 108 36.469 1.032 -16.779 785 HB3 SER 108 HB3 SER 108 35.582 0.538 -15.317 786 HG SER 108 HG SER 108 37.003 -1.105 -16.262 787 H LEU 109 H LEU 109 33.888 -1.843 -17.071 788 HA LEU 109 HA LEU 109 31.213 -1.936 -16.011 789 HB2 LEU 109 HB2 LEU 109 33.457 -3.993 -15.918 790 HB3 LEU 109 HB3 LEU 109 31.731 -4.321 -15.645 791 HG LEU 109 HG LEU 109 33.066 -3.486 -18.256 792 HD11 LEU 109 HD11 LEU 109 31.571 -6.006 -17.422 793 HD12 LEU 109 HD12 LEU 109 32.321 -5.695 -19.005 794 HD13 LEU 109 HD13 LEU 109 33.334 -5.834 -17.555 795 HD21 LEU 109 HD21 LEU 109 30.890 -2.389 -18.199 796 HD22 LEU 109 HD22 LEU 109 30.815 -3.773 -19.293 797 HD23 LEU 109 HD23 LEU 109 30.103 -3.885 -17.669 798 H GLU 110 H GLU 110 34.371 -2.108 -14.396 799 HA GLU 110 HA GLU 110 33.426 -2.520 -11.738 800 HB2 GLU 110 HB2 GLU 110 35.791 -2.663 -12.473 801 HB3 GLU 110 HB3 GLU 110 35.836 -0.906 -12.682 802 HG2 GLU 110 HG2 GLU 110 35.460 -0.587 -10.271 803 HG3 GLU 110 HG3 GLU 110 35.244 -2.326 -10.048 804 H VAL 111 H VAL 111 33.551 0.486 -13.612 805 HA VAL 111 HA VAL 111 32.719 2.165 -11.351 806 HB VAL 111 HB VAL 111 32.896 2.713 -14.319 807 HG11 VAL 111 HG11 VAL 111 32.763 5.110 -13.684 808 HG12 VAL 111 HG12 VAL 111 31.250 4.249 -13.411 809 HG13 VAL 111 HG13 VAL 111 32.310 4.632 -12.033 810 HG21 VAL 111 HG21 VAL 111 35.084 2.357 -13.216 811 HG22 VAL 111 HG22 VAL 111 34.881 4.060 -13.644 812 HG23 VAL 111 HG23 VAL 111 34.646 3.534 -11.963 813 H PHE 112 H PHE 112 31.056 0.547 -14.113 814 HA PHE 112 HA PHE 112 28.413 1.528 -13.437 815 HB2 PHE 112 HB2 PHE 112 29.491 -0.874 -14.911 816 HB3 PHE 112 HB3 PHE 112 27.810 -0.841 -14.398 817 HD1 PHE 112 HD2 PHE 112 26.190 0.711 -15.317 818 HD2 PHE 112 HD1 PHE 112 30.253 0.607 -16.739 819 HE1 PHE 112 HE2 PHE 112 25.499 1.942 -17.368 820 HE2 PHE 112 HE1 PHE 112 29.570 1.865 -18.766 821 HZ PHE 112 HZ PHE 112 27.211 2.572 -19.047 822 H ARG 113 H ARG 113 30.187 -1.402 -12.356 823 HA ARG 113 HA ARG 113 28.182 -2.372 -10.540 824 HB2 ARG 113 HB2 ARG 113 31.215 -2.678 -10.569 825 HB3 ARG 113 HB3 ARG 113 30.150 -3.589 -9.500 826 HG2 ARG 113 HG2 ARG 113 29.053 -4.688 -11.370 827 HG3 ARG 113 HG3 ARG 113 29.904 -3.691 -12.540 828 HD2 ARG 113 HD2 ARG 113 32.064 -4.581 -11.705 829 HD3 ARG 113 HD3 ARG 113 31.171 -5.673 -10.621 830 HE ARG 113 HE ARG 113 30.094 -6.600 -12.756 831 HH11 ARG 113 HH11 ARG 113 33.461 -5.502 -12.694 832 HH12 ARG 113 HH12 ARG 113 33.917 -6.590 -13.969 833 HH21 ARG 113 HH21 ARG 113 30.790 -7.999 -14.257 834 HH22 ARG 113 HH22 ARG 113 32.439 -7.970 -14.850 835 H THR 114 H THR 114 30.895 -0.126 -9.989 836 HA THR 114 HA THR 114 30.508 0.302 -7.183 837 HB THR 114 HB THR 114 31.609 2.153 -9.331 838 HG1 THR 114 HG1 THR 114 32.847 0.343 -9.098 839 HG21 THR 114 HG21 THR 114 31.081 3.562 -7.442 840 HG22 THR 114 HG22 THR 114 31.771 2.380 -6.298 841 HG23 THR 114 HG23 THR 114 32.822 3.257 -7.440 842 H VAL 115 H VAL 115 29.026 2.000 -9.990 843 HA VAL 115 HA VAL 115 27.327 3.680 -8.318 844 HB VAL 115 HB VAL 115 27.340 2.933 -11.257 845 HG11 VAL 115 HG11 VAL 115 24.958 3.315 -10.736 846 HG12 VAL 115 HG12 VAL 115 25.382 4.836 -9.898 847 HG13 VAL 115 HG13 VAL 115 25.639 4.656 -11.654 848 HG21 VAL 115 HG21 VAL 115 27.872 5.472 -9.647 849 HG22 VAL 115 HG22 VAL 115 29.069 4.478 -10.501 850 HG23 VAL 115 HG23 VAL 115 27.865 5.407 -11.410 851 H ARG 116 H ARG 116 26.647 0.649 -10.103 852 HA ARG 116 HA ARG 116 23.969 0.247 -9.484 853 HB2 ARG 116 HB2 ARG 116 25.423 -1.133 -11.010 854 HB3 ARG 116 HB3 ARG 116 26.196 -1.846 -9.596 855 HG2 ARG 116 HG2 ARG 116 23.889 -2.689 -8.899 856 HG3 ARG 116 HG3 ARG 116 23.309 -2.134 -10.481 857 HD2 ARG 116 HD2 ARG 116 23.764 -4.487 -10.647 858 HD3 ARG 116 HD3 ARG 116 25.021 -3.625 -11.549 859 HE ARG 116 HE ARG 116 25.686 -4.268 -8.729 860 HH11 ARG 116 HH11 ARG 116 25.713 -5.717 -11.905 861 HH12 ARG 116 HH12 ARG 116 27.291 -6.448 -11.689 862 HH21 ARG 116 HH21 ARG 116 27.516 -5.520 -8.361 863 HH22 ARG 116 HH22 ARG 116 28.095 -6.565 -9.621 864 H GLY 117 H GLY 117 26.724 -0.789 -7.418 865 HA2 GLY 117 HA2 GLY 117 25.227 -1.970 -5.318 866 HA3 GLY 117 HA3 GLY 117 26.827 -1.240 -5.146 867 H GLN 118 H GLN 118 26.317 1.469 -5.608 868 HA GLN 118 HA GLN 118 25.123 2.244 -3.076 869 HB2 GLN 118 HB2 GLN 118 26.061 3.883 -5.453 870 HB3 GLN 118 HB3 GLN 118 25.537 4.563 -3.898 871 HG2 GLN 118 HG2 GLN 118 27.355 3.489 -2.716 872 HG3 GLN 118 HG3 GLN 118 27.824 2.548 -4.137 873 HE21 GLN 118 HE22 GLN 118 28.815 3.655 -5.967 874 HE22 GLN 118 HE21 GLN 118 29.532 5.254 -5.744 875 H VAL 119 H VAL 119 23.951 2.390 -6.424 876 HA VAL 119 HA VAL 119 21.422 3.686 -5.816 877 HB VAL 119 HB VAL 119 22.024 1.834 -8.163 878 HG11 VAL 119 HG11 VAL 119 19.616 2.085 -7.883 879 HG12 VAL 119 HG12 VAL 119 19.796 3.846 -7.675 880 HG13 VAL 119 HG13 VAL 119 20.142 3.087 -9.246 881 HG21 VAL 119 HG21 VAL 119 22.065 4.884 -7.970 882 HG22 VAL 119 HG22 VAL 119 23.490 3.842 -8.146 883 HG23 VAL 119 HG23 VAL 119 22.312 3.922 -9.448 884 H LYS 120 H LYS 120 22.288 0.195 -6.022 885 HA LYS 120 HA LYS 120 19.781 -0.939 -5.245 886 HB2 LYS 120 HB2 LYS 120 21.788 -2.246 -5.959 887 HB3 LYS 120 HB3 LYS 120 22.608 -1.824 -4.471 888 HG2 LYS 120 HG2 LYS 120 20.819 -2.958 -3.149 889 HG3 LYS 120 HG3 LYS 120 20.022 -3.415 -4.655 890 HD2 LYS 120 HD2 LYS 120 22.174 -4.644 -5.297 891 HD3 LYS 120 HD3 LYS 120 22.789 -4.254 -3.674 892 HE2 LYS 120 HE2 LYS 120 20.694 -5.349 -2.718 893 HE3 LYS 120 HE3 LYS 120 20.291 -5.874 -4.358 894 HZ1 LYS 120 HZ1 LYS 120 21.497 -7.618 -3.130 895 HZ2 LYS 120 HZ2 LYS 120 22.422 -7.130 -4.388 896 HZ3 LYS 120 HZ3 LYS 120 22.766 -6.638 -2.863 897 H GLU 121 H GLU 121 22.517 0.070 -3.119 898 HA GLU 121 HA GLU 121 21.247 -0.349 -0.644 899 HB2 GLU 121 HB2 GLU 121 23.331 1.726 -1.476 900 HB3 GLU 121 HB3 GLU 121 22.743 1.572 0.185 901 HG2 GLU 121 HG2 GLU 121 23.316 -0.785 0.182 902 HG3 GLU 121 HG3 GLU 121 24.026 -0.611 -1.455 903 H ARG 122 H ARG 122 21.255 2.764 -2.512 904 HA ARG 122 HA ARG 122 19.690 3.985 -0.452 905 HB2 ARG 122 HB2 ARG 122 19.998 4.807 -3.370 906 HB3 ARG 122 HB3 ARG 122 19.265 5.777 -2.089 907 HG2 ARG 122 HG2 ARG 122 22.163 4.924 -2.176 908 HG3 ARG 122 HG3 ARG 122 21.539 6.520 -2.583 909 HD2 ARG 122 HD2 ARG 122 21.584 5.169 0.132 910 HD3 ARG 122 HD3 ARG 122 22.575 6.526 -0.423 911 HE ARG 122 HE ARG 122 19.877 7.359 -0.664 912 HH11 ARG 122 HH11 ARG 122 22.180 6.690 1.896 913 HH12 ARG 122 HH12 ARG 122 21.329 7.676 3.048 914 HH21 ARG 122 HH21 ARG 122 18.756 8.548 0.928 915 HH22 ARG 122 HH22 ARG 122 19.496 8.720 2.491 916 H VAL 123 H VAL 123 18.621 2.143 -3.297 917 HA VAL 123 HA VAL 123 15.842 2.589 -2.643 918 HB VAL 123 HB VAL 123 17.353 0.553 -4.335 919 HG11 VAL 123 HG11 VAL 123 15.288 -0.346 -5.192 920 HG12 VAL 123 HG12 VAL 123 15.447 -0.735 -3.493 921 HG13 VAL 123 HG13 VAL 123 14.339 0.576 -3.985 922 HG21 VAL 123 HG21 VAL 123 17.104 2.797 -5.265 923 HG22 VAL 123 HG22 VAL 123 16.138 1.640 -6.188 924 HG23 VAL 123 HG23 VAL 123 15.333 2.725 -5.037 925 H GLU 124 H GLU 124 17.943 -0.256 -1.847 926 HA GLU 124 HA GLU 124 15.687 -1.469 -0.513 927 HB2 GLU 124 HB2 GLU 124 17.208 -3.106 0.324 928 HB3 GLU 124 HB3 GLU 124 17.357 -2.843 -1.418 929 HG2 GLU 124 HG2 GLU 124 19.487 -2.121 -1.298 930 HG3 GLU 124 HG3 GLU 124 19.287 -1.341 0.278 931 H ASN 125 H ASN 125 18.041 0.792 0.639 932 HA ASN 125 HA ASN 125 17.142 0.474 3.352 933 HB2 ASN 125 HB2 ASN 125 19.010 1.532 3.864 934 HB3 ASN 125 HB3 ASN 125 19.378 1.537 2.136 935 HD21 ASN 125 HD22 ASN 125 18.661 3.230 0.882 936 HD22 ASN 125 HD21 ASN 125 18.508 4.870 1.552 937 H LEU 126 H LEU 126 16.087 2.424 0.664 938 HA LEU 126 HA LEU 126 14.379 4.208 2.232 939 HB2 LEU 126 HB2 LEU 126 15.252 5.014 0.142 940 HB3 LEU 126 HB3 LEU 126 14.676 3.592 -0.727 941 HG LEU 126 HG LEU 126 12.331 4.308 -0.411 942 HD11 LEU 126 HD11 LEU 126 12.550 5.655 1.666 943 HD12 LEU 126 HD12 LEU 126 13.548 6.836 0.794 944 HD13 LEU 126 HD13 LEU 126 11.838 6.605 0.363 945 HD21 LEU 126 HD21 LEU 126 12.410 6.131 -2.011 946 HD22 LEU 126 HD22 LEU 126 14.118 6.437 -1.612 947 HD23 LEU 126 HD23 LEU 126 13.643 4.923 -2.415 948 H ILE 127 H ILE 127 13.724 1.274 0.192 949 HA ILE 127 HA ILE 127 10.900 1.523 0.512 950 HB ILE 127 HB ILE 127 10.735 -0.837 -0.172 951 HG12 ILE 127 HG12 ILE 127 13.753 -0.841 0.110 952 HG13 ILE 127 HG13 ILE 127 12.591 -1.892 0.909 953 HG21 ILE 127 HG21 ILE 127 12.738 0.778 -1.839 954 HG22 ILE 127 HG22 ILE 127 11.581 -0.433 -2.434 955 HG23 ILE 127 HG23 ILE 127 10.991 1.090 -1.773 956 HD11 ILE 127 HD11 ILE 127 13.693 -3.141 -0.817 957 HD12 ILE 127 HD12 ILE 127 12.020 -2.863 -1.348 958 HD13 ILE 127 HD13 ILE 127 13.367 -1.897 -2.032 959 H ALA 128 H ALA 128 13.215 0.040 2.744 960 HA ALA 128 HA ALA 128 11.209 -1.208 4.346 961 HB1 ALA 128 HB1 ALA 128 13.994 -0.175 5.094 962 HB2 ALA 128 HB2 ALA 128 13.034 -1.337 6.033 963 HB3 ALA 128 HB3 ALA 128 13.622 -1.774 4.422 964 H LYS 129 H LYS 129 12.127 2.164 4.065 965 HA LYS 129 HA LYS 129 10.869 3.020 6.595 966 HB2 LYS 129 HB2 LYS 129 11.808 4.654 4.201 967 HB3 LYS 129 HB3 LYS 129 11.311 5.288 5.765 968 HG2 LYS 129 HG2 LYS 129 13.212 4.205 6.867 969 HG3 LYS 129 HG3 LYS 129 13.709 3.454 5.344 970 HD2 LYS 129 HD2 LYS 129 13.948 5.731 4.322 971 HD3 LYS 129 HD3 LYS 129 13.590 6.461 5.886 972 HE2 LYS 129 HE2 LYS 129 15.935 4.593 5.279 973 HE3 LYS 129 HE3 LYS 129 16.021 6.357 5.298 974 HZ1 LYS 129 HZ1 LYS 129 16.774 5.458 7.414 975 HZ2 LYS 129 HZ2 LYS 129 15.401 6.306 7.671 976 HZ3 LYS 129 HZ3 LYS 129 15.377 4.665 7.668 977 H ILE 130 H ILE 130 9.982 2.911 3.151 978 HA ILE 130 HA ILE 130 7.397 4.224 3.811 979 HB ILE 130 HB ILE 130 7.271 4.959 1.498 980 HG12 ILE 130 HG12 ILE 130 9.351 5.083 0.140 981 HG13 ILE 130 HG13 ILE 130 10.128 3.930 1.209 982 HG21 ILE 130 HG21 ILE 130 9.832 5.819 2.891 983 HG22 ILE 130 HG22 ILE 130 8.811 6.765 1.791 984 HG23 ILE 130 HG23 ILE 130 8.195 6.317 3.383 985 HD11 ILE 130 HD11 ILE 130 7.631 3.366 -0.447 986 HD12 ILE 130 HD12 ILE 130 9.284 2.950 -0.920 987 HD13 ILE 130 HD13 ILE 130 8.567 2.179 0.502 988 H SER 131 H SER 131 8.261 1.049 3.175 989 HA SER 131 HA SER 131 6.125 0.204 1.456 990 HB2 SER 131 HB2 SER 131 7.595 -1.274 3.658 991 HB3 SER 131 HB3 SER 131 6.389 -2.011 2.581 992 HG SER 131 HG SER 131 8.804 -0.694 1.839 Start of MODEL 4 1 H MET 1 H1 MET 1 2.446 0.065 1.698 2 HA MET 1 HA MET 1 3.224 -0.527 -0.381 3 HB2 MET 1 HB2 MET 1 1.350 -2.034 -0.988 4 HB3 MET 1 HB3 MET 1 0.327 -0.635 -1.351 5 HG2 MET 1 HG2 MET 1 1.875 0.038 -3.159 6 HG3 MET 1 HG3 MET 1 2.983 -1.255 -2.707 7 HE1 MET 1 HE1 MET 1 2.081 -3.013 -5.905 8 HE2 MET 1 HE2 MET 1 2.756 -1.419 -5.502 9 HE3 MET 1 HE3 MET 1 3.279 -2.863 -4.607 10 H LYS 2 H LYS 2 4.199 1.221 -1.172 11 HA LYS 2 HA LYS 2 2.611 3.630 -2.001 12 HB2 LYS 2 HB2 LYS 2 5.164 3.549 -0.332 13 HB3 LYS 2 HB3 LYS 2 4.636 4.988 -1.201 14 HG2 LYS 2 HG2 LYS 2 2.414 4.848 -0.038 15 HG3 LYS 2 HG3 LYS 2 3.054 3.541 0.953 16 HD2 LYS 2 HD2 LYS 2 4.666 4.968 2.001 17 HD3 LYS 2 HD3 LYS 2 4.353 6.302 0.885 18 HE2 LYS 2 HE2 LYS 2 2.114 5.108 2.560 19 HE3 LYS 2 HE3 LYS 2 3.217 6.288 3.272 20 HZ1 LYS 2 HZ1 LYS 2 1.865 6.977 0.718 21 HZ2 LYS 2 HZ2 LYS 2 1.085 7.166 2.161 22 HZ3 LYS 2 HZ3 LYS 2 2.479 7.956 1.894 23 H LYS 3 H LYS 3 3.768 5.040 -3.513 24 HA LYS 3 HA LYS 3 5.261 3.375 -5.508 25 HB2 LYS 3 HB2 LYS 3 3.644 5.885 -6.086 26 HB3 LYS 3 HB3 LYS 3 4.503 4.906 -7.245 27 HG2 LYS 3 HG2 LYS 3 2.396 4.095 -7.558 28 HG3 LYS 3 HG3 LYS 3 3.063 2.914 -6.448 29 HD2 LYS 3 HD2 LYS 3 0.766 3.425 -5.840 30 HD3 LYS 3 HD3 LYS 3 1.833 3.988 -4.563 31 HE2 LYS 3 HE2 LYS 3 1.784 6.242 -5.999 32 HE3 LYS 3 HE3 LYS 3 0.286 5.564 -6.626 33 HZ1 LYS 3 HZ1 LYS 3 -0.485 5.442 -4.257 34 HZ2 LYS 3 HZ2 LYS 3 0.946 6.127 -3.771 35 HZ3 LYS 3 HZ3 LYS 3 -0.102 6.980 -4.696 36 H VAL 4 H VAL 4 7.124 3.986 -6.349 37 HA VAL 4 HA VAL 4 8.398 6.526 -5.379 38 HB VAL 4 HB VAL 4 10.006 3.997 -5.700 39 HG11 VAL 4 HG11 VAL 4 10.637 6.686 -4.455 40 HG12 VAL 4 HG12 VAL 4 11.695 5.258 -4.444 41 HG13 VAL 4 HG13 VAL 4 11.307 6.041 -5.972 42 HG21 VAL 4 HG21 VAL 4 8.538 3.568 -3.823 43 HG22 VAL 4 HG22 VAL 4 10.159 3.936 -3.234 44 HG23 VAL 4 HG23 VAL 4 8.880 5.168 -3.137 45 H MET 5 H MET 5 9.537 7.700 -6.845 46 HA MET 5 HA MET 5 9.702 6.667 -9.643 47 HB2 MET 5 HB2 MET 5 7.714 7.951 -9.649 48 HB3 MET 5 HB3 MET 5 8.444 9.239 -8.684 49 HG2 MET 5 HG2 MET 5 8.215 9.934 -11.000 50 HG3 MET 5 HG3 MET 5 9.907 9.865 -10.542 51 HE1 MET 5 HE1 MET 5 8.143 8.222 -14.262 52 HE2 MET 5 HE2 MET 5 7.082 8.365 -12.845 53 HE3 MET 5 HE3 MET 5 8.005 9.770 -13.420 54 H PHE 6 H PHE 6 11.542 7.035 -10.618 55 HA PHE 6 HA PHE 6 13.655 8.581 -9.149 56 HB2 PHE 6 HB2 PHE 6 13.998 6.372 -11.185 57 HB3 PHE 6 HB3 PHE 6 15.233 7.091 -10.144 58 HD1 PHE 6 HD1 PHE 6 15.130 6.717 -7.635 59 HD2 PHE 6 HD2 PHE 6 12.701 4.538 -10.434 60 HE1 PHE 6 HE1 PHE 6 14.558 5.100 -5.842 61 HE2 PHE 6 HE2 PHE 6 12.098 2.936 -8.631 62 HZ PHE 6 HZ PHE 6 12.976 3.250 -6.318 63 H VAL 7 H VAL 7 14.715 10.240 -10.080 64 HA VAL 7 HA VAL 7 14.217 10.943 -12.944 65 HB VAL 7 HB VAL 7 14.074 12.577 -10.462 66 HG11 VAL 7 HG11 VAL 7 15.439 13.750 -12.930 67 HG12 VAL 7 HG12 VAL 7 14.753 14.669 -11.581 68 HG13 VAL 7 HG13 VAL 7 16.111 13.611 -11.278 69 HG21 VAL 7 HG21 VAL 7 13.030 12.972 -13.303 70 HG22 VAL 7 HG22 VAL 7 12.161 12.169 -11.947 71 HG23 VAL 7 HG23 VAL 7 12.551 13.878 -11.849 72 H CYS 8 H CYS 8 15.924 11.144 -14.281 73 HA CYS 8 HA CYS 8 18.635 11.677 -13.145 74 HB2 CYS 8 HB2 CYS 8 17.835 9.222 -14.387 75 HB3 CYS 8 HB3 CYS 8 18.849 10.061 -15.578 76 HG CYS 8 HG CYS 8 19.394 9.289 -12.433 77 H LYS 9 H LYS 9 20.154 12.367 -15.128 78 HA LYS 9 HA LYS 9 18.939 14.750 -16.182 79 HB2 LYS 9 HB2 LYS 9 21.488 13.980 -15.597 80 HB3 LYS 9 HB3 LYS 9 21.573 13.896 -17.344 81 HG2 LYS 9 HG2 LYS 9 20.626 16.293 -15.690 82 HG3 LYS 9 HG3 LYS 9 22.261 16.082 -16.274 83 HD2 LYS 9 HD2 LYS 9 19.813 16.444 -18.065 84 HD3 LYS 9 HD3 LYS 9 20.959 17.693 -17.600 85 HE2 LYS 9 HE2 LYS 9 22.817 16.266 -18.628 86 HE3 LYS 9 HE3 LYS 9 21.548 15.233 -19.302 87 HZ1 LYS 9 HZ1 LYS 9 21.877 18.142 -19.858 88 HZ2 LYS 9 HZ2 LYS 9 22.205 16.936 -20.904 89 HZ3 LYS 9 HZ3 LYS 9 20.656 17.232 -20.455 90 H ARG 10 H ARG 10 20.002 11.821 -17.960 91 HA ARG 10 HA ARG 10 17.913 12.477 -20.018 92 HB2 ARG 10 HB2 ARG 10 19.161 11.869 -21.845 93 HB3 ARG 10 HB3 ARG 10 20.145 12.978 -20.920 94 HG2 ARG 10 HG2 ARG 10 20.544 9.946 -20.935 95 HG3 ARG 10 HG3 ARG 10 21.322 11.063 -22.031 96 HD2 ARG 10 HD2 ARG 10 21.869 12.134 -19.479 97 HD3 ARG 10 HD3 ARG 10 22.068 10.396 -19.281 98 HE ARG 10 HE ARG 10 23.695 12.267 -20.861 99 HH11 ARG 10 HH21 ARG 10 23.068 8.785 -20.525 100 HH12 ARG 10 HH22 ARG 10 24.667 8.443 -21.223 101 HH21 ARG 10 HH11 ARG 10 25.657 11.567 -21.752 102 HH22 ARG 10 HH12 ARG 10 25.942 9.828 -21.831 103 H ASN 11 H ASN 11 17.863 10.716 -17.692 104 HA ASN 11 HA ASN 11 17.383 8.593 -16.954 105 HB2 ASN 11 HB2 ASN 11 15.328 9.780 -17.587 106 HB3 ASN 11 HB3 ASN 11 15.339 9.022 -19.156 107 HD21 ASN 11 HD22 ASN 11 15.554 7.907 -15.665 108 HD22 ASN 11 HD21 ASN 11 14.509 6.544 -15.934 109 H SER 12 H SER 12 19.638 8.271 -18.570 110 HA SER 12 HA SER 12 19.151 5.818 -20.126 111 HB2 SER 12 HB2 SER 12 21.588 6.201 -20.745 112 HB3 SER 12 HB3 SER 12 20.461 7.502 -21.155 113 HG SER 12 HG SER 12 22.238 7.444 -18.895 114 H CYS 13 H CYS 13 20.652 6.657 -17.039 115 HA CYS 13 HA CYS 13 21.207 3.771 -16.495 116 HB2 CYS 13 HB2 CYS 13 23.234 4.949 -17.491 117 HB3 CYS 13 HB3 CYS 13 23.272 6.001 -16.070 118 HG CYS 13 HG CYS 13 25.121 4.048 -16.000 119 H ARG 14 H ARG 14 22.453 4.370 -13.940 120 HA ARG 14 HA ARG 14 21.793 4.544 -11.710 121 HB2 ARG 14 HB2 ARG 14 21.478 7.327 -12.875 122 HB3 ARG 14 HB3 ARG 14 21.375 7.049 -11.130 123 HG2 ARG 14 HG2 ARG 14 23.629 6.733 -10.917 124 HG3 ARG 14 HG3 ARG 14 23.723 5.774 -12.389 125 HD2 ARG 14 HD2 ARG 14 25.082 7.670 -12.683 126 HD3 ARG 14 HD3 ARG 14 23.708 7.816 -13.772 127 HE ARG 14 HE ARG 14 22.732 9.376 -11.902 128 HH11 ARG 14 HH11 ARG 14 26.208 9.253 -12.405 129 HH12 ARG 14 HH12 ARG 14 26.347 10.981 -12.357 130 HH21 ARG 14 HH21 ARG 14 23.049 11.503 -11.707 131 HH22 ARG 14 HH22 ARG 14 24.610 12.250 -12.015 132 H SER 15 H SER 15 19.262 6.828 -12.621 133 HA SER 15 HA SER 15 17.235 5.847 -10.974 134 HB2 SER 15 HB2 SER 15 16.901 7.161 -13.698 135 HB3 SER 15 HB3 SER 15 15.856 7.352 -12.278 136 HG SER 15 HG SER 15 17.209 8.951 -11.723 137 H GLN 16 H GLN 16 18.071 4.756 -14.268 138 HA GLN 16 HA GLN 16 15.764 3.005 -14.572 139 HB2 GLN 16 HB2 GLN 16 18.528 3.092 -15.856 140 HB3 GLN 16 HB3 GLN 16 17.281 1.993 -16.385 141 HG2 GLN 16 HG2 GLN 16 16.949 5.033 -16.396 142 HG3 GLN 16 HG3 GLN 16 17.563 4.085 -17.737 143 HE21 GLN 16 HE22 GLN 16 15.745 5.164 -18.866 144 HE22 GLN 16 HE21 GLN 16 14.185 4.333 -18.834 145 H MET 17 H MET 17 19.059 2.481 -13.229 146 HA MET 17 HA MET 17 18.697 -0.360 -12.628 147 HB2 MET 17 HB2 MET 17 20.587 1.718 -11.424 148 HB3 MET 17 HB3 MET 17 20.608 0.000 -11.061 149 HG2 MET 17 HG2 MET 17 21.198 -0.510 -13.399 150 HG3 MET 17 HG3 MET 17 21.196 1.221 -13.785 151 HE1 MET 17 HE1 MET 17 23.543 -1.044 -14.067 152 HE2 MET 17 HE2 MET 17 23.809 0.610 -14.679 153 HE3 MET 17 HE3 MET 17 25.000 -0.137 -13.590 154 H ALA 18 H ALA 18 17.988 2.692 -10.909 155 HA ALA 18 HA ALA 18 17.418 1.547 -8.365 156 HB1 ALA 18 HB1 ALA 18 16.399 3.673 -7.867 157 HB2 ALA 18 HB2 ALA 18 17.791 3.994 -8.917 158 HB3 ALA 18 HB3 ALA 18 16.146 4.034 -9.588 159 H GLU 19 H GLU 19 15.246 2.110 -11.167 160 HA GLU 19 HA GLU 19 12.933 0.848 -10.008 161 HB2 GLU 19 HB2 GLU 19 13.028 2.274 -12.102 162 HB3 GLU 19 HB3 GLU 19 13.762 0.896 -12.923 163 HG2 GLU 19 HG2 GLU 19 11.664 -0.445 -12.162 164 HG3 GLU 19 HG3 GLU 19 10.975 1.112 -11.718 165 H GLY 20 H GLY 20 15.699 -0.522 -11.830 166 HA2 GLY 20 HA2 GLY 20 14.933 -3.234 -11.940 167 HA3 GLY 20 HA3 GLY 20 16.589 -2.645 -11.858 168 H PHE 21 H PHE 21 16.861 -1.663 -9.288 169 HA PHE 21 HA PHE 21 16.772 -4.102 -7.690 170 HB2 PHE 21 HB2 PHE 21 17.537 -1.228 -7.047 171 HB3 PHE 21 HB3 PHE 21 17.571 -2.522 -5.845 172 HD1 PHE 21 HD2 PHE 21 18.729 -4.790 -6.673 173 HD2 PHE 21 HD1 PHE 21 19.553 -0.855 -8.243 174 HE1 PHE 21 HE2 PHE 21 20.911 -5.594 -7.526 175 HE2 PHE 21 HE1 PHE 21 21.734 -1.652 -9.082 176 HZ PHE 21 HZ PHE 21 22.408 -4.050 -8.737 177 H ALA 22 H ALA 22 14.829 -1.081 -7.557 178 HA ALA 22 HA ALA 22 13.341 -1.924 -5.274 179 HB1 ALA 22 HB1 ALA 22 11.853 -0.080 -5.868 180 HB2 ALA 22 HB2 ALA 22 13.543 0.410 -6.091 181 HB3 ALA 22 HB3 ALA 22 12.579 -0.011 -7.508 182 H LYS 23 H LYS 23 12.578 -2.506 -8.776 183 HA LYS 23 HA LYS 23 10.006 -3.689 -8.249 184 HB2 LYS 23 HB2 LYS 23 10.035 -4.465 -10.499 185 HB3 LYS 23 HB3 LYS 23 10.814 -2.877 -10.459 186 HG2 LYS 23 HG2 LYS 23 13.025 -4.070 -10.468 187 HG3 LYS 23 HG3 LYS 23 12.196 -5.591 -10.738 188 HD2 LYS 23 HD2 LYS 23 11.895 -3.175 -12.574 189 HD3 LYS 23 HD3 LYS 23 13.203 -4.322 -12.777 190 HE2 LYS 23 HE2 LYS 23 10.307 -5.257 -12.752 191 HE3 LYS 23 HE3 LYS 23 11.061 -4.605 -14.207 192 HZ1 LYS 23 HZ1 LYS 23 12.120 -6.965 -12.720 193 HZ2 LYS 23 HZ2 LYS 23 11.264 -7.029 -14.107 194 HZ3 LYS 23 HZ3 LYS 23 12.749 -6.348 -14.115 195 H THR 24 H THR 24 13.170 -5.002 -8.042 196 HA THR 24 HA THR 24 12.323 -7.808 -7.713 197 HB THR 24 HB THR 24 15.067 -6.611 -7.268 198 HG1 THR 24 HG1 THR 24 14.755 -6.156 -9.345 199 HG21 THR 24 HG21 THR 24 15.850 -8.872 -7.878 200 HG22 THR 24 HG22 THR 24 14.799 -8.954 -6.461 201 HG23 THR 24 HG23 THR 24 14.173 -9.422 -8.060 202 H LEU 25 H LEU 25 13.876 -5.346 -5.583 203 HA LEU 25 HA LEU 25 13.816 -7.148 -3.271 204 HB2 LEU 25 HB2 LEU 25 14.728 -4.243 -3.516 205 HB3 LEU 25 HB3 LEU 25 15.078 -5.312 -2.170 206 HG LEU 25 HG LEU 25 16.057 -5.727 -5.040 207 HD11 LEU 25 HD11 LEU 25 17.026 -3.787 -3.700 208 HD12 LEU 25 HD12 LEU 25 17.631 -5.023 -2.571 209 HD13 LEU 25 HD13 LEU 25 18.186 -5.016 -4.256 210 HD21 LEU 25 HD21 LEU 25 17.546 -7.440 -4.043 211 HD22 LEU 25 HD22 LEU 25 16.681 -7.272 -2.493 212 HD23 LEU 25 HD23 LEU 25 15.845 -7.902 -3.932 213 H GLY 26 H GLY 26 11.929 -4.393 -4.399 214 HA2 GLY 26 HA2 GLY 26 10.218 -4.363 -1.975 215 HA3 GLY 26 HA3 GLY 26 10.274 -3.197 -3.299 216 H ALA 27 H ALA 27 10.264 -6.435 -4.439 217 HA ALA 27 HA ALA 27 8.125 -6.133 -6.119 218 HB1 ALA 27 HB1 ALA 27 9.076 -8.725 -4.813 219 HB2 ALA 27 HB2 ALA 27 8.154 -8.606 -6.330 220 HB3 ALA 27 HB3 ALA 27 9.800 -7.958 -6.234 221 H GLY 28 H GLY 28 6.087 -5.504 -5.625 222 HA2 GLY 28 HA2 GLY 28 3.855 -5.975 -5.169 223 HA3 GLY 28 HA3 GLY 28 4.322 -7.368 -4.193 224 H LYS 29 H LYS 29 6.250 -5.393 -2.705 225 HA LYS 29 HA LYS 29 4.232 -4.176 -0.885 226 HB2 LYS 29 HB2 LYS 29 6.166 -3.605 0.540 227 HB3 LYS 29 HB3 LYS 29 5.804 -5.332 0.370 228 HG2 LYS 29 HG2 LYS 29 7.661 -5.452 -1.353 229 HG3 LYS 29 HG3 LYS 29 8.103 -3.793 -0.899 230 HD2 LYS 29 HD2 LYS 29 8.042 -6.258 0.915 231 HD3 LYS 29 HD3 LYS 29 9.490 -5.590 0.150 232 HE2 LYS 29 HE2 LYS 29 9.224 -3.478 1.415 233 HE3 LYS 29 HE3 LYS 29 7.743 -4.102 2.168 234 HZ1 LYS 29 HZ1 LYS 29 10.451 -5.288 2.544 235 HZ2 LYS 29 HZ2 LYS 29 9.632 -4.407 3.654 236 HZ3 LYS 29 HZ3 LYS 29 9.074 -5.873 3.204 237 H ILE 30 H ILE 30 6.468 -3.199 -3.372 238 HA ILE 30 HA ILE 30 5.152 -0.580 -3.166 239 HB ILE 30 HB ILE 30 7.223 0.658 -3.757 240 HG12 ILE 30 HG12 ILE 30 9.413 -0.214 -3.343 241 HG13 ILE 30 HG13 ILE 30 8.778 -1.799 -2.917 242 HG21 ILE 30 HG21 ILE 30 8.208 0.635 -1.523 243 HG22 ILE 30 HG22 ILE 30 6.439 0.521 -1.408 244 HG23 ILE 30 HG23 ILE 30 7.459 -0.921 -1.159 245 HD11 ILE 30 HD11 ILE 30 9.898 -1.527 -5.186 246 HD12 ILE 30 HD12 ILE 30 8.327 -2.330 -5.190 247 HD13 ILE 30 HD13 ILE 30 8.472 -0.620 -5.701 248 H ALA 31 H ALA 31 5.489 0.756 -5.237 249 HA ALA 31 HA ALA 31 5.926 -0.937 -7.643 250 HB1 ALA 31 HB1 ALA 31 3.526 -0.794 -7.517 251 HB2 ALA 31 HB2 ALA 31 3.580 0.958 -7.236 252 HB3 ALA 31 HB3 ALA 31 4.070 0.287 -8.804 253 H VAL 32 H VAL 32 6.987 0.167 -9.397 254 HA VAL 32 HA VAL 32 8.048 2.847 -8.741 255 HB VAL 32 HB VAL 32 10.248 1.736 -9.586 256 HG11 VAL 32 HG11 VAL 32 9.184 1.368 -6.758 257 HG12 VAL 32 HG12 VAL 32 10.892 1.441 -7.235 258 HG13 VAL 32 HG13 VAL 32 9.875 2.846 -7.463 259 HG21 VAL 32 HG21 VAL 32 10.701 -0.503 -8.921 260 HG22 VAL 32 HG22 VAL 32 9.074 -0.717 -8.251 261 HG23 VAL 32 HG23 VAL 32 9.312 -0.538 -10.010 262 H THR 33 H THR 33 8.920 4.067 -10.233 263 HA THR 33 HA THR 33 8.746 3.312 -13.114 264 HB THR 33 HB THR 33 7.701 5.938 -12.004 265 HG1 THR 33 HG1 THR 33 5.624 5.070 -12.339 266 HG21 THR 33 HG21 THR 33 6.565 6.116 -14.185 267 HG22 THR 33 HG22 THR 33 8.309 5.964 -14.426 268 HG23 THR 33 HG23 THR 33 7.255 4.555 -14.697 269 H SER 34 H SER 34 10.336 4.344 -14.419 270 HA SER 34 HA SER 34 12.209 6.234 -13.058 271 HB2 SER 34 HB2 SER 34 13.018 3.895 -13.842 272 HB3 SER 34 HB3 SER 34 12.876 4.567 -15.485 273 HG SER 34 HG SER 34 14.558 5.279 -13.342 274 H CYS 35 H CYS 35 12.777 8.119 -14.011 275 HA CYS 35 HA CYS 35 12.107 8.740 -16.795 276 HB2 CYS 35 HB2 CYS 35 10.635 10.561 -16.317 277 HB3 CYS 35 HB3 CYS 35 10.034 9.157 -15.409 278 HG CYS 35 HG CYS 35 11.361 9.819 -13.173 279 H GLY 36 H GLY 36 12.665 11.289 -17.102 280 HA2 GLY 36 HA2 GLY 36 14.708 12.280 -15.237 281 HA3 GLY 36 HA3 GLY 36 15.310 11.920 -16.865 282 H LEU 37 H LEU 37 15.532 14.499 -15.922 283 HA LEU 37 HA LEU 37 13.247 16.070 -16.791 284 HB2 LEU 37 HB2 LEU 37 14.666 18.028 -16.752 285 HB3 LEU 37 HB3 LEU 37 14.533 17.177 -15.234 286 HG LEU 37 HG LEU 37 16.919 16.530 -16.982 287 HD11 LEU 37 HD11 LEU 37 16.688 19.050 -15.281 288 HD12 LEU 37 HD12 LEU 37 18.181 18.428 -16.021 289 HD13 LEU 37 HD13 LEU 37 16.854 18.988 -17.050 290 HD21 LEU 37 HD21 LEU 37 16.519 15.379 -14.780 291 HD22 LEU 37 HD22 LEU 37 18.003 16.346 -14.752 292 HD23 LEU 37 HD23 LEU 37 16.518 16.947 -13.985 293 H GLU 38 H GLU 38 15.637 14.420 -18.459 294 HA GLU 38 HA GLU 38 14.453 15.231 -21.037 295 HB2 GLU 38 HB2 GLU 38 17.474 14.946 -20.747 296 HB3 GLU 38 HB3 GLU 38 16.573 15.290 -22.208 297 HG2 GLU 38 HG2 GLU 38 15.809 17.459 -21.206 298 HG3 GLU 38 HG3 GLU 38 16.850 17.140 -19.809 299 H SER 39 H SER 39 15.136 13.546 -22.752 300 HA SER 39 HA SER 39 15.471 10.809 -21.584 301 HB2 SER 39 HB2 SER 39 13.071 11.294 -22.002 302 HB3 SER 39 HB3 SER 39 13.462 11.593 -23.714 303 HG SER 39 HG SER 39 12.871 9.443 -23.525 304 H SER 40 H SER 40 16.501 9.318 -22.910 305 HA SER 40 HA SER 40 17.293 10.094 -25.663 306 HB2 SER 40 HB2 SER 40 19.159 10.913 -24.395 307 HB3 SER 40 HB3 SER 40 19.333 9.369 -23.541 308 HG SER 40 HG SER 40 20.751 9.740 -25.460 309 H ARG 41 H ARG 41 18.518 7.457 -23.636 310 HA ARG 41 HA ARG 41 16.592 5.474 -24.361 311 HB2 ARG 41 HB2 ARG 41 18.315 3.953 -25.569 312 HB3 ARG 41 HB3 ARG 41 17.508 5.203 -26.482 313 HG2 ARG 41 HG2 ARG 41 19.847 4.982 -27.101 314 HG3 ARG 41 HG3 ARG 41 19.468 6.598 -26.545 315 HD2 ARG 41 HD2 ARG 41 20.603 6.252 -24.444 316 HD3 ARG 41 HD3 ARG 41 20.806 4.524 -24.759 317 HE ARG 41 HE ARG 41 22.361 6.770 -25.843 318 HH11 ARG 41 HH21 ARG 41 21.665 3.360 -26.366 319 HH12 ARG 41 HH22 ARG 41 23.135 3.111 -27.259 320 HH21 ARG 41 HH11 ARG 41 24.239 6.357 -26.941 321 HH22 ARG 41 HH12 ARG 41 24.567 4.766 -27.554 322 H VAL 42 H VAL 42 17.168 3.318 -23.293 323 HA VAL 42 HA VAL 42 18.721 3.720 -20.836 324 HB VAL 42 HB VAL 42 17.995 0.991 -21.995 325 HG11 VAL 42 HG11 VAL 42 18.754 1.966 -19.184 326 HG12 VAL 42 HG12 VAL 42 18.192 0.326 -19.575 327 HG13 VAL 42 HG13 VAL 42 19.722 0.889 -20.215 328 HG21 VAL 42 HG21 VAL 42 16.198 0.983 -20.379 329 HG22 VAL 42 HG22 VAL 42 16.479 2.705 -20.004 330 HG23 VAL 42 HG23 VAL 42 15.931 2.209 -21.633 331 H HIS 43 H HIS 43 20.878 3.262 -20.431 332 HA HIS 43 HA HIS 43 22.696 2.962 -22.693 333 HB2 HIS 43 HB2 HIS 43 23.067 4.205 -20.447 334 HB3 HIS 43 HB3 HIS 43 23.382 2.620 -19.747 335 HD2 HIS 43 HD2 HIS 43 24.947 5.398 -21.701 336 HE1 HIS 43 HE1 HIS 43 27.796 2.242 -21.868 337 HE2 HIS 43 HE2 HIS 43 27.390 4.729 -22.336 338 HA PRO 44 HA PRO 44 21.780 -1.295 -22.776 339 HB2 PRO 44 HB2 PRO 44 23.632 -2.327 -24.539 340 HB3 PRO 44 HB3 PRO 44 22.312 -1.211 -25.024 341 HG2 PRO 44 HG2 PRO 44 25.189 -0.481 -24.373 342 HG3 PRO 44 HG3 PRO 44 24.239 -0.038 -25.828 343 HD2 PRO 44 HD2 PRO 44 24.451 1.637 -23.701 344 HD3 PRO 44 HD3 PRO 44 22.911 1.496 -24.610 345 H THR 45 H THR 45 25.076 -0.296 -21.866 346 HA THR 45 HA THR 45 25.834 -2.785 -20.625 347 HB THR 45 HB THR 45 26.857 0.015 -20.039 348 HG1 THR 45 HG1 THR 45 28.444 -0.582 -21.574 349 HG21 THR 45 HG21 THR 45 27.613 -1.523 -18.323 350 HG22 THR 45 HG22 THR 45 27.974 -2.783 -19.523 351 HG23 THR 45 HG23 THR 45 28.949 -1.281 -19.448 352 H ALA 46 H ALA 46 23.833 -0.062 -19.470 353 HA ALA 46 HA ALA 46 23.906 -0.737 -16.682 354 HB1 ALA 46 HB1 ALA 46 21.820 0.556 -16.563 355 HB2 ALA 46 HB2 ALA 46 22.955 1.374 -17.655 356 HB3 ALA 46 HB3 ALA 46 21.598 0.425 -18.319 357 H ILE 47 H ILE 47 21.772 -1.859 -19.323 358 HA ILE 47 HA ILE 47 20.204 -3.724 -17.796 359 HB ILE 47 HB ILE 47 21.000 -3.612 -20.727 360 HG12 ILE 47 HG12 ILE 47 18.160 -3.172 -19.951 361 HG13 ILE 47 HG13 ILE 47 19.252 -1.959 -19.292 362 HG21 ILE 47 HG21 ILE 47 20.440 -5.928 -20.271 363 HG22 ILE 47 HG22 ILE 47 18.963 -5.455 -19.415 364 HG23 ILE 47 HG23 ILE 47 19.120 -5.175 -21.166 365 HD11 ILE 47 HD11 ILE 47 18.281 -1.381 -21.521 366 HD12 ILE 47 HD12 ILE 47 20.051 -1.329 -21.435 367 HD13 ILE 47 HD13 ILE 47 19.230 -2.700 -22.241 368 H ALA 48 H ALA 48 23.353 -4.152 -19.503 369 HA ALA 48 HA ALA 48 23.569 -6.969 -18.973 370 HB1 ALA 48 HB1 ALA 48 25.917 -6.667 -19.527 371 HB2 ALA 48 HB2 ALA 48 24.902 -5.776 -20.672 372 HB3 ALA 48 HB3 ALA 48 25.769 -4.908 -19.382 373 H MET 49 H MET 49 24.681 -4.121 -17.164 374 HA MET 49 HA MET 49 25.974 -5.578 -15.045 375 HB2 MET 49 HB2 MET 49 24.909 -2.735 -15.164 376 HB3 MET 49 HB3 MET 49 25.982 -3.342 -13.897 377 HG2 MET 49 HG2 MET 49 26.865 -3.584 -16.772 378 HG3 MET 49 HG3 MET 49 26.868 -2.022 -15.994 379 HE1 MET 49 HE1 MET 49 28.323 -5.481 -16.346 380 HE2 MET 49 HE2 MET 49 29.720 -5.523 -15.237 381 HE3 MET 49 HE3 MET 49 28.085 -5.753 -14.596 382 H MET 50 H MET 50 22.594 -4.646 -15.468 383 HA MET 50 HA MET 50 21.862 -5.522 -12.747 384 HB2 MET 50 HB2 MET 50 20.183 -4.960 -15.222 385 HB3 MET 50 HB3 MET 50 19.539 -5.351 -13.630 386 HG2 MET 50 HG2 MET 50 21.137 -2.885 -14.372 387 HG3 MET 50 HG3 MET 50 19.432 -2.970 -13.967 388 HE1 MET 50 HE1 MET 50 19.882 -5.072 -11.210 389 HE2 MET 50 HE2 MET 50 19.464 -3.711 -10.150 390 HE3 MET 50 HE3 MET 50 18.612 -3.915 -11.691 391 H GLU 51 H GLU 51 21.923 -7.011 -16.041 392 HA GLU 51 HA GLU 51 20.706 -9.477 -15.182 393 HB2 GLU 51 HB2 GLU 51 22.378 -8.619 -17.552 394 HB3 GLU 51 HB3 GLU 51 21.980 -10.320 -17.320 395 HG2 GLU 51 HG2 GLU 51 19.782 -8.230 -17.294 396 HG3 GLU 51 HG3 GLU 51 20.444 -8.841 -18.805 397 H GLU 52 H GLU 52 24.055 -8.321 -15.038 398 HA GLU 52 HA GLU 52 25.322 -10.762 -14.277 399 HB2 GLU 52 HB2 GLU 52 25.868 -7.850 -13.619 400 HB3 GLU 52 HB3 GLU 52 26.920 -9.136 -13.048 401 HG2 GLU 52 HG2 GLU 52 26.300 -8.705 -15.995 402 HG3 GLU 52 HG3 GLU 52 27.648 -7.967 -15.155 403 H VAL 53 H VAL 53 23.064 -8.835 -12.449 404 HA VAL 53 HA VAL 53 23.514 -10.578 -10.060 405 HB VAL 53 HB VAL 53 22.380 -8.872 -8.684 406 HG11 VAL 53 HG11 VAL 53 24.886 -7.938 -10.121 407 HG12 VAL 53 HG12 VAL 53 24.312 -7.370 -8.533 408 HG13 VAL 53 HG13 VAL 53 24.822 -9.050 -8.746 409 HG21 VAL 53 HG21 VAL 53 22.164 -6.574 -9.448 410 HG22 VAL 53 HG22 VAL 53 22.736 -7.002 -11.068 411 HG23 VAL 53 HG23 VAL 53 21.173 -7.613 -10.472 412 H GLY 54 H GLY 54 21.906 -10.882 -12.663 413 HA2 GLY 54 HA2 GLY 54 20.128 -12.186 -13.220 414 HA3 GLY 54 HA3 GLY 54 19.871 -12.520 -11.502 415 H ILE 55 H ILE 55 19.747 -9.165 -12.501 416 HA ILE 55 HA ILE 55 16.784 -9.134 -12.106 417 HB ILE 55 HB ILE 55 18.904 -7.021 -11.685 418 HG12 ILE 55 HG12 ILE 55 16.948 -8.447 -9.832 419 HG13 ILE 55 HG13 ILE 55 18.692 -8.676 -9.878 420 HG21 ILE 55 HG21 ILE 55 17.071 -5.512 -11.013 421 HG22 ILE 55 HG22 ILE 55 16.911 -5.937 -12.703 422 HG23 ILE 55 HG23 ILE 55 15.869 -6.726 -11.488 423 HD11 ILE 55 HD11 ILE 55 18.980 -6.277 -9.162 424 HD12 ILE 55 HD12 ILE 55 17.222 -6.206 -8.895 425 HD13 ILE 55 HD13 ILE 55 18.207 -7.341 -7.968 426 H ASP 56 H ASP 56 15.514 -8.751 -13.813 427 HA ASP 56 HA ASP 56 16.821 -7.989 -16.358 428 HB2 ASP 56 HB2 ASP 56 15.493 -10.015 -16.346 429 HB3 ASP 56 HB3 ASP 56 14.068 -9.103 -15.817 430 H ILE 57 H ILE 57 16.786 -6.046 -17.089 431 HA ILE 57 HA ILE 57 14.357 -4.346 -16.813 432 HB ILE 57 HB ILE 57 15.714 -2.338 -16.808 433 HG12 ILE 57 HG12 ILE 57 18.177 -3.845 -15.970 434 HG13 ILE 57 HG13 ILE 57 17.855 -3.616 -17.683 435 HG21 ILE 57 HG21 ILE 57 16.301 -2.315 -14.450 436 HG22 ILE 57 HG22 ILE 57 14.809 -3.238 -14.693 437 HG23 ILE 57 HG23 ILE 57 16.351 -4.097 -14.415 438 HD11 ILE 57 HD11 ILE 57 19.319 -1.826 -16.734 439 HD12 ILE 57 HD12 ILE 57 17.834 -1.185 -17.454 440 HD13 ILE 57 HD13 ILE 57 17.988 -1.315 -15.683 441 H SER 58 H SER 58 15.543 -6.267 -18.954 442 HA SER 58 HA SER 58 16.630 -4.747 -21.077 443 HB2 SER 58 HB2 SER 58 14.981 -7.285 -21.388 444 HB3 SER 58 HB3 SER 58 16.257 -6.681 -22.456 445 HG SER 58 HG SER 58 16.410 -7.771 -19.856 446 H GLY 59 H GLY 59 13.253 -5.205 -20.210 447 HA2 GLY 59 HA2 GLY 59 12.150 -4.133 -22.699 448 HA3 GLY 59 HA3 GLY 59 11.280 -4.531 -21.222 449 H GLN 60 H GLN 60 13.859 -2.407 -20.357 450 HA GLN 60 HA GLN 60 11.961 -0.232 -19.924 451 HB2 GLN 60 HB2 GLN 60 14.915 -0.610 -19.363 452 HB3 GLN 60 HB3 GLN 60 14.124 0.958 -19.178 453 HG2 GLN 60 HG2 GLN 60 12.568 0.060 -17.527 454 HG3 GLN 60 HG3 GLN 60 13.328 -1.535 -17.653 455 HE21 GLN 60 HE22 GLN 60 13.223 -0.137 -15.175 456 HE22 GLN 60 HE21 GLN 60 14.916 0.259 -14.769 457 H THR 61 H THR 61 12.193 1.832 -20.637 458 HA THR 61 HA THR 61 13.918 2.562 -22.899 459 HB THR 61 HB THR 61 12.007 3.871 -23.892 460 HG1 THR 61 HG1 THR 61 9.909 3.194 -23.380 461 HG21 THR 61 HG21 THR 61 11.560 0.855 -23.942 462 HG22 THR 61 HG22 THR 61 11.048 2.037 -25.165 463 HG23 THR 61 HG23 THR 61 12.771 1.722 -24.909 464 H SER 62 H SER 62 14.062 5.029 -22.968 465 HA SER 62 HA SER 62 13.807 6.098 -20.227 466 HB2 SER 62 HB2 SER 62 15.125 7.979 -21.051 467 HB3 SER 62 HB3 SER 62 15.915 6.393 -21.258 468 HG SER 62 HG SER 62 14.576 7.940 -23.243 469 H ASP 63 H ASP 63 12.634 7.877 -19.654 470 HA ASP 63 HA ASP 63 10.806 9.102 -21.663 471 HB2 ASP 63 HB2 ASP 63 9.905 7.611 -19.197 472 HB3 ASP 63 HB3 ASP 63 8.925 8.885 -19.926 473 HA PRO 64 HA PRO 64 11.743 12.719 -19.352 474 HB2 PRO 64 HB2 PRO 64 10.228 14.593 -20.572 475 HB3 PRO 64 HB3 PRO 64 11.479 13.668 -21.457 476 HG2 PRO 64 HG2 PRO 64 8.492 13.104 -21.342 477 HG3 PRO 64 HG3 PRO 64 9.534 13.217 -22.792 478 HD2 PRO 64 HD2 PRO 64 8.913 10.825 -21.582 479 HD3 PRO 64 HD3 PRO 64 10.473 11.114 -22.402 480 H ILE 65 H ILE 65 11.190 13.961 -17.629 481 HA ILE 65 HA ILE 65 9.167 13.296 -15.823 482 HB ILE 65 HB ILE 65 11.394 14.502 -15.514 483 HG12 ILE 65 HG12 ILE 65 8.975 15.562 -14.066 484 HG13 ILE 65 HG13 ILE 65 9.881 14.075 -13.713 485 HG21 ILE 65 HG21 ILE 65 9.809 17.064 -15.980 486 HG22 ILE 65 HG22 ILE 65 11.508 16.917 -15.545 487 HG23 ILE 65 HG23 ILE 65 10.984 16.398 -17.147 488 HD11 ILE 65 HD11 ILE 65 11.933 15.581 -13.377 489 HD12 ILE 65 HD12 ILE 65 10.788 16.941 -13.352 490 HD13 ILE 65 HD13 ILE 65 10.670 15.669 -12.139 491 H GLU 66 H GLU 66 9.138 15.784 -18.333 492 HA GLU 66 HA GLU 66 6.825 17.225 -17.665 493 HB2 GLU 66 HB2 GLU 66 7.958 16.488 -20.397 494 HB3 GLU 66 HB3 GLU 66 6.712 17.712 -20.154 495 HG2 GLU 66 HG2 GLU 66 9.498 17.851 -18.919 496 HG3 GLU 66 HG3 GLU 66 9.027 18.619 -20.426 497 H ASN 67 H ASN 67 6.899 13.964 -19.039 498 HA ASN 67 HA ASN 67 4.027 14.117 -19.751 499 HB2 ASN 67 HB2 ASN 67 4.405 12.476 -21.181 500 HB3 ASN 67 HB3 ASN 67 6.110 12.820 -20.971 501 HD21 ASN 67 HD22 ASN 67 7.103 11.522 -18.938 502 HD22 ASN 67 HD21 ASN 67 6.472 9.908 -18.728 503 H PHE 68 H PHE 68 5.719 13.455 -16.893 504 HA PHE 68 HA PHE 68 3.907 11.279 -16.005 505 HB2 PHE 68 HB2 PHE 68 6.646 12.245 -15.177 506 HB3 PHE 68 HB3 PHE 68 5.724 11.159 -14.164 507 HD1 PHE 68 HD2 PHE 68 4.536 9.134 -15.754 508 HD2 PHE 68 HD1 PHE 68 8.320 11.112 -16.335 509 HE1 PHE 68 HE2 PHE 68 5.376 7.161 -16.991 510 HE2 PHE 68 HE1 PHE 68 9.151 9.130 -17.580 511 HZ PHE 68 HZ PHE 68 7.689 7.149 -17.907 512 H ASN 69 H ASN 69 3.573 11.219 -13.583 513 HA ASN 69 HA ASN 69 2.216 13.775 -12.802 514 HB2 ASN 69 HB2 ASN 69 0.369 12.237 -11.979 515 HB3 ASN 69 HB3 ASN 69 0.554 12.444 -13.712 516 HD21 ASN 69 HD22 ASN 69 1.756 10.178 -11.157 517 HD22 ASN 69 HD21 ASN 69 1.433 8.737 -12.120 518 H ALA 70 H ALA 70 3.947 14.375 -11.385 519 HA ALA 70 HA ALA 70 5.031 12.911 -9.309 520 HB1 ALA 70 HB1 ALA 70 4.211 15.835 -9.262 521 HB2 ALA 70 HB2 ALA 70 5.342 15.071 -8.132 522 HB3 ALA 70 HB3 ALA 70 5.752 15.175 -9.859 523 H ASP 71 H ASP 71 1.828 14.402 -9.391 524 HA ASP 71 HA ASP 71 1.109 14.435 -6.675 525 HB2 ASP 71 HB2 ASP 71 -0.084 15.497 -8.590 526 HB3 ASP 71 HB3 ASP 71 -0.618 13.900 -9.121 527 H ASP 72 H ASP 72 1.239 11.650 -8.834 528 HA ASP 72 HA ASP 72 -0.322 9.946 -6.970 529 HB2 ASP 72 HB2 ASP 72 -0.544 9.725 -9.474 530 HB3 ASP 72 HB3 ASP 72 1.142 9.174 -9.498 531 H TYR 73 H TYR 73 3.079 10.568 -7.780 532 HA TYR 73 HA TYR 73 4.030 8.087 -6.616 533 HB2 TYR 73 HB2 TYR 73 5.628 10.570 -7.248 534 HB3 TYR 73 HB3 TYR 73 6.217 8.914 -7.129 535 HD1 TYR 73 HD1 TYR 73 4.102 7.526 -8.883 536 HD2 TYR 73 HD2 TYR 73 6.347 11.184 -9.389 537 HE1 TYR 73 HE1 TYR 73 3.704 7.440 -11.327 538 HE2 TYR 73 HE2 TYR 73 5.927 11.095 -11.840 539 HH TYR 73 HH TYR 73 3.986 8.474 -13.346 540 H ASP 74 H ASP 74 3.770 7.782 -4.451 541 HA ASP 74 HA ASP 74 3.582 9.710 -2.411 542 HB2 ASP 74 HB2 ASP 74 4.882 6.943 -2.326 543 HB3 ASP 74 HB3 ASP 74 4.433 7.887 -0.915 544 H VAL 75 H VAL 75 6.461 8.335 -3.954 545 HA VAL 75 HA VAL 75 8.199 10.288 -2.481 546 HB VAL 75 HB VAL 75 8.805 7.373 -3.057 547 HG11 VAL 75 HG11 VAL 75 10.839 8.745 -3.178 548 HG12 VAL 75 HG12 VAL 75 10.471 9.463 -1.599 549 HG13 VAL 75 HG13 VAL 75 10.842 7.730 -1.738 550 HG21 VAL 75 HG21 VAL 75 8.923 7.253 -0.518 551 HG22 VAL 75 HG22 VAL 75 8.109 8.831 -0.480 552 HG23 VAL 75 HG23 VAL 75 7.303 7.415 -1.196 553 H VAL 76 H VAL 76 9.726 11.292 -3.728 554 HA VAL 76 HA VAL 76 10.239 10.286 -6.510 555 HB VAL 76 HB VAL 76 9.704 13.120 -5.617 556 HG11 VAL 76 HG11 VAL 76 11.752 13.174 -7.061 557 HG12 VAL 76 HG12 VAL 76 10.877 12.247 -8.305 558 HG13 VAL 76 HG13 VAL 76 10.365 13.889 -7.843 559 HG21 VAL 76 HG21 VAL 76 8.116 13.082 -7.514 560 HG22 VAL 76 HG22 VAL 76 8.588 11.414 -7.887 561 HG23 VAL 76 HG23 VAL 76 7.749 11.788 -6.358 562 H ILE 77 H ILE 77 12.329 10.177 -7.101 563 HA ILE 77 HA ILE 77 14.410 11.133 -5.154 564 HB ILE 77 HB ILE 77 14.442 8.571 -6.776 565 HG12 ILE 77 HG12 ILE 77 12.630 8.349 -5.104 566 HG13 ILE 77 HG13 ILE 77 13.973 7.267 -4.804 567 HG21 ILE 77 HG21 ILE 77 16.650 9.341 -6.256 568 HG22 ILE 77 HG22 ILE 77 16.227 9.611 -4.560 569 HG23 ILE 77 HG23 ILE 77 16.274 7.951 -5.234 570 HD11 ILE 77 HD11 ILE 77 13.032 8.352 -2.745 571 HD12 ILE 77 HD12 ILE 77 14.763 8.577 -2.955 572 HD13 ILE 77 HD13 ILE 77 13.632 9.908 -3.314 573 H SER 78 H SER 78 15.927 12.393 -6.059 574 HA SER 78 HA SER 78 16.320 12.337 -9.022 575 HB2 SER 78 HB2 SER 78 16.044 14.552 -7.961 576 HB3 SER 78 HB3 SER 78 17.504 14.247 -6.993 577 HG SER 78 HG SER 78 18.006 15.363 -8.949 578 H LEU 79 H LEU 79 18.140 11.582 -9.917 579 HA LEU 79 HA LEU 79 20.456 10.849 -8.178 580 HB2 LEU 79 HB2 LEU 79 19.424 9.138 -10.483 581 HB3 LEU 79 HB3 LEU 79 20.829 8.842 -9.474 582 HG LEU 79 HG LEU 79 18.933 8.892 -7.518 583 HD11 LEU 79 HD11 LEU 79 16.925 7.853 -8.148 584 HD12 LEU 79 HD12 LEU 79 17.080 9.288 -9.179 585 HD13 LEU 79 HD13 LEU 79 17.454 7.678 -9.826 586 HD21 LEU 79 HD21 LEU 79 19.498 6.503 -9.319 587 HD22 LEU 79 HD22 LEU 79 20.501 7.032 -7.945 588 HD23 LEU 79 HD23 LEU 79 18.856 6.440 -7.659 589 H CYS 80 H CYS 80 20.145 13.293 -9.374 590 HA CYS 80 HA CYS 80 21.438 13.237 -12.062 591 HB2 CYS 80 HB2 CYS 80 20.080 15.496 -10.531 592 HB3 CYS 80 HB3 CYS 80 20.711 15.577 -12.184 593 HG CYS 80 HG CYS 80 18.212 13.904 -10.883 594 H GLY 81 H GLY 81 22.052 14.679 -8.823 595 HA2 GLY 81 HA2 GLY 81 24.262 15.355 -8.054 596 HA3 GLY 81 HA3 GLY 81 24.780 15.516 -9.720 597 H CYS 82 H CYS 82 25.467 17.680 -9.127 598 HA CYS 82 HA CYS 82 23.612 19.764 -8.374 599 HB2 CYS 82 HB2 CYS 82 25.488 21.272 -8.952 600 HB3 CYS 82 HB3 CYS 82 25.993 19.936 -7.910 601 HG CYS 82 HG CYS 82 27.897 20.467 -9.640 602 H GLY 83 H GLY 83 23.171 21.700 -9.699 603 HA2 GLY 83 HA2 GLY 83 22.465 22.797 -11.627 604 HA3 GLY 83 HA3 GLY 83 22.950 21.412 -12.609 605 H VAL 84 H VAL 84 20.994 20.219 -10.166 606 HA VAL 84 HA VAL 84 18.408 20.598 -11.621 607 HB VAL 84 HB VAL 84 19.532 17.921 -10.692 608 HG11 VAL 84 HG11 VAL 84 16.906 18.605 -12.100 609 HG12 VAL 84 HG12 VAL 84 17.518 16.967 -11.792 610 HG13 VAL 84 HG13 VAL 84 17.083 17.984 -10.433 611 HG21 VAL 84 HG21 VAL 84 19.445 17.325 -13.124 612 HG22 VAL 84 HG22 VAL 84 19.069 19.019 -13.498 613 HG23 VAL 84 HG23 VAL 84 20.629 18.581 -12.766 614 H ASN 85 H ASN 85 16.742 21.063 -10.258 615 HA ASN 85 HA ASN 85 16.912 20.124 -7.430 616 HB2 ASN 85 HB2 ASN 85 17.770 22.585 -8.014 617 HB3 ASN 85 HB3 ASN 85 16.051 22.967 -8.007 618 HD21 ASN 85 HD22 ASN 85 18.606 21.314 -6.051 619 HD22 ASN 85 HD21 ASN 85 17.940 21.835 -4.510 620 H LEU 86 H LEU 86 14.935 20.142 -10.108 621 HA LEU 86 HA LEU 86 12.670 19.971 -10.509 622 HB2 LEU 86 HB2 LEU 86 12.866 18.239 -8.028 623 HB3 LEU 86 HB3 LEU 86 11.610 18.182 -9.274 624 HG LEU 86 HG LEU 86 14.479 17.311 -9.560 625 HD11 LEU 86 HD11 LEU 86 13.513 15.132 -9.661 626 HD12 LEU 86 HD12 LEU 86 12.639 15.932 -8.331 627 HD13 LEU 86 HD13 LEU 86 11.884 15.773 -9.929 628 HD21 LEU 86 HD21 LEU 86 13.619 16.564 -11.856 629 HD22 LEU 86 HD22 LEU 86 12.194 17.591 -11.552 630 HD23 LEU 86 HD23 LEU 86 13.819 18.312 -11.689 631 HA PRO 87 HA PRO 87 11.370 23.113 -7.293 632 HB2 PRO 87 HB2 PRO 87 10.643 25.154 -9.045 633 HB3 PRO 87 HB3 PRO 87 12.244 24.943 -8.276 634 HG2 PRO 87 HG2 PRO 87 11.364 24.066 -11.033 635 HG3 PRO 87 HG3 PRO 87 12.871 24.913 -10.560 636 HD2 PRO 87 HD2 PRO 87 12.840 22.237 -10.950 637 HD3 PRO 87 HD3 PRO 87 13.786 22.950 -9.604 638 HA PRO 88 HA PRO 88 6.957 22.849 -9.059 639 HB2 PRO 88 HB2 PRO 88 6.818 20.319 -10.594 640 HB3 PRO 88 HB3 PRO 88 6.217 21.943 -11.030 641 HG2 PRO 88 HG2 PRO 88 8.370 20.750 -12.230 642 HG3 PRO 88 HG3 PRO 88 8.258 22.532 -11.986 643 HD2 PRO 88 HD2 PRO 88 9.712 20.473 -10.308 644 HD3 PRO 88 HD3 PRO 88 10.270 22.065 -10.904 645 H GLU 89 H GLU 89 5.211 20.603 -9.009 646 HA GLU 89 HA GLU 89 5.249 19.776 -6.290 647 HB2 GLU 89 HB2 GLU 89 3.478 18.159 -7.000 648 HB3 GLU 89 HB3 GLU 89 3.163 19.841 -7.383 649 HG2 GLU 89 HG2 GLU 89 4.462 18.192 -9.535 650 HG3 GLU 89 HG3 GLU 89 2.800 17.790 -9.107 651 H TRP 90 H TRP 90 7.300 18.609 -8.659 652 HA TRP 90 HA TRP 90 7.652 15.851 -7.941 653 HB2 TRP 90 HB2 TRP 90 9.412 17.927 -9.233 654 HB3 TRP 90 HB3 TRP 90 9.915 16.254 -8.944 655 HD1 TRP 90 HD1 TRP 90 7.429 18.288 -11.060 656 HE1 TRP 90 HE1 TRP 90 6.338 16.778 -12.818 657 HE3 TRP 90 HE3 TRP 90 9.779 13.915 -9.915 658 HZ2 TRP 90 HZ2 TRP 90 6.385 13.972 -13.547 659 HZ3 TRP 90 HZ3 TRP 90 9.403 11.895 -11.282 660 HH2 TRP 90 HH2 TRP 90 7.714 11.901 -13.084 661 H VAL 91 H VAL 91 8.450 18.707 -6.139 662 HA VAL 91 HA VAL 91 9.953 16.981 -4.190 663 HB VAL 91 HB VAL 91 11.116 18.929 -3.377 664 HG11 VAL 91 HG11 VAL 91 12.213 17.589 -5.017 665 HG12 VAL 91 HG12 VAL 91 11.428 18.462 -6.337 666 HG13 VAL 91 HG13 VAL 91 12.607 19.287 -5.297 667 HG21 VAL 91 HG21 VAL 91 9.495 20.722 -3.934 668 HG22 VAL 91 HG22 VAL 91 11.103 21.071 -4.589 669 HG23 VAL 91 HG23 VAL 91 9.824 20.486 -5.660 670 H THR 92 H THR 92 6.915 18.153 -4.567 671 HA THR 92 HA THR 92 6.551 18.909 -1.708 672 HB THR 92 HB THR 92 4.341 19.634 -2.301 673 HG1 THR 92 HG1 THR 92 3.481 19.297 -4.258 674 HG21 THR 92 HG21 THR 92 4.812 21.445 -3.860 675 HG22 THR 92 HG22 THR 92 6.196 21.230 -2.766 676 HG23 THR 92 HG23 THR 92 6.283 20.636 -4.441 677 H GLN 93 H GLN 93 6.796 16.053 -3.223 678 HA GLN 93 HA GLN 93 4.435 14.687 -2.218 679 HB2 GLN 93 HB2 GLN 93 7.012 13.528 -3.348 680 HB3 GLN 93 HB3 GLN 93 5.492 12.676 -3.071 681 HG2 GLN 93 HG2 GLN 93 6.083 14.780 -5.151 682 HG3 GLN 93 HG3 GLN 93 5.511 13.139 -5.385 683 HE21 GLN 93 HE22 GLN 93 4.512 16.281 -5.605 684 HE22 GLN 93 HE21 GLN 93 2.805 16.073 -5.219 685 H GLU 94 H GLU 94 5.223 12.396 -1.026 686 HA GLU 94 HA GLU 94 5.315 13.351 1.676 687 HB2 GLU 94 HB2 GLU 94 4.100 11.333 0.865 688 HB3 GLU 94 HB3 GLU 94 5.650 10.497 0.680 689 HG2 GLU 94 HG2 GLU 94 6.130 10.674 3.023 690 HG3 GLU 94 HG3 GLU 94 4.640 11.593 3.310 691 H ILE 95 H ILE 95 7.780 11.724 -0.315 692 HA ILE 95 HA ILE 95 9.887 12.863 1.429 693 HB ILE 95 HB ILE 95 9.879 9.946 0.553 694 HG12 ILE 95 HG12 ILE 95 9.716 11.213 3.314 695 HG13 ILE 95 HG13 ILE 95 8.493 10.232 2.500 696 HG21 ILE 95 HG21 ILE 95 12.066 11.503 2.004 697 HG22 ILE 95 HG22 ILE 95 12.088 9.764 1.650 698 HG23 ILE 95 HG23 ILE 95 12.148 10.893 0.328 699 HD11 ILE 95 HD11 ILE 95 9.452 8.800 4.090 700 HD12 ILE 95 HD12 ILE 95 10.181 8.305 2.546 701 HD13 ILE 95 HD13 ILE 95 11.104 9.293 3.697 702 H PHE 96 H PHE 96 11.577 13.663 0.337 703 HA PHE 96 HA PHE 96 11.982 12.888 -2.474 704 HB2 PHE 96 HB2 PHE 96 10.931 15.016 -2.714 705 HB3 PHE 96 HB3 PHE 96 11.970 15.737 -1.483 706 HD1 PHE 96 HD1 PHE 96 11.870 14.430 -5.000 707 HD2 PHE 96 HD2 PHE 96 14.247 16.416 -1.982 708 HE1 PHE 96 HE1 PHE 96 13.655 14.842 -6.659 709 HE2 PHE 96 HE2 PHE 96 15.991 16.889 -3.682 710 HZ PHE 96 HZ PHE 96 15.703 16.103 -6.016 711 H GLU 97 H GLU 97 14.066 12.462 -3.022 712 HA GLU 97 HA GLU 97 16.276 13.198 -1.174 713 HB2 GLU 97 HB2 GLU 97 15.817 10.403 -2.217 714 HB3 GLU 97 HB3 GLU 97 17.281 10.946 -1.427 715 HG2 GLU 97 HG2 GLU 97 14.523 10.824 -0.153 716 HG3 GLU 97 HG3 GLU 97 15.810 9.659 0.073 717 H ASP 98 H ASP 98 18.368 13.206 -2.135 718 HA ASP 98 HA ASP 98 18.488 13.020 -5.102 719 HB2 ASP 98 HB2 ASP 98 18.186 15.356 -4.711 720 HB3 ASP 98 HB3 ASP 98 19.401 15.362 -3.425 721 H TRP 99 H TRP 99 19.615 11.114 -5.078 722 HA TRP 99 HA TRP 99 22.028 10.850 -3.353 723 HB2 TRP 99 HB2 TRP 99 20.934 8.727 -5.185 724 HB3 TRP 99 HB3 TRP 99 22.025 8.555 -3.826 725 HD1 TRP 99 HD1 TRP 99 18.539 8.413 -4.857 726 HE1 TRP 99 HE1 TRP 99 16.917 7.953 -2.893 727 HE3 TRP 99 HE3 TRP 99 21.699 9.286 -0.924 728 HZ2 TRP 99 HZ2 TRP 99 17.094 7.529 -0.088 729 HZ3 TRP 99 HZ3 TRP 99 20.921 8.886 1.401 730 HH2 TRP 99 HH2 TRP 99 18.640 8.014 1.844 731 H GLN 100 H GLN 100 23.674 12.002 -4.220 732 HA GLN 100 HA GLN 100 23.996 12.239 -7.120 733 HB2 GLN 100 HB2 GLN 100 25.722 13.361 -4.874 734 HB3 GLN 100 HB3 GLN 100 25.741 13.823 -6.583 735 HG2 GLN 100 HG2 GLN 100 23.253 14.473 -6.262 736 HG3 GLN 100 HG3 GLN 100 23.516 14.293 -4.538 737 HE21 GLN 100 HE22 GLN 100 22.649 16.702 -5.351 738 HE22 GLN 100 HE21 GLN 100 23.967 17.884 -5.301 739 H LEU 101 H LEU 101 25.030 10.702 -8.273 740 HA LEU 101 HA LEU 101 27.254 9.065 -7.073 741 HB2 LEU 101 HB2 LEU 101 25.082 8.187 -9.015 742 HB3 LEU 101 HB3 LEU 101 26.403 7.194 -8.413 743 HG LEU 101 HG LEU 101 24.060 8.239 -6.775 744 HD11 LEU 101 HD11 LEU 101 23.488 5.901 -6.571 745 HD12 LEU 101 HD12 LEU 101 23.595 6.357 -8.282 746 HD13 LEU 101 HD13 LEU 101 24.921 5.430 -7.521 747 HD21 LEU 101 HD21 LEU 101 26.058 8.179 -5.318 748 HD22 LEU 101 HD22 LEU 101 24.966 6.858 -4.929 749 HD23 LEU 101 HD23 LEU 101 26.431 6.552 -5.899 750 H GLU 102 H GLU 102 28.572 7.930 -8.726 751 HA GLU 102 HA GLU 102 29.836 9.701 -10.574 752 HB2 GLU 102 HB2 GLU 102 29.923 6.680 -10.223 753 HB3 GLU 102 HB3 GLU 102 31.027 7.596 -11.228 754 HG2 GLU 102 HG2 GLU 102 32.144 7.018 -9.242 755 HG3 GLU 102 HG3 GLU 102 31.882 8.763 -9.235 756 H ASP 103 H ASP 103 30.138 9.120 -12.868 757 HA ASP 103 HA ASP 103 27.552 8.398 -14.228 758 HB2 ASP 103 HB2 ASP 103 28.068 10.738 -14.407 759 HB3 ASP 103 HB3 ASP 103 29.683 10.384 -15.010 760 HA PRO 104 HA PRO 104 30.440 5.109 -15.469 761 HB2 PRO 104 HB2 PRO 104 27.908 3.696 -16.166 762 HB3 PRO 104 HB3 PRO 104 29.328 3.114 -15.240 763 HG2 PRO 104 HG2 PRO 104 27.058 3.799 -13.950 764 HG3 PRO 104 HG3 PRO 104 28.651 4.361 -13.323 765 HD2 PRO 104 HD2 PRO 104 26.730 5.872 -15.150 766 HD3 PRO 104 HD3 PRO 104 27.417 6.389 -13.588 767 H ASP 105 H ASP 105 28.199 6.721 -17.565 768 HA ASP 105 HA ASP 105 28.362 5.145 -19.917 769 HB2 ASP 105 HB2 ASP 105 26.703 6.904 -19.435 770 HB3 ASP 105 HB3 ASP 105 27.953 8.142 -19.571 771 H GLY 106 H GLY 106 30.240 4.498 -20.796 772 HA2 GLY 106 HA2 GLY 106 32.098 4.739 -22.194 773 HA3 GLY 106 HA3 GLY 106 32.151 6.469 -21.873 774 H GLN 107 H GLN 107 31.947 4.552 -19.002 775 HA GLN 107 HA GLN 107 34.800 5.077 -18.363 776 HB2 GLN 107 HB2 GLN 107 32.579 4.113 -16.544 777 HB3 GLN 107 HB3 GLN 107 34.194 4.642 -16.064 778 HG2 GLN 107 HG2 GLN 107 32.078 6.425 -17.353 779 HG3 GLN 107 HG3 GLN 107 32.302 6.182 -15.634 780 HE21 GLN 107 HE22 GLN 107 32.346 8.572 -15.873 781 HE22 GLN 107 HE21 GLN 107 33.949 9.307 -16.028 782 H SER 108 H SER 108 33.320 2.450 -16.692 783 HA SER 108 HA SER 108 34.143 0.292 -18.425 784 HB2 SER 108 HB2 SER 108 36.350 1.000 -17.341 785 HB3 SER 108 HB3 SER 108 35.646 0.499 -15.786 786 HG SER 108 HG SER 108 36.907 -1.152 -16.932 787 H LEU 109 H LEU 109 33.762 -1.837 -17.273 788 HA LEU 109 HA LEU 109 31.155 -1.925 -16.078 789 HB2 LEU 109 HB2 LEU 109 33.401 -3.979 -16.071 790 HB3 LEU 109 HB3 LEU 109 31.697 -4.314 -15.714 791 HG LEU 109 HG LEU 109 32.841 -3.431 -18.400 792 HD11 LEU 109 HD11 LEU 109 32.210 -5.686 -19.106 793 HD12 LEU 109 HD12 LEU 109 33.328 -5.745 -17.730 794 HD13 LEU 109 HD13 LEU 109 31.594 -6.048 -17.475 795 HD21 LEU 109 HD21 LEU 109 29.966 -4.106 -17.654 796 HD22 LEU 109 HD22 LEU 109 30.572 -2.507 -18.127 797 HD23 LEU 109 HD23 LEU 109 30.572 -3.831 -19.302 798 H GLU 110 H GLU 110 34.365 -2.024 -14.582 799 HA GLU 110 HA GLU 110 33.554 -2.450 -11.872 800 HB2 GLU 110 HB2 GLU 110 35.817 -0.656 -12.879 801 HB3 GLU 110 HB3 GLU 110 35.642 -1.306 -11.237 802 HG2 GLU 110 HG2 GLU 110 35.658 -3.601 -12.223 803 HG3 GLU 110 HG3 GLU 110 36.031 -2.873 -13.793 804 H VAL 111 H VAL 111 33.531 0.499 -13.825 805 HA VAL 111 HA VAL 111 32.842 2.133 -11.524 806 HB VAL 111 HB VAL 111 32.956 2.794 -14.479 807 HG11 VAL 111 HG11 VAL 111 32.952 5.175 -13.740 808 HG12 VAL 111 HG12 VAL 111 31.396 4.368 -13.503 809 HG13 VAL 111 HG13 VAL 111 32.482 4.649 -12.112 810 HG21 VAL 111 HG21 VAL 111 34.784 3.477 -12.134 811 HG22 VAL 111 HG22 VAL 111 35.156 2.314 -13.423 812 HG23 VAL 111 HG23 VAL 111 35.012 4.028 -13.812 813 H PHE 112 H PHE 112 31.084 0.552 -14.212 814 HA PHE 112 HA PHE 112 28.447 1.584 -13.497 815 HB2 PHE 112 HB2 PHE 112 29.481 -0.826 -14.993 816 HB3 PHE 112 HB3 PHE 112 27.808 -0.763 -14.465 817 HD1 PHE 112 HD2 PHE 112 26.192 0.785 -15.395 818 HD2 PHE 112 HD1 PHE 112 30.249 0.651 -16.833 819 HE1 PHE 112 HE2 PHE 112 25.504 1.998 -17.453 820 HE2 PHE 112 HE1 PHE 112 29.569 1.897 -18.862 821 HZ PHE 112 HZ PHE 112 27.207 2.603 -19.147 822 H ARG 113 H ARG 113 30.255 -1.341 -12.453 823 HA ARG 113 HA ARG 113 28.358 -2.322 -10.547 824 HB2 ARG 113 HB2 ARG 113 31.392 -2.504 -10.747 825 HB3 ARG 113 HB3 ARG 113 30.479 -3.352 -9.500 826 HG2 ARG 113 HG2 ARG 113 29.341 -4.729 -11.076 827 HG3 ARG 113 HG3 ARG 113 29.756 -3.689 -12.431 828 HD2 ARG 113 HD2 ARG 113 31.052 -5.748 -12.497 829 HD3 ARG 113 HD3 ARG 113 32.096 -4.329 -12.299 830 HE ARG 113 HE ARG 113 31.436 -5.477 -9.726 831 HH11 ARG 113 HH11 ARG 113 33.487 -6.191 -12.484 832 HH12 ARG 113 HH12 ARG 113 34.647 -7.041 -11.504 833 HH21 ARG 113 HH21 ARG 113 32.966 -6.568 -8.543 834 HH22 ARG 113 HH22 ARG 113 34.346 -7.262 -9.336 835 H THR 114 H THR 114 31.005 0.017 -10.099 836 HA THR 114 HA THR 114 30.663 0.527 -7.306 837 HB THR 114 HB THR 114 31.640 2.362 -9.532 838 HG1 THR 114 HG1 THR 114 32.938 0.569 -9.263 839 HG21 THR 114 HG21 THR 114 31.093 3.788 -7.651 840 HG22 THR 114 HG22 THR 114 31.880 2.666 -6.512 841 HG23 THR 114 HG23 THR 114 32.843 3.566 -7.705 842 H VAL 115 H VAL 115 29.109 2.207 -10.107 843 HA VAL 115 HA VAL 115 27.355 3.799 -8.414 844 HB VAL 115 HB VAL 115 27.299 3.046 -11.350 845 HG11 VAL 115 HG11 VAL 115 25.623 4.826 -11.660 846 HG12 VAL 115 HG12 VAL 115 24.941 3.483 -10.746 847 HG13 VAL 115 HG13 VAL 115 25.425 4.980 -9.899 848 HG21 VAL 115 HG21 VAL 115 27.918 5.577 -9.756 849 HG22 VAL 115 HG22 VAL 115 29.081 4.565 -10.648 850 HG23 VAL 115 HG23 VAL 115 27.860 5.506 -11.513 851 H ARG 116 H ARG 116 26.753 0.744 -10.163 852 HA ARG 116 HA ARG 116 24.060 0.333 -9.549 853 HB2 ARG 116 HB2 ARG 116 25.509 -0.986 -11.122 854 HB3 ARG 116 HB3 ARG 116 26.303 -1.736 -9.740 855 HG2 ARG 116 HG2 ARG 116 23.965 -2.583 -9.066 856 HG3 ARG 116 HG3 ARG 116 23.432 -2.044 -10.670 857 HD2 ARG 116 HD2 ARG 116 23.908 -4.376 -10.832 858 HD3 ARG 116 HD3 ARG 116 25.223 -3.522 -11.664 859 HE ARG 116 HE ARG 116 25.821 -4.049 -8.846 860 HH11 ARG 116 HH11 ARG 116 25.714 -5.825 -11.876 861 HH12 ARG 116 HH12 ARG 116 27.089 -6.809 -11.422 862 HH21 ARG 116 HH22 ARG 116 27.457 -5.431 -8.296 863 HH22 ARG 116 HH21 ARG 116 27.929 -6.690 -9.387 864 H GLY 117 H GLY 117 26.838 -0.716 -7.531 865 HA2 GLY 117 HA2 GLY 117 25.345 -1.948 -5.439 866 HA3 GLY 117 HA3 GLY 117 26.966 -1.256 -5.283 867 H GLN 118 H GLN 118 26.297 1.498 -5.847 868 HA GLN 118 HA GLN 118 25.206 2.308 -3.271 869 HB2 GLN 118 HB2 GLN 118 25.927 3.963 -5.714 870 HB3 GLN 118 HB3 GLN 118 25.459 4.605 -4.128 871 HG2 GLN 118 HG2 GLN 118 27.431 3.702 -3.069 872 HG3 GLN 118 HG3 GLN 118 27.871 2.775 -4.499 873 HE21 GLN 118 HE22 GLN 118 28.704 3.894 -6.378 874 HE22 GLN 118 HE21 GLN 118 29.205 5.591 -6.315 875 H VAL 119 H VAL 119 23.947 2.631 -6.685 876 HA VAL 119 HA VAL 119 21.413 3.693 -6.024 877 HB VAL 119 HB VAL 119 21.992 1.643 -8.212 878 HG11 VAL 119 HG11 VAL 119 19.605 1.810 -7.892 879 HG12 VAL 119 HG12 VAL 119 19.701 3.588 -7.790 880 HG13 VAL 119 HG13 VAL 119 20.034 2.750 -9.324 881 HG21 VAL 119 HG21 VAL 119 23.373 3.747 -8.406 882 HG22 VAL 119 HG22 VAL 119 22.214 3.534 -9.712 883 HG23 VAL 119 HG23 VAL 119 21.862 4.683 -8.394 884 H LYS 120 H LYS 120 22.370 0.222 -6.067 885 HA LYS 120 HA LYS 120 19.904 -0.890 -5.210 886 HB2 LYS 120 HB2 LYS 120 21.909 -2.176 -6.019 887 HB3 LYS 120 HB3 LYS 120 22.741 -1.809 -4.515 888 HG2 LYS 120 HG2 LYS 120 20.904 -2.952 -3.248 889 HG3 LYS 120 HG3 LYS 120 20.135 -3.364 -4.772 890 HD2 LYS 120 HD2 LYS 120 22.266 -4.631 -5.389 891 HD3 LYS 120 HD3 LYS 120 22.878 -4.253 -3.765 892 HE2 LYS 120 HE2 LYS 120 20.738 -5.311 -2.839 893 HE3 LYS 120 HE3 LYS 120 20.377 -5.864 -4.482 894 HZ1 LYS 120 HZ1 LYS 120 22.502 -7.123 -4.438 895 HZ2 LYS 120 HZ2 LYS 120 22.806 -6.619 -2.908 896 HZ3 LYS 120 HZ3 LYS 120 21.539 -7.597 -3.205 897 H GLU 121 H GLU 121 22.701 0.111 -3.119 898 HA GLU 121 HA GLU 121 21.237 -0.477 -0.727 899 HB2 GLU 121 HB2 GLU 121 23.071 0.064 0.453 900 HB3 GLU 121 HB3 GLU 121 23.827 -0.232 -1.106 901 HG2 GLU 121 HG2 GLU 121 23.842 2.247 -1.513 902 HG3 GLU 121 HG3 GLU 121 23.158 2.493 0.087 903 H ARG 122 H ARG 122 21.438 2.610 -2.502 904 HA ARG 122 HA ARG 122 20.013 4.040 -0.409 905 HB2 ARG 122 HB2 ARG 122 20.095 4.623 -3.423 906 HB3 ARG 122 HB3 ARG 122 19.523 5.720 -2.176 907 HG2 ARG 122 HG2 ARG 122 22.377 4.831 -2.681 908 HG3 ARG 122 HG3 ARG 122 21.690 6.442 -2.794 909 HD2 ARG 122 HD2 ARG 122 21.310 6.273 -0.263 910 HD3 ARG 122 HD3 ARG 122 22.312 4.800 -0.334 911 HE ARG 122 HE ARG 122 23.801 6.770 -1.640 912 HH11 ARG 122 HH11 ARG 122 22.628 6.325 1.643 913 HH12 ARG 122 HH12 ARG 122 23.936 7.243 2.328 914 HH21 ARG 122 HH21 ARG 122 25.453 7.921 -0.679 915 HH22 ARG 122 HH22 ARG 122 25.485 8.123 1.046 916 H VAL 123 H VAL 123 18.768 2.314 -3.340 917 HA VAL 123 HA VAL 123 16.048 2.700 -2.619 918 HB VAL 123 HB VAL 123 17.526 0.681 -4.340 919 HG11 VAL 123 HG11 VAL 123 15.450 -0.266 -5.117 920 HG12 VAL 123 HG12 VAL 123 15.682 -0.648 -3.422 921 HG13 VAL 123 HG13 VAL 123 14.527 0.638 -3.874 922 HG21 VAL 123 HG21 VAL 123 17.190 2.966 -5.180 923 HG22 VAL 123 HG22 VAL 123 16.259 1.785 -6.123 924 HG23 VAL 123 HG23 VAL 123 15.434 2.807 -4.929 925 H GLU 124 H GLU 124 18.157 -0.144 -1.692 926 HA GLU 124 HA GLU 124 16.079 -1.426 -0.194 927 HB2 GLU 124 HB2 GLU 124 19.074 -1.427 0.317 928 HB3 GLU 124 HB3 GLU 124 17.885 -2.491 1.094 929 HG2 GLU 124 HG2 GLU 124 17.227 -3.385 -1.083 930 HG3 GLU 124 HG3 GLU 124 18.516 -2.464 -1.863 931 H ASN 125 H ASN 125 18.254 1.186 0.808 932 HA ASN 125 HA ASN 125 17.253 1.066 3.479 933 HB2 ASN 125 HB2 ASN 125 19.114 2.228 3.869 934 HB3 ASN 125 HB3 ASN 125 19.397 2.341 2.142 935 HD21 ASN 125 HD22 ASN 125 18.317 4.169 0.964 936 HD22 ASN 125 HD21 ASN 125 18.319 5.701 1.826 937 H LEU 126 H LEU 126 16.029 2.529 0.671 938 HA LEU 126 HA LEU 126 14.242 4.414 2.078 939 HB2 LEU 126 HB2 LEU 126 15.371 5.104 0.012 940 HB3 LEU 126 HB3 LEU 126 14.770 3.685 -0.837 941 HG LEU 126 HG LEU 126 12.448 4.529 -0.601 942 HD11 LEU 126 HD11 LEU 126 12.103 6.919 -0.027 943 HD12 LEU 126 HD12 LEU 126 12.678 5.997 1.361 944 HD13 LEU 126 HD13 LEU 126 13.809 7.045 0.461 945 HD21 LEU 126 HD21 LEU 126 14.404 6.401 -1.956 946 HD22 LEU 126 HD22 LEU 126 13.789 4.869 -2.625 947 HD23 LEU 126 HD23 LEU 126 12.665 6.196 -2.342 948 H ILE 127 H ILE 127 13.865 1.397 0.078 949 HA ILE 127 HA ILE 127 10.999 1.454 0.356 950 HB ILE 127 HB ILE 127 11.017 -0.903 -0.344 951 HG12 ILE 127 HG12 ILE 127 14.030 -0.716 -0.061 952 HG13 ILE 127 HG13 ILE 127 12.935 -1.845 0.718 953 HG21 ILE 127 HG21 ILE 127 12.908 0.842 -2.009 954 HG22 ILE 127 HG22 ILE 127 11.814 -0.425 -2.612 955 HG23 ILE 127 HG23 ILE 127 11.145 1.056 -1.936 956 HD11 ILE 127 HD11 ILE 127 14.128 -2.991 -1.012 957 HD12 ILE 127 HD12 ILE 127 12.440 -2.827 -1.545 958 HD13 ILE 127 HD13 ILE 127 13.708 -1.757 -2.214 959 H ALA 128 H ALA 128 13.464 0.185 2.565 960 HA ALA 128 HA ALA 128 11.589 -1.251 4.177 961 HB1 ALA 128 HB1 ALA 128 13.429 -1.222 5.844 962 HB2 ALA 128 HB2 ALA 128 14.036 -1.621 4.226 963 HB3 ALA 128 HB3 ALA 128 14.283 0.011 4.889 964 H LYS 129 H LYS 129 12.130 2.173 3.829 965 HA LYS 129 HA LYS 129 10.859 2.908 6.407 966 HB2 LYS 129 HB2 LYS 129 11.873 4.598 4.075 967 HB3 LYS 129 HB3 LYS 129 11.182 5.234 5.565 968 HG2 LYS 129 HG2 LYS 129 12.979 4.309 6.904 969 HG3 LYS 129 HG3 LYS 129 13.653 3.456 5.495 970 HD2 LYS 129 HD2 LYS 129 14.207 5.543 4.387 971 HD3 LYS 129 HD3 LYS 129 13.344 6.484 5.605 972 HE2 LYS 129 HE2 LYS 129 15.757 6.644 5.918 973 HE3 LYS 129 HE3 LYS 129 14.970 5.929 7.322 974 HZ1 LYS 129 HZ1 LYS 129 15.786 3.774 6.694 975 HZ2 LYS 129 HZ2 LYS 129 16.266 4.273 5.208 976 HZ3 LYS 129 HZ3 LYS 129 17.063 4.781 6.550 977 H ILE 130 H ILE 130 10.041 2.944 2.928 978 HA ILE 130 HA ILE 130 7.393 4.078 3.617 979 HB ILE 130 HB ILE 130 7.232 4.864 1.325 980 HG12 ILE 130 HG12 ILE 130 9.230 5.065 -0.081 981 HG13 ILE 130 HG13 ILE 130 10.133 4.007 0.983 982 HG21 ILE 130 HG21 ILE 130 8.718 6.711 1.670 983 HG22 ILE 130 HG22 ILE 130 8.116 6.196 3.243 984 HG23 ILE 130 HG23 ILE 130 9.770 5.761 2.745 985 HD11 ILE 130 HD11 ILE 130 7.653 3.206 -0.605 986 HD12 ILE 130 HD12 ILE 130 9.332 2.905 -1.094 987 HD13 ILE 130 HD13 ILE 130 8.691 2.117 0.351 988 H SER 131 H SER 131 8.324 0.940 3.033 989 HA SER 131 HA SER 131 6.262 0.048 1.276 990 HB2 SER 131 HB2 SER 131 6.601 -2.154 2.316 991 HB3 SER 131 HB3 SER 131 8.117 -1.370 1.806 992 HG SER 131 HG SER 131 7.109 -1.120 4.452 Start of MODEL 5 1 H MET 1 H1 MET 1 2.850 0.240 2.156 2 HA MET 1 HA MET 1 3.586 -0.362 0.067 3 HB2 MET 1 HB2 MET 1 1.725 -1.930 -0.439 4 HB3 MET 1 HB3 MET 1 0.682 -0.558 -0.830 5 HG2 MET 1 HG2 MET 1 2.259 0.098 -2.654 6 HG3 MET 1 HG3 MET 1 3.313 -1.244 -2.205 7 HE1 MET 1 HE1 MET 1 2.095 -2.723 -5.527 8 HE2 MET 1 HE2 MET 1 2.785 -1.151 -5.061 9 HE3 MET 1 HE3 MET 1 3.440 -2.656 -4.368 10 H LYS 2 H LYS 2 4.498 1.440 -0.741 11 HA LYS 2 HA LYS 2 2.746 3.733 -1.602 12 HB2 LYS 2 HB2 LYS 2 5.362 3.851 -0.045 13 HB3 LYS 2 HB3 LYS 2 4.677 5.239 -0.879 14 HG2 LYS 2 HG2 LYS 2 2.577 5.034 0.409 15 HG3 LYS 2 HG3 LYS 2 3.254 3.657 1.292 16 HD2 LYS 2 HD2 LYS 2 5.001 5.075 2.263 17 HD3 LYS 2 HD3 LYS 2 4.386 6.480 1.361 18 HE2 LYS 2 HE2 LYS 2 2.245 6.370 2.509 19 HE3 LYS 2 HE3 LYS 2 2.663 4.835 3.280 20 HZ1 LYS 2 HZ1 LYS 2 4.167 7.354 3.763 21 HZ2 LYS 2 HZ2 LYS 2 2.948 6.850 4.734 22 HZ3 LYS 2 HZ3 LYS 2 4.314 5.957 4.608 23 H LYS 3 H LYS 3 3.835 5.193 -3.172 24 HA LYS 3 HA LYS 3 5.248 3.521 -5.217 25 HB2 LYS 3 HB2 LYS 3 3.589 6.018 -5.694 26 HB3 LYS 3 HB3 LYS 3 4.402 5.070 -6.916 27 HG2 LYS 3 HG2 LYS 3 2.325 4.171 -7.137 28 HG3 LYS 3 HG3 LYS 3 3.033 3.045 -5.991 29 HD2 LYS 3 HD2 LYS 3 0.743 3.560 -5.343 30 HD3 LYS 3 HD3 LYS 3 1.844 4.204 -4.128 31 HE2 LYS 3 HE2 LYS 3 1.720 6.375 -5.694 32 HE3 LYS 3 HE3 LYS 3 0.202 5.650 -6.224 33 HZ1 LYS 3 HZ1 LYS 3 -0.103 7.177 -4.350 34 HZ2 LYS 3 HZ2 LYS 3 -0.492 5.664 -3.841 35 HZ3 LYS 3 HZ3 LYS 3 0.961 6.352 -3.428 36 H VAL 4 H VAL 4 7.045 4.111 -6.189 37 HA VAL 4 HA VAL 4 8.437 6.610 -5.281 38 HB VAL 4 HB VAL 4 9.920 4.001 -5.598 39 HG11 VAL 4 HG11 VAL 4 11.305 5.993 -5.931 40 HG12 VAL 4 HG12 VAL 4 10.703 6.678 -4.402 41 HG13 VAL 4 HG13 VAL 4 11.702 5.206 -4.414 42 HG21 VAL 4 HG21 VAL 4 8.931 5.266 -3.024 43 HG22 VAL 4 HG22 VAL 4 8.495 3.671 -3.675 44 HG23 VAL 4 HG23 VAL 4 10.147 3.977 -3.140 45 H MET 5 H MET 5 9.595 7.710 -6.810 46 HA MET 5 HA MET 5 9.684 6.588 -9.583 47 HB2 MET 5 HB2 MET 5 7.710 7.903 -9.585 48 HB3 MET 5 HB3 MET 5 8.476 9.207 -8.674 49 HG2 MET 5 HG2 MET 5 8.200 9.847 -10.990 50 HG3 MET 5 HG3 MET 5 9.898 9.771 -10.572 51 HE1 MET 5 HE1 MET 5 7.995 9.688 -13.432 52 HE2 MET 5 HE2 MET 5 8.035 8.112 -14.221 53 HE3 MET 5 HE3 MET 5 7.002 8.355 -12.795 54 H PHE 6 H PHE 6 11.517 6.926 -10.626 55 HA PHE 6 HA PHE 6 13.640 8.471 -9.199 56 HB2 PHE 6 HB2 PHE 6 13.968 6.291 -11.275 57 HB3 PHE 6 HB3 PHE 6 15.232 7.036 -10.299 58 HD1 PHE 6 HD2 PHE 6 15.334 6.578 -7.805 59 HD2 PHE 6 HD1 PHE 6 12.554 4.559 -10.398 60 HE1 PHE 6 HE2 PHE 6 14.764 5.015 -5.962 61 HE2 PHE 6 HE1 PHE 6 11.959 3.029 -8.552 62 HZ PHE 6 HZ PHE 6 13.014 3.283 -6.313 63 H VAL 7 H VAL 7 14.758 10.092 -10.109 64 HA VAL 7 HA VAL 7 14.285 10.850 -12.959 65 HB VAL 7 HB VAL 7 14.166 12.566 -10.494 66 HG11 VAL 7 HG11 VAL 7 16.069 13.640 -11.565 67 HG12 VAL 7 HG12 VAL 7 15.255 13.583 -13.156 68 HG13 VAL 7 HG13 VAL 7 14.627 14.588 -11.840 69 HG21 VAL 7 HG21 VAL 7 12.440 13.668 -11.808 70 HG22 VAL 7 HG22 VAL 7 12.890 12.760 -13.267 71 HG23 VAL 7 HG23 VAL 7 12.166 11.928 -11.845 72 H CYS 8 H CYS 8 15.990 10.874 -14.206 73 HA CYS 8 HA CYS 8 18.688 11.539 -13.077 74 HB2 CYS 8 HB2 CYS 8 18.695 9.187 -13.405 75 HB3 CYS 8 HB3 CYS 8 17.901 9.303 -14.987 76 HG CYS 8 HG CYS 8 20.456 8.458 -15.136 77 H LYS 9 H LYS 9 20.117 12.521 -14.874 78 HA LYS 9 HA LYS 9 18.673 14.732 -15.914 79 HB2 LYS 9 HB2 LYS 9 21.243 14.300 -15.296 80 HB3 LYS 9 HB3 LYS 9 21.422 14.102 -17.026 81 HG2 LYS 9 HG2 LYS 9 19.890 16.540 -16.137 82 HG3 LYS 9 HG3 LYS 9 21.532 16.440 -15.553 83 HD2 LYS 9 HD2 LYS 9 21.628 17.733 -17.492 84 HD3 LYS 9 HD3 LYS 9 22.359 16.186 -17.916 85 HE2 LYS 9 HE2 LYS 9 20.342 15.511 -19.144 86 HE3 LYS 9 HE3 LYS 9 19.447 16.901 -18.509 87 HZ1 LYS 9 HZ1 LYS 9 21.734 17.031 -20.417 88 HZ2 LYS 9 HZ2 LYS 9 20.149 17.367 -20.734 89 HZ3 LYS 9 HZ3 LYS 9 21.009 18.351 -19.759 90 H ARG 10 H ARG 10 19.665 11.813 -17.610 91 HA ARG 10 HA ARG 10 17.647 12.503 -19.708 92 HB2 ARG 10 HB2 ARG 10 18.936 12.029 -21.548 93 HB3 ARG 10 HB3 ARG 10 19.879 13.104 -20.555 94 HG2 ARG 10 HG2 ARG 10 20.343 10.091 -20.802 95 HG3 ARG 10 HG3 ARG 10 21.208 11.358 -21.672 96 HD2 ARG 10 HD2 ARG 10 21.936 12.276 -19.423 97 HD3 ARG 10 HD3 ARG 10 21.292 10.765 -18.715 98 HE ARG 10 HE ARG 10 23.124 10.253 -20.912 99 HH11 ARG 10 HH11 ARG 10 23.220 11.288 -17.554 100 HH12 ARG 10 HH12 ARG 10 24.745 10.486 -17.267 101 HH21 ARG 10 HH21 ARG 10 25.080 9.175 -20.394 102 HH22 ARG 10 HH22 ARG 10 25.813 9.563 -18.829 103 H ASN 11 H ASN 11 17.818 10.478 -17.429 104 HA ASN 11 HA ASN 11 17.265 8.318 -16.926 105 HB2 ASN 11 HB2 ASN 11 15.238 9.606 -17.460 106 HB3 ASN 11 HB3 ASN 11 15.202 8.919 -19.068 107 HD21 ASN 11 HD22 ASN 11 15.745 7.297 -15.770 108 HD22 ASN 11 HD21 ASN 11 14.382 6.259 -15.997 109 H SER 12 H SER 12 19.418 8.268 -18.836 110 HA SER 12 HA SER 12 19.034 5.791 -20.379 111 HB2 SER 12 HB2 SER 12 21.494 6.248 -20.843 112 HB3 SER 12 HB3 SER 12 20.398 7.578 -21.283 113 HG SER 12 HG SER 12 22.283 8.206 -19.966 114 H CYS 13 H CYS 13 20.513 6.850 -17.354 115 HA CYS 13 HA CYS 13 21.229 4.079 -16.535 116 HB2 CYS 13 HB2 CYS 13 23.572 4.899 -16.059 117 HB3 CYS 13 HB3 CYS 13 23.149 4.941 -17.766 118 HG CYS 13 HG CYS 13 22.571 7.465 -17.951 119 H ARG 14 H ARG 14 22.236 4.269 -14.192 120 HA ARG 14 HA ARG 14 21.651 4.376 -11.985 121 HB2 ARG 14 HB2 ARG 14 21.389 7.347 -12.662 122 HB3 ARG 14 HB3 ARG 14 21.380 6.695 -11.016 123 HG2 ARG 14 HG2 ARG 14 23.602 5.595 -11.546 124 HG3 ARG 14 HG3 ARG 14 23.656 6.555 -13.027 125 HD2 ARG 14 HD2 ARG 14 23.508 7.607 -10.163 126 HD3 ARG 14 HD3 ARG 14 24.949 7.595 -11.175 127 HE ARG 14 HE ARG 14 22.699 9.491 -11.274 128 HH11 ARG 14 HH11 ARG 14 25.677 8.633 -12.884 129 HH12 ARG 14 HH12 ARG 14 25.299 9.661 -14.276 130 HH21 ARG 14 HH21 ARG 14 22.525 11.012 -12.796 131 HH22 ARG 14 HH22 ARG 14 23.733 11.156 -14.070 132 H SER 15 H SER 15 19.249 6.745 -12.970 133 HA SER 15 HA SER 15 17.092 5.968 -11.397 134 HB2 SER 15 HB2 SER 15 15.659 6.977 -13.238 135 HB3 SER 15 HB3 SER 15 17.036 7.962 -12.784 136 HG SER 15 HG SER 15 18.187 6.960 -14.689 137 H GLN 16 H GLN 16 17.829 4.564 -14.577 138 HA GLN 16 HA GLN 16 15.530 2.774 -14.609 139 HB2 GLN 16 HB2 GLN 16 18.225 2.623 -16.056 140 HB3 GLN 16 HB3 GLN 16 16.827 1.634 -16.460 141 HG2 GLN 16 HG2 GLN 16 16.760 4.701 -16.559 142 HG3 GLN 16 HG3 GLN 16 17.266 3.695 -17.909 143 HE21 GLN 16 HE22 GLN 16 15.404 5.109 -18.732 144 HE22 GLN 16 HE21 GLN 16 13.821 4.326 -18.721 145 H MET 17 H MET 17 18.875 2.385 -13.408 146 HA MET 17 HA MET 17 18.596 -0.446 -12.698 147 HB2 MET 17 HB2 MET 17 20.650 1.673 -11.920 148 HB3 MET 17 HB3 MET 17 20.803 -0.042 -11.549 149 HG2 MET 17 HG2 MET 17 21.468 -0.576 -13.667 150 HG3 MET 17 HG3 MET 17 20.271 0.464 -14.413 151 HE1 MET 17 HE1 MET 17 23.929 0.008 -13.342 152 HE2 MET 17 HE2 MET 17 24.571 1.666 -13.271 153 HE3 MET 17 HE3 MET 17 23.435 1.102 -12.025 154 H ALA 18 H ALA 18 18.152 2.654 -10.974 155 HA ALA 18 HA ALA 18 17.607 1.565 -8.368 156 HB1 ALA 18 HB1 ALA 18 18.059 3.992 -8.983 157 HB2 ALA 18 HB2 ALA 18 16.422 4.069 -9.651 158 HB3 ALA 18 HB3 ALA 18 16.657 3.748 -7.921 159 H GLU 19 H GLU 19 15.392 2.294 -11.103 160 HA GLU 19 HA GLU 19 13.052 1.138 -9.926 161 HB2 GLU 19 HB2 GLU 19 13.234 2.653 -11.904 162 HB3 GLU 19 HB3 GLU 19 13.806 1.311 -12.874 163 HG2 GLU 19 HG2 GLU 19 11.130 1.396 -11.414 164 HG3 GLU 19 HG3 GLU 19 11.352 1.959 -13.061 165 H GLY 20 H GLY 20 15.580 -0.380 -11.971 166 HA2 GLY 20 HA2 GLY 20 14.782 -3.040 -12.021 167 HA3 GLY 20 HA3 GLY 20 16.456 -2.494 -11.933 168 H PHE 21 H PHE 21 16.819 -1.582 -9.368 169 HA PHE 21 HA PHE 21 16.700 -4.034 -7.814 170 HB2 PHE 21 HB2 PHE 21 17.535 -1.180 -7.159 171 HB3 PHE 21 HB3 PHE 21 17.523 -2.459 -5.946 172 HD1 PHE 21 HD1 PHE 21 18.626 -4.767 -6.733 173 HD2 PHE 21 HD2 PHE 21 19.608 -0.863 -8.293 174 HE1 PHE 21 HE1 PHE 21 20.795 -5.631 -7.518 175 HE2 PHE 21 HE2 PHE 21 21.781 -1.726 -9.071 176 HZ PHE 21 HZ PHE 21 22.377 -4.142 -8.704 177 H ALA 22 H ALA 22 14.871 -0.959 -7.563 178 HA ALA 22 HA ALA 22 13.427 -1.754 -5.249 179 HB1 ALA 22 HB1 ALA 22 11.992 0.141 -5.782 180 HB2 ALA 22 HB2 ALA 22 13.672 0.578 -6.116 181 HB3 ALA 22 HB3 ALA 22 12.616 0.166 -7.470 182 H LYS 23 H LYS 23 12.511 -2.297 -8.716 183 HA LYS 23 HA LYS 23 9.916 -3.346 -8.091 184 HB2 LYS 23 HB2 LYS 23 9.778 -3.954 -10.347 185 HB3 LYS 23 HB3 LYS 23 10.848 -2.554 -10.328 186 HG2 LYS 23 HG2 LYS 23 12.739 -4.394 -10.230 187 HG3 LYS 23 HG3 LYS 23 11.493 -5.472 -10.849 188 HD2 LYS 23 HD2 LYS 23 12.527 -2.908 -12.109 189 HD3 LYS 23 HD3 LYS 23 12.931 -4.546 -12.632 190 HE2 LYS 23 HE2 LYS 23 10.635 -4.932 -13.375 191 HE3 LYS 23 HE3 LYS 23 10.117 -3.384 -12.682 192 HZ1 LYS 23 HZ1 LYS 23 10.518 -3.106 -15.045 193 HZ2 LYS 23 HZ2 LYS 23 11.636 -2.243 -14.208 194 HZ3 LYS 23 HZ3 LYS 23 12.056 -3.661 -14.927 195 H THR 24 H THR 24 13.019 -4.807 -7.985 196 HA THR 24 HA THR 24 12.066 -7.582 -7.677 197 HB THR 24 HB THR 24 14.875 -6.502 -7.334 198 HG1 THR 24 HG1 THR 24 14.501 -6.007 -9.394 199 HG21 THR 24 HG21 THR 24 13.833 -9.261 -8.099 200 HG22 THR 24 HG22 THR 24 15.539 -8.780 -8.011 201 HG23 THR 24 HG23 THR 24 14.570 -8.827 -6.535 202 H LEU 25 H LEU 25 13.854 -5.246 -5.599 203 HA LEU 25 HA LEU 25 13.781 -7.045 -3.293 204 HB2 LEU 25 HB2 LEU 25 14.720 -4.147 -3.534 205 HB3 LEU 25 HB3 LEU 25 15.104 -5.226 -2.209 206 HG LEU 25 HG LEU 25 16.010 -5.612 -5.105 207 HD11 LEU 25 HD11 LEU 25 16.991 -3.676 -3.736 208 HD12 LEU 25 HD12 LEU 25 17.660 -4.937 -2.679 209 HD13 LEU 25 HD13 LEU 25 18.140 -4.871 -4.387 210 HD21 LEU 25 HD21 LEU 25 17.525 -7.335 -4.154 211 HD22 LEU 25 HD22 LEU 25 16.694 -7.175 -2.587 212 HD23 LEU 25 HD23 LEU 25 15.821 -7.787 -4.008 213 H GLY 26 H GLY 26 11.996 -4.198 -4.339 214 HA2 GLY 26 HA2 GLY 26 10.412 -4.045 -1.848 215 HA3 GLY 26 HA3 GLY 26 10.431 -2.902 -3.192 216 H ALA 27 H ALA 27 10.183 -6.141 -4.339 217 HA ALA 27 HA ALA 27 7.737 -5.794 -5.609 218 HB1 ALA 27 HB1 ALA 27 8.949 -8.399 -4.566 219 HB2 ALA 27 HB2 ALA 27 7.737 -8.258 -5.857 220 HB3 ALA 27 HB3 ALA 27 9.363 -7.603 -6.091 221 H GLY 28 H GLY 28 5.786 -5.304 -4.800 222 HA2 GLY 28 HA2 GLY 28 3.759 -5.646 -3.702 223 HA3 GLY 28 HA3 GLY 28 4.470 -6.929 -2.727 224 H LYS 29 H LYS 29 6.730 -4.851 -2.081 225 HA LYS 29 HA LYS 29 5.483 -3.516 0.252 226 HB2 LYS 29 HB2 LYS 29 8.325 -3.426 -0.874 227 HB3 LYS 29 HB3 LYS 29 7.795 -2.666 0.615 228 HG2 LYS 29 HG2 LYS 29 7.238 -4.826 1.600 229 HG3 LYS 29 HG3 LYS 29 7.577 -5.658 0.084 230 HD2 LYS 29 HD2 LYS 29 9.433 -6.036 1.551 231 HD3 LYS 29 HD3 LYS 29 9.944 -5.046 0.196 232 HE2 LYS 29 HE2 LYS 29 10.980 -4.203 2.190 233 HE3 LYS 29 HE3 LYS 29 9.807 -3.004 1.635 234 HZ1 LYS 29 HZ1 LYS 29 9.233 -5.015 3.781 235 HZ2 LYS 29 HZ2 LYS 29 9.728 -3.498 4.102 236 HZ3 LYS 29 HZ3 LYS 29 8.274 -3.736 3.374 237 H ILE 30 H ILE 30 6.763 -2.710 -2.954 238 HA ILE 30 HA ILE 30 5.335 -0.117 -2.893 239 HB ILE 30 HB ILE 30 7.346 1.070 -3.796 240 HG12 ILE 30 HG12 ILE 30 9.587 0.307 -3.381 241 HG13 ILE 30 HG13 ILE 30 9.036 -1.233 -2.741 242 HG21 ILE 30 HG21 ILE 30 8.435 1.427 -1.698 243 HG22 ILE 30 HG22 ILE 30 6.705 1.218 -1.399 244 HG23 ILE 30 HG23 ILE 30 7.844 -0.108 -1.036 245 HD11 ILE 30 HD11 ILE 30 10.040 -1.183 -5.064 246 HD12 ILE 30 HD12 ILE 30 8.503 -2.040 -4.922 247 HD13 ILE 30 HD13 ILE 30 8.556 -0.401 -5.624 248 H ALA 31 H ALA 31 5.388 0.996 -4.999 249 HA ALA 31 HA ALA 31 5.785 -0.798 -7.357 250 HB1 ALA 31 HB1 ALA 31 3.386 -0.623 -7.132 251 HB2 ALA 31 HB2 ALA 31 3.475 1.138 -6.942 252 HB3 ALA 31 HB3 ALA 31 3.895 0.383 -8.492 253 H VAL 32 H VAL 32 6.880 0.194 -9.131 254 HA VAL 32 HA VAL 32 7.959 2.897 -8.592 255 HB VAL 32 HB VAL 32 10.115 1.761 -9.476 256 HG11 VAL 32 HG11 VAL 32 9.902 2.939 -7.417 257 HG12 VAL 32 HG12 VAL 32 9.106 1.564 -6.623 258 HG13 VAL 32 HG13 VAL 32 10.809 1.472 -7.119 259 HG21 VAL 32 HG21 VAL 32 8.980 -0.645 -8.041 260 HG22 VAL 32 HG22 VAL 32 9.181 -0.515 -9.808 261 HG23 VAL 32 HG23 VAL 32 10.593 -0.443 -8.747 262 H THR 33 H THR 33 8.824 4.057 -10.144 263 HA THR 33 HA THR 33 8.528 3.234 -12.998 264 HB THR 33 HB THR 33 7.559 5.909 -11.911 265 HG1 THR 33 HG1 THR 33 5.473 5.068 -12.199 266 HG21 THR 33 HG21 THR 33 8.119 5.875 -14.360 267 HG22 THR 33 HG22 THR 33 7.018 4.499 -14.574 268 HG23 THR 33 HG23 THR 33 6.389 6.083 -14.070 269 H SER 34 H SER 34 10.098 4.243 -14.401 270 HA SER 34 HA SER 34 12.122 6.000 -13.066 271 HB2 SER 34 HB2 SER 34 12.761 3.653 -13.908 272 HB3 SER 34 HB3 SER 34 12.606 4.337 -15.537 273 HG SER 34 HG SER 34 14.421 4.902 -13.475 274 H CYS 35 H CYS 35 12.653 7.939 -13.985 275 HA CYS 35 HA CYS 35 11.962 8.553 -16.760 276 HB2 CYS 35 HB2 CYS 35 10.511 10.370 -16.319 277 HB3 CYS 35 HB3 CYS 35 9.901 9.006 -15.370 278 HG CYS 35 HG CYS 35 11.265 9.747 -13.155 279 H GLY 36 H GLY 36 12.580 11.033 -17.161 280 HA2 GLY 36 HA2 GLY 36 14.578 12.101 -15.260 281 HA3 GLY 36 HA3 GLY 36 15.181 11.726 -16.886 282 H LEU 37 H LEU 37 15.360 14.308 -15.951 283 HA LEU 37 HA LEU 37 13.056 15.830 -16.825 284 HB2 LEU 37 HB2 LEU 37 14.450 17.833 -16.692 285 HB3 LEU 37 HB3 LEU 37 14.210 16.944 -15.210 286 HG LEU 37 HG LEU 37 16.732 16.381 -16.793 287 HD11 LEU 37 HD11 LEU 37 17.875 18.257 -15.667 288 HD12 LEU 37 HD12 LEU 37 16.608 18.852 -16.746 289 HD13 LEU 37 HD13 LEU 37 16.323 18.810 -14.991 290 HD21 LEU 37 HD21 LEU 37 17.640 16.214 -14.441 291 HD22 LEU 37 HD22 LEU 37 16.017 16.582 -13.827 292 HD23 LEU 37 HD23 LEU 37 16.312 15.088 -14.729 293 H GLU 38 H GLU 38 15.290 14.183 -18.531 294 HA GLU 38 HA GLU 38 14.187 15.101 -21.081 295 HB2 GLU 38 HB2 GLU 38 17.212 14.887 -20.683 296 HB3 GLU 38 HB3 GLU 38 16.385 14.998 -22.232 297 HG2 GLU 38 HG2 GLU 38 15.400 17.214 -21.439 298 HG3 GLU 38 HG3 GLU 38 16.548 17.141 -20.095 299 H SER 39 H SER 39 14.640 13.382 -22.782 300 HA SER 39 HA SER 39 15.182 10.703 -21.571 301 HB2 SER 39 HB2 SER 39 13.467 9.800 -23.184 302 HB3 SER 39 HB3 SER 39 12.870 10.744 -21.815 303 HG SER 39 HG SER 39 13.152 11.669 -24.505 304 H SER 40 H SER 40 16.906 9.828 -22.338 305 HA SER 40 HA SER 40 17.852 10.317 -25.141 306 HB2 SER 40 HB2 SER 40 19.412 10.855 -23.367 307 HB3 SER 40 HB3 SER 40 19.206 9.252 -22.643 308 HG SER 40 HG SER 40 20.547 9.985 -25.043 309 H ARG 41 H ARG 41 19.256 7.581 -24.209 310 HA ARG 41 HA ARG 41 17.098 5.658 -24.939 311 HB2 ARG 41 HB2 ARG 41 18.522 4.422 -26.336 312 HB3 ARG 41 HB3 ARG 41 18.762 6.084 -26.837 313 HG2 ARG 41 HG2 ARG 41 20.665 4.367 -25.176 314 HG3 ARG 41 HG3 ARG 41 20.844 4.820 -26.860 315 HD2 ARG 41 HD2 ARG 41 21.177 7.185 -26.210 316 HD3 ARG 41 HD3 ARG 41 20.957 6.739 -24.509 317 HE ARG 41 HE ARG 41 23.100 5.382 -26.043 318 HH11 ARG 41 HH11 ARG 41 22.473 7.922 -23.688 319 HH12 ARG 41 HH12 ARG 41 24.062 7.708 -22.947 320 HH21 ARG 41 HH21 ARG 41 25.132 5.319 -25.109 321 HH22 ARG 41 HH22 ARG 41 25.505 6.355 -23.750 322 H VAL 42 H VAL 42 17.065 3.748 -23.675 323 HA VAL 42 HA VAL 42 18.489 3.734 -21.194 324 HB VAL 42 HB VAL 42 16.550 2.067 -22.451 325 HG11 VAL 42 HG11 VAL 42 17.119 -0.150 -21.711 326 HG12 VAL 42 HG12 VAL 42 18.219 0.372 -22.988 327 HG13 VAL 42 HG13 VAL 42 18.767 0.366 -21.284 328 HG21 VAL 42 HG21 VAL 42 17.801 1.984 -19.680 329 HG22 VAL 42 HG22 VAL 42 16.511 3.123 -20.201 330 HG23 VAL 42 HG23 VAL 42 16.185 1.374 -20.114 331 H HIS 43 H HIS 43 20.451 3.038 -20.547 332 HA HIS 43 HA HIS 43 22.399 2.729 -22.661 333 HB2 HIS 43 HB2 HIS 43 22.711 3.935 -20.429 334 HB3 HIS 43 HB3 HIS 43 22.899 2.339 -19.687 335 HD2 HIS 43 HD2 HIS 43 24.607 4.875 -21.920 336 HE1 HIS 43 HE1 HIS 43 27.317 1.617 -21.654 337 HE2 HIS 43 HE2 HIS 43 27.006 3.985 -22.525 338 HA PRO 44 HA PRO 44 21.787 -1.569 -22.918 339 HB2 PRO 44 HB2 PRO 44 23.802 -2.397 -24.612 340 HB3 PRO 44 HB3 PRO 44 22.427 -1.367 -25.137 341 HG2 PRO 44 HG2 PRO 44 25.201 -0.461 -24.296 342 HG3 PRO 44 HG3 PRO 44 24.300 -0.018 -25.782 343 HD2 PRO 44 HD2 PRO 44 24.290 1.574 -23.588 344 HD3 PRO 44 HD3 PRO 44 22.813 1.369 -24.577 345 H THR 45 H THR 45 24.976 -0.401 -21.839 346 HA THR 45 HA THR 45 25.817 -2.928 -20.663 347 HB THR 45 HB THR 45 26.768 -0.133 -19.978 348 HG1 THR 45 HG1 THR 45 27.797 -1.932 -21.934 349 HG21 THR 45 HG21 THR 45 28.036 -2.888 -19.691 350 HG22 THR 45 HG22 THR 45 28.920 -1.344 -19.521 351 HG23 THR 45 HG23 THR 45 27.625 -1.744 -18.396 352 H ALA 46 H ALA 46 23.794 -0.227 -19.506 353 HA ALA 46 HA ALA 46 23.788 -0.894 -16.742 354 HB1 ALA 46 HB1 ALA 46 22.712 1.135 -17.746 355 HB2 ALA 46 HB2 ALA 46 21.454 0.088 -18.466 356 HB3 ALA 46 HB3 ALA 46 21.593 0.236 -16.705 357 H ILE 47 H ILE 47 21.700 -2.161 -19.369 358 HA ILE 47 HA ILE 47 20.215 -4.051 -17.802 359 HB ILE 47 HB ILE 47 21.084 -4.106 -20.722 360 HG12 ILE 47 HG12 ILE 47 18.229 -3.625 -20.039 361 HG13 ILE 47 HG13 ILE 47 19.297 -2.344 -19.485 362 HG21 ILE 47 HG21 ILE 47 19.186 -5.695 -21.084 363 HG22 ILE 47 HG22 ILE 47 20.496 -6.384 -20.125 364 HG23 ILE 47 HG23 ILE 47 19.012 -5.843 -19.314 365 HD11 ILE 47 HD11 ILE 47 18.326 -2.116 -21.821 366 HD12 ILE 47 HD12 ILE 47 20.066 -1.826 -21.604 367 HD13 ILE 47 HD13 ILE 47 19.479 -3.359 -22.330 368 H ALA 48 H ALA 48 23.331 -4.432 -19.593 369 HA ALA 48 HA ALA 48 23.740 -7.172 -18.975 370 HB1 ALA 48 HB1 ALA 48 24.974 -5.866 -20.684 371 HB2 ALA 48 HB2 ALA 48 25.811 -4.980 -19.380 372 HB3 ALA 48 HB3 ALA 48 26.064 -6.731 -19.573 373 H MET 49 H MET 49 24.597 -4.260 -17.116 374 HA MET 49 HA MET 49 26.024 -5.707 -15.037 375 HB2 MET 49 HB2 MET 49 25.001 -2.857 -15.142 376 HB3 MET 49 HB3 MET 49 26.129 -3.500 -13.934 377 HG2 MET 49 HG2 MET 49 26.870 -3.801 -16.843 378 HG3 MET 49 HG3 MET 49 26.935 -2.214 -16.111 379 HE1 MET 49 HE1 MET 49 28.140 -6.010 -15.311 380 HE2 MET 49 HE2 MET 49 28.722 -5.391 -16.878 381 HE3 MET 49 HE3 MET 49 29.866 -5.666 -15.545 382 H MET 50 H MET 50 22.646 -4.666 -15.446 383 HA MET 50 HA MET 50 21.877 -5.529 -12.748 384 HB2 MET 50 HB2 MET 50 20.245 -4.967 -15.265 385 HB3 MET 50 HB3 MET 50 19.562 -5.351 -13.691 386 HG2 MET 50 HG2 MET 50 21.230 -2.917 -14.397 387 HG3 MET 50 HG3 MET 50 19.512 -2.958 -14.039 388 HE1 MET 50 HE1 MET 50 18.596 -3.816 -11.746 389 HE2 MET 50 HE2 MET 50 19.800 -5.052 -11.285 390 HE3 MET 50 HE3 MET 50 19.458 -3.688 -10.201 391 H GLU 51 H GLU 51 22.132 -7.128 -15.948 392 HA GLU 51 HA GLU 51 20.841 -9.551 -15.095 393 HB2 GLU 51 HB2 GLU 51 22.823 -8.936 -17.314 394 HB3 GLU 51 HB3 GLU 51 22.243 -10.574 -17.001 395 HG2 GLU 51 HG2 GLU 51 19.906 -9.822 -17.263 396 HG3 GLU 51 HG3 GLU 51 20.468 -8.207 -17.696 397 H GLU 52 H GLU 52 24.149 -8.376 -14.453 398 HA GLU 52 HA GLU 52 25.275 -10.897 -13.659 399 HB2 GLU 52 HB2 GLU 52 25.796 -8.185 -12.388 400 HB3 GLU 52 HB3 GLU 52 26.807 -9.623 -12.263 401 HG2 GLU 52 HG2 GLU 52 26.944 -9.461 -14.881 402 HG3 GLU 52 HG3 GLU 52 26.438 -7.785 -14.617 403 H VAL 53 H VAL 53 22.976 -8.809 -12.030 404 HA VAL 53 HA VAL 53 23.002 -10.527 -9.586 405 HB VAL 53 HB VAL 53 21.762 -8.710 -8.475 406 HG11 VAL 53 HG11 VAL 53 24.222 -8.890 -8.280 407 HG12 VAL 53 HG12 VAL 53 24.418 -7.812 -9.676 408 HG13 VAL 53 HG13 VAL 53 23.666 -7.217 -8.179 409 HG21 VAL 53 HG21 VAL 53 21.668 -6.471 -9.452 410 HG22 VAL 53 HG22 VAL 53 22.418 -7.033 -10.947 411 HG23 VAL 53 HG23 VAL 53 20.787 -7.591 -10.490 412 H GLY 54 H GLY 54 21.640 -10.826 -12.402 413 HA2 GLY 54 HA2 GLY 54 19.875 -12.064 -13.131 414 HA3 GLY 54 HA3 GLY 54 19.451 -12.406 -11.451 415 H ILE 55 H ILE 55 19.538 -9.066 -12.620 416 HA ILE 55 HA ILE 55 16.560 -8.904 -12.348 417 HB ILE 55 HB ILE 55 18.746 -6.909 -11.749 418 HG12 ILE 55 HG12 ILE 55 16.655 -8.291 -10.011 419 HG13 ILE 55 HG13 ILE 55 18.383 -8.628 -10.020 420 HG21 ILE 55 HG21 ILE 55 16.840 -5.695 -12.777 421 HG22 ILE 55 HG22 ILE 55 15.728 -6.466 -11.612 422 HG23 ILE 55 HG23 ILE 55 16.982 -5.338 -11.067 423 HD11 ILE 55 HD11 ILE 55 18.796 -6.273 -9.220 424 HD12 ILE 55 HD12 ILE 55 17.037 -6.118 -8.976 425 HD13 ILE 55 HD13 ILE 55 17.947 -7.330 -8.074 426 H ASP 56 H ASP 56 15.348 -7.998 -13.911 427 HA ASP 56 HA ASP 56 16.692 -7.429 -16.512 428 HB2 ASP 56 HB2 ASP 56 15.283 -9.353 -16.546 429 HB3 ASP 56 HB3 ASP 56 13.932 -8.457 -15.836 430 H ILE 57 H ILE 57 16.740 -5.489 -17.276 431 HA ILE 57 HA ILE 57 14.417 -3.662 -16.983 432 HB ILE 57 HB ILE 57 15.837 -1.695 -16.857 433 HG12 ILE 57 HG12 ILE 57 18.238 -3.368 -16.074 434 HG13 ILE 57 HG13 ILE 57 17.925 -3.058 -17.770 435 HG21 ILE 57 HG21 ILE 57 16.436 -1.833 -14.495 436 HG22 ILE 57 HG22 ILE 57 14.896 -2.644 -14.784 437 HG23 ILE 57 HG23 ILE 57 16.378 -3.607 -14.550 438 HD11 ILE 57 HD11 ILE 57 18.258 -0.873 -15.681 439 HD12 ILE 57 HD12 ILE 57 19.458 -1.374 -16.883 440 HD13 ILE 57 HD13 ILE 57 17.932 -0.640 -17.418 441 H SER 58 H SER 58 15.340 -5.582 -19.117 442 HA SER 58 HA SER 58 16.312 -3.935 -21.332 443 HB2 SER 58 HB2 SER 58 16.771 -6.398 -20.974 444 HB3 SER 58 HB3 SER 58 15.082 -6.714 -21.421 445 HG SER 58 HG SER 58 16.538 -6.867 -23.226 446 H GLY 59 H GLY 59 13.141 -4.943 -20.167 447 HA2 GLY 59 HA2 GLY 59 11.658 -4.321 -22.564 448 HA3 GLY 59 HA3 GLY 59 11.003 -4.687 -20.970 449 H GLN 60 H GLN 60 13.186 -2.006 -20.845 450 HA GLN 60 HA GLN 60 11.016 0.003 -21.179 451 HB2 GLN 60 HB2 GLN 60 11.499 1.006 -19.029 452 HB3 GLN 60 HB3 GLN 60 11.092 -0.693 -18.804 453 HG2 GLN 60 HG2 GLN 60 13.726 -1.034 -18.910 454 HG3 GLN 60 HG3 GLN 60 13.784 0.681 -18.530 455 HE21 GLN 60 HE22 GLN 60 13.608 1.200 -16.289 456 HE22 GLN 60 HE21 GLN 60 13.076 -0.013 -15.085 457 H THR 61 H THR 61 11.879 2.288 -21.338 458 HA THR 61 HA THR 61 14.726 2.552 -21.687 459 HB THR 61 HB THR 61 13.961 1.890 -23.948 460 HG1 THR 61 HG1 THR 61 15.012 3.623 -24.972 461 HG21 THR 61 HG21 THR 61 12.503 4.565 -23.985 462 HG22 THR 61 HG22 THR 61 12.703 3.435 -25.337 463 HG23 THR 61 HG23 THR 61 11.716 2.969 -23.946 464 H SER 62 H SER 62 14.841 5.059 -22.590 465 HA SER 62 HA SER 62 14.347 6.580 -20.241 466 HB2 SER 62 HB2 SER 62 14.830 7.390 -23.079 467 HB3 SER 62 HB3 SER 62 15.086 8.431 -21.636 468 HG SER 62 HG SER 62 16.663 6.743 -20.981 469 H ASP 63 H ASP 63 12.600 7.761 -19.584 470 HA ASP 63 HA ASP 63 10.759 8.883 -21.640 471 HB2 ASP 63 HB2 ASP 63 9.927 7.340 -19.181 472 HB3 ASP 63 HB3 ASP 63 8.870 8.521 -19.950 473 HA PRO 64 HA PRO 64 11.545 12.544 -19.430 474 HB2 PRO 64 HB2 PRO 64 9.953 14.347 -20.666 475 HB3 PRO 64 HB3 PRO 64 11.212 13.423 -21.548 476 HG2 PRO 64 HG2 PRO 64 8.246 12.786 -21.354 477 HG3 PRO 64 HG3 PRO 64 9.255 12.893 -22.829 478 HD2 PRO 64 HD2 PRO 64 8.725 10.514 -21.551 479 HD3 PRO 64 HD3 PRO 64 10.268 10.831 -22.399 480 H ILE 65 H ILE 65 11.044 13.760 -17.716 481 HA ILE 65 HA ILE 65 9.100 13.154 -15.813 482 HB ILE 65 HB ILE 65 11.328 14.399 -15.661 483 HG12 ILE 65 HG12 ILE 65 9.024 15.535 -14.102 484 HG13 ILE 65 HG13 ILE 65 9.864 14.003 -13.769 485 HG21 ILE 65 HG21 ILE 65 10.811 16.255 -17.302 486 HG22 ILE 65 HG22 ILE 65 9.652 16.915 -16.114 487 HG23 ILE 65 HG23 ILE 65 11.368 16.837 -15.736 488 HD11 ILE 65 HD11 ILE 65 10.957 16.823 -13.512 489 HD12 ILE 65 HD12 ILE 65 10.782 15.597 -12.255 490 HD13 ILE 65 HD13 ILE 65 12.007 15.382 -13.518 491 H GLU 66 H GLU 66 8.938 15.541 -18.409 492 HA GLU 66 HA GLU 66 6.649 16.983 -17.603 493 HB2 GLU 66 HB2 GLU 66 7.640 16.393 -20.424 494 HB3 GLU 66 HB3 GLU 66 6.491 17.660 -19.983 495 HG2 GLU 66 HG2 GLU 66 8.260 18.660 -18.484 496 HG3 GLU 66 HG3 GLU 66 9.413 17.490 -19.134 497 H ASN 67 H ASN 67 6.703 13.754 -19.021 498 HA ASN 67 HA ASN 67 3.815 13.900 -19.676 499 HB2 ASN 67 HB2 ASN 67 4.161 12.238 -21.102 500 HB3 ASN 67 HB3 ASN 67 5.868 12.586 -20.934 501 HD21 ASN 67 HD22 ASN 67 6.922 11.314 -18.915 502 HD22 ASN 67 HD21 ASN 67 6.289 9.706 -18.659 503 H PHE 68 H PHE 68 5.594 13.245 -16.871 504 HA PHE 68 HA PHE 68 3.795 11.105 -15.883 505 HB2 PHE 68 HB2 PHE 68 6.547 12.088 -15.122 506 HB3 PHE 68 HB3 PHE 68 5.643 11.001 -14.092 507 HD1 PHE 68 HD1 PHE 68 4.475 8.941 -15.610 508 HD2 PHE 68 HD2 PHE 68 8.203 10.985 -16.342 509 HE1 PHE 68 HE1 PHE 68 5.308 6.976 -16.861 510 HE2 PHE 68 HE2 PHE 68 9.026 9.008 -17.606 511 HZ PHE 68 HZ PHE 68 7.589 6.997 -17.852 512 H ASN 69 H ASN 69 3.509 11.118 -13.445 513 HA ASN 69 HA ASN 69 2.206 13.711 -12.700 514 HB2 ASN 69 HB2 ASN 69 0.347 12.232 -11.800 515 HB3 ASN 69 HB3 ASN 69 0.501 12.390 -13.544 516 HD21 ASN 69 HD22 ASN 69 1.717 10.178 -10.949 517 HD22 ASN 69 HD21 ASN 69 1.349 8.717 -11.867 518 H ALA 70 H ALA 70 3.960 14.322 -11.347 519 HA ALA 70 HA ALA 70 5.105 12.794 -9.332 520 HB1 ALA 70 HB1 ALA 70 5.971 14.790 -8.472 521 HB2 ALA 70 HB2 ALA 70 5.719 15.147 -10.189 522 HB3 ALA 70 HB3 ALA 70 4.567 15.732 -8.977 523 H ASP 71 H ASP 71 2.010 14.446 -9.275 524 HA ASP 71 HA ASP 71 1.414 14.602 -6.538 525 HB2 ASP 71 HB2 ASP 71 0.142 15.623 -8.427 526 HB3 ASP 71 HB3 ASP 71 -0.419 14.013 -8.897 527 H ASP 72 H ASP 72 1.288 11.752 -8.640 528 HA ASP 72 HA ASP 72 -0.200 10.160 -6.635 529 HB2 ASP 72 HB2 ASP 72 -0.610 9.910 -9.095 530 HB3 ASP 72 HB3 ASP 72 1.038 9.277 -9.244 531 H TYR 73 H TYR 73 3.164 10.523 -7.729 532 HA TYR 73 HA TYR 73 4.118 8.117 -6.445 533 HB2 TYR 73 HB2 TYR 73 5.741 10.554 -7.163 534 HB3 TYR 73 HB3 TYR 73 6.296 8.888 -7.028 535 HD1 TYR 73 HD1 TYR 73 4.115 7.505 -8.696 536 HD2 TYR 73 HD2 TYR 73 6.417 11.102 -9.346 537 HE1 TYR 73 HE1 TYR 73 3.626 7.383 -11.118 538 HE2 TYR 73 HE2 TYR 73 5.868 11.002 -11.773 539 HH TYR 73 HH TYR 73 3.835 8.393 -13.164 540 H ASP 74 H ASP 74 4.042 7.858 -4.272 541 HA ASP 74 HA ASP 74 3.745 9.939 -2.343 542 HB2 ASP 74 HB2 ASP 74 4.896 7.131 -2.075 543 HB3 ASP 74 HB3 ASP 74 4.393 8.149 -0.723 544 H VAL 75 H VAL 75 6.589 8.492 -3.822 545 HA VAL 75 HA VAL 75 8.392 10.407 -2.387 546 HB VAL 75 HB VAL 75 8.862 7.458 -2.888 547 HG11 VAL 75 HG11 VAL 75 10.957 8.699 -3.130 548 HG12 VAL 75 HG12 VAL 75 10.689 9.508 -1.575 549 HG13 VAL 75 HG13 VAL 75 10.949 7.755 -1.642 550 HG21 VAL 75 HG21 VAL 75 7.419 7.635 -0.999 551 HG22 VAL 75 HG22 VAL 75 9.047 7.451 -0.335 552 HG23 VAL 75 HG23 VAL 75 8.286 9.053 -0.364 553 H VAL 76 H VAL 76 10.023 11.296 -3.682 554 HA VAL 76 HA VAL 76 10.387 10.251 -6.464 555 HB VAL 76 HB VAL 76 9.898 13.112 -5.647 556 HG11 VAL 76 HG11 VAL 76 11.895 13.136 -7.137 557 HG12 VAL 76 HG12 VAL 76 11.003 12.153 -8.326 558 HG13 VAL 76 HG13 VAL 76 10.477 13.803 -7.913 559 HG21 VAL 76 HG21 VAL 76 7.929 11.682 -6.352 560 HG22 VAL 76 HG22 VAL 76 8.234 13.069 -7.420 561 HG23 VAL 76 HG23 VAL 76 8.738 11.433 -7.913 562 H ILE 77 H ILE 77 12.436 10.081 -7.131 563 HA ILE 77 HA ILE 77 14.607 10.932 -5.222 564 HB ILE 77 HB ILE 77 14.420 8.368 -6.834 565 HG12 ILE 77 HG12 ILE 77 12.663 8.262 -5.116 566 HG13 ILE 77 HG13 ILE 77 13.954 7.122 -4.808 567 HG21 ILE 77 HG21 ILE 77 16.694 8.953 -6.431 568 HG22 ILE 77 HG22 ILE 77 16.368 9.332 -4.732 569 HG23 ILE 77 HG23 ILE 77 16.274 7.640 -5.320 570 HD11 ILE 77 HD11 ILE 77 13.718 9.811 -3.379 571 HD12 ILE 77 HD12 ILE 77 13.139 8.270 -2.751 572 HD13 ILE 77 HD13 ILE 77 14.858 8.492 -3.021 573 H SER 78 H SER 78 15.888 12.377 -6.194 574 HA SER 78 HA SER 78 16.403 12.228 -9.114 575 HB2 SER 78 HB2 SER 78 16.072 14.440 -8.046 576 HB3 SER 78 HB3 SER 78 17.538 14.155 -7.075 577 HG SER 78 HG SER 78 18.024 15.285 -9.037 578 H LEU 79 H LEU 79 18.333 11.628 -9.961 579 HA LEU 79 HA LEU 79 20.608 10.922 -8.170 580 HB2 LEU 79 HB2 LEU 79 19.838 9.148 -10.521 581 HB3 LEU 79 HB3 LEU 79 21.064 8.882 -9.292 582 HG LEU 79 HG LEU 79 18.889 8.848 -7.650 583 HD11 LEU 79 HD11 LEU 79 17.238 9.296 -9.420 584 HD12 LEU 79 HD12 LEU 79 17.843 7.915 -10.353 585 HD13 LEU 79 HD13 LEU 79 17.048 7.665 -8.775 586 HD21 LEU 79 HD21 LEU 79 20.541 7.014 -7.960 587 HD22 LEU 79 HD22 LEU 79 18.875 6.436 -7.827 588 HD23 LEU 79 HD23 LEU 79 19.657 6.492 -9.420 589 H CYS 80 H CYS 80 20.364 13.334 -9.306 590 HA CYS 80 HA CYS 80 21.700 13.300 -11.986 591 HB2 CYS 80 HB2 CYS 80 20.137 15.488 -10.562 592 HB3 CYS 80 HB3 CYS 80 20.809 15.577 -12.201 593 HG CYS 80 HG CYS 80 18.348 13.828 -10.924 594 H GLY 81 H GLY 81 22.259 14.551 -8.689 595 HA2 GLY 81 HA2 GLY 81 24.262 15.506 -7.858 596 HA3 GLY 81 HA3 GLY 81 24.931 15.561 -9.479 597 H CYS 82 H CYS 82 25.538 17.739 -8.719 598 HA CYS 82 HA CYS 82 23.712 19.833 -8.168 599 HB2 CYS 82 HB2 CYS 82 26.485 19.941 -9.427 600 HB3 CYS 82 HB3 CYS 82 25.619 21.331 -8.748 601 HG CYS 82 HG CYS 82 27.467 20.573 -7.042 602 H GLY 83 H GLY 83 22.985 21.628 -9.407 603 HA2 GLY 83 HA2 GLY 83 22.400 22.797 -11.355 604 HA3 GLY 83 HA3 GLY 83 22.999 21.486 -12.361 605 H VAL 84 H VAL 84 21.021 20.009 -10.112 606 HA VAL 84 HA VAL 84 18.470 20.468 -11.604 607 HB VAL 84 HB VAL 84 19.593 17.750 -10.832 608 HG11 VAL 84 HG11 VAL 84 17.604 16.830 -11.958 609 HG12 VAL 84 HG12 VAL 84 17.114 17.820 -10.588 610 HG13 VAL 84 HG13 VAL 84 16.979 18.471 -12.245 611 HG21 VAL 84 HG21 VAL 84 20.686 18.550 -12.858 612 HG22 VAL 84 HG22 VAL 84 19.522 17.301 -13.290 613 HG23 VAL 84 HG23 VAL 84 19.118 19.010 -13.566 614 H ASN 85 H ASN 85 16.999 21.190 -10.218 615 HA ASN 85 HA ASN 85 16.923 20.105 -7.416 616 HB2 ASN 85 HB2 ASN 85 16.598 22.978 -8.376 617 HB3 ASN 85 HB3 ASN 85 16.317 22.432 -6.723 618 HD21 ASN 85 HD22 ASN 85 18.191 21.499 -5.502 619 HD22 ASN 85 HD21 ASN 85 19.796 22.043 -5.954 620 H LEU 86 H LEU 86 15.099 20.098 -10.192 621 HA LEU 86 HA LEU 86 12.841 20.026 -10.721 622 HB2 LEU 86 HB2 LEU 86 12.879 18.306 -8.222 623 HB3 LEU 86 HB3 LEU 86 11.695 18.260 -9.534 624 HG LEU 86 HG LEU 86 14.561 17.349 -9.653 625 HD11 LEU 86 HD11 LEU 86 13.621 15.195 -9.738 626 HD12 LEU 86 HD12 LEU 86 12.595 16.030 -8.540 627 HD13 LEU 86 HD13 LEU 86 12.023 15.806 -10.206 628 HD21 LEU 86 HD21 LEU 86 12.414 17.626 -11.806 629 HD22 LEU 86 HD22 LEU 86 14.030 18.367 -11.822 630 HD23 LEU 86 HD23 LEU 86 13.868 16.619 -11.998 631 HA PRO 87 HA PRO 87 11.531 23.433 -7.782 632 HB2 PRO 87 HB2 PRO 87 10.753 24.510 -10.500 633 HB3 PRO 87 HB3 PRO 87 11.285 25.403 -9.042 634 HG2 PRO 87 HG2 PRO 87 13.057 24.901 -11.014 635 HG3 PRO 87 HG3 PRO 87 13.539 24.626 -9.306 636 HD2 PRO 87 HD2 PRO 87 12.631 22.595 -11.354 637 HD3 PRO 87 HD3 PRO 87 13.993 22.526 -10.206 638 HA PRO 88 HA PRO 88 7.054 22.875 -9.382 639 HB2 PRO 88 HB2 PRO 88 7.000 20.294 -10.884 640 HB3 PRO 88 HB3 PRO 88 6.281 21.873 -11.316 641 HG2 PRO 88 HG2 PRO 88 8.468 20.822 -12.561 642 HG3 PRO 88 HG3 PRO 88 8.312 22.600 -12.270 643 HD2 PRO 88 HD2 PRO 88 9.835 20.538 -10.655 644 HD3 PRO 88 HD3 PRO 88 10.345 22.161 -11.218 645 H GLU 89 H GLU 89 5.318 20.680 -9.366 646 HA GLU 89 HA GLU 89 5.158 19.673 -6.746 647 HB2 GLU 89 HB2 GLU 89 3.523 18.068 -7.731 648 HB3 GLU 89 HB3 GLU 89 3.256 19.745 -8.190 649 HG2 GLU 89 HG2 GLU 89 4.202 19.362 -10.408 650 HG3 GLU 89 HG3 GLU 89 4.711 17.744 -9.974 651 H TRP 90 H TRP 90 7.588 18.762 -8.857 652 HA TRP 90 HA TRP 90 7.918 15.963 -8.116 653 HB2 TRP 90 HB2 TRP 90 9.577 17.979 -9.618 654 HB3 TRP 90 HB3 TRP 90 10.091 16.315 -9.278 655 HD1 TRP 90 HD1 TRP 90 7.619 18.286 -11.429 656 HE1 TRP 90 HE1 TRP 90 6.375 16.688 -13.016 657 HE3 TRP 90 HE3 TRP 90 9.776 13.909 -9.981 658 HZ2 TRP 90 HZ2 TRP 90 6.348 13.856 -13.584 659 HZ3 TRP 90 HZ3 TRP 90 9.326 11.823 -11.218 660 HH2 TRP 90 HH2 TRP 90 7.619 11.771 -13.011 661 H VAL 91 H VAL 91 8.194 18.542 -6.184 662 HA VAL 91 HA VAL 91 10.021 17.049 -4.403 663 HB VAL 91 HB VAL 91 11.126 19.038 -3.555 664 HG11 VAL 91 HG11 VAL 91 12.281 17.735 -5.197 665 HG12 VAL 91 HG12 VAL 91 11.534 18.660 -6.500 666 HG13 VAL 91 HG13 VAL 91 12.661 19.451 -5.383 667 HG21 VAL 91 HG21 VAL 91 9.852 20.561 -5.876 668 HG22 VAL 91 HG22 VAL 91 9.438 20.777 -4.165 669 HG23 VAL 91 HG23 VAL 91 11.056 21.181 -4.738 670 H THR 92 H THR 92 6.980 17.721 -4.687 671 HA THR 92 HA THR 92 6.501 18.847 -1.954 672 HB THR 92 HB THR 92 4.186 19.210 -2.630 673 HG1 THR 92 HG1 THR 92 3.517 18.772 -4.659 674 HG21 THR 92 HG21 THR 92 4.539 21.059 -4.181 675 HG22 THR 92 HG22 THR 92 5.855 21.021 -2.993 676 HG23 THR 92 HG23 THR 92 6.131 20.420 -4.642 677 H GLN 93 H GLN 93 7.139 16.022 -3.133 678 HA GLN 93 HA GLN 93 5.238 14.107 -2.437 679 HB2 GLN 93 HB2 GLN 93 8.282 14.204 -2.578 680 HB3 GLN 93 HB3 GLN 93 7.464 12.722 -2.120 681 HG2 GLN 93 HG2 GLN 93 7.947 12.713 -4.454 682 HG3 GLN 93 HG3 GLN 93 6.199 12.676 -4.185 683 HE21 GLN 93 HE22 GLN 93 5.259 13.788 -5.953 684 HE22 GLN 93 HE21 GLN 93 5.829 15.413 -6.362 685 H GLU 94 H GLU 94 5.768 12.354 -0.783 686 HA GLU 94 HA GLU 94 5.684 13.453 1.961 687 HB2 GLU 94 HB2 GLU 94 4.389 11.445 1.386 688 HB3 GLU 94 HB3 GLU 94 5.881 10.573 0.978 689 HG2 GLU 94 HG2 GLU 94 6.694 10.723 3.231 690 HG3 GLU 94 HG3 GLU 94 5.346 11.761 3.719 691 H ILE 95 H ILE 95 8.035 11.738 -0.110 692 HA ILE 95 HA ILE 95 10.250 12.934 1.466 693 HB ILE 95 HB ILE 95 10.211 10.021 0.581 694 HG12 ILE 95 HG12 ILE 95 10.103 11.247 3.363 695 HG13 ILE 95 HG13 ILE 95 8.884 10.238 2.568 696 HG21 ILE 95 HG21 ILE 95 12.450 11.010 0.298 697 HG22 ILE 95 HG22 ILE 95 12.419 11.591 1.981 698 HG23 ILE 95 HG23 ILE 95 12.458 9.857 1.604 699 HD11 ILE 95 HD11 ILE 95 9.928 8.809 4.111 700 HD12 ILE 95 HD12 ILE 95 10.635 8.364 2.545 701 HD13 ILE 95 HD13 ILE 95 11.554 9.369 3.692 702 H PHE 96 H PHE 96 11.841 13.768 0.228 703 HA PHE 96 HA PHE 96 12.072 12.935 -2.596 704 HB2 PHE 96 HB2 PHE 96 11.048 15.083 -2.798 705 HB3 PHE 96 HB3 PHE 96 12.139 15.789 -1.604 706 HD1 PHE 96 HD1 PHE 96 11.867 14.633 -5.164 707 HD2 PHE 96 HD2 PHE 96 14.453 16.341 -2.138 708 HE1 PHE 96 HE1 PHE 96 13.617 15.027 -6.849 709 HE2 PHE 96 HE2 PHE 96 16.162 16.804 -3.871 710 HZ PHE 96 HZ PHE 96 15.752 16.149 -6.229 711 H GLU 97 H GLU 97 14.150 12.496 -3.251 712 HA GLU 97 HA GLU 97 16.409 13.117 -1.398 713 HB2 GLU 97 HB2 GLU 97 15.917 10.430 -2.662 714 HB3 GLU 97 HB3 GLU 97 17.380 10.892 -1.816 715 HG2 GLU 97 HG2 GLU 97 14.614 10.735 -0.557 716 HG3 GLU 97 HG3 GLU 97 15.850 9.507 -0.448 717 H ASP 98 H ASP 98 18.498 13.068 -2.370 718 HA ASP 98 HA ASP 98 18.630 12.994 -5.309 719 HB2 ASP 98 HB2 ASP 98 18.398 15.339 -4.952 720 HB3 ASP 98 HB3 ASP 98 19.597 15.327 -3.654 721 H TRP 99 H TRP 99 19.696 11.026 -5.214 722 HA TRP 99 HA TRP 99 22.058 10.717 -3.440 723 HB2 TRP 99 HB2 TRP 99 20.918 8.662 -5.322 724 HB3 TRP 99 HB3 TRP 99 22.039 8.420 -3.996 725 HD1 TRP 99 HD1 TRP 99 18.589 8.164 -4.904 726 HE1 TRP 99 HE1 TRP 99 17.002 7.798 -2.886 727 HE3 TRP 99 HE3 TRP 99 21.711 9.561 -1.099 728 HZ2 TRP 99 HZ2 TRP 99 17.246 7.562 -0.066 729 HZ3 TRP 99 HZ3 TRP 99 20.963 9.333 1.263 730 HH2 TRP 99 HH2 TRP 99 18.767 8.307 1.801 731 H GLN 100 H GLN 100 23.703 11.914 -4.231 732 HA GLN 100 HA GLN 100 24.167 12.188 -7.088 733 HB2 GLN 100 HB2 GLN 100 25.869 13.171 -4.758 734 HB3 GLN 100 HB3 GLN 100 25.930 13.708 -6.447 735 HG2 GLN 100 HG2 GLN 100 23.457 14.404 -6.145 736 HG3 GLN 100 HG3 GLN 100 23.682 14.138 -4.423 737 HE21 GLN 100 HE22 GLN 100 22.898 16.610 -5.304 738 HE22 GLN 100 HE21 GLN 100 24.241 17.750 -5.086 739 H LEU 101 H LEU 101 25.452 10.955 -8.351 740 HA LEU 101 HA LEU 101 27.727 9.370 -7.304 741 HB2 LEU 101 HB2 LEU 101 25.307 8.250 -8.777 742 HB3 LEU 101 HB3 LEU 101 26.834 7.391 -8.653 743 HG LEU 101 HG LEU 101 25.027 8.095 -6.295 744 HD11 LEU 101 HD11 LEU 101 24.558 5.726 -6.209 745 HD12 LEU 101 HD12 LEU 101 24.127 6.369 -7.801 746 HD13 LEU 101 HD13 LEU 101 25.633 5.426 -7.601 747 HD21 LEU 101 HD21 LEU 101 27.570 6.422 -6.418 748 HD22 LEU 101 HD22 LEU 101 27.403 7.992 -5.593 749 HD23 LEU 101 HD23 LEU 101 26.498 6.598 -5.009 750 H GLU 102 H GLU 102 28.921 8.323 -9.208 751 HA GLU 102 HA GLU 102 29.386 10.346 -11.259 752 HB2 GLU 102 HB2 GLU 102 31.192 8.917 -11.983 753 HB3 GLU 102 HB3 GLU 102 31.295 9.272 -10.270 754 HG2 GLU 102 HG2 GLU 102 30.055 6.676 -11.191 755 HG3 GLU 102 HG3 GLU 102 31.792 6.880 -11.211 756 H ASP 103 H ASP 103 29.898 9.275 -13.535 757 HA ASP 103 HA ASP 103 27.243 8.299 -14.478 758 HB2 ASP 103 HB2 ASP 103 27.911 10.745 -14.692 759 HB3 ASP 103 HB3 ASP 103 29.010 10.234 -15.972 760 HA PRO 104 HA PRO 104 30.064 5.052 -15.893 761 HB2 PRO 104 HB2 PRO 104 27.473 3.590 -16.183 762 HB3 PRO 104 HB3 PRO 104 29.029 3.034 -15.470 763 HG2 PRO 104 HG2 PRO 104 27.000 3.748 -13.860 764 HG3 PRO 104 HG3 PRO 104 28.651 4.374 -13.513 765 HD2 PRO 104 HD2 PRO 104 26.412 5.757 -15.042 766 HD3 PRO 104 HD3 PRO 104 27.370 6.358 -13.659 767 H ASP 105 H ASP 105 27.555 6.472 -17.789 768 HA ASP 105 HA ASP 105 27.445 4.873 -20.118 769 HB2 ASP 105 HB2 ASP 105 25.896 6.672 -19.431 770 HB3 ASP 105 HB3 ASP 105 27.151 7.879 -19.701 771 H GLY 106 H GLY 106 29.351 4.143 -20.971 772 HA2 GLY 106 HA2 GLY 106 31.053 4.277 -22.573 773 HA3 GLY 106 HA3 GLY 106 31.088 6.034 -22.433 774 H GLN 107 H GLN 107 31.246 4.373 -19.380 775 HA GLN 107 HA GLN 107 34.106 5.076 -19.087 776 HB2 GLN 107 HB2 GLN 107 32.145 4.103 -16.986 777 HB3 GLN 107 HB3 GLN 107 33.766 4.742 -16.703 778 HG2 GLN 107 HG2 GLN 107 31.384 6.266 -17.818 779 HG3 GLN 107 HG3 GLN 107 31.937 6.270 -16.154 780 HE21 GLN 107 HE22 GLN 107 31.612 8.628 -17.081 781 HE22 GLN 107 HE21 GLN 107 33.133 9.415 -17.532 782 H SER 108 H SER 108 32.940 2.467 -17.142 783 HA SER 108 HA SER 108 34.080 0.294 -18.725 784 HB2 SER 108 HB2 SER 108 35.810 -0.322 -17.193 785 HB3 SER 108 HB3 SER 108 36.070 1.387 -17.580 786 HG SER 108 HG SER 108 36.237 1.080 -15.344 787 H LEU 109 H LEU 109 33.777 -1.812 -17.577 788 HA LEU 109 HA LEU 109 31.174 -2.016 -16.356 789 HB2 LEU 109 HB2 LEU 109 33.460 -4.035 -16.302 790 HB3 LEU 109 HB3 LEU 109 31.755 -4.366 -16.002 791 HG LEU 109 HG LEU 109 33.034 -3.567 -18.648 792 HD11 LEU 109 HD11 LEU 109 32.301 -5.791 -19.334 793 HD12 LEU 109 HD12 LEU 109 33.333 -5.884 -17.885 794 HD13 LEU 109 HD13 LEU 109 31.568 -6.065 -17.735 795 HD21 LEU 109 HD21 LEU 109 30.768 -3.879 -19.644 796 HD22 LEU 109 HD22 LEU 109 30.085 -3.954 -18.003 797 HD23 LEU 109 HD23 LEU 109 30.865 -2.467 -18.569 798 H GLU 110 H GLU 110 34.422 -1.955 -14.964 799 HA GLU 110 HA GLU 110 33.677 -2.395 -12.235 800 HB2 GLU 110 HB2 GLU 110 35.998 -2.442 -13.127 801 HB3 GLU 110 HB3 GLU 110 35.947 -0.683 -13.333 802 HG2 GLU 110 HG2 GLU 110 35.671 -0.391 -10.899 803 HG3 GLU 110 HG3 GLU 110 35.587 -2.140 -10.676 804 H VAL 111 H VAL 111 33.705 0.663 -14.127 805 HA VAL 111 HA VAL 111 32.820 2.276 -11.860 806 HB VAL 111 HB VAL 111 32.843 2.780 -14.841 807 HG11 VAL 111 HG11 VAL 111 32.058 4.673 -12.583 808 HG12 VAL 111 HG12 VAL 111 32.485 5.191 -14.224 809 HG13 VAL 111 HG13 VAL 111 31.063 4.175 -13.973 810 HG21 VAL 111 HG21 VAL 111 34.699 4.301 -14.282 811 HG22 VAL 111 HG22 VAL 111 34.498 3.947 -12.550 812 HG23 VAL 111 HG23 VAL 111 35.066 2.688 -13.664 813 H PHE 112 H PHE 112 31.046 0.528 -14.511 814 HA PHE 112 HA PHE 112 28.433 1.450 -13.680 815 HB2 PHE 112 HB2 PHE 112 29.494 -0.911 -15.219 816 HB3 PHE 112 HB3 PHE 112 27.878 -1.010 -14.537 817 HD1 PHE 112 HD1 PHE 112 26.062 0.481 -15.226 818 HD2 PHE 112 HD2 PHE 112 29.930 0.559 -17.128 819 HE1 PHE 112 HE1 PHE 112 25.101 1.743 -17.148 820 HE2 PHE 112 HE2 PHE 112 28.974 1.816 -19.033 821 HZ PHE 112 HZ PHE 112 26.572 2.447 -19.018 822 H ARG 113 H ARG 113 30.303 -1.446 -12.679 823 HA ARG 113 HA ARG 113 28.431 -2.422 -10.733 824 HB2 ARG 113 HB2 ARG 113 31.458 -2.686 -10.950 825 HB3 ARG 113 HB3 ARG 113 30.481 -3.592 -9.790 826 HG2 ARG 113 HG2 ARG 113 29.271 -4.732 -11.566 827 HG3 ARG 113 HG3 ARG 113 30.014 -3.728 -12.802 828 HD2 ARG 113 HD2 ARG 113 32.237 -4.579 -12.159 829 HD3 ARG 113 HD3 ARG 113 31.464 -5.681 -10.990 830 HE ARG 113 HE ARG 113 30.214 -6.606 -13.048 831 HH11 ARG 113 HH21 ARG 113 33.588 -5.573 -13.155 832 HH12 ARG 113 HH22 ARG 113 33.980 -6.714 -14.409 833 HH21 ARG 113 HH11 ARG 113 30.820 -8.083 -14.522 834 HH22 ARG 113 HH12 ARG 113 32.441 -8.093 -15.190 835 H THR 114 H THR 114 31.104 -0.092 -10.384 836 HA THR 114 HA THR 114 30.903 0.338 -7.555 837 HB THR 114 HB THR 114 31.800 2.223 -9.776 838 HG1 THR 114 HG1 THR 114 33.093 0.442 -9.653 839 HG21 THR 114 HG21 THR 114 33.130 3.329 -7.964 840 HG22 THR 114 HG22 THR 114 31.390 3.596 -7.826 841 HG23 THR 114 HG23 THR 114 32.192 2.415 -6.762 842 H VAL 115 H VAL 115 29.166 1.933 -10.258 843 HA VAL 115 HA VAL 115 27.567 3.616 -8.466 844 HB VAL 115 HB VAL 115 27.459 2.937 -11.416 845 HG11 VAL 115 HG11 VAL 115 25.101 3.334 -10.790 846 HG12 VAL 115 HG12 VAL 115 25.572 4.828 -9.933 847 HG13 VAL 115 HG13 VAL 115 25.758 4.697 -11.697 848 HG21 VAL 115 HG21 VAL 115 29.227 4.468 -10.693 849 HG22 VAL 115 HG22 VAL 115 27.993 5.403 -11.555 850 HG23 VAL 115 HG23 VAL 115 28.050 5.454 -9.792 851 H ARG 116 H ARG 116 26.894 0.564 -10.207 852 HA ARG 116 HA ARG 116 24.198 0.184 -9.566 853 HB2 ARG 116 HB2 ARG 116 25.611 -1.198 -11.127 854 HB3 ARG 116 HB3 ARG 116 26.407 -1.931 -9.733 855 HG2 ARG 116 HG2 ARG 116 24.094 -2.768 -9.006 856 HG3 ARG 116 HG3 ARG 116 23.494 -2.181 -10.566 857 HD2 ARG 116 HD2 ARG 116 23.923 -4.538 -10.777 858 HD3 ARG 116 HD3 ARG 116 25.166 -3.671 -11.687 859 HE ARG 116 HE ARG 116 25.858 -4.385 -8.883 860 HH11 ARG 116 HH21 ARG 116 25.872 -5.733 -12.089 861 HH12 ARG 116 HH22 ARG 116 27.461 -6.451 -11.925 862 HH21 ARG 116 HH11 ARG 116 27.739 -5.593 -8.581 863 HH22 ARG 116 HH12 ARG 116 28.309 -6.595 -9.881 864 H GLY 117 H GLY 117 26.962 -0.921 -7.550 865 HA2 GLY 117 HA2 GLY 117 25.437 -2.110 -5.463 866 HA3 GLY 117 HA3 GLY 117 27.074 -1.455 -5.297 867 H GLN 118 H GLN 118 26.391 1.317 -5.911 868 HA GLN 118 HA GLN 118 25.342 2.089 -3.289 869 HB2 GLN 118 HB2 GLN 118 26.323 3.755 -5.636 870 HB3 GLN 118 HB3 GLN 118 25.801 4.412 -4.070 871 HG2 GLN 118 HG2 GLN 118 27.561 3.189 -2.899 872 HG3 GLN 118 HG3 GLN 118 28.057 2.363 -4.376 873 HE21 GLN 118 HE22 GLN 118 29.203 3.550 -6.034 874 HE22 GLN 118 HE21 GLN 118 29.922 5.117 -5.652 875 H VAL 119 H VAL 119 24.193 2.572 -6.687 876 HA VAL 119 HA VAL 119 21.683 3.738 -6.069 877 HB VAL 119 HB VAL 119 22.322 1.793 -8.330 878 HG11 VAL 119 HG11 VAL 119 19.906 1.972 -8.116 879 HG12 VAL 119 HG12 VAL 119 20.025 3.746 -7.956 880 HG13 VAL 119 HG13 VAL 119 20.424 2.940 -9.502 881 HG21 VAL 119 HG21 VAL 119 22.606 3.817 -9.698 882 HG22 VAL 119 HG22 VAL 119 22.234 4.851 -8.296 883 HG23 VAL 119 HG23 VAL 119 23.721 3.886 -8.341 884 H LYS 120 H LYS 120 22.530 0.245 -6.131 885 HA LYS 120 HA LYS 120 20.010 -0.819 -5.344 886 HB2 LYS 120 HB2 LYS 120 21.953 -2.166 -6.119 887 HB3 LYS 120 HB3 LYS 120 22.837 -1.785 -4.648 888 HG2 LYS 120 HG2 LYS 120 21.079 -2.885 -3.288 889 HG3 LYS 120 HG3 LYS 120 20.168 -3.237 -4.758 890 HD2 LYS 120 HD2 LYS 120 22.092 -4.631 -5.553 891 HD3 LYS 120 HD3 LYS 120 22.950 -4.303 -4.047 892 HE2 LYS 120 HE2 LYS 120 20.110 -5.283 -3.851 893 HE3 LYS 120 HE3 LYS 120 21.298 -6.460 -4.441 894 HZ1 LYS 120 HZ1 LYS 120 22.606 -6.017 -2.376 895 HZ2 LYS 120 HZ2 LYS 120 21.422 -5.002 -1.827 896 HZ3 LYS 120 HZ3 LYS 120 21.123 -6.594 -2.021 897 H GLU 121 H GLU 121 22.792 0.030 -3.168 898 HA GLU 121 HA GLU 121 21.263 -0.575 -0.821 899 HB2 GLU 121 HB2 GLU 121 23.072 0.025 0.436 900 HB3 GLU 121 HB3 GLU 121 23.847 -0.399 -1.095 901 HG2 GLU 121 HG2 GLU 121 24.137 1.949 -1.645 902 HG3 GLU 121 HG3 GLU 121 23.168 2.453 -0.279 903 H ARG 122 H ARG 122 21.547 2.528 -2.555 904 HA ARG 122 HA ARG 122 20.203 4.024 -0.461 905 HB2 ARG 122 HB2 ARG 122 20.346 4.513 -3.484 906 HB3 ARG 122 HB3 ARG 122 19.721 5.667 -2.317 907 HG2 ARG 122 HG2 ARG 122 22.610 4.681 -2.451 908 HG3 ARG 122 HG3 ARG 122 21.986 6.206 -3.033 909 HD2 ARG 122 HD2 ARG 122 22.892 6.855 -1.061 910 HD3 ARG 122 HD3 ARG 122 21.220 6.552 -0.550 911 HE ARG 122 HE ARG 122 23.297 4.413 -0.241 912 HH11 ARG 122 HH11 ARG 122 21.396 6.829 1.431 913 HH12 ARG 122 HH12 ARG 122 21.787 6.184 3.000 914 HH21 ARG 122 HH21 ARG 122 23.861 3.708 1.792 915 HH22 ARG 122 HH22 ARG 122 23.135 4.457 3.186 916 H VAL 123 H VAL 123 18.909 2.270 -3.333 917 HA VAL 123 HA VAL 123 16.183 2.706 -2.566 918 HB VAL 123 HB VAL 123 17.597 0.727 -4.388 919 HG11 VAL 123 HG11 VAL 123 15.511 -0.208 -5.113 920 HG12 VAL 123 HG12 VAL 123 15.778 -0.621 -3.430 921 HG13 VAL 123 HG13 VAL 123 14.617 0.670 -3.837 922 HG21 VAL 123 HG21 VAL 123 17.246 3.029 -5.148 923 HG22 VAL 123 HG22 VAL 123 16.275 1.882 -6.094 924 HG23 VAL 123 HG23 VAL 123 15.496 2.874 -4.839 925 H GLU 124 H GLU 124 18.263 -0.209 -1.737 926 HA GLU 124 HA GLU 124 16.207 -1.420 -0.168 927 HB2 GLU 124 HB2 GLU 124 19.205 -1.458 0.308 928 HB3 GLU 124 HB3 GLU 124 18.005 -2.536 1.055 929 HG2 GLU 124 HG2 GLU 124 17.343 -3.369 -1.130 930 HG3 GLU 124 HG3 GLU 124 18.593 -2.401 -1.911 931 H ASN 125 H ASN 125 18.446 1.160 0.778 932 HA ASN 125 HA ASN 125 17.484 1.067 3.468 933 HB2 ASN 125 HB2 ASN 125 19.329 2.234 3.862 934 HB3 ASN 125 HB3 ASN 125 19.641 2.299 2.142 935 HD21 ASN 125 HD22 ASN 125 18.477 4.131 0.923 936 HD22 ASN 125 HD21 ASN 125 18.503 5.675 1.773 937 H LEU 126 H LEU 126 16.311 2.658 0.644 938 HA LEU 126 HA LEU 126 14.536 4.519 2.051 939 HB2 LEU 126 HB2 LEU 126 15.571 5.098 -0.106 940 HB3 LEU 126 HB3 LEU 126 14.903 3.649 -0.853 941 HG LEU 126 HG LEU 126 12.606 4.552 -0.507 942 HD11 LEU 126 HD11 LEU 126 14.085 7.092 0.292 943 HD12 LEU 126 HD12 LEU 126 12.345 6.976 -0.045 944 HD13 LEU 126 HD13 LEU 126 13.018 6.123 1.343 945 HD21 LEU 126 HD21 LEU 126 12.740 6.110 -2.356 946 HD22 LEU 126 HD22 LEU 126 14.510 6.271 -2.112 947 HD23 LEU 126 HD23 LEU 126 13.801 4.727 -2.636 948 H ILE 127 H ILE 127 14.056 1.441 0.175 949 HA ILE 127 HA ILE 127 11.207 1.562 0.553 950 HB ILE 127 HB ILE 127 11.113 -0.771 -0.119 951 HG12 ILE 127 HG12 ILE 127 14.118 -0.777 0.184 952 HG13 ILE 127 HG13 ILE 127 12.912 -1.903 0.825 953 HG21 ILE 127 HG21 ILE 127 11.294 1.160 -1.735 954 HG22 ILE 127 HG22 ILE 127 13.037 0.850 -1.865 955 HG23 ILE 127 HG23 ILE 127 11.862 -0.364 -2.421 956 HD11 ILE 127 HD11 ILE 127 13.838 -1.660 -2.058 957 HD12 ILE 127 HD12 ILE 127 14.167 -2.977 -0.921 958 HD13 ILE 127 HD13 ILE 127 12.509 -2.710 -1.497 959 H ALA 128 H ALA 128 13.700 0.295 2.698 960 HA ALA 128 HA ALA 128 11.864 -1.062 4.398 961 HB1 ALA 128 HB1 ALA 128 13.742 -0.987 6.031 962 HB2 ALA 128 HB2 ALA 128 14.313 -1.434 4.414 963 HB3 ALA 128 HB3 ALA 128 14.572 0.219 5.021 964 H LYS 129 H LYS 129 12.506 2.367 4.011 965 HA LYS 129 HA LYS 129 11.252 3.165 6.567 966 HB2 LYS 129 HB2 LYS 129 12.193 4.804 4.176 967 HB3 LYS 129 HB3 LYS 129 11.574 5.463 5.690 968 HG2 LYS 129 HG2 LYS 129 13.417 4.461 6.947 969 HG3 LYS 129 HG3 LYS 129 14.034 3.678 5.486 970 HD2 LYS 129 HD2 LYS 129 14.324 5.925 4.425 971 HD3 LYS 129 HD3 LYS 129 13.844 6.695 5.938 972 HE2 LYS 129 HE2 LYS 129 16.232 4.815 5.582 973 HE3 LYS 129 HE3 LYS 129 16.326 6.578 5.523 974 HZ1 LYS 129 HZ1 LYS 129 15.524 6.643 7.846 975 HZ2 LYS 129 HZ2 LYS 129 15.485 5.003 7.915 976 HZ3 LYS 129 HZ3 LYS 129 16.906 5.783 7.731 977 H ILE 130 H ILE 130 10.333 3.124 3.121 978 HA ILE 130 HA ILE 130 7.675 4.216 3.880 979 HB ILE 130 HB ILE 130 7.456 5.026 1.567 980 HG12 ILE 130 HG12 ILE 130 9.505 5.379 0.229 981 HG13 ILE 130 HG13 ILE 130 10.413 4.330 1.292 982 HG21 ILE 130 HG21 ILE 130 8.847 6.956 1.971 983 HG22 ILE 130 HG22 ILE 130 8.200 6.391 3.507 984 HG23 ILE 130 HG23 ILE 130 9.891 6.044 3.087 985 HD11 ILE 130 HD11 ILE 130 9.012 2.404 0.585 986 HD12 ILE 130 HD12 ILE 130 8.019 3.502 -0.409 987 HD13 ILE 130 HD13 ILE 130 9.726 3.227 -0.809 988 H SER 131 H SER 131 8.636 1.187 3.414 989 HA SER 131 HA SER 131 6.605 -0.017 1.801 990 HB2 SER 131 HB2 SER 131 8.577 -1.122 2.784 991 HB3 SER 131 HB3 SER 131 7.846 -0.995 4.397 992 HG SER 131 HG SER 131 6.056 -2.273 3.490 Start of MODEL 6 1 H MET 1 H1 MET 1 2.604 0.085 2.023 2 HA MET 1 HA MET 1 3.507 -0.317 -0.017 3 HB2 MET 1 HB2 MET 1 1.861 -1.872 -0.922 4 HB3 MET 1 HB3 MET 1 0.670 -0.576 -1.109 5 HG2 MET 1 HG2 MET 1 2.088 0.543 -2.766 6 HG3 MET 1 HG3 MET 1 3.363 -0.643 -2.517 7 HE1 MET 1 HE1 MET 1 2.294 -3.731 -4.478 8 HE2 MET 1 HE2 MET 1 3.599 -2.841 -3.662 9 HE3 MET 1 HE3 MET 1 2.241 -3.496 -2.717 10 H LYS 2 H LYS 2 4.436 1.497 -0.701 11 HA LYS 2 HA LYS 2 2.758 3.834 -1.550 12 HB2 LYS 2 HB2 LYS 2 5.357 3.933 0.040 13 HB3 LYS 2 HB3 LYS 2 4.598 5.319 -0.720 14 HG2 LYS 2 HG2 LYS 2 2.523 4.933 0.601 15 HG3 LYS 2 HG3 LYS 2 3.341 3.627 1.474 16 HD2 LYS 2 HD2 LYS 2 5.007 5.224 2.349 17 HD3 LYS 2 HD3 LYS 2 4.249 6.536 1.416 18 HE2 LYS 2 HE2 LYS 2 2.107 6.138 2.643 19 HE3 LYS 2 HE3 LYS 2 2.896 4.888 3.612 20 HZ1 LYS 2 HZ1 LYS 2 3.749 7.745 3.517 21 HZ2 LYS 2 HZ2 LYS 2 2.833 7.103 4.717 22 HZ3 LYS 2 HZ3 LYS 2 4.378 6.596 4.512 23 H LYS 3 H LYS 3 4.050 5.317 -2.995 24 HA LYS 3 HA LYS 3 5.362 3.602 -5.074 25 HB2 LYS 3 HB2 LYS 3 3.776 6.168 -5.484 26 HB3 LYS 3 HB3 LYS 3 4.543 5.232 -6.737 27 HG2 LYS 3 HG2 LYS 3 2.383 4.517 -6.940 28 HG3 LYS 3 HG3 LYS 3 3.107 3.240 -5.975 29 HD2 LYS 3 HD2 LYS 3 0.862 3.745 -5.188 30 HD3 LYS 3 HD3 LYS 3 2.028 4.150 -3.935 31 HE2 LYS 3 HE2 LYS 3 1.965 6.549 -4.949 32 HE3 LYS 3 HE3 LYS 3 0.508 6.020 -5.788 33 HZ1 LYS 3 HZ1 LYS 3 -0.120 7.050 -3.718 34 HZ2 LYS 3 HZ2 LYS 3 -0.355 5.449 -3.461 35 HZ3 LYS 3 HZ3 LYS 3 1.000 6.212 -2.867 36 H VAL 4 H VAL 4 7.177 4.174 -6.062 37 HA VAL 4 HA VAL 4 8.609 6.641 -5.145 38 HB VAL 4 HB VAL 4 10.072 4.033 -5.527 39 HG11 VAL 4 HG11 VAL 4 11.915 5.228 -4.451 40 HG12 VAL 4 HG12 VAL 4 11.438 6.018 -5.943 41 HG13 VAL 4 HG13 VAL 4 10.932 6.709 -4.381 42 HG21 VAL 4 HG21 VAL 4 9.169 5.323 -2.932 43 HG22 VAL 4 HG22 VAL 4 8.725 3.720 -3.546 44 HG23 VAL 4 HG23 VAL 4 10.390 4.037 -3.068 45 H MET 5 H MET 5 9.712 7.769 -6.683 46 HA MET 5 HA MET 5 9.747 6.683 -9.464 47 HB2 MET 5 HB2 MET 5 7.761 7.972 -9.425 48 HB3 MET 5 HB3 MET 5 8.535 9.284 -8.526 49 HG2 MET 5 HG2 MET 5 8.194 9.910 -10.832 50 HG3 MET 5 HG3 MET 5 9.908 9.863 -10.449 51 HE1 MET 5 HE1 MET 5 7.000 8.420 -12.654 52 HE2 MET 5 HE2 MET 5 7.961 9.792 -13.248 53 HE3 MET 5 HE3 MET 5 8.026 8.241 -14.087 54 H PHE 6 H PHE 6 11.511 7.043 -10.536 55 HA PHE 6 HA PHE 6 13.699 8.586 -9.189 56 HB2 PHE 6 HB2 PHE 6 13.934 6.372 -11.250 57 HB3 PHE 6 HB3 PHE 6 15.225 7.064 -10.285 58 HD1 PHE 6 HD2 PHE 6 15.156 6.713 -7.715 59 HD2 PHE 6 HD1 PHE 6 12.714 4.521 -10.496 60 HE1 PHE 6 HE2 PHE 6 14.595 5.092 -5.915 61 HE2 PHE 6 HE1 PHE 6 12.129 2.908 -8.684 62 HZ PHE 6 HZ PHE 6 13.040 3.225 -6.379 63 H VAL 7 H VAL 7 14.544 10.334 -10.119 64 HA VAL 7 HA VAL 7 14.109 10.914 -13.014 65 HB VAL 7 HB VAL 7 14.116 12.691 -10.588 66 HG11 VAL 7 HG11 VAL 7 15.104 13.627 -13.325 67 HG12 VAL 7 HG12 VAL 7 14.563 14.680 -12.009 68 HG13 VAL 7 HG13 VAL 7 15.995 13.704 -11.776 69 HG21 VAL 7 HG21 VAL 7 12.717 12.875 -13.289 70 HG22 VAL 7 HG22 VAL 7 12.050 12.053 -11.840 71 HG23 VAL 7 HG23 VAL 7 12.353 13.786 -11.805 72 H CYS 8 H CYS 8 15.862 10.822 -14.310 73 HA CYS 8 HA CYS 8 18.539 11.470 -13.127 74 HB2 CYS 8 HB2 CYS 8 18.200 9.015 -13.352 75 HB3 CYS 8 HB3 CYS 8 17.953 9.192 -15.084 76 HG CYS 8 HG CYS 8 20.602 9.941 -13.196 77 H LYS 9 H LYS 9 20.158 12.091 -14.955 78 HA LYS 9 HA LYS 9 18.946 14.392 -16.161 79 HB2 LYS 9 HB2 LYS 9 21.480 13.735 -15.323 80 HB3 LYS 9 HB3 LYS 9 21.724 13.702 -17.052 81 HG2 LYS 9 HG2 LYS 9 20.614 16.004 -15.371 82 HG3 LYS 9 HG3 LYS 9 22.250 15.881 -15.983 83 HD2 LYS 9 HD2 LYS 9 19.742 16.326 -17.654 84 HD3 LYS 9 HD3 LYS 9 20.981 17.500 -17.238 85 HE2 LYS 9 HE2 LYS 9 22.683 16.075 -18.461 86 HE3 LYS 9 HE3 LYS 9 21.356 15.053 -19.039 87 HZ1 LYS 9 HZ1 LYS 9 20.393 17.027 -20.135 88 HZ2 LYS 9 HZ2 LYS 9 21.618 17.975 -19.578 89 HZ3 LYS 9 HZ3 LYS 9 21.924 16.786 -20.653 90 H ARG 10 H ARG 10 19.824 11.329 -17.675 91 HA ARG 10 HA ARG 10 18.065 12.180 -19.932 92 HB2 ARG 10 HB2 ARG 10 19.401 11.552 -21.700 93 HB3 ARG 10 HB3 ARG 10 20.338 12.622 -20.698 94 HG2 ARG 10 HG2 ARG 10 20.693 9.607 -20.914 95 HG3 ARG 10 HG3 ARG 10 21.666 10.854 -21.692 96 HD2 ARG 10 HD2 ARG 10 22.221 11.720 -19.355 97 HD3 ARG 10 HD3 ARG 10 21.565 10.176 -18.749 98 HE ARG 10 HE ARG 10 23.499 9.666 -20.820 99 HH11 ARG 10 HH21 ARG 10 23.480 10.836 -17.506 100 HH12 ARG 10 HH22 ARG 10 25.151 10.380 -17.243 101 HH21 ARG 10 HH11 ARG 10 25.652 9.043 -20.354 102 HH22 ARG 10 HH12 ARG 10 26.265 9.409 -18.741 103 H ASN 11 H ASN 11 17.745 10.423 -17.637 104 HA ASN 11 HA ASN 11 17.063 8.346 -16.972 105 HB2 ASN 11 HB2 ASN 11 15.133 9.629 -17.902 106 HB3 ASN 11 HB3 ASN 11 15.298 8.767 -19.415 107 HD21 ASN 11 HD22 ASN 11 15.157 7.836 -15.847 108 HD22 ASN 11 HD21 ASN 11 14.093 6.491 -16.179 109 H SER 12 H SER 12 19.454 7.928 -18.319 110 HA SER 12 HA SER 12 19.049 5.604 -20.086 111 HB2 SER 12 HB2 SER 12 21.519 5.990 -20.469 112 HB3 SER 12 HB3 SER 12 20.489 7.391 -20.810 113 HG SER 12 HG SER 12 22.367 7.856 -19.422 114 H CYS 13 H CYS 13 20.567 6.296 -16.943 115 HA CYS 13 HA CYS 13 21.140 3.357 -16.615 116 HB2 CYS 13 HB2 CYS 13 23.421 4.062 -15.735 117 HB3 CYS 13 HB3 CYS 13 23.153 4.282 -17.469 118 HG CYS 13 HG CYS 13 22.678 6.813 -17.487 119 H ARG 14 H ARG 14 21.722 6.148 -14.449 120 HA ARG 14 HA ARG 14 21.507 4.548 -12.137 121 HB2 ARG 14 HB2 ARG 14 20.843 7.515 -12.311 122 HB3 ARG 14 HB3 ARG 14 21.313 6.614 -10.852 123 HG2 ARG 14 HG2 ARG 14 23.542 6.132 -12.024 124 HG3 ARG 14 HG3 ARG 14 23.048 7.321 -13.239 125 HD2 ARG 14 HD2 ARG 14 22.641 8.905 -11.163 126 HD3 ARG 14 HD3 ARG 14 23.629 7.747 -10.298 127 HE ARG 14 HE ARG 14 25.539 8.370 -11.596 128 HH11 ARG 14 HH11 ARG 14 22.789 10.381 -12.632 129 HH12 ARG 14 HH12 ARG 14 23.808 11.206 -13.790 130 HH21 ARG 14 HH22 ARG 14 26.675 9.682 -12.805 131 HH22 ARG 14 HH21 ARG 14 25.915 10.633 -14.080 132 H SER 15 H SER 15 18.812 6.523 -13.484 133 HA SER 15 HA SER 15 16.904 5.742 -11.442 134 HB2 SER 15 HB2 SER 15 15.259 6.667 -13.210 135 HB3 SER 15 HB3 SER 15 16.518 7.756 -12.641 136 HG SER 15 HG SER 15 16.478 6.299 -15.107 137 H GLN 16 H GLN 16 17.916 4.268 -14.478 138 HA GLN 16 HA GLN 16 15.656 2.380 -14.616 139 HB2 GLN 16 HB2 GLN 16 18.376 2.299 -16.017 140 HB3 GLN 16 HB3 GLN 16 16.972 1.331 -16.439 141 HG2 GLN 16 HG2 GLN 16 17.080 4.391 -16.660 142 HG3 GLN 16 HG3 GLN 16 17.411 3.276 -17.963 143 HE21 GLN 16 HE22 GLN 16 15.552 4.909 -18.724 144 HE22 GLN 16 HE21 GLN 16 13.932 4.259 -18.489 145 H MET 17 H MET 17 19.058 2.215 -13.470 146 HA MET 17 HA MET 17 18.935 -0.481 -12.429 147 HB2 MET 17 HB2 MET 17 20.563 1.950 -11.545 148 HB3 MET 17 HB3 MET 17 20.778 0.320 -10.910 149 HG2 MET 17 HG2 MET 17 21.337 -0.484 -13.209 150 HG3 MET 17 HG3 MET 17 21.257 1.185 -13.785 151 HE1 MET 17 HE1 MET 17 23.651 -1.113 -13.735 152 HE2 MET 17 HE2 MET 17 23.884 0.412 -14.632 153 HE3 MET 17 HE3 MET 17 25.102 -0.125 -13.446 154 H ALA 18 H ALA 18 18.013 2.680 -10.969 155 HA ALA 18 HA ALA 18 17.479 1.659 -8.353 156 HB1 ALA 18 HB1 ALA 18 16.194 4.065 -9.724 157 HB2 ALA 18 HB2 ALA 18 16.416 3.797 -7.981 158 HB3 ALA 18 HB3 ALA 18 17.826 4.080 -9.018 159 H GLU 19 H GLU 19 15.237 2.179 -11.138 160 HA GLU 19 HA GLU 19 12.984 0.913 -9.895 161 HB2 GLU 19 HB2 GLU 19 13.102 2.281 -12.077 162 HB3 GLU 19 HB3 GLU 19 13.593 0.770 -12.861 163 HG2 GLU 19 HG2 GLU 19 11.440 -0.214 -11.645 164 HG3 GLU 19 HG3 GLU 19 10.984 1.474 -11.470 165 H GLY 20 H GLY 20 15.677 -0.526 -11.814 166 HA2 GLY 20 HA2 GLY 20 14.844 -3.206 -11.878 167 HA3 GLY 20 HA3 GLY 20 16.523 -2.659 -11.802 168 H PHE 21 H PHE 21 16.854 -1.674 -9.257 169 HA PHE 21 HA PHE 21 16.733 -4.086 -7.636 170 HB2 PHE 21 HB2 PHE 21 17.502 -1.204 -7.027 171 HB3 PHE 21 HB3 PHE 21 17.547 -2.487 -5.813 172 HD1 PHE 21 HD2 PHE 21 18.709 -4.761 -6.619 173 HD2 PHE 21 HD1 PHE 21 19.550 -0.827 -8.177 174 HE1 PHE 21 HE2 PHE 21 20.918 -5.547 -7.400 175 HE2 PHE 21 HE1 PHE 21 21.747 -1.612 -8.972 176 HZ PHE 21 HZ PHE 21 22.436 -4.007 -8.594 177 H ALA 22 H ALA 22 14.838 -1.032 -7.528 178 HA ALA 22 HA ALA 22 13.357 -1.828 -5.226 179 HB1 ALA 22 HB1 ALA 22 12.569 0.094 -7.451 180 HB2 ALA 22 HB2 ALA 22 11.931 0.058 -5.770 181 HB3 ALA 22 HB3 ALA 22 13.611 0.500 -6.083 182 H LYS 23 H LYS 23 12.539 -2.381 -8.697 183 HA LYS 23 HA LYS 23 9.930 -3.487 -8.123 184 HB2 LYS 23 HB2 LYS 23 9.823 -4.063 -10.403 185 HB3 LYS 23 HB3 LYS 23 10.717 -2.540 -10.297 186 HG2 LYS 23 HG2 LYS 23 12.835 -4.052 -10.408 187 HG3 LYS 23 HG3 LYS 23 11.755 -5.304 -10.997 188 HD2 LYS 23 HD2 LYS 23 12.151 -2.537 -12.240 189 HD3 LYS 23 HD3 LYS 23 12.919 -4.018 -12.806 190 HE2 LYS 23 HE2 LYS 23 10.836 -4.977 -13.503 191 HE3 LYS 23 HE3 LYS 23 9.892 -3.705 -12.714 192 HZ1 LYS 23 HZ1 LYS 23 11.771 -3.169 -14.979 193 HZ2 LYS 23 HZ2 LYS 23 10.136 -3.323 -15.134 194 HZ3 LYS 23 HZ3 LYS 23 10.784 -2.079 -14.282 195 H THR 24 H THR 24 13.065 -4.870 -8.098 196 HA THR 24 HA THR 24 12.178 -7.664 -7.774 197 HB THR 24 HB THR 24 14.936 -6.501 -7.326 198 HG1 THR 24 HG1 THR 24 14.596 -6.085 -9.407 199 HG21 THR 24 HG21 THR 24 14.012 -9.327 -8.022 200 HG22 THR 24 HG22 THR 24 15.697 -8.793 -7.893 201 HG23 THR 24 HG23 THR 24 14.681 -8.814 -6.452 202 H LEU 25 H LEU 25 13.921 -5.360 -5.597 203 HA LEU 25 HA LEU 25 13.704 -7.174 -3.311 204 HB2 LEU 25 HB2 LEU 25 14.734 -4.295 -3.484 205 HB3 LEU 25 HB3 LEU 25 15.036 -5.411 -2.165 206 HG LEU 25 HG LEU 25 16.049 -5.761 -5.031 207 HD11 LEU 25 HD11 LEU 25 17.054 -3.894 -3.654 208 HD12 LEU 25 HD12 LEU 25 17.552 -5.140 -2.488 209 HD13 LEU 25 HD13 LEU 25 18.200 -5.163 -4.144 210 HD21 LEU 25 HD21 LEU 25 15.749 -7.963 -3.991 211 HD22 LEU 25 HD22 LEU 25 17.467 -7.554 -4.056 212 HD23 LEU 25 HD23 LEU 25 16.578 -7.403 -2.522 213 H GLY 26 H GLY 26 11.921 -4.416 -4.472 214 HA2 GLY 26 HA2 GLY 26 10.345 -4.101 -1.981 215 HA3 GLY 26 HA3 GLY 26 10.399 -3.035 -3.389 216 H ALA 27 H ALA 27 10.096 -6.215 -4.549 217 HA ALA 27 HA ALA 27 7.577 -5.883 -5.671 218 HB1 ALA 27 HB1 ALA 27 8.921 -8.481 -4.804 219 HB2 ALA 27 HB2 ALA 27 7.611 -8.335 -5.998 220 HB3 ALA 27 HB3 ALA 27 9.197 -7.618 -6.329 221 H GLY 28 H GLY 28 5.653 -5.476 -4.715 222 HA2 GLY 28 HA2 GLY 28 3.694 -6.061 -3.561 223 HA3 GLY 28 HA3 GLY 28 4.567 -7.282 -2.635 224 H LYS 29 H LYS 29 6.634 -4.956 -2.163 225 HA LYS 29 HA LYS 29 5.339 -3.656 0.198 226 HB2 LYS 29 HB2 LYS 29 8.204 -3.686 -0.843 227 HB3 LYS 29 HB3 LYS 29 7.677 -2.777 0.566 228 HG2 LYS 29 HG2 LYS 29 7.533 -4.614 1.903 229 HG3 LYS 29 HG3 LYS 29 6.835 -5.617 0.649 230 HD2 LYS 29 HD2 LYS 29 8.875 -6.615 1.192 231 HD3 LYS 29 HD3 LYS 29 9.118 -5.855 -0.391 232 HE2 LYS 29 HE2 LYS 29 10.304 -3.959 0.727 233 HE3 LYS 29 HE3 LYS 29 10.006 -4.713 2.302 234 HZ1 LYS 29 HZ1 LYS 29 11.658 -5.933 0.111 235 HZ2 LYS 29 HZ2 LYS 29 12.237 -5.292 1.513 236 HZ3 LYS 29 HZ3 LYS 29 11.335 -6.646 1.554 237 H ILE 30 H ILE 30 6.704 -2.844 -2.989 238 HA ILE 30 HA ILE 30 5.334 -0.209 -2.878 239 HB ILE 30 HB ILE 30 7.324 0.942 -3.710 240 HG12 ILE 30 HG12 ILE 30 9.557 0.089 -3.520 241 HG13 ILE 30 HG13 ILE 30 8.985 -1.489 -2.989 242 HG21 ILE 30 HG21 ILE 30 8.547 1.068 -1.640 243 HG22 ILE 30 HG22 ILE 30 6.823 0.916 -1.279 244 HG23 ILE 30 HG23 ILE 30 7.911 -0.479 -1.084 245 HD11 ILE 30 HD11 ILE 30 9.849 -1.211 -5.393 246 HD12 ILE 30 HD12 ILE 30 8.317 -2.073 -5.206 247 HD13 ILE 30 HD13 ILE 30 8.337 -0.369 -5.742 248 H ALA 31 H ALA 31 5.519 0.992 -4.966 249 HA ALA 31 HA ALA 31 5.714 -0.741 -7.371 250 HB1 ALA 31 HB1 ALA 31 3.804 0.431 -8.391 251 HB2 ALA 31 HB2 ALA 31 3.317 -0.435 -6.918 252 HB3 ALA 31 HB3 ALA 31 3.536 1.322 -6.880 253 H VAL 32 H VAL 32 6.861 0.281 -9.116 254 HA VAL 32 HA VAL 32 7.971 2.969 -8.532 255 HB VAL 32 HB VAL 32 10.126 1.809 -9.413 256 HG11 VAL 32 HG11 VAL 32 10.815 1.496 -7.064 257 HG12 VAL 32 HG12 VAL 32 9.934 2.979 -7.366 258 HG13 VAL 32 HG13 VAL 32 9.116 1.618 -6.563 259 HG21 VAL 32 HG21 VAL 32 10.567 -0.417 -8.702 260 HG22 VAL 32 HG22 VAL 32 8.936 -0.605 -8.028 261 HG23 VAL 32 HG23 VAL 32 9.174 -0.446 -9.787 262 H THR 33 H THR 33 8.844 4.140 -10.059 263 HA THR 33 HA THR 33 8.668 3.289 -12.913 264 HB THR 33 HB THR 33 7.641 5.954 -11.871 265 HG1 THR 33 HG1 THR 33 5.575 5.103 -12.315 266 HG21 THR 33 HG21 THR 33 6.600 6.147 -14.100 267 HG22 THR 33 HG22 THR 33 8.352 5.989 -14.267 268 HG23 THR 33 HG23 THR 33 7.307 4.590 -14.587 269 H SER 34 H SER 34 10.347 4.062 -14.175 270 HA SER 34 HA SER 34 12.289 6.004 -13.018 271 HB2 SER 34 HB2 SER 34 13.143 3.804 -13.578 272 HB3 SER 34 HB3 SER 34 12.520 3.947 -15.239 273 HG SER 34 HG SER 34 14.734 4.498 -15.069 274 H CYS 35 H CYS 35 12.661 7.930 -13.948 275 HA CYS 35 HA CYS 35 11.942 8.500 -16.745 276 HB2 CYS 35 HB2 CYS 35 10.482 10.309 -16.282 277 HB3 CYS 35 HB3 CYS 35 9.910 8.939 -15.306 278 HG CYS 35 HG CYS 35 11.279 9.700 -13.123 279 H GLY 36 H GLY 36 12.557 10.979 -17.170 280 HA2 GLY 36 HA2 GLY 36 14.649 11.989 -15.325 281 HA3 GLY 36 HA3 GLY 36 15.156 11.678 -16.993 282 H LEU 37 H LEU 37 15.388 14.238 -15.990 283 HA LEU 37 HA LEU 37 13.043 15.803 -16.647 284 HB2 LEU 37 HB2 LEU 37 14.536 17.761 -16.701 285 HB3 LEU 37 HB3 LEU 37 14.395 16.906 -15.190 286 HG LEU 37 HG LEU 37 16.722 16.125 -16.960 287 HD11 LEU 37 HD11 LEU 37 16.762 18.609 -17.072 288 HD12 LEU 37 HD12 LEU 37 16.645 18.694 -15.300 289 HD13 LEU 37 HD13 LEU 37 18.087 17.994 -16.070 290 HD21 LEU 37 HD21 LEU 37 16.404 15.008 -14.790 291 HD22 LEU 37 HD22 LEU 37 17.854 16.018 -14.732 292 HD23 LEU 37 HD23 LEU 37 16.351 16.574 -13.972 293 H GLU 38 H GLU 38 15.151 14.157 -18.572 294 HA GLU 38 HA GLU 38 13.728 14.862 -20.969 295 HB2 GLU 38 HB2 GLU 38 15.672 15.321 -22.389 296 HB3 GLU 38 HB3 GLU 38 15.429 16.585 -21.186 297 HG2 GLU 38 HG2 GLU 38 17.219 15.639 -19.789 298 HG3 GLU 38 HG3 GLU 38 17.492 14.352 -20.981 299 H SER 39 H SER 39 14.197 13.212 -22.679 300 HA SER 39 HA SER 39 15.118 10.639 -21.477 301 HB2 SER 39 HB2 SER 39 13.522 9.590 -23.085 302 HB3 SER 39 HB3 SER 39 12.766 10.591 -21.828 303 HG SER 39 HG SER 39 11.969 10.941 -24.054 304 H SER 40 H SER 40 16.508 9.338 -22.544 305 HA SER 40 HA SER 40 17.176 9.920 -25.396 306 HB2 SER 40 HB2 SER 40 18.948 10.817 -24.026 307 HB3 SER 40 HB3 SER 40 19.173 9.255 -23.219 308 HG SER 40 HG SER 40 20.574 9.773 -25.126 309 H ARG 41 H ARG 41 18.746 7.282 -23.744 310 HA ARG 41 HA ARG 41 16.630 5.352 -24.222 311 HB2 ARG 41 HB2 ARG 41 17.674 3.941 -25.782 312 HB3 ARG 41 HB3 ARG 41 17.822 5.535 -26.470 313 HG2 ARG 41 HG2 ARG 41 20.015 3.907 -25.126 314 HG3 ARG 41 HG3 ARG 41 19.819 4.201 -26.834 315 HD2 ARG 41 HD2 ARG 41 20.579 6.263 -24.726 316 HD3 ARG 41 HD3 ARG 41 21.650 5.544 -25.907 317 HE ARG 41 HE ARG 41 19.863 7.772 -26.276 318 HH11 ARG 41 HH11 ARG 41 21.430 5.246 -28.159 319 HH12 ARG 41 HH12 ARG 41 21.314 6.170 -29.625 320 HH21 ARG 41 HH21 ARG 41 19.752 8.863 -28.151 321 HH22 ARG 41 HH22 ARG 41 20.380 8.176 -29.623 322 H VAL 42 H VAL 42 17.123 3.205 -23.199 323 HA VAL 42 HA VAL 42 18.695 3.468 -20.776 324 HB VAL 42 HB VAL 42 17.924 0.799 -22.031 325 HG11 VAL 42 HG11 VAL 42 18.080 0.054 -19.644 326 HG12 VAL 42 HG12 VAL 42 19.634 0.644 -20.226 327 HG13 VAL 42 HG13 VAL 42 18.636 1.670 -19.174 328 HG21 VAL 42 HG21 VAL 42 16.083 0.827 -20.409 329 HG22 VAL 42 HG22 VAL 42 16.396 2.560 -20.093 330 HG23 VAL 42 HG23 VAL 42 15.890 2.018 -21.705 331 H HIS 43 H HIS 43 20.821 3.135 -20.416 332 HA HIS 43 HA HIS 43 22.647 2.841 -22.661 333 HB2 HIS 43 HB2 HIS 43 23.027 4.122 -20.461 334 HB3 HIS 43 HB3 HIS 43 23.305 2.557 -19.702 335 HD2 HIS 43 HD2 HIS 43 24.962 5.240 -21.699 336 HE1 HIS 43 HE1 HIS 43 27.709 1.989 -21.814 337 HE2 HIS 43 HE2 HIS 43 27.373 4.482 -22.338 338 HA PRO 44 HA PRO 44 21.844 -1.421 -22.709 339 HB2 PRO 44 HB2 PRO 44 23.700 -2.423 -24.497 340 HB3 PRO 44 HB3 PRO 44 22.343 -1.346 -24.966 341 HG2 PRO 44 HG2 PRO 44 25.206 -0.541 -24.380 342 HG3 PRO 44 HG3 PRO 44 24.213 -0.118 -25.809 343 HD2 PRO 44 HD2 PRO 44 24.440 1.557 -23.678 344 HD3 PRO 44 HD3 PRO 44 22.887 1.392 -24.559 345 H THR 45 H THR 45 25.148 -0.352 -21.873 346 HA THR 45 HA THR 45 25.980 -2.811 -20.598 347 HB THR 45 HB THR 45 26.932 0.001 -19.975 348 HG1 THR 45 HG1 THR 45 27.908 -1.835 -21.931 349 HG21 THR 45 HG21 THR 45 28.188 -2.764 -19.665 350 HG22 THR 45 HG22 THR 45 29.086 -1.224 -19.532 351 HG23 THR 45 HG23 THR 45 27.801 -1.596 -18.381 352 H ALA 46 H ALA 46 23.942 -0.093 -19.475 353 HA ALA 46 HA ALA 46 24.037 -0.752 -16.688 354 HB1 ALA 46 HB1 ALA 46 21.685 0.371 -18.298 355 HB2 ALA 46 HB2 ALA 46 21.934 0.515 -16.550 356 HB3 ALA 46 HB3 ALA 46 23.038 1.348 -17.668 357 H ILE 47 H ILE 47 21.882 -1.899 -19.304 358 HA ILE 47 HA ILE 47 20.359 -3.768 -17.742 359 HB ILE 47 HB ILE 47 21.135 -3.745 -20.682 360 HG12 ILE 47 HG12 ILE 47 18.308 -3.250 -19.920 361 HG13 ILE 47 HG13 ILE 47 19.396 -2.028 -19.292 362 HG21 ILE 47 HG21 ILE 47 20.530 -6.035 -20.111 363 HG22 ILE 47 HG22 ILE 47 19.060 -5.481 -19.284 364 HG23 ILE 47 HG23 ILE 47 19.230 -5.297 -21.044 365 HD11 ILE 47 HD11 ILE 47 18.400 -1.557 -21.563 366 HD12 ILE 47 HD12 ILE 47 20.163 -1.409 -21.419 367 HD13 ILE 47 HD13 ILE 47 19.432 -2.846 -22.214 368 H ALA 48 H ALA 48 23.439 -4.205 -19.549 369 HA ALA 48 HA ALA 48 23.788 -6.962 -18.931 370 HB1 ALA 48 HB1 ALA 48 25.061 -5.697 -20.643 371 HB2 ALA 48 HB2 ALA 48 25.926 -4.840 -19.336 372 HB3 ALA 48 HB3 ALA 48 26.112 -6.594 -19.524 373 H MET 49 H MET 49 24.705 -4.080 -17.069 374 HA MET 49 HA MET 49 26.071 -5.539 -14.964 375 HB2 MET 49 HB2 MET 49 25.029 -2.694 -15.057 376 HB3 MET 49 HB3 MET 49 26.131 -3.339 -13.826 377 HG2 MET 49 HG2 MET 49 26.940 -3.575 -16.720 378 HG3 MET 49 HG3 MET 49 26.972 -2.006 -15.946 379 HE1 MET 49 HE1 MET 49 28.152 -5.814 -15.252 380 HE2 MET 49 HE2 MET 49 28.814 -5.154 -16.760 381 HE3 MET 49 HE3 MET 49 29.889 -5.479 -15.376 382 H MET 50 H MET 50 22.691 -4.561 -15.431 383 HA MET 50 HA MET 50 21.934 -5.423 -12.723 384 HB2 MET 50 HB2 MET 50 20.286 -4.864 -15.219 385 HB3 MET 50 HB3 MET 50 19.611 -5.282 -13.646 386 HG2 MET 50 HG2 MET 50 21.233 -2.804 -14.330 387 HG3 MET 50 HG3 MET 50 19.528 -2.878 -13.943 388 HE1 MET 50 HE1 MET 50 19.525 -3.657 -10.115 389 HE2 MET 50 HE2 MET 50 18.646 -3.764 -11.652 390 HE3 MET 50 HE3 MET 50 19.861 -5.000 -11.224 391 H GLU 51 H GLU 51 22.183 -7.002 -15.941 392 HA GLU 51 HA GLU 51 20.945 -9.439 -15.083 393 HB2 GLU 51 HB2 GLU 51 22.923 -8.826 -17.304 394 HB3 GLU 51 HB3 GLU 51 22.309 -10.450 -17.001 395 HG2 GLU 51 HG2 GLU 51 19.985 -9.644 -17.261 396 HG3 GLU 51 HG3 GLU 51 20.583 -8.034 -17.661 397 H GLU 52 H GLU 52 24.246 -8.244 -14.470 398 HA GLU 52 HA GLU 52 25.425 -10.724 -13.662 399 HB2 GLU 52 HB2 GLU 52 25.839 -7.986 -12.406 400 HB3 GLU 52 HB3 GLU 52 26.879 -9.399 -12.218 401 HG2 GLU 52 HG2 GLU 52 27.121 -9.299 -14.809 402 HG3 GLU 52 HG3 GLU 52 26.515 -7.645 -14.640 403 H VAL 53 H VAL 53 23.132 -8.633 -11.978 404 HA VAL 53 HA VAL 53 23.226 -10.346 -9.538 405 HB VAL 53 HB VAL 53 21.916 -8.579 -8.432 406 HG11 VAL 53 HG11 VAL 53 24.382 -8.621 -8.273 407 HG12 VAL 53 HG12 VAL 53 24.495 -7.563 -9.697 408 HG13 VAL 53 HG13 VAL 53 23.738 -6.970 -8.206 409 HG21 VAL 53 HG21 VAL 53 22.451 -6.891 -10.921 410 HG22 VAL 53 HG22 VAL 53 20.857 -7.551 -10.461 411 HG23 VAL 53 HG23 VAL 53 21.668 -6.366 -9.430 412 H GLY 54 H GLY 54 21.850 -10.753 -12.337 413 HA2 GLY 54 HA2 GLY 54 20.134 -12.070 -13.034 414 HA3 GLY 54 HA3 GLY 54 19.731 -12.407 -11.348 415 H ILE 55 H ILE 55 19.705 -9.071 -12.496 416 HA ILE 55 HA ILE 55 16.722 -9.000 -12.226 417 HB ILE 55 HB ILE 55 18.847 -6.907 -11.704 418 HG12 ILE 55 HG12 ILE 55 16.809 -8.300 -9.907 419 HG13 ILE 55 HG13 ILE 55 18.544 -8.596 -9.924 420 HG21 ILE 55 HG21 ILE 55 17.020 -5.382 -11.075 421 HG22 ILE 55 HG22 ILE 55 16.896 -5.803 -12.770 422 HG23 ILE 55 HG23 ILE 55 15.814 -6.580 -11.580 423 HD11 ILE 55 HD11 ILE 55 17.162 -6.072 -8.947 424 HD12 ILE 55 HD12 ILE 55 18.083 -7.253 -8.016 425 HD13 ILE 55 HD13 ILE 55 18.921 -6.216 -9.188 426 H ASP 56 H ASP 56 15.482 -8.270 -13.857 427 HA ASP 56 HA ASP 56 16.846 -7.640 -16.430 428 HB2 ASP 56 HB2 ASP 56 15.463 -9.607 -16.477 429 HB3 ASP 56 HB3 ASP 56 14.083 -8.716 -15.837 430 H ILE 57 H ILE 57 16.954 -5.623 -17.024 431 HA ILE 57 HA ILE 57 14.553 -3.881 -16.753 432 HB ILE 57 HB ILE 57 15.911 -1.900 -16.634 433 HG12 ILE 57 HG12 ILE 57 18.402 -3.490 -16.001 434 HG13 ILE 57 HG13 ILE 57 18.002 -3.140 -17.669 435 HG21 ILE 57 HG21 ILE 57 15.099 -2.972 -14.539 436 HG22 ILE 57 HG22 ILE 57 16.647 -3.833 -14.390 437 HG23 ILE 57 HG23 ILE 57 16.596 -2.061 -14.292 438 HD11 ILE 57 HD11 ILE 57 17.962 -0.728 -17.245 439 HD12 ILE 57 HD12 ILE 57 18.324 -1.003 -15.519 440 HD13 ILE 57 HD13 ILE 57 19.519 -1.424 -16.760 441 H SER 58 H SER 58 15.747 -5.772 -18.946 442 HA SER 58 HA SER 58 16.562 -4.060 -21.135 443 HB2 SER 58 HB2 SER 58 17.040 -6.540 -20.811 444 HB3 SER 58 HB3 SER 58 15.369 -6.852 -21.297 445 HG SER 58 HG SER 58 16.854 -6.941 -23.082 446 H GLY 59 H GLY 59 13.419 -5.142 -19.968 447 HA2 GLY 59 HA2 GLY 59 11.867 -4.280 -22.260 448 HA3 GLY 59 HA3 GLY 59 11.263 -4.698 -20.658 449 H GLN 60 H GLN 60 13.615 -2.256 -20.221 450 HA GLN 60 HA GLN 60 11.500 -0.168 -20.025 451 HB2 GLN 60 HB2 GLN 60 14.224 -0.486 -18.733 452 HB3 GLN 60 HB3 GLN 60 13.376 1.050 -18.757 453 HG2 GLN 60 HG2 GLN 60 11.703 0.374 -17.324 454 HG3 GLN 60 HG3 GLN 60 11.772 -1.312 -17.837 455 HE21 GLN 60 HE22 GLN 60 14.069 1.007 -16.191 456 HE22 GLN 60 HE21 GLN 60 14.535 -0.207 -14.989 457 H THR 61 H THR 61 11.972 1.959 -20.754 458 HA THR 61 HA THR 61 13.879 2.470 -22.872 459 HB THR 61 HB THR 61 12.065 3.361 -24.360 460 HG1 THR 61 HG1 THR 61 9.973 2.519 -24.085 461 HG21 THR 61 HG21 THR 61 11.845 0.344 -23.985 462 HG22 THR 61 HG22 THR 61 11.501 1.277 -25.457 463 HG23 THR 61 HG23 THR 61 13.158 1.168 -24.853 464 H SER 62 H SER 62 14.004 4.832 -23.128 465 HA SER 62 HA SER 62 13.643 5.968 -20.523 466 HB2 SER 62 HB2 SER 62 14.637 7.158 -23.080 467 HB3 SER 62 HB3 SER 62 14.798 7.901 -21.456 468 HG SER 62 HG SER 62 16.155 6.211 -20.852 469 H ASP 63 H ASP 63 12.316 7.550 -19.764 470 HA ASP 63 HA ASP 63 10.427 8.914 -21.646 471 HB2 ASP 63 HB2 ASP 63 9.691 7.318 -19.194 472 HB3 ASP 63 HB3 ASP 63 8.649 8.595 -19.821 473 HA PRO 64 HA PRO 64 11.515 12.448 -19.295 474 HB2 PRO 64 HB2 PRO 64 10.065 14.380 -20.483 475 HB3 PRO 64 HB3 PRO 64 11.229 13.383 -21.413 476 HG2 PRO 64 HG2 PRO 64 8.225 12.988 -21.169 477 HG3 PRO 64 HG3 PRO 64 9.217 13.033 -22.662 478 HD2 PRO 64 HD2 PRO 64 8.508 10.688 -21.387 479 HD3 PRO 64 HD3 PRO 64 10.023 10.887 -22.314 480 H ILE 65 H ILE 65 11.008 13.803 -17.608 481 HA ILE 65 HA ILE 65 9.071 13.116 -15.727 482 HB ILE 65 HB ILE 65 11.269 14.364 -15.479 483 HG12 ILE 65 HG12 ILE 65 8.867 15.422 -13.999 484 HG13 ILE 65 HG13 ILE 65 9.796 13.950 -13.623 485 HG21 ILE 65 HG21 ILE 65 10.803 16.234 -17.126 486 HG22 ILE 65 HG22 ILE 65 9.630 16.896 -15.953 487 HG23 ILE 65 HG23 ILE 65 11.334 16.798 -15.539 488 HD11 ILE 65 HD11 ILE 65 11.827 15.510 -13.345 489 HD12 ILE 65 HD12 ILE 65 10.646 16.845 -13.329 490 HD13 ILE 65 HD13 ILE 65 10.574 15.580 -12.097 491 H GLU 66 H GLU 66 8.909 15.632 -18.209 492 HA GLU 66 HA GLU 66 6.593 16.996 -17.362 493 HB2 GLU 66 HB2 GLU 66 7.613 16.543 -20.199 494 HB3 GLU 66 HB3 GLU 66 6.408 17.749 -19.729 495 HG2 GLU 66 HG2 GLU 66 8.085 18.772 -18.170 496 HG3 GLU 66 HG3 GLU 66 9.309 17.667 -18.813 497 H ASN 67 H ASN 67 6.668 13.828 -18.872 498 HA ASN 67 HA ASN 67 3.783 13.957 -19.540 499 HB2 ASN 67 HB2 ASN 67 4.160 12.328 -20.990 500 HB3 ASN 67 HB3 ASN 67 5.867 12.657 -20.781 501 HD21 ASN 67 HD22 ASN 67 6.859 11.348 -18.755 502 HD22 ASN 67 HD21 ASN 67 6.220 9.736 -18.543 503 H PHE 68 H PHE 68 5.531 13.296 -16.722 504 HA PHE 68 HA PHE 68 3.735 11.130 -15.775 505 HB2 PHE 68 HB2 PHE 68 6.499 12.077 -15.014 506 HB3 PHE 68 HB3 PHE 68 5.589 11.001 -13.988 507 HD1 PHE 68 HD2 PHE 68 4.372 8.978 -15.546 508 HD2 PHE 68 HD1 PHE 68 8.154 10.937 -16.203 509 HE1 PHE 68 HE2 PHE 68 5.162 7.013 -16.821 510 HE2 PHE 68 HE1 PHE 68 8.947 8.945 -17.474 511 HZ PHE 68 HZ PHE 68 7.458 6.983 -17.779 512 H ASN 69 H ASN 69 3.478 11.116 -13.306 513 HA ASN 69 HA ASN 69 2.158 13.701 -12.552 514 HB2 ASN 69 HB2 ASN 69 0.335 12.179 -11.635 515 HB3 ASN 69 HB3 ASN 69 0.453 12.375 -13.376 516 HD21 ASN 69 HD22 ASN 69 1.786 10.115 -10.871 517 HD22 ASN 69 HD21 ASN 69 1.399 8.675 -11.803 518 H ALA 70 H ALA 70 3.801 14.388 -11.128 519 HA ALA 70 HA ALA 70 5.105 12.948 -9.180 520 HB1 ALA 70 HB1 ALA 70 4.077 15.801 -8.975 521 HB2 ALA 70 HB2 ALA 70 5.355 15.094 -7.972 522 HB3 ALA 70 HB3 ALA 70 5.607 15.290 -9.723 523 H ASP 71 H ASP 71 1.800 14.175 -8.986 524 HA ASP 71 HA ASP 71 1.338 14.060 -6.200 525 HB2 ASP 71 HB2 ASP 71 -0.560 13.673 -8.552 526 HB3 ASP 71 HB3 ASP 71 -1.081 13.929 -6.891 527 H ASP 72 H ASP 72 1.486 11.395 -8.479 528 HA ASP 72 HA ASP 72 0.238 9.555 -6.490 529 HB2 ASP 72 HB2 ASP 72 -0.588 9.667 -8.926 530 HB3 ASP 72 HB3 ASP 72 0.928 8.838 -9.322 531 H TYR 73 H TYR 73 3.226 10.719 -6.897 532 HA TYR 73 HA TYR 73 4.537 8.097 -6.277 533 HB2 TYR 73 HB2 TYR 73 6.015 10.571 -7.137 534 HB3 TYR 73 HB3 TYR 73 6.580 8.908 -7.062 535 HD1 TYR 73 HD1 TYR 73 4.392 7.463 -8.578 536 HD2 TYR 73 HD2 TYR 73 6.397 11.212 -9.324 537 HE1 TYR 73 HE1 TYR 73 3.771 7.319 -10.982 538 HE2 TYR 73 HE2 TYR 73 5.755 11.074 -11.718 539 HH TYR 73 HH TYR 73 3.843 8.350 -13.048 540 H ASP 74 H ASP 74 4.179 7.960 -4.080 541 HA ASP 74 HA ASP 74 4.075 10.071 -2.221 542 HB2 ASP 74 HB2 ASP 74 5.100 7.238 -1.779 543 HB3 ASP 74 HB3 ASP 74 4.540 8.334 -0.521 544 H VAL 75 H VAL 75 6.879 8.377 -3.550 545 HA VAL 75 HA VAL 75 8.659 10.423 -2.302 546 HB VAL 75 HB VAL 75 9.373 7.526 -2.821 547 HG11 VAL 75 HG11 VAL 75 11.318 8.925 -3.048 548 HG12 VAL 75 HG12 VAL 75 10.928 9.820 -1.577 549 HG13 VAL 75 HG13 VAL 75 11.413 8.122 -1.479 550 HG21 VAL 75 HG21 VAL 75 7.914 7.452 -0.967 551 HG22 VAL 75 HG22 VAL 75 9.541 7.456 -0.271 552 HG23 VAL 75 HG23 VAL 75 8.575 8.945 -0.265 553 H VAL 76 H VAL 76 10.040 11.441 -3.622 554 HA VAL 76 HA VAL 76 10.476 10.371 -6.388 555 HB VAL 76 HB VAL 76 10.030 13.225 -5.549 556 HG11 VAL 76 HG11 VAL 76 10.610 13.920 -7.830 557 HG12 VAL 76 HG12 VAL 76 12.008 13.190 -7.082 558 HG13 VAL 76 HG13 VAL 76 11.061 12.250 -8.257 559 HG21 VAL 76 HG21 VAL 76 8.335 13.174 -7.346 560 HG22 VAL 76 HG22 VAL 76 8.760 11.488 -7.711 561 HG23 VAL 76 HG23 VAL 76 8.011 11.915 -6.144 562 H ILE 77 H ILE 77 12.522 10.235 -7.047 563 HA ILE 77 HA ILE 77 14.701 11.183 -5.213 564 HB ILE 77 HB ILE 77 14.641 8.694 -6.930 565 HG12 ILE 77 HG12 ILE 77 12.992 8.316 -5.189 566 HG13 ILE 77 HG13 ILE 77 14.398 7.300 -4.971 567 HG21 ILE 77 HG21 ILE 77 16.624 8.030 -5.634 568 HG22 ILE 77 HG22 ILE 77 16.907 9.529 -6.503 569 HG23 ILE 77 HG23 ILE 77 16.593 9.587 -4.767 570 HD11 ILE 77 HD11 ILE 77 13.511 8.206 -2.856 571 HD12 ILE 77 HD12 ILE 77 15.199 8.652 -3.119 572 HD13 ILE 77 HD13 ILE 77 13.907 9.849 -3.373 573 H SER 78 H SER 78 16.277 12.385 -6.192 574 HA SER 78 HA SER 78 16.415 12.420 -9.190 575 HB2 SER 78 HB2 SER 78 16.097 14.626 -8.115 576 HB3 SER 78 HB3 SER 78 17.651 14.405 -7.265 577 HG SER 78 HG SER 78 17.971 15.507 -9.250 578 H LEU 79 H LEU 79 18.202 11.785 -10.199 579 HA LEU 79 HA LEU 79 20.612 10.906 -8.664 580 HB2 LEU 79 HB2 LEU 79 19.312 9.252 -10.875 581 HB3 LEU 79 HB3 LEU 79 20.702 8.851 -9.884 582 HG LEU 79 HG LEU 79 18.960 8.985 -7.869 583 HD11 LEU 79 HD11 LEU 79 16.749 8.076 -8.588 584 HD12 LEU 79 HD12 LEU 79 16.984 9.701 -9.212 585 HD13 LEU 79 HD13 LEU 79 17.208 8.320 -10.289 586 HD21 LEU 79 HD21 LEU 79 18.497 6.584 -8.166 587 HD22 LEU 79 HD22 LEU 79 19.003 6.675 -9.857 588 HD23 LEU 79 HD23 LEU 79 20.186 6.960 -8.552 589 H CYS 80 H CYS 80 20.480 13.326 -9.832 590 HA CYS 80 HA CYS 80 21.633 13.105 -12.591 591 HB2 CYS 80 HB2 CYS 80 20.365 15.494 -11.175 592 HB3 CYS 80 HB3 CYS 80 20.814 15.377 -12.883 593 HG CYS 80 HG CYS 80 18.372 14.056 -11.144 594 H GLY 81 H GLY 81 22.590 14.133 -9.372 595 HA2 GLY 81 HA2 GLY 81 24.732 14.930 -8.701 596 HA3 GLY 81 HA3 GLY 81 25.163 15.211 -10.382 597 H CYS 82 H CYS 82 25.835 17.344 -9.837 598 HA CYS 82 HA CYS 82 24.102 19.362 -8.727 599 HB2 CYS 82 HB2 CYS 82 25.861 20.922 -9.522 600 HB3 CYS 82 HB3 CYS 82 26.506 19.561 -8.591 601 HG CYS 82 HG CYS 82 26.350 19.880 -11.914 602 H GLY 83 H GLY 83 23.376 21.331 -9.792 603 HA2 GLY 83 HA2 GLY 83 22.538 22.616 -11.519 604 HA3 GLY 83 HA3 GLY 83 22.992 21.370 -12.681 605 H VAL 84 H VAL 84 21.056 19.995 -10.238 606 HA VAL 84 HA VAL 84 18.493 20.457 -11.719 607 HB VAL 84 HB VAL 84 19.564 17.736 -10.867 608 HG11 VAL 84 HG11 VAL 84 17.096 17.875 -10.619 609 HG12 VAL 84 HG12 VAL 84 16.962 18.482 -12.293 610 HG13 VAL 84 HG13 VAL 84 17.551 16.833 -11.959 611 HG21 VAL 84 HG21 VAL 84 19.452 17.245 -13.331 612 HG22 VAL 84 HG22 VAL 84 19.130 18.967 -13.625 613 HG23 VAL 84 HG23 VAL 84 20.677 18.449 -12.914 614 H ASN 85 H ASN 85 16.951 21.113 -10.381 615 HA ASN 85 HA ASN 85 17.011 20.270 -7.498 616 HB2 ASN 85 HB2 ASN 85 16.513 23.034 -8.695 617 HB3 ASN 85 HB3 ASN 85 16.330 22.630 -6.987 618 HD21 ASN 85 HD22 ASN 85 18.303 21.892 -5.784 619 HD22 ASN 85 HD21 ASN 85 19.859 22.463 -6.361 620 H LEU 86 H LEU 86 15.029 20.156 -10.228 621 HA LEU 86 HA LEU 86 12.749 20.081 -10.627 622 HB2 LEU 86 HB2 LEU 86 12.940 18.345 -8.143 623 HB3 LEU 86 HB3 LEU 86 11.646 18.317 -9.346 624 HG LEU 86 HG LEU 86 14.505 17.430 -9.766 625 HD11 LEU 86 HD11 LEU 86 13.549 15.246 -9.823 626 HD12 LEU 86 HD12 LEU 86 12.768 16.028 -8.423 627 HD13 LEU 86 HD13 LEU 86 11.897 15.875 -9.969 628 HD21 LEU 86 HD21 LEU 86 13.694 18.414 -11.862 629 HD22 LEU 86 HD22 LEU 86 13.534 16.662 -11.996 630 HD23 LEU 86 HD23 LEU 86 12.102 17.650 -11.633 631 HA PRO 87 HA PRO 87 11.560 23.490 -7.660 632 HB2 PRO 87 HB2 PRO 87 10.662 24.542 -10.344 633 HB3 PRO 87 HB3 PRO 87 11.250 25.451 -8.920 634 HG2 PRO 87 HG2 PRO 87 12.945 24.951 -10.956 635 HG3 PRO 87 HG3 PRO 87 13.500 24.694 -9.270 636 HD2 PRO 87 HD2 PRO 87 12.519 22.631 -11.267 637 HD3 PRO 87 HD3 PRO 87 13.929 22.578 -10.174 638 HA PRO 88 HA PRO 88 7.030 22.881 -9.066 639 HB2 PRO 88 HB2 PRO 88 6.897 20.324 -10.565 640 HB3 PRO 88 HB3 PRO 88 6.204 21.915 -10.979 641 HG2 PRO 88 HG2 PRO 88 8.328 20.832 -12.296 642 HG3 PRO 88 HG3 PRO 88 8.178 22.608 -12.017 643 HD2 PRO 88 HD2 PRO 88 9.777 20.569 -10.447 644 HD3 PRO 88 HD3 PRO 88 10.250 22.194 -11.037 645 H GLU 89 H GLU 89 5.288 20.658 -8.938 646 HA GLU 89 HA GLU 89 5.385 19.881 -6.209 647 HB2 GLU 89 HB2 GLU 89 3.566 18.284 -6.833 648 HB3 GLU 89 HB3 GLU 89 3.268 19.964 -7.239 649 HG2 GLU 89 HG2 GLU 89 4.463 18.229 -9.393 650 HG3 GLU 89 HG3 GLU 89 2.801 17.903 -8.916 651 H TRP 90 H TRP 90 7.328 18.644 -8.621 652 HA TRP 90 HA TRP 90 7.692 15.902 -7.880 653 HB2 TRP 90 HB2 TRP 90 9.431 17.970 -9.224 654 HB3 TRP 90 HB3 TRP 90 9.931 16.291 -8.942 655 HD1 TRP 90 HD1 TRP 90 7.517 18.351 -11.089 656 HE1 TRP 90 HE1 TRP 90 6.320 16.836 -12.772 657 HE3 TRP 90 HE3 TRP 90 9.579 13.904 -9.731 658 HZ2 TRP 90 HZ2 TRP 90 6.283 14.008 -13.456 659 HZ3 TRP 90 HZ3 TRP 90 9.162 11.872 -11.064 660 HH2 TRP 90 HH2 TRP 90 7.515 11.904 -12.911 661 H VAL 91 H VAL 91 8.542 18.769 -6.114 662 HA VAL 91 HA VAL 91 10.096 17.060 -4.199 663 HB VAL 91 HB VAL 91 11.309 18.997 -3.448 664 HG11 VAL 91 HG11 VAL 91 12.303 17.661 -5.176 665 HG12 VAL 91 HG12 VAL 91 11.483 18.596 -6.430 666 HG13 VAL 91 HG13 VAL 91 12.722 19.358 -5.410 667 HG21 VAL 91 HG21 VAL 91 9.943 20.571 -5.677 668 HG22 VAL 91 HG22 VAL 91 9.646 20.789 -3.942 669 HG23 VAL 91 HG23 VAL 91 11.238 21.152 -4.627 670 H THR 92 H THR 92 7.052 18.198 -4.495 671 HA THR 92 HA THR 92 6.761 19.007 -1.644 672 HB THR 92 HB THR 92 4.566 19.794 -2.185 673 HG1 THR 92 HG1 THR 92 3.641 19.473 -4.115 674 HG21 THR 92 HG21 THR 92 6.481 21.317 -2.716 675 HG22 THR 92 HG22 THR 92 6.476 20.717 -4.392 676 HG23 THR 92 HG23 THR 92 5.068 21.588 -3.751 677 H GLN 93 H GLN 93 7.015 16.147 -3.016 678 HA GLN 93 HA GLN 93 4.620 14.785 -2.024 679 HB2 GLN 93 HB2 GLN 93 7.202 13.623 -3.127 680 HB3 GLN 93 HB3 GLN 93 5.669 12.781 -2.869 681 HG2 GLN 93 HG2 GLN 93 6.280 14.940 -4.912 682 HG3 GLN 93 HG3 GLN 93 5.799 13.290 -5.219 683 HE21 GLN 93 HE22 GLN 93 4.632 16.326 -5.501 684 HE22 GLN 93 HE21 GLN 93 2.933 16.038 -5.145 685 H GLU 94 H GLU 94 5.602 12.475 -0.745 686 HA GLU 94 HA GLU 94 5.721 13.620 1.921 687 HB2 GLU 94 HB2 GLU 94 6.337 10.714 1.281 688 HB3 GLU 94 HB3 GLU 94 5.802 11.428 2.794 689 HG2 GLU 94 HG2 GLU 94 3.683 12.128 1.365 690 HG3 GLU 94 HG3 GLU 94 4.230 10.802 0.318 691 H ILE 95 H ILE 95 8.128 12.100 -0.172 692 HA ILE 95 HA ILE 95 10.337 13.155 1.509 693 HB ILE 95 HB ILE 95 10.261 10.296 0.483 694 HG12 ILE 95 HG12 ILE 95 10.037 11.195 3.381 695 HG13 ILE 95 HG13 ILE 95 8.712 10.554 2.402 696 HG21 ILE 95 HG21 ILE 95 12.319 11.712 2.241 697 HG22 ILE 95 HG22 ILE 95 12.372 10.011 1.738 698 HG23 ILE 95 HG23 ILE 95 12.549 11.266 0.536 699 HD11 ILE 95 HD11 ILE 95 11.120 9.009 3.358 700 HD12 ILE 95 HD12 ILE 95 9.401 8.744 3.700 701 HD13 ILE 95 HD13 ILE 95 10.029 8.436 2.073 702 H PHE 96 H PHE 96 11.992 13.946 0.313 703 HA PHE 96 HA PHE 96 12.280 13.103 -2.498 704 HB2 PHE 96 HB2 PHE 96 11.239 15.249 -2.716 705 HB3 PHE 96 HB3 PHE 96 12.352 15.974 -1.560 706 HD1 PHE 96 HD1 PHE 96 12.070 14.591 -5.044 707 HD2 PHE 96 HD2 PHE 96 14.585 16.625 -2.180 708 HE1 PHE 96 HE1 PHE 96 13.794 14.936 -6.783 709 HE2 PHE 96 HE2 PHE 96 16.252 17.060 -3.961 710 HZ PHE 96 HZ PHE 96 15.872 16.208 -6.259 711 H GLU 97 H GLU 97 14.345 12.627 -3.096 712 HA GLU 97 HA GLU 97 16.589 13.371 -1.294 713 HB2 GLU 97 HB2 GLU 97 16.173 10.552 -2.354 714 HB3 GLU 97 HB3 GLU 97 17.565 11.159 -1.454 715 HG2 GLU 97 HG2 GLU 97 16.065 11.594 0.513 716 HG3 GLU 97 HG3 GLU 97 14.735 10.850 -0.386 717 H ASP 98 H ASP 98 18.670 13.378 -2.309 718 HA ASP 98 HA ASP 98 18.702 13.220 -5.291 719 HB2 ASP 98 HB2 ASP 98 18.532 15.540 -4.704 720 HB3 ASP 98 HB3 ASP 98 19.831 15.385 -3.514 721 H TRP 99 H TRP 99 19.747 11.353 -5.560 722 HA TRP 99 HA TRP 99 22.100 10.611 -3.911 723 HB2 TRP 99 HB2 TRP 99 20.658 9.051 -6.076 724 HB3 TRP 99 HB3 TRP 99 21.866 8.431 -4.966 725 HD1 TRP 99 HD1 TRP 99 20.065 10.150 -2.521 726 HE1 TRP 99 HE1 TRP 99 18.056 8.875 -1.551 727 HE3 TRP 99 HE3 TRP 99 19.627 6.502 -6.080 728 HZ2 TRP 99 HZ2 TRP 99 16.420 6.629 -2.275 729 HZ3 TRP 99 HZ3 TRP 99 17.821 4.809 -5.927 730 HH2 TRP 99 HH2 TRP 99 16.205 4.860 -4.022 731 H GLN 100 H GLN 100 23.472 12.279 -4.673 732 HA GLN 100 HA GLN 100 24.239 12.431 -7.460 733 HB2 GLN 100 HB2 GLN 100 25.690 13.487 -5.000 734 HB3 GLN 100 HB3 GLN 100 25.991 13.937 -6.692 735 HG2 GLN 100 HG2 GLN 100 23.560 14.757 -6.768 736 HG3 GLN 100 HG3 GLN 100 23.496 14.505 -5.029 737 HE21 GLN 100 HE22 GLN 100 22.888 16.916 -5.479 738 HE22 GLN 100 HE21 GLN 100 24.241 18.051 -5.297 739 H LEU 101 H LEU 101 25.400 10.952 -8.519 740 HA LEU 101 HA LEU 101 27.684 9.515 -7.256 741 HB2 LEU 101 HB2 LEU 101 25.416 8.259 -8.866 742 HB3 LEU 101 HB3 LEU 101 26.912 7.432 -8.460 743 HG LEU 101 HG LEU 101 24.825 8.349 -6.430 744 HD11 LEU 101 HD11 LEU 101 24.317 6.005 -6.179 745 HD12 LEU 101 HD12 LEU 101 24.075 6.498 -7.864 746 HD13 LEU 101 HD13 LEU 101 25.526 5.564 -7.411 747 HD21 LEU 101 HD21 LEU 101 27.335 6.654 -6.085 748 HD22 LEU 101 HD22 LEU 101 27.098 8.287 -5.435 749 HD23 LEU 101 HD23 LEU 101 26.099 6.963 -4.839 750 H GLU 102 H GLU 102 29.072 8.453 -9.009 751 HA GLU 102 HA GLU 102 29.652 10.400 -11.068 752 HB2 GLU 102 HB2 GLU 102 31.495 8.987 -11.647 753 HB3 GLU 102 HB3 GLU 102 31.417 9.225 -9.901 754 HG2 GLU 102 HG2 GLU 102 30.318 6.949 -9.719 755 HG3 GLU 102 HG3 GLU 102 30.653 6.715 -11.442 756 H ASP 103 H ASP 103 30.267 9.354 -13.322 757 HA ASP 103 HA ASP 103 27.646 8.403 -14.390 758 HB2 ASP 103 HB2 ASP 103 28.404 10.858 -14.619 759 HB3 ASP 103 HB3 ASP 103 29.468 10.269 -15.889 760 HA PRO 104 HA PRO 104 30.541 5.115 -15.549 761 HB2 PRO 104 HB2 PRO 104 27.974 3.668 -16.045 762 HB3 PRO 104 HB3 PRO 104 29.447 3.115 -15.181 763 HG2 PRO 104 HG2 PRO 104 27.268 3.877 -13.786 764 HG3 PRO 104 HG3 PRO 104 28.884 4.487 -13.276 765 HD2 PRO 104 HD2 PRO 104 26.826 5.870 -15.051 766 HD3 PRO 104 HD3 PRO 104 27.646 6.481 -13.587 767 H ASP 105 H ASP 105 28.201 6.534 -17.631 768 HA ASP 105 HA ASP 105 28.237 4.936 -19.945 769 HB2 ASP 105 HB2 ASP 105 26.696 6.774 -19.424 770 HB3 ASP 105 HB3 ASP 105 28.006 7.944 -19.571 771 H GLY 106 H GLY 106 30.068 4.174 -20.854 772 HA2 GLY 106 HA2 GLY 106 31.913 4.228 -22.252 773 HA3 GLY 106 HA3 GLY 106 31.958 5.986 -22.154 774 H GLN 107 H GLN 107 31.925 4.373 -19.078 775 HA GLN 107 HA GLN 107 34.780 5.086 -18.623 776 HB2 GLN 107 HB2 GLN 107 32.727 4.171 -16.595 777 HB3 GLN 107 HB3 GLN 107 34.325 4.843 -16.268 778 HG2 GLN 107 HG2 GLN 107 31.971 6.296 -17.531 779 HG3 GLN 107 HG3 GLN 107 32.432 6.338 -15.841 780 HE21 GLN 107 HE22 GLN 107 32.121 8.672 -16.781 781 HE22 GLN 107 HE21 GLN 107 33.644 9.482 -17.189 782 H SER 108 H SER 108 33.376 2.503 -16.770 783 HA SER 108 HA SER 108 34.350 0.304 -18.364 784 HB2 SER 108 HB2 SER 108 36.471 1.120 -17.183 785 HB3 SER 108 HB3 SER 108 35.688 0.639 -15.656 786 HG SER 108 HG SER 108 37.051 -1.016 -16.667 787 H LEU 109 H LEU 109 33.936 -1.766 -17.193 788 HA LEU 109 HA LEU 109 31.275 -1.862 -16.114 789 HB2 LEU 109 HB2 LEU 109 33.534 -3.899 -15.988 790 HB3 LEU 109 HB3 LEU 109 31.815 -4.237 -15.720 791 HG LEU 109 HG LEU 109 33.187 -3.466 -18.323 792 HD11 LEU 109 HD11 LEU 109 32.378 -5.658 -19.053 793 HD12 LEU 109 HD12 LEU 109 33.350 -5.804 -17.575 794 HD13 LEU 109 HD13 LEU 109 31.577 -5.906 -17.479 795 HD21 LEU 109 HD21 LEU 109 31.066 -2.277 -18.342 796 HD22 LEU 109 HD22 LEU 109 30.947 -3.689 -19.401 797 HD23 LEU 109 HD23 LEU 109 30.200 -3.722 -17.790 798 H GLU 110 H GLU 110 34.436 -2.010 -14.503 799 HA GLU 110 HA GLU 110 33.491 -2.389 -11.837 800 HB2 GLU 110 HB2 GLU 110 35.852 -2.549 -12.573 801 HB3 GLU 110 HB3 GLU 110 35.907 -0.794 -12.795 802 HG2 GLU 110 HG2 GLU 110 35.519 -0.459 -10.382 803 HG3 GLU 110 HG3 GLU 110 35.317 -2.197 -10.153 804 H VAL 111 H VAL 111 33.627 0.600 -13.750 805 HA VAL 111 HA VAL 111 32.814 2.320 -11.517 806 HB VAL 111 HB VAL 111 32.936 2.803 -14.507 807 HG11 VAL 111 HG11 VAL 111 31.286 4.336 -13.593 808 HG12 VAL 111 HG12 VAL 111 32.369 4.759 -12.252 809 HG13 VAL 111 HG13 VAL 111 32.785 5.208 -13.916 810 HG21 VAL 111 HG21 VAL 111 35.150 2.490 -13.428 811 HG22 VAL 111 HG22 VAL 111 34.913 4.176 -13.896 812 HG23 VAL 111 HG23 VAL 111 34.707 3.694 -12.196 813 H PHE 112 H PHE 112 31.109 0.653 -14.226 814 HA PHE 112 HA PHE 112 28.481 1.646 -13.518 815 HB2 PHE 112 HB2 PHE 112 29.531 -0.770 -14.989 816 HB3 PHE 112 HB3 PHE 112 27.865 -0.746 -14.443 817 HD1 PHE 112 HD1 PHE 112 26.242 0.888 -15.279 818 HD2 PHE 112 HD2 PHE 112 30.231 0.630 -16.886 819 HE1 PHE 112 HE1 PHE 112 25.495 2.091 -17.328 820 HE2 PHE 112 HE2 PHE 112 29.490 1.848 -18.911 821 HZ PHE 112 HZ PHE 112 27.136 2.607 -19.115 822 H ARG 113 H ARG 113 30.240 -1.290 -12.441 823 HA ARG 113 HA ARG 113 28.273 -2.236 -10.584 824 HB2 ARG 113 HB2 ARG 113 31.308 -2.506 -10.609 825 HB3 ARG 113 HB3 ARG 113 30.249 -3.424 -9.539 826 HG2 ARG 113 HG2 ARG 113 29.169 -4.538 -11.422 827 HG3 ARG 113 HG3 ARG 113 30.013 -3.535 -12.582 828 HD2 ARG 113 HD2 ARG 113 32.181 -4.415 -11.726 829 HD3 ARG 113 HD3 ARG 113 31.274 -5.534 -10.682 830 HE ARG 113 HE ARG 113 30.240 -6.385 -12.881 831 HH11 ARG 113 HH11 ARG 113 33.620 -5.384 -12.642 832 HH12 ARG 113 HH12 ARG 113 34.104 -6.447 -13.924 833 HH21 ARG 113 HH21 ARG 113 30.963 -7.771 -14.381 834 HH22 ARG 113 HH22 ARG 113 32.639 -7.768 -14.900 835 H THR 114 H THR 114 30.951 0.055 -10.106 836 HA THR 114 HA THR 114 30.594 0.493 -7.298 837 HB THR 114 HB THR 114 31.731 2.332 -9.448 838 HG1 THR 114 HG1 THR 114 32.928 0.486 -9.241 839 HG21 THR 114 HG21 THR 114 31.247 3.720 -7.542 840 HG22 THR 114 HG22 THR 114 31.902 2.500 -6.415 841 HG23 THR 114 HG23 THR 114 32.980 3.363 -7.534 842 H VAL 115 H VAL 115 29.098 2.214 -10.089 843 HA VAL 115 HA VAL 115 27.445 3.896 -8.352 844 HB VAL 115 HB VAL 115 27.358 3.248 -11.310 845 HG11 VAL 115 HG11 VAL 115 25.019 3.783 -10.670 846 HG12 VAL 115 HG12 VAL 115 25.585 5.236 -9.804 847 HG13 VAL 115 HG13 VAL 115 25.749 5.112 -11.570 848 HG21 VAL 115 HG21 VAL 115 28.035 5.688 -11.414 849 HG22 VAL 115 HG22 VAL 115 28.124 5.700 -9.652 850 HG23 VAL 115 HG23 VAL 115 29.222 4.667 -10.593 851 H ARG 116 H ARG 116 26.743 0.886 -10.151 852 HA ARG 116 HA ARG 116 24.068 0.463 -9.529 853 HB2 ARG 116 HB2 ARG 116 25.518 -0.895 -11.055 854 HB3 ARG 116 HB3 ARG 116 26.309 -1.612 -9.653 855 HG2 ARG 116 HG2 ARG 116 24.011 -2.493 -8.956 856 HG3 ARG 116 HG3 ARG 116 23.424 -1.936 -10.533 857 HD2 ARG 116 HD2 ARG 116 23.902 -4.272 -10.723 858 HD3 ARG 116 HD3 ARG 116 25.159 -3.396 -11.611 859 HE ARG 116 HE ARG 116 25.825 -4.050 -8.799 860 HH11 ARG 116 HH11 ARG 116 25.838 -5.524 -11.961 861 HH12 ARG 116 HH12 ARG 116 27.420 -6.248 -11.753 862 HH21 ARG 116 HH21 ARG 116 27.659 -5.302 -8.428 863 HH22 ARG 116 HH22 ARG 116 28.217 -6.367 -9.677 864 H GLY 117 H GLY 117 26.809 -0.609 -7.454 865 HA2 GLY 117 HA2 GLY 117 25.239 -1.812 -5.406 866 HA3 GLY 117 HA3 GLY 117 26.881 -1.174 -5.209 867 H GLN 118 H GLN 118 26.217 1.610 -5.801 868 HA GLN 118 HA GLN 118 25.170 2.372 -3.173 869 HB2 GLN 118 HB2 GLN 118 26.195 4.001 -5.523 870 HB3 GLN 118 HB3 GLN 118 25.642 4.695 -3.985 871 HG2 GLN 118 HG2 GLN 118 27.349 3.488 -2.737 872 HG3 GLN 118 HG3 GLN 118 27.868 2.609 -4.175 873 HE21 GLN 118 HE22 GLN 118 29.057 3.732 -5.842 874 HE22 GLN 118 HE21 GLN 118 29.859 5.261 -5.446 875 H VAL 119 H VAL 119 23.988 2.809 -6.576 876 HA VAL 119 HA VAL 119 21.453 3.924 -5.899 877 HB VAL 119 HB VAL 119 22.093 1.991 -8.169 878 HG11 VAL 119 HG11 VAL 119 19.674 2.143 -7.862 879 HG12 VAL 119 HG12 VAL 119 19.777 3.920 -7.771 880 HG13 VAL 119 HG13 VAL 119 20.148 3.067 -9.289 881 HG21 VAL 119 HG21 VAL 119 23.477 4.058 -8.273 882 HG22 VAL 119 HG22 VAL 119 22.269 4.029 -9.557 883 HG23 VAL 119 HG23 VAL 119 22.004 5.045 -8.121 884 H LYS 120 H LYS 120 22.398 0.450 -6.015 885 HA LYS 120 HA LYS 120 19.918 -0.689 -5.209 886 HB2 LYS 120 HB2 LYS 120 21.934 -1.951 -6.018 887 HB3 LYS 120 HB3 LYS 120 22.756 -1.599 -4.505 888 HG2 LYS 120 HG2 LYS 120 20.929 -2.786 -3.264 889 HG3 LYS 120 HG3 LYS 120 20.184 -3.197 -4.805 890 HD2 LYS 120 HD2 LYS 120 22.385 -4.366 -5.422 891 HD3 LYS 120 HD3 LYS 120 22.927 -4.036 -3.763 892 HE2 LYS 120 HE2 LYS 120 20.789 -5.194 -2.964 893 HE3 LYS 120 HE3 LYS 120 20.504 -5.686 -4.642 894 HZ1 LYS 120 HZ1 LYS 120 21.674 -7.438 -3.390 895 HZ2 LYS 120 HZ2 LYS 120 22.674 -6.883 -4.556 896 HZ3 LYS 120 HZ3 LYS 120 22.896 -6.433 -3.000 897 H GLU 121 H GLU 121 22.693 0.239 -3.045 898 HA GLU 121 HA GLU 121 21.201 -0.431 -0.698 899 HB2 GLU 121 HB2 GLU 121 23.011 0.154 0.539 900 HB3 GLU 121 HB3 GLU 121 23.776 -0.177 -1.010 901 HG2 GLU 121 HG2 GLU 121 23.828 2.285 -1.457 902 HG3 GLU 121 HG3 GLU 121 23.118 2.577 0.125 903 H ARG 122 H ARG 122 21.356 2.719 -2.366 904 HA ARG 122 HA ARG 122 19.862 4.030 -0.253 905 HB2 ARG 122 HB2 ARG 122 19.983 4.685 -3.235 906 HB3 ARG 122 HB3 ARG 122 19.285 5.693 -1.967 907 HG2 ARG 122 HG2 ARG 122 22.213 4.989 -2.247 908 HG3 ARG 122 HG3 ARG 122 21.466 6.537 -2.629 909 HD2 ARG 122 HD2 ARG 122 21.799 5.258 0.101 910 HD3 ARG 122 HD3 ARG 122 22.667 6.657 -0.546 911 HE ARG 122 HE ARG 122 19.974 7.411 -0.644 912 HH11 ARG 122 HH12 ARG 122 22.267 6.632 1.896 913 HH12 ARG 122 HH11 ARG 122 21.397 7.556 3.087 914 HH21 ARG 122 HH21 ARG 122 18.861 8.538 0.962 915 HH22 ARG 122 HH22 ARG 122 19.564 8.630 2.552 916 H VAL 123 H VAL 123 18.709 2.342 -3.247 917 HA VAL 123 HA VAL 123 15.949 2.570 -2.564 918 HB VAL 123 HB VAL 123 17.503 0.564 -4.234 919 HG11 VAL 123 HG11 VAL 123 15.439 -0.404 -5.019 920 HG12 VAL 123 HG12 VAL 123 15.659 -0.764 -3.320 921 HG13 VAL 123 HG13 VAL 123 14.499 0.507 -3.794 922 HG21 VAL 123 HG21 VAL 123 16.267 1.591 -6.068 923 HG22 VAL 123 HG22 VAL 123 15.421 2.656 -4.921 924 HG23 VAL 123 HG23 VAL 123 17.189 2.786 -5.147 925 H GLU 124 H GLU 124 18.163 -0.148 -1.606 926 HA GLU 124 HA GLU 124 16.101 -1.508 -0.151 927 HB2 GLU 124 HB2 GLU 124 19.089 -1.485 0.408 928 HB3 GLU 124 HB3 GLU 124 17.886 -2.618 1.077 929 HG2 GLU 124 HG2 GLU 124 17.328 -3.383 -1.162 930 HG3 GLU 124 HG3 GLU 124 18.620 -2.396 -1.846 931 H ASN 125 H ASN 125 18.195 1.137 0.891 932 HA ASN 125 HA ASN 125 17.179 0.964 3.565 933 HB2 ASN 125 HB2 ASN 125 18.960 2.259 3.974 934 HB3 ASN 125 HB3 ASN 125 19.263 2.368 2.251 935 HD21 ASN 125 HD22 ASN 125 18.183 4.134 1.036 936 HD22 ASN 125 HD21 ASN 125 17.952 5.654 1.903 937 H LEU 126 H LEU 126 15.965 2.526 0.709 938 HA LEU 126 HA LEU 126 14.102 4.277 2.130 939 HB2 LEU 126 HB2 LEU 126 15.108 4.989 0.043 940 HB3 LEU 126 HB3 LEU 126 14.583 3.527 -0.791 941 HG LEU 126 HG LEU 126 12.226 4.213 -0.608 942 HD11 LEU 126 HD11 LEU 126 11.640 6.496 0.116 943 HD12 LEU 126 HD12 LEU 126 12.344 5.611 1.463 944 HD13 LEU 126 HD13 LEU 126 13.327 6.803 0.582 945 HD21 LEU 126 HD21 LEU 126 13.563 4.815 -2.572 946 HD22 LEU 126 HD22 LEU 126 12.368 6.074 -2.202 947 HD23 LEU 126 HD23 LEU 126 14.081 6.312 -1.762 948 H ILE 127 H ILE 127 13.779 1.184 0.222 949 HA ILE 127 HA ILE 127 10.917 1.153 0.532 950 HB ILE 127 HB ILE 127 11.003 -1.223 -0.050 951 HG12 ILE 127 HG12 ILE 127 14.012 -0.911 0.150 952 HG13 ILE 127 HG13 ILE 127 12.968 -2.063 0.977 953 HG21 ILE 127 HG21 ILE 127 12.795 0.484 -1.852 954 HG22 ILE 127 HG22 ILE 127 11.679 -0.815 -2.353 955 HG23 ILE 127 HG23 ILE 127 11.038 0.700 -1.714 956 HD11 ILE 127 HD11 ILE 127 12.492 -3.121 -1.253 957 HD12 ILE 127 HD12 ILE 127 13.701 -2.025 -1.970 958 HD13 ILE 127 HD13 ILE 127 14.195 -3.205 -0.751 959 H ALA 128 H ALA 128 13.430 0.045 2.763 960 HA ALA 128 HA ALA 128 11.588 -1.292 4.491 961 HB1 ALA 128 HB1 ALA 128 14.288 0.014 5.071 962 HB2 ALA 128 HB2 ALA 128 13.455 -1.147 6.127 963 HB3 ALA 128 HB3 ALA 128 14.030 -1.658 4.526 964 H LYS 129 H LYS 129 12.207 2.110 3.971 965 HA LYS 129 HA LYS 129 10.931 3.029 6.480 966 HB2 LYS 129 HB2 LYS 129 11.985 4.530 4.041 967 HB3 LYS 129 HB3 LYS 129 11.253 5.296 5.448 968 HG2 LYS 129 HG2 LYS 129 12.995 4.505 6.917 969 HG3 LYS 129 HG3 LYS 129 13.701 3.502 5.637 970 HD2 LYS 129 HD2 LYS 129 14.379 5.443 4.353 971 HD3 LYS 129 HD3 LYS 129 13.419 6.517 5.380 972 HE2 LYS 129 HE2 LYS 129 15.728 6.799 5.944 973 HE3 LYS 129 HE3 LYS 129 14.873 6.051 7.299 974 HZ1 LYS 129 HZ1 LYS 129 15.826 3.872 6.519 975 HZ2 LYS 129 HZ2 LYS 129 16.712 4.680 5.389 976 HZ3 LYS 129 HZ3 LYS 129 16.971 4.943 6.974 977 H ILE 130 H ILE 130 10.119 3.010 2.984 978 HA ILE 130 HA ILE 130 7.431 4.028 3.724 979 HB ILE 130 HB ILE 130 7.171 4.736 1.365 980 HG12 ILE 130 HG12 ILE 130 9.164 5.246 0.071 981 HG13 ILE 130 HG13 ILE 130 10.185 4.370 1.202 982 HG21 ILE 130 HG21 ILE 130 9.420 6.040 2.924 983 HG22 ILE 130 HG22 ILE 130 8.302 6.801 1.763 984 HG23 ILE 130 HG23 ILE 130 7.689 6.208 3.298 985 HD11 ILE 130 HD11 ILE 130 9.720 3.060 -0.821 986 HD12 ILE 130 HD12 ILE 130 8.983 2.261 0.578 987 HD13 ILE 130 HD13 ILE 130 7.972 3.204 -0.541 988 H SER 131 H SER 131 8.431 0.954 3.264 989 HA SER 131 HA SER 131 6.353 -0.224 1.713 990 HB2 SER 131 HB2 SER 131 8.211 -1.540 2.622 991 HB3 SER 131 HB3 SER 131 7.658 -1.199 4.280 992 HG SER 131 HG SER 131 6.798 -3.193 3.714 Start of MODEL 7 1 H MET 1 H1 MET 1 2.757 0.130 2.147 2 HA MET 1 HA MET 1 3.570 -0.250 0.065 3 HB2 MET 1 HB2 MET 1 1.872 -1.772 -0.779 4 HB3 MET 1 HB3 MET 1 0.689 -0.461 -0.922 5 HG2 MET 1 HG2 MET 1 2.033 0.629 -2.636 6 HG3 MET 1 HG3 MET 1 3.341 -0.528 -2.414 7 HE1 MET 1 HE1 MET 1 2.217 -3.673 -4.277 8 HE2 MET 1 HE2 MET 1 3.565 -2.767 -3.558 9 HE3 MET 1 HE3 MET 1 2.261 -3.399 -2.525 10 H LYS 2 H LYS 2 4.509 1.538 -0.622 11 HA LYS 2 HA LYS 2 2.875 3.930 -1.397 12 HB2 LYS 2 HB2 LYS 2 5.530 3.917 0.096 13 HB3 LYS 2 HB3 LYS 2 4.809 5.342 -0.632 14 HG2 LYS 2 HG2 LYS 2 2.808 5.137 0.772 15 HG3 LYS 2 HG3 LYS 2 3.474 3.690 1.548 16 HD2 LYS 2 HD2 LYS 2 5.362 4.987 2.427 17 HD3 LYS 2 HD3 LYS 2 4.753 6.461 1.662 18 HE2 LYS 2 HE2 LYS 2 3.187 4.811 3.713 19 HE3 LYS 2 HE3 LYS 2 4.278 6.128 4.156 20 HZ1 LYS 2 HZ1 LYS 2 2.947 7.653 2.825 21 HZ2 LYS 2 HZ2 LYS 2 1.871 6.464 2.436 22 HZ3 LYS 2 HZ3 LYS 2 2.024 6.962 3.989 23 H LYS 3 H LYS 3 4.090 5.341 -2.932 24 HA LYS 3 HA LYS 3 5.400 3.610 -5.005 25 HB2 LYS 3 HB2 LYS 3 3.809 6.168 -5.425 26 HB3 LYS 3 HB3 LYS 3 4.573 5.229 -6.676 27 HG2 LYS 3 HG2 LYS 3 2.410 4.513 -6.862 28 HG3 LYS 3 HG3 LYS 3 3.154 3.241 -5.908 29 HD2 LYS 3 HD2 LYS 3 0.899 3.737 -5.097 30 HD3 LYS 3 HD3 LYS 3 2.077 4.121 -3.855 31 HE2 LYS 3 HE2 LYS 3 2.006 6.538 -4.832 32 HE3 LYS 3 HE3 LYS 3 0.547 6.016 -5.681 33 HZ1 LYS 3 HZ1 LYS 3 -0.306 5.405 -3.361 34 HZ2 LYS 3 HZ2 LYS 3 1.040 6.177 -2.754 35 HZ3 LYS 3 HZ3 LYS 3 -0.081 7.010 -3.595 36 H VAL 4 H VAL 4 7.216 4.189 -6.010 37 HA VAL 4 HA VAL 4 8.636 6.672 -5.110 38 HB VAL 4 HB VAL 4 10.121 4.085 -5.504 39 HG11 VAL 4 HG11 VAL 4 10.971 6.765 -4.355 40 HG12 VAL 4 HG12 VAL 4 11.961 5.285 -4.467 41 HG13 VAL 4 HG13 VAL 4 11.456 6.092 -5.935 42 HG21 VAL 4 HG21 VAL 4 8.797 3.756 -3.517 43 HG22 VAL 4 HG22 VAL 4 10.470 4.081 -3.058 44 HG23 VAL 4 HG23 VAL 4 9.238 5.363 -2.901 45 H MET 5 H MET 5 9.737 7.800 -6.649 46 HA MET 5 HA MET 5 9.785 6.710 -9.426 47 HB2 MET 5 HB2 MET 5 7.801 7.996 -9.408 48 HB3 MET 5 HB3 MET 5 8.562 9.310 -8.495 49 HG2 MET 5 HG2 MET 5 8.252 9.946 -10.805 50 HG3 MET 5 HG3 MET 5 9.957 9.895 -10.404 51 HE1 MET 5 HE1 MET 5 8.084 8.266 -14.059 52 HE2 MET 5 HE2 MET 5 7.060 8.423 -12.615 53 HE3 MET 5 HE3 MET 5 8.001 9.812 -13.215 54 H PHE 6 H PHE 6 11.562 7.081 -10.480 55 HA PHE 6 HA PHE 6 13.729 8.629 -9.118 56 HB2 PHE 6 HB2 PHE 6 13.999 6.452 -11.199 57 HB3 PHE 6 HB3 PHE 6 15.281 7.160 -10.222 58 HD1 PHE 6 HD1 PHE 6 15.237 6.774 -7.673 59 HD2 PHE 6 HD2 PHE 6 12.776 4.596 -10.441 60 HE1 PHE 6 HE1 PHE 6 14.691 5.142 -5.877 61 HE2 PHE 6 HE2 PHE 6 12.181 2.987 -8.631 62 HZ PHE 6 HZ PHE 6 13.110 3.289 -6.335 63 H VAL 7 H VAL 7 14.659 10.345 -10.049 64 HA VAL 7 HA VAL 7 14.188 10.959 -12.927 65 HB VAL 7 HB VAL 7 14.132 12.736 -10.502 66 HG11 VAL 7 HG11 VAL 7 16.011 13.789 -11.611 67 HG12 VAL 7 HG12 VAL 7 15.210 13.664 -13.207 68 HG13 VAL 7 HG13 VAL 7 14.574 14.734 -11.946 69 HG21 VAL 7 HG21 VAL 7 12.813 12.901 -13.251 70 HG22 VAL 7 HG22 VAL 7 12.118 12.067 -11.821 71 HG23 VAL 7 HG23 VAL 7 12.386 13.805 -11.774 72 H CYS 8 H CYS 8 15.884 10.833 -14.210 73 HA CYS 8 HA CYS 8 18.632 11.404 -13.147 74 HB2 CYS 8 HB2 CYS 8 18.344 9.022 -13.500 75 HB3 CYS 8 HB3 CYS 8 17.679 9.261 -15.105 76 HG CYS 8 HG CYS 8 20.095 8.217 -15.239 77 H LYS 9 H LYS 9 20.117 12.122 -15.084 78 HA LYS 9 HA LYS 9 18.830 14.506 -16.104 79 HB2 LYS 9 HB2 LYS 9 21.391 13.859 -15.464 80 HB3 LYS 9 HB3 LYS 9 21.532 13.751 -17.205 81 HG2 LYS 9 HG2 LYS 9 20.443 16.130 -15.611 82 HG3 LYS 9 HG3 LYS 9 22.106 15.977 -16.152 83 HD2 LYS 9 HD2 LYS 9 19.697 16.239 -18.013 84 HD3 LYS 9 HD3 LYS 9 20.790 17.533 -17.518 85 HE2 LYS 9 HE2 LYS 9 22.722 16.205 -18.493 86 HE3 LYS 9 HE3 LYS 9 21.536 15.075 -19.171 87 HZ1 LYS 9 HZ1 LYS 9 22.120 16.773 -20.796 88 HZ2 LYS 9 HZ2 LYS 9 20.546 16.986 -20.388 89 HZ3 LYS 9 HZ3 LYS 9 21.699 17.988 -19.792 90 H ARG 10 H ARG 10 19.973 11.617 -17.855 91 HA ARG 10 HA ARG 10 17.976 12.289 -19.993 92 HB2 ARG 10 HB2 ARG 10 19.283 11.734 -21.769 93 HB3 ARG 10 HB3 ARG 10 20.275 12.753 -20.760 94 HG2 ARG 10 HG2 ARG 10 20.540 9.723 -21.085 95 HG3 ARG 10 HG3 ARG 10 21.506 10.961 -21.863 96 HD2 ARG 10 HD2 ARG 10 22.138 11.737 -19.462 97 HD3 ARG 10 HD3 ARG 10 21.530 10.133 -18.970 98 HE ARG 10 HE ARG 10 23.464 10.056 -21.174 99 HH11 ARG 10 HH11 ARG 10 23.335 10.124 -17.633 100 HH12 ARG 10 HH12 ARG 10 24.994 9.521 -17.560 101 HH21 ARG 10 HH21 ARG 10 25.612 9.277 -20.809 102 HH22 ARG 10 HH22 ARG 10 26.202 9.403 -19.154 103 H ASN 11 H ASN 11 18.009 10.384 -17.630 104 HA ASN 11 HA ASN 11 17.231 8.332 -17.029 105 HB2 ASN 11 HB2 ASN 11 15.289 9.709 -17.754 106 HB3 ASN 11 HB3 ASN 11 15.327 8.925 -19.322 107 HD21 ASN 11 HD22 ASN 11 15.292 7.884 -15.791 108 HD22 ASN 11 HD21 ASN 11 14.186 6.578 -16.122 109 H SER 12 H SER 12 19.488 8.034 -18.765 110 HA SER 12 HA SER 12 18.957 5.546 -20.256 111 HB2 SER 12 HB2 SER 12 21.380 5.927 -20.926 112 HB3 SER 12 HB3 SER 12 20.282 7.273 -21.320 113 HG SER 12 HG SER 12 22.306 7.857 -20.163 114 H CYS 13 H CYS 13 21.026 6.670 -17.596 115 HA CYS 13 HA CYS 13 21.221 3.877 -16.509 116 HB2 CYS 13 HB2 CYS 13 23.272 4.810 -17.724 117 HB3 CYS 13 HB3 CYS 13 23.421 6.006 -16.432 118 HG CYS 13 HG CYS 13 25.155 3.983 -16.139 119 H ARG 14 H ARG 14 22.299 4.364 -14.072 120 HA ARG 14 HA ARG 14 21.680 4.752 -11.908 121 HB2 ARG 14 HB2 ARG 14 20.886 7.537 -12.839 122 HB3 ARG 14 HB3 ARG 14 21.276 7.036 -11.194 123 HG2 ARG 14 HG2 ARG 14 23.625 6.603 -11.876 124 HG3 ARG 14 HG3 ARG 14 23.225 7.091 -13.542 125 HD2 ARG 14 HD2 ARG 14 22.397 9.279 -12.642 126 HD3 ARG 14 HD3 ARG 14 23.030 8.836 -11.041 127 HE ARG 14 HE ARG 14 25.277 8.580 -12.559 128 HH11 ARG 14 HH11 ARG 14 23.040 11.242 -12.184 129 HH12 ARG 14 HH12 ARG 14 24.186 12.430 -12.760 130 HH21 ARG 14 HH21 ARG 14 26.685 10.128 -13.157 131 HH22 ARG 14 HH22 ARG 14 26.204 11.799 -13.354 132 H SER 15 H SER 15 18.936 6.546 -13.423 133 HA SER 15 HA SER 15 17.083 5.693 -11.375 134 HB2 SER 15 HB2 SER 15 15.392 6.686 -13.048 135 HB3 SER 15 HB3 SER 15 16.703 7.745 -12.526 136 HG SER 15 HG SER 15 16.523 6.321 -15.006 137 H GLN 16 H GLN 16 17.878 4.359 -14.555 138 HA GLN 16 HA GLN 16 15.672 2.447 -14.628 139 HB2 GLN 16 HB2 GLN 16 18.384 2.394 -16.041 140 HB3 GLN 16 HB3 GLN 16 16.992 1.404 -16.470 141 HG2 GLN 16 HG2 GLN 16 17.041 4.465 -16.652 142 HG3 GLN 16 HG3 GLN 16 17.374 3.372 -17.969 143 HE21 GLN 16 HE21 GLN 16 15.476 4.997 -18.653 144 HE22 GLN 16 HE22 GLN 16 13.873 4.288 -18.444 145 H MET 17 H MET 17 19.006 2.270 -13.333 146 HA MET 17 HA MET 17 18.832 -0.523 -12.481 147 HB2 MET 17 HB2 MET 17 20.580 1.780 -11.492 148 HB3 MET 17 HB3 MET 17 20.740 0.102 -10.989 149 HG2 MET 17 HG2 MET 17 21.300 -0.555 -13.312 150 HG3 MET 17 HG3 MET 17 21.194 1.142 -13.809 151 HE1 MET 17 HE1 MET 17 25.069 0.063 -13.672 152 HE2 MET 17 HE2 MET 17 23.664 -0.949 -14.089 153 HE3 MET 17 HE3 MET 17 23.811 0.704 -14.757 154 H ALA 18 H ALA 18 18.016 2.634 -10.977 155 HA ALA 18 HA ALA 18 17.484 1.612 -8.357 156 HB1 ALA 18 HB1 ALA 18 17.864 4.033 -9.030 157 HB2 ALA 18 HB2 ALA 18 16.224 4.050 -9.693 158 HB3 ALA 18 HB3 ALA 18 16.480 3.763 -7.958 159 H GLU 19 H GLU 19 15.251 2.157 -11.147 160 HA GLU 19 HA GLU 19 12.991 0.908 -9.889 161 HB2 GLU 19 HB2 GLU 19 13.090 2.277 -12.068 162 HB3 GLU 19 HB3 GLU 19 13.580 0.777 -12.858 163 HG2 GLU 19 HG2 GLU 19 11.435 -0.214 -11.632 164 HG3 GLU 19 HG3 GLU 19 10.977 1.469 -11.448 165 H GLY 20 H GLY 20 15.654 -0.545 -11.838 166 HA2 GLY 20 HA2 GLY 20 14.810 -3.216 -11.892 167 HA3 GLY 20 HA3 GLY 20 16.489 -2.685 -11.838 168 H PHE 21 H PHE 21 16.840 -1.706 -9.298 169 HA PHE 21 HA PHE 21 16.748 -4.105 -7.657 170 HB2 PHE 21 HB2 PHE 21 17.488 -1.209 -7.069 171 HB3 PHE 21 HB3 PHE 21 17.562 -2.487 -5.850 172 HD1 PHE 21 HD1 PHE 21 18.738 -4.741 -6.661 173 HD2 PHE 21 HD2 PHE 21 19.520 -0.796 -8.223 174 HE1 PHE 21 HE1 PHE 21 20.944 -5.501 -7.464 175 HE2 PHE 21 HE2 PHE 21 21.718 -1.559 -9.041 176 HZ PHE 21 HZ PHE 21 22.416 -3.946 -8.702 177 H ALA 22 H ALA 22 14.856 -1.051 -7.524 178 HA ALA 22 HA ALA 22 13.383 -1.849 -5.224 179 HB1 ALA 22 HB1 ALA 22 13.620 0.483 -6.080 180 HB2 ALA 22 HB2 ALA 22 12.588 0.065 -7.451 181 HB3 ALA 22 HB3 ALA 22 11.936 0.028 -5.779 182 H LYS 23 H LYS 23 12.545 -2.401 -8.698 183 HA LYS 23 HA LYS 23 9.945 -3.507 -8.100 184 HB2 LYS 23 HB2 LYS 23 9.819 -4.080 -10.384 185 HB3 LYS 23 HB3 LYS 23 10.701 -2.556 -10.277 186 HG2 LYS 23 HG2 LYS 23 12.826 -4.059 -10.405 187 HG3 LYS 23 HG3 LYS 23 11.745 -5.317 -10.994 188 HD2 LYS 23 HD2 LYS 23 12.111 -2.545 -12.226 189 HD3 LYS 23 HD3 LYS 23 12.908 -4.013 -12.801 190 HE2 LYS 23 HE2 LYS 23 10.869 -4.999 -13.521 191 HE3 LYS 23 HE3 LYS 23 9.882 -3.781 -12.690 192 HZ1 LYS 23 HZ1 LYS 23 10.711 -2.085 -14.222 193 HZ2 LYS 23 HZ2 LYS 23 11.719 -3.126 -14.959 194 HZ3 LYS 23 HZ3 LYS 23 10.089 -3.327 -15.103 195 H THR 24 H THR 24 13.076 -4.902 -8.109 196 HA THR 24 HA THR 24 12.174 -7.686 -7.786 197 HB THR 24 HB THR 24 14.943 -6.555 -7.337 198 HG1 THR 24 HG1 THR 24 14.609 -6.112 -9.412 199 HG21 THR 24 HG21 THR 24 13.990 -9.358 -8.075 200 HG22 THR 24 HG22 THR 24 15.679 -8.843 -7.911 201 HG23 THR 24 HG23 THR 24 14.639 -8.880 -6.488 202 H LEU 25 H LEU 25 13.923 -5.380 -5.618 203 HA LEU 25 HA LEU 25 13.740 -7.218 -3.345 204 HB2 LEU 25 HB2 LEU 25 14.777 -4.341 -3.507 205 HB3 LEU 25 HB3 LEU 25 15.097 -5.461 -2.199 206 HG LEU 25 HG LEU 25 16.055 -5.808 -5.082 207 HD11 LEU 25 HD11 LEU 25 18.230 -5.241 -4.231 208 HD12 LEU 25 HD12 LEU 25 17.104 -3.949 -3.738 209 HD13 LEU 25 HD13 LEU 25 17.608 -5.191 -2.572 210 HD21 LEU 25 HD21 LEU 25 17.481 -7.611 -4.147 211 HD22 LEU 25 HD22 LEU 25 16.639 -7.453 -2.589 212 HD23 LEU 25 HD23 LEU 25 15.762 -8.009 -4.036 213 H GLY 26 H GLY 26 11.970 -4.396 -4.430 214 HA2 GLY 26 HA2 GLY 26 10.416 -4.150 -1.918 215 HA3 GLY 26 HA3 GLY 26 10.445 -3.060 -3.306 216 H ALA 27 H ALA 27 10.135 -6.233 -4.498 217 HA ALA 27 HA ALA 27 7.602 -5.900 -5.593 218 HB1 ALA 27 HB1 ALA 27 8.957 -8.511 -4.776 219 HB2 ALA 27 HB2 ALA 27 7.653 -8.339 -5.973 220 HB3 ALA 27 HB3 ALA 27 9.240 -7.619 -6.281 221 H GLY 28 H GLY 28 5.690 -5.522 -4.626 222 HA2 GLY 28 HA2 GLY 28 3.738 -6.161 -3.468 223 HA3 GLY 28 HA3 GLY 28 4.647 -7.347 -2.535 224 H LYS 29 H LYS 29 6.678 -4.974 -2.079 225 HA LYS 29 HA LYS 29 5.310 -3.667 0.240 226 HB2 LYS 29 HB2 LYS 29 8.212 -3.636 -0.699 227 HB3 LYS 29 HB3 LYS 29 7.597 -2.748 0.685 228 HG2 LYS 29 HG2 LYS 29 7.676 -4.537 2.030 229 HG3 LYS 29 HG3 LYS 29 6.737 -5.508 0.914 230 HD2 LYS 29 HD2 LYS 29 8.699 -6.718 1.125 231 HD3 LYS 29 HD3 LYS 29 8.927 -5.878 -0.414 232 HE2 LYS 29 HE2 LYS 29 10.356 -4.181 0.734 233 HE3 LYS 29 HE3 LYS 29 10.034 -4.962 2.292 234 HZ1 LYS 29 HZ1 LYS 29 11.146 -6.988 1.426 235 HZ2 LYS 29 HZ2 LYS 29 11.527 -6.222 0.022 236 HZ3 LYS 29 HZ3 LYS 29 12.163 -5.720 1.445 237 H ILE 30 H ILE 30 6.715 -2.874 -2.934 238 HA ILE 30 HA ILE 30 5.358 -0.228 -2.831 239 HB ILE 30 HB ILE 30 7.371 0.914 -3.631 240 HG12 ILE 30 HG12 ILE 30 9.591 0.037 -3.441 241 HG13 ILE 30 HG13 ILE 30 9.001 -1.536 -2.912 242 HG21 ILE 30 HG21 ILE 30 6.854 0.876 -1.207 243 HG22 ILE 30 HG22 ILE 30 7.932 -0.534 -1.010 244 HG23 ILE 30 HG23 ILE 30 8.586 1.008 -1.558 245 HD11 ILE 30 HD11 ILE 30 8.390 -0.403 -5.665 246 HD12 ILE 30 HD12 ILE 30 9.879 -1.280 -5.306 247 HD13 ILE 30 HD13 ILE 30 8.332 -2.111 -5.132 248 H ALA 31 H ALA 31 5.582 0.989 -4.905 249 HA ALA 31 HA ALA 31 5.784 -0.733 -7.319 250 HB1 ALA 31 HB1 ALA 31 3.593 1.329 -6.830 251 HB2 ALA 31 HB2 ALA 31 3.867 0.446 -8.340 252 HB3 ALA 31 HB3 ALA 31 3.377 -0.432 -6.875 253 H VAL 32 H VAL 32 6.903 0.310 -9.072 254 HA VAL 32 HA VAL 32 8.022 2.991 -8.480 255 HB VAL 32 HB VAL 32 10.177 1.820 -9.364 256 HG11 VAL 32 HG11 VAL 32 10.896 1.556 -7.038 257 HG12 VAL 32 HG12 VAL 32 9.949 3.003 -7.301 258 HG13 VAL 32 HG13 VAL 32 9.199 1.601 -6.504 259 HG21 VAL 32 HG21 VAL 32 10.617 -0.399 -8.659 260 HG22 VAL 32 HG22 VAL 32 8.991 -0.581 -7.962 261 HG23 VAL 32 HG23 VAL 32 9.210 -0.433 -9.720 262 H THR 33 H THR 33 8.908 4.158 -10.013 263 HA THR 33 HA THR 33 8.736 3.308 -12.866 264 HB THR 33 HB THR 33 7.691 5.967 -11.824 265 HG1 THR 33 HG1 THR 33 5.635 5.105 -12.251 266 HG21 THR 33 HG21 THR 33 7.375 4.599 -14.538 267 HG22 THR 33 HG22 THR 33 6.650 6.152 -14.054 268 HG23 THR 33 HG23 THR 33 8.403 6.007 -14.212 269 H SER 34 H SER 34 10.381 4.153 -14.151 270 HA SER 34 HA SER 34 12.336 6.068 -12.950 271 HB2 SER 34 HB2 SER 34 13.207 3.868 -13.519 272 HB3 SER 34 HB3 SER 34 12.606 4.033 -15.185 273 HG SER 34 HG SER 34 14.827 4.599 -14.963 274 H CYS 35 H CYS 35 12.711 8.004 -13.887 275 HA CYS 35 HA CYS 35 12.025 8.556 -16.690 276 HB2 CYS 35 HB2 CYS 35 10.535 10.343 -16.256 277 HB3 CYS 35 HB3 CYS 35 9.964 8.979 -15.273 278 HG CYS 35 HG CYS 35 11.314 9.789 -13.083 279 H GLY 36 H GLY 36 12.596 11.061 -17.099 280 HA2 GLY 36 HA2 GLY 36 14.620 12.103 -15.212 281 HA3 GLY 36 HA3 GLY 36 15.215 11.751 -16.841 282 H LEU 37 H LEU 37 15.438 14.306 -15.896 283 HA LEU 37 HA LEU 37 13.183 15.914 -16.771 284 HB2 LEU 37 HB2 LEU 37 14.715 17.825 -16.807 285 HB3 LEU 37 HB3 LEU 37 14.470 17.050 -15.266 286 HG LEU 37 HG LEU 37 16.868 16.119 -16.850 287 HD11 LEU 37 HD11 LEU 37 16.765 18.806 -15.394 288 HD12 LEU 37 HD12 LEU 37 18.237 18.014 -16.004 289 HD13 LEU 37 HD13 LEU 37 16.998 18.572 -17.142 290 HD21 LEU 37 HD21 LEU 37 17.863 16.132 -14.555 291 HD22 LEU 37 HD22 LEU 37 16.345 16.812 -13.923 292 HD23 LEU 37 HD23 LEU 37 16.372 15.183 -14.618 293 H GLU 38 H GLU 38 15.516 14.178 -18.406 294 HA GLU 38 HA GLU 38 14.346 14.909 -20.994 295 HB2 GLU 38 HB2 GLU 38 17.373 14.654 -20.714 296 HB3 GLU 38 HB3 GLU 38 16.458 14.922 -22.186 297 HG2 GLU 38 HG2 GLU 38 15.718 17.137 -21.306 298 HG3 GLU 38 HG3 GLU 38 16.723 16.888 -19.872 299 H SER 39 H SER 39 14.764 13.107 -22.587 300 HA SER 39 HA SER 39 15.450 10.493 -21.325 301 HB2 SER 39 HB2 SER 39 13.391 9.534 -22.426 302 HB3 SER 39 HB3 SER 39 13.147 10.565 -21.009 303 HG SER 39 HG SER 39 12.808 11.368 -23.737 304 H SER 40 H SER 40 16.758 9.309 -22.533 305 HA SER 40 HA SER 40 16.822 9.740 -25.505 306 HB2 SER 40 HB2 SER 40 18.812 10.588 -24.408 307 HB3 SER 40 HB3 SER 40 19.107 9.014 -23.657 308 HG SER 40 HG SER 40 19.118 9.687 -26.443 309 H ARG 41 H ARG 41 18.380 7.113 -23.742 310 HA ARG 41 HA ARG 41 16.352 5.123 -24.273 311 HB2 ARG 41 HB2 ARG 41 17.549 3.699 -25.775 312 HB3 ARG 41 HB3 ARG 41 17.473 5.276 -26.525 313 HG2 ARG 41 HG2 ARG 41 19.920 4.043 -25.182 314 HG3 ARG 41 HG3 ARG 41 19.609 4.189 -26.905 315 HD2 ARG 41 HD2 ARG 41 19.603 6.678 -26.665 316 HD3 ARG 41 HD3 ARG 41 20.109 6.478 -24.969 317 HE ARG 41 HE ARG 41 21.901 5.008 -26.607 318 HH11 ARG 41 HH11 ARG 41 21.109 8.381 -26.021 319 HH12 ARG 41 HH12 ARG 41 22.731 8.912 -26.396 320 HH21 ARG 41 HH21 ARG 41 23.941 5.767 -27.106 321 HH22 ARG 41 HH22 ARG 41 24.286 7.464 -26.997 322 H VAL 42 H VAL 42 16.907 3.043 -23.165 323 HA VAL 42 HA VAL 42 18.506 3.418 -20.776 324 HB VAL 42 HB VAL 42 17.756 0.702 -21.943 325 HG11 VAL 42 HG11 VAL 42 17.952 0.017 -19.546 326 HG12 VAL 42 HG12 VAL 42 19.492 0.604 -20.163 327 HG13 VAL 42 HG13 VAL 42 18.506 1.649 -19.121 328 HG21 VAL 42 HG21 VAL 42 15.714 1.912 -21.624 329 HG22 VAL 42 HG22 VAL 42 15.932 0.767 -20.291 330 HG23 VAL 42 HG23 VAL 42 16.238 2.513 -20.035 331 H HIS 43 H HIS 43 20.655 3.063 -20.395 332 HA HIS 43 HA HIS 43 22.451 2.763 -22.672 333 HB2 HIS 43 HB2 HIS 43 22.862 4.032 -20.464 334 HB3 HIS 43 HB3 HIS 43 23.211 2.463 -19.744 335 HD2 HIS 43 HD2 HIS 43 24.716 5.216 -21.768 336 HE1 HIS 43 HE1 HIS 43 27.506 2.022 -22.125 337 HE2 HIS 43 HE2 HIS 43 27.098 4.516 -22.574 338 HA PRO 44 HA PRO 44 21.634 -1.494 -22.720 339 HB2 PRO 44 HB2 PRO 44 23.464 -2.491 -24.537 340 HB3 PRO 44 HB3 PRO 44 22.094 -1.428 -24.985 341 HG2 PRO 44 HG2 PRO 44 24.966 -0.602 -24.440 342 HG3 PRO 44 HG3 PRO 44 23.950 -0.189 -25.854 343 HD2 PRO 44 HD2 PRO 44 24.194 1.499 -23.747 344 HD3 PRO 44 HD3 PRO 44 22.621 1.307 -24.592 345 H THR 45 H THR 45 24.957 -0.432 -21.955 346 HA THR 45 HA THR 45 25.811 -2.884 -20.696 347 HB THR 45 HB THR 45 26.790 -0.051 -20.202 348 HG1 THR 45 HG1 THR 45 28.344 -0.640 -21.778 349 HG21 THR 45 HG21 THR 45 28.931 -1.255 -19.640 350 HG22 THR 45 HG22 THR 45 27.632 -1.592 -18.498 351 HG23 THR 45 HG23 THR 45 28.041 -2.800 -19.729 352 H ALA 46 H ALA 46 23.798 -0.168 -19.529 353 HA ALA 46 HA ALA 46 23.970 -0.829 -16.741 354 HB1 ALA 46 HB1 ALA 46 21.598 0.328 -18.287 355 HB2 ALA 46 HB2 ALA 46 21.875 0.446 -16.543 356 HB3 ALA 46 HB3 ALA 46 22.968 1.287 -17.666 357 H ILE 47 H ILE 47 21.738 -1.960 -19.309 358 HA ILE 47 HA ILE 47 20.249 -3.844 -17.723 359 HB ILE 47 HB ILE 47 20.987 -3.833 -20.676 360 HG12 ILE 47 HG12 ILE 47 18.156 -3.384 -19.945 361 HG13 ILE 47 HG13 ILE 47 19.204 -2.156 -19.250 362 HG21 ILE 47 HG21 ILE 47 18.967 -5.595 -19.229 363 HG22 ILE 47 HG22 ILE 47 19.089 -5.405 -20.992 364 HG23 ILE 47 HG23 ILE 47 20.421 -6.128 -20.098 365 HD11 ILE 47 HD11 ILE 47 18.260 -1.626 -21.516 366 HD12 ILE 47 HD12 ILE 47 20.018 -1.469 -21.344 367 HD13 ILE 47 HD13 ILE 47 19.319 -2.886 -22.190 368 H ALA 48 H ALA 48 23.285 -4.259 -19.613 369 HA ALA 48 HA ALA 48 23.664 -7.005 -19.013 370 HB1 ALA 48 HB1 ALA 48 24.874 -5.725 -20.761 371 HB2 ALA 48 HB2 ALA 48 25.793 -4.891 -19.480 372 HB3 ALA 48 HB3 ALA 48 25.958 -6.643 -19.700 373 H MET 49 H MET 49 24.611 -4.146 -17.122 374 HA MET 49 HA MET 49 26.077 -5.642 -15.117 375 HB2 MET 49 HB2 MET 49 24.984 -2.821 -15.085 376 HB3 MET 49 HB3 MET 49 26.135 -3.477 -13.913 377 HG2 MET 49 HG2 MET 49 26.856 -3.638 -16.825 378 HG3 MET 49 HG3 MET 49 26.886 -2.081 -16.032 379 HE1 MET 49 HE1 MET 49 28.171 -5.844 -15.709 380 HE2 MET 49 HE2 MET 49 28.867 -4.994 -17.101 381 HE3 MET 49 HE3 MET 49 29.905 -5.469 -15.741 382 H MET 50 H MET 50 22.685 -4.531 -15.378 383 HA MET 50 HA MET 50 21.958 -5.468 -12.713 384 HB2 MET 50 HB2 MET 50 20.283 -4.966 -15.207 385 HB3 MET 50 HB3 MET 50 19.625 -5.370 -13.625 386 HG2 MET 50 HG2 MET 50 21.215 -2.881 -14.337 387 HG3 MET 50 HG3 MET 50 19.505 -2.972 -13.970 388 HE1 MET 50 HE1 MET 50 18.598 -3.810 -11.677 389 HE2 MET 50 HE2 MET 50 19.803 -5.043 -11.223 390 HE3 MET 50 HE3 MET 50 19.466 -3.686 -10.133 391 H GLU 51 H GLU 51 22.222 -7.077 -15.906 392 HA GLU 51 HA GLU 51 21.023 -9.526 -14.995 393 HB2 GLU 51 HB2 GLU 51 22.967 -8.933 -17.254 394 HB3 GLU 51 HB3 GLU 51 22.351 -10.548 -16.910 395 HG2 GLU 51 HG2 GLU 51 20.029 -9.751 -17.174 396 HG3 GLU 51 HG3 GLU 51 20.612 -8.145 -17.596 397 H GLU 52 H GLU 52 24.219 -8.198 -14.266 398 HA GLU 52 HA GLU 52 25.544 -10.642 -13.565 399 HB2 GLU 52 HB2 GLU 52 25.803 -7.930 -12.214 400 HB3 GLU 52 HB3 GLU 52 26.933 -9.272 -12.093 401 HG2 GLU 52 HG2 GLU 52 27.320 -9.134 -14.567 402 HG3 GLU 52 HG3 GLU 52 26.325 -7.674 -14.603 403 H VAL 53 H VAL 53 23.073 -8.780 -11.905 404 HA VAL 53 HA VAL 53 23.193 -10.583 -9.520 405 HB VAL 53 HB VAL 53 21.814 -8.869 -8.369 406 HG11 VAL 53 HG11 VAL 53 23.634 -7.295 -7.995 407 HG12 VAL 53 HG12 VAL 53 24.263 -8.948 -8.109 408 HG13 VAL 53 HG13 VAL 53 24.450 -7.833 -9.482 409 HG21 VAL 53 HG21 VAL 53 22.445 -7.081 -10.766 410 HG22 VAL 53 HG22 VAL 53 20.837 -7.752 -10.390 411 HG23 VAL 53 HG23 VAL 53 21.614 -6.618 -9.279 412 H GLY 54 H GLY 54 21.875 -10.909 -12.340 413 HA2 GLY 54 HA2 GLY 54 20.140 -12.164 -13.134 414 HA3 GLY 54 HA3 GLY 54 19.728 -12.577 -11.466 415 H ILE 55 H ILE 55 19.715 -9.181 -12.378 416 HA ILE 55 HA ILE 55 16.737 -9.105 -12.147 417 HB ILE 55 HB ILE 55 18.877 -7.020 -11.655 418 HG12 ILE 55 HG12 ILE 55 16.824 -8.386 -9.857 419 HG13 ILE 55 HG13 ILE 55 18.561 -8.673 -9.849 420 HG21 ILE 55 HG21 ILE 55 16.952 -5.902 -12.746 421 HG22 ILE 55 HG22 ILE 55 15.843 -6.667 -11.575 422 HG23 ILE 55 HG23 ILE 55 17.043 -5.474 -11.050 423 HD11 ILE 55 HD11 ILE 55 18.905 -6.278 -9.145 424 HD12 ILE 55 HD12 ILE 55 17.143 -6.151 -8.927 425 HD13 ILE 55 HD13 ILE 55 18.066 -7.307 -7.965 426 H ASP 56 H ASP 56 15.500 -8.357 -13.781 427 HA ASP 56 HA ASP 56 16.884 -7.707 -16.345 428 HB2 ASP 56 HB2 ASP 56 15.590 -9.746 -16.419 429 HB3 ASP 56 HB3 ASP 56 14.148 -8.893 -15.847 430 H ILE 57 H ILE 57 16.837 -5.739 -17.031 431 HA ILE 57 HA ILE 57 14.407 -4.057 -16.644 432 HB ILE 57 HB ILE 57 15.744 -2.033 -16.622 433 HG12 ILE 57 HG12 ILE 57 18.247 -3.636 -16.035 434 HG13 ILE 57 HG13 ILE 57 17.813 -3.228 -17.688 435 HG21 ILE 57 HG21 ILE 57 14.981 -3.122 -14.499 436 HG22 ILE 57 HG22 ILE 57 16.556 -3.916 -14.361 437 HG23 ILE 57 HG23 ILE 57 16.438 -2.141 -14.300 438 HD11 ILE 57 HD11 ILE 57 18.210 -1.174 -15.473 439 HD12 ILE 57 HD12 ILE 57 19.360 -1.550 -16.765 440 HD13 ILE 57 HD13 ILE 57 17.792 -0.825 -17.172 441 H SER 58 H SER 58 15.522 -5.935 -18.870 442 HA SER 58 HA SER 58 16.299 -4.342 -21.096 443 HB2 SER 58 HB2 SER 58 14.801 -6.978 -21.266 444 HB3 SER 58 HB3 SER 58 15.941 -6.299 -22.437 445 HG SER 58 HG SER 58 16.368 -7.399 -19.881 446 H GLY 59 H GLY 59 13.083 -5.098 -19.869 447 HA2 GLY 59 HA2 GLY 59 11.603 -4.206 -22.207 448 HA3 GLY 59 HA3 GLY 59 10.960 -4.584 -20.605 449 H GLN 60 H GLN 60 13.404 -2.282 -20.108 450 HA GLN 60 HA GLN 60 11.392 -0.110 -19.903 451 HB2 GLN 60 HB2 GLN 60 14.133 -0.551 -18.692 452 HB3 GLN 60 HB3 GLN 60 13.366 1.033 -18.695 453 HG2 GLN 60 HG2 GLN 60 11.687 0.428 -17.220 454 HG3 GLN 60 HG3 GLN 60 11.691 -1.262 -17.713 455 HE21 GLN 60 HE22 GLN 60 14.065 1.018 -16.148 456 HE22 GLN 60 HE21 GLN 60 14.562 -0.194 -14.956 457 H THR 61 H THR 61 11.905 1.992 -20.640 458 HA THR 61 HA THR 61 13.774 2.470 -22.800 459 HB THR 61 HB THR 61 11.936 3.432 -24.223 460 HG1 THR 61 HG1 THR 61 9.835 2.622 -23.906 461 HG21 THR 61 HG21 THR 61 11.702 0.414 -23.887 462 HG22 THR 61 HG22 THR 61 11.299 1.365 -25.329 463 HG23 THR 61 HG23 THR 61 12.981 1.243 -24.795 464 H SER 62 H SER 62 13.937 4.838 -23.038 465 HA SER 62 HA SER 62 13.618 5.978 -20.412 466 HB2 SER 62 HB2 SER 62 14.606 7.193 -22.963 467 HB3 SER 62 HB3 SER 62 14.806 7.877 -21.320 468 HG SER 62 HG SER 62 16.160 6.162 -20.802 469 H ASP 63 H ASP 63 12.353 7.633 -19.686 470 HA ASP 63 HA ASP 63 10.470 8.963 -21.582 471 HB2 ASP 63 HB2 ASP 63 9.661 7.365 -19.157 472 HB3 ASP 63 HB3 ASP 63 8.656 8.672 -19.780 473 HA PRO 64 HA PRO 64 11.528 12.489 -19.262 474 HB2 PRO 64 HB2 PRO 64 10.030 14.413 -20.417 475 HB3 PRO 64 HB3 PRO 64 11.213 13.444 -21.352 476 HG2 PRO 64 HG2 PRO 64 8.215 13.004 -21.117 477 HG3 PRO 64 HG3 PRO 64 9.204 13.053 -22.608 478 HD2 PRO 64 HD2 PRO 64 8.513 10.705 -21.319 479 HD3 PRO 64 HD3 PRO 64 10.032 10.909 -22.247 480 H ILE 65 H ILE 65 11.078 13.750 -17.521 481 HA ILE 65 HA ILE 65 9.112 13.148 -15.639 482 HB ILE 65 HB ILE 65 11.349 14.335 -15.391 483 HG12 ILE 65 HG12 ILE 65 8.957 15.471 -13.950 484 HG13 ILE 65 HG13 ILE 65 9.855 13.993 -13.543 485 HG21 ILE 65 HG21 ILE 65 11.503 16.747 -15.492 486 HG22 ILE 65 HG22 ILE 65 10.938 16.195 -17.072 487 HG23 ILE 65 HG23 ILE 65 9.797 16.911 -15.899 488 HD11 ILE 65 HD11 ILE 65 10.656 15.637 -12.032 489 HD12 ILE 65 HD12 ILE 65 11.916 15.534 -13.278 490 HD13 ILE 65 HD13 ILE 65 10.744 16.880 -13.286 491 H GLU 66 H GLU 66 9.046 15.616 -18.172 492 HA GLU 66 HA GLU 66 6.794 17.106 -17.425 493 HB2 GLU 66 HB2 GLU 66 7.696 16.416 -20.254 494 HB3 GLU 66 HB3 GLU 66 6.661 17.767 -19.787 495 HG2 GLU 66 HG2 GLU 66 8.567 18.626 -18.342 496 HG3 GLU 66 HG3 GLU 66 9.596 17.386 -19.065 497 H ASN 67 H ASN 67 6.737 13.852 -18.792 498 HA ASN 67 HA ASN 67 3.853 14.078 -19.452 499 HB2 ASN 67 HB2 ASN 67 4.162 12.432 -20.902 500 HB3 ASN 67 HB3 ASN 67 5.878 12.742 -20.735 501 HD21 ASN 67 HD22 ASN 67 6.899 11.420 -18.720 502 HD22 ASN 67 HD21 ASN 67 6.246 9.810 -18.517 503 H PHE 68 H PHE 68 5.622 13.343 -16.661 504 HA PHE 68 HA PHE 68 3.803 11.193 -15.731 505 HB2 PHE 68 HB2 PHE 68 6.565 12.133 -14.935 506 HB3 PHE 68 HB3 PHE 68 5.644 11.052 -13.921 507 HD1 PHE 68 HD2 PHE 68 4.440 9.027 -15.451 508 HD2 PHE 68 HD1 PHE 68 8.202 10.999 -16.165 509 HE1 PHE 68 HE2 PHE 68 5.232 7.053 -16.717 510 HE2 PHE 68 HE1 PHE 68 8.988 9.018 -17.443 511 HZ PHE 68 HZ PHE 68 7.506 7.040 -17.715 512 H ASN 69 H ASN 69 3.509 11.140 -13.280 513 HA ASN 69 HA ASN 69 2.153 13.705 -12.512 514 HB2 ASN 69 HB2 ASN 69 0.347 12.156 -11.617 515 HB3 ASN 69 HB3 ASN 69 0.484 12.342 -13.359 516 HD21 ASN 69 HD22 ASN 69 1.802 10.107 -10.820 517 HD22 ASN 69 HD21 ASN 69 1.442 8.666 -11.753 518 H ALA 70 H ALA 70 3.824 14.393 -11.101 519 HA ALA 70 HA ALA 70 5.138 12.963 -9.159 520 HB1 ALA 70 HB1 ALA 70 5.622 15.314 -9.696 521 HB2 ALA 70 HB2 ALA 70 4.094 15.810 -8.935 522 HB3 ALA 70 HB3 ALA 70 5.386 15.108 -7.945 523 H ASP 71 H ASP 71 1.833 14.188 -8.949 524 HA ASP 71 HA ASP 71 1.378 14.056 -6.164 525 HB2 ASP 71 HB2 ASP 71 -0.528 13.672 -8.503 526 HB3 ASP 71 HB3 ASP 71 -1.035 13.931 -6.837 527 H ASP 72 H ASP 72 1.504 11.395 -8.455 528 HA ASP 72 HA ASP 72 0.243 9.556 -6.481 529 HB2 ASP 72 HB2 ASP 72 -0.501 9.640 -8.950 530 HB3 ASP 72 HB3 ASP 72 1.038 8.819 -9.277 531 H TYR 73 H TYR 73 3.253 10.724 -6.864 532 HA TYR 73 HA TYR 73 4.565 8.110 -6.193 533 HB2 TYR 73 HB2 TYR 73 6.038 10.593 -7.033 534 HB3 TYR 73 HB3 TYR 73 6.613 8.934 -6.963 535 HD1 TYR 73 HD1 TYR 73 4.439 7.489 -8.500 536 HD2 TYR 73 HD2 TYR 73 6.441 11.246 -9.219 537 HE1 TYR 73 HE1 TYR 73 3.852 7.347 -10.905 538 HE2 TYR 73 HE2 TYR 73 5.819 11.111 -11.622 539 HH TYR 73 HH TYR 73 3.936 8.372 -12.968 540 H ASP 74 H ASP 74 4.188 7.977 -4.006 541 HA ASP 74 HA ASP 74 4.081 10.088 -2.135 542 HB2 ASP 74 HB2 ASP 74 5.129 7.262 -1.718 543 HB3 ASP 74 HB3 ASP 74 4.573 8.345 -0.447 544 H VAL 75 H VAL 75 6.884 8.378 -3.451 545 HA VAL 75 HA VAL 75 8.674 10.442 -2.227 546 HB VAL 75 HB VAL 75 9.396 7.550 -2.773 547 HG11 VAL 75 HG11 VAL 75 11.327 8.981 -2.995 548 HG12 VAL 75 HG12 VAL 75 10.942 9.834 -1.493 549 HG13 VAL 75 HG13 VAL 75 11.445 8.137 -1.453 550 HG21 VAL 75 HG21 VAL 75 8.630 8.953 -0.195 551 HG22 VAL 75 HG22 VAL 75 7.950 7.464 -0.891 552 HG23 VAL 75 HG23 VAL 75 9.591 7.457 -0.224 553 H VAL 76 H VAL 76 10.035 11.472 -3.563 554 HA VAL 76 HA VAL 76 10.475 10.390 -6.324 555 HB VAL 76 HB VAL 76 10.032 13.250 -5.494 556 HG11 VAL 76 HG11 VAL 76 10.633 13.951 -7.754 557 HG12 VAL 76 HG12 VAL 76 12.025 13.204 -7.010 558 HG13 VAL 76 HG13 VAL 76 11.078 12.282 -8.201 559 HG21 VAL 76 HG21 VAL 76 8.012 11.957 -6.099 560 HG22 VAL 76 HG22 VAL 76 8.359 13.194 -7.315 561 HG23 VAL 76 HG23 VAL 76 8.772 11.500 -7.652 562 H ILE 77 H ILE 77 12.529 10.247 -6.971 563 HA ILE 77 HA ILE 77 14.693 11.204 -5.109 564 HB ILE 77 HB ILE 77 14.633 8.672 -6.772 565 HG12 ILE 77 HG12 ILE 77 12.967 8.352 -5.036 566 HG13 ILE 77 HG13 ILE 77 14.357 7.318 -4.805 567 HG21 ILE 77 HG21 ILE 77 16.592 8.041 -5.424 568 HG22 ILE 77 HG22 ILE 77 16.895 9.487 -6.371 569 HG23 ILE 77 HG23 ILE 77 16.577 9.632 -4.634 570 HD11 ILE 77 HD11 ILE 77 13.879 9.892 -3.242 571 HD12 ILE 77 HD12 ILE 77 13.505 8.250 -2.698 572 HD13 ILE 77 HD13 ILE 77 15.182 8.709 -2.983 573 H SER 78 H SER 78 16.129 12.533 -6.104 574 HA SER 78 HA SER 78 16.367 12.447 -9.092 575 HB2 SER 78 HB2 SER 78 16.071 14.687 -8.106 576 HB3 SER 78 HB3 SER 78 17.583 14.457 -7.183 577 HG SER 78 HG SER 78 17.966 15.506 -9.206 578 H LEU 79 H LEU 79 18.211 11.809 -10.035 579 HA LEU 79 HA LEU 79 20.575 11.063 -8.369 580 HB2 LEU 79 HB2 LEU 79 19.549 9.374 -10.692 581 HB3 LEU 79 HB3 LEU 79 20.910 9.056 -9.625 582 HG LEU 79 HG LEU 79 19.032 9.030 -7.721 583 HD11 LEU 79 HD11 LEU 79 17.117 9.600 -9.227 584 HD12 LEU 79 HD12 LEU 79 17.497 8.196 -10.234 585 HD13 LEU 79 HD13 LEU 79 16.957 7.983 -8.548 586 HD21 LEU 79 HD21 LEU 79 20.480 7.121 -8.322 587 HD22 LEU 79 HD22 LEU 79 18.808 6.598 -8.047 588 HD23 LEU 79 HD23 LEU 79 19.419 6.745 -9.706 589 H CYS 80 H CYS 80 20.079 13.517 -9.780 590 HA CYS 80 HA CYS 80 21.441 13.260 -12.400 591 HB2 CYS 80 HB2 CYS 80 20.111 15.677 -11.113 592 HB3 CYS 80 HB3 CYS 80 20.658 15.516 -12.795 593 HG CYS 80 HG CYS 80 18.211 14.064 -11.120 594 H GLY 81 H GLY 81 21.891 15.377 -9.519 595 HA2 GLY 81 HA2 GLY 81 24.442 15.688 -8.943 596 HA3 GLY 81 HA3 GLY 81 24.519 16.287 -10.598 597 H CYS 82 H CYS 82 25.325 18.111 -8.986 598 HA CYS 82 HA CYS 82 23.488 19.602 -7.431 599 HB2 CYS 82 HB2 CYS 82 26.115 20.336 -8.793 600 HB3 CYS 82 HB3 CYS 82 25.257 21.431 -7.702 601 HG CYS 82 HG CYS 82 26.272 18.324 -6.990 602 H GLY 83 H GLY 83 23.873 19.767 -10.913 603 HA2 GLY 83 HA2 GLY 83 22.862 22.436 -11.297 604 HA3 GLY 83 HA3 GLY 83 23.003 21.171 -12.521 605 H VAL 84 H VAL 84 21.099 19.879 -10.088 606 HA VAL 84 HA VAL 84 18.551 20.631 -11.476 607 HB VAL 84 HB VAL 84 19.444 17.842 -10.665 608 HG11 VAL 84 HG11 VAL 84 16.977 18.127 -10.568 609 HG12 VAL 84 HG12 VAL 84 16.994 18.759 -12.238 610 HG13 VAL 84 HG13 VAL 84 17.460 17.078 -11.891 611 HG21 VAL 84 HG21 VAL 84 19.434 17.442 -13.170 612 HG22 VAL 84 HG22 VAL 84 19.322 19.199 -13.392 613 HG23 VAL 84 HG23 VAL 84 20.745 18.479 -12.594 614 H ASN 85 H ASN 85 16.967 21.245 -10.165 615 HA ASN 85 HA ASN 85 16.957 20.348 -7.297 616 HB2 ASN 85 HB2 ASN 85 16.419 23.122 -8.443 617 HB3 ASN 85 HB3 ASN 85 16.260 22.675 -6.746 618 HD21 ASN 85 HD22 ASN 85 18.301 21.851 -5.628 619 HD22 ASN 85 HD21 ASN 85 19.816 22.550 -6.174 620 H LEU 86 H LEU 86 15.052 20.232 -10.080 621 HA LEU 86 HA LEU 86 12.783 20.146 -10.539 622 HB2 LEU 86 HB2 LEU 86 12.915 18.390 -8.068 623 HB3 LEU 86 HB3 LEU 86 11.650 18.376 -9.301 624 HG LEU 86 HG LEU 86 14.515 17.494 -9.663 625 HD11 LEU 86 HD11 LEU 86 12.767 16.083 -8.363 626 HD12 LEU 86 HD12 LEU 86 11.917 15.934 -9.912 627 HD13 LEU 86 HD13 LEU 86 13.570 15.305 -9.751 628 HD21 LEU 86 HD21 LEU 86 13.757 18.474 -11.772 629 HD22 LEU 86 HD22 LEU 86 13.589 16.730 -11.920 630 HD23 LEU 86 HD23 LEU 86 12.154 17.723 -11.575 631 HA PRO 87 HA PRO 87 11.519 23.541 -7.576 632 HB2 PRO 87 HB2 PRO 87 10.658 24.579 -10.284 633 HB3 PRO 87 HB3 PRO 87 11.215 25.498 -8.847 634 HG2 PRO 87 HG2 PRO 87 12.944 25.006 -10.852 635 HG3 PRO 87 HG3 PRO 87 13.473 24.745 -9.153 636 HD2 PRO 87 HD2 PRO 87 12.535 22.689 -11.168 637 HD3 PRO 87 HD3 PRO 87 13.931 22.640 -10.054 638 HA PRO 88 HA PRO 88 7.009 22.917 -9.033 639 HB2 PRO 88 HB2 PRO 88 6.915 20.361 -10.538 640 HB3 PRO 88 HB3 PRO 88 6.207 21.947 -10.953 641 HG2 PRO 88 HG2 PRO 88 8.356 20.895 -12.261 642 HG3 PRO 88 HG3 PRO 88 8.191 22.667 -11.964 643 HD2 PRO 88 HD2 PRO 88 9.784 20.625 -10.398 644 HD3 PRO 88 HD3 PRO 88 10.255 22.255 -10.976 645 H GLU 89 H GLU 89 5.286 20.681 -8.939 646 HA GLU 89 HA GLU 89 5.359 19.910 -6.200 647 HB2 GLU 89 HB2 GLU 89 3.550 18.317 -6.825 648 HB3 GLU 89 HB3 GLU 89 3.255 19.990 -7.257 649 HG2 GLU 89 HG2 GLU 89 4.463 18.222 -9.374 650 HG3 GLU 89 HG3 GLU 89 2.797 17.912 -8.911 651 H TRP 90 H TRP 90 7.327 18.677 -8.596 652 HA TRP 90 HA TRP 90 7.712 15.939 -7.865 653 HB2 TRP 90 HB2 TRP 90 9.441 18.033 -9.173 654 HB3 TRP 90 HB3 TRP 90 9.962 16.366 -8.891 655 HD1 TRP 90 HD1 TRP 90 7.562 18.396 -11.067 656 HE1 TRP 90 HE1 TRP 90 6.393 16.869 -12.767 657 HE3 TRP 90 HE3 TRP 90 9.603 13.955 -9.654 658 HZ2 TRP 90 HZ2 TRP 90 6.354 14.041 -13.419 659 HZ3 TRP 90 HZ3 TRP 90 9.187 11.917 -10.971 660 HH2 TRP 90 HH2 TRP 90 7.566 11.935 -12.838 661 H VAL 91 H VAL 91 8.531 18.809 -6.084 662 HA VAL 91 HA VAL 91 10.079 17.100 -4.154 663 HB VAL 91 HB VAL 91 11.267 19.044 -3.390 664 HG11 VAL 91 HG11 VAL 91 11.474 18.636 -6.372 665 HG12 VAL 91 HG12 VAL 91 12.699 19.407 -5.347 666 HG13 VAL 91 HG13 VAL 91 12.284 17.710 -5.107 667 HG21 VAL 91 HG21 VAL 91 9.616 20.833 -3.891 668 HG22 VAL 91 HG22 VAL 91 11.208 21.193 -4.571 669 HG23 VAL 91 HG23 VAL 91 9.917 20.609 -5.628 670 H THR 92 H THR 92 7.030 18.249 -4.478 671 HA THR 92 HA THR 92 6.728 19.041 -1.623 672 HB THR 92 HB THR 92 4.538 19.822 -2.173 673 HG1 THR 92 HG1 THR 92 3.610 19.486 -4.098 674 HG21 THR 92 HG21 THR 92 6.462 20.743 -4.368 675 HG22 THR 92 HG22 THR 92 5.032 21.607 -3.765 676 HG23 THR 92 HG23 THR 92 6.427 21.361 -2.697 677 H GLN 93 H GLN 93 6.987 16.184 -2.998 678 HA GLN 93 HA GLN 93 4.599 14.821 -1.996 679 HB2 GLN 93 HB2 GLN 93 7.191 13.655 -3.074 680 HB3 GLN 93 HB3 GLN 93 5.653 12.817 -2.828 681 HG2 GLN 93 HG2 GLN 93 6.280 14.962 -4.878 682 HG3 GLN 93 HG3 GLN 93 5.804 13.305 -5.176 683 HE21 GLN 93 HE22 GLN 93 4.643 16.335 -5.491 684 HE22 GLN 93 HE21 GLN 93 2.937 16.055 -5.152 685 H GLU 94 H GLU 94 5.593 12.516 -0.713 686 HA GLU 94 HA GLU 94 5.685 13.676 1.947 687 HB2 GLU 94 HB2 GLU 94 6.336 10.769 1.364 688 HB3 GLU 94 HB3 GLU 94 5.731 11.502 2.843 689 HG2 GLU 94 HG2 GLU 94 3.679 12.154 1.224 690 HG3 GLU 94 HG3 GLU 94 4.286 10.733 0.351 691 H ILE 95 H ILE 95 8.111 12.155 -0.121 692 HA ILE 95 HA ILE 95 10.310 13.237 1.559 693 HB ILE 95 HB ILE 95 10.256 10.370 0.560 694 HG12 ILE 95 HG12 ILE 95 9.986 11.283 3.449 695 HG13 ILE 95 HG13 ILE 95 8.674 10.637 2.458 696 HG21 ILE 95 HG21 ILE 95 12.353 10.112 1.837 697 HG22 ILE 95 HG22 ILE 95 12.529 11.372 0.634 698 HG23 ILE 95 HG23 ILE 95 12.273 11.812 2.340 699 HD11 ILE 95 HD11 ILE 95 9.355 8.828 3.757 700 HD12 ILE 95 HD12 ILE 95 10.006 8.523 2.141 701 HD13 ILE 95 HD13 ILE 95 11.079 9.105 3.440 702 H PHE 96 H PHE 96 11.953 14.045 0.348 703 HA PHE 96 HA PHE 96 12.264 13.155 -2.447 704 HB2 PHE 96 HB2 PHE 96 11.188 15.288 -2.700 705 HB3 PHE 96 HB3 PHE 96 12.282 16.035 -1.539 706 HD1 PHE 96 HD1 PHE 96 12.055 14.614 -5.001 707 HD2 PHE 96 HD2 PHE 96 14.512 16.732 -2.148 708 HE1 PHE 96 HE1 PHE 96 13.784 14.976 -6.739 709 HE2 PHE 96 HE2 PHE 96 16.179 17.181 -3.923 710 HZ PHE 96 HZ PHE 96 15.827 16.297 -6.219 711 H GLU 97 H GLU 97 14.327 12.641 -2.995 712 HA GLU 97 HA GLU 97 16.558 13.461 -1.207 713 HB2 GLU 97 HB2 GLU 97 16.167 10.629 -2.220 714 HB3 GLU 97 HB3 GLU 97 17.535 11.257 -1.299 715 HG2 GLU 97 HG2 GLU 97 15.968 11.758 0.607 716 HG3 GLU 97 HG3 GLU 97 14.671 10.974 -0.313 717 H ASP 98 H ASP 98 18.666 13.383 -2.210 718 HA ASP 98 HA ASP 98 18.675 13.308 -5.194 719 HB2 ASP 98 HB2 ASP 98 18.502 15.611 -4.535 720 HB3 ASP 98 HB3 ASP 98 19.815 15.428 -3.369 721 H TRP 99 H TRP 99 19.644 11.368 -5.388 722 HA TRP 99 HA TRP 99 22.088 10.676 -3.858 723 HB2 TRP 99 HB2 TRP 99 20.506 9.008 -5.827 724 HB3 TRP 99 HB3 TRP 99 21.759 8.448 -4.729 725 HD1 TRP 99 HD1 TRP 99 20.107 10.259 -2.273 726 HE1 TRP 99 HE1 TRP 99 18.137 9.037 -1.163 727 HE3 TRP 99 HE3 TRP 99 19.396 6.582 -5.744 728 HZ2 TRP 99 HZ2 TRP 99 16.451 6.776 -1.734 729 HZ3 TRP 99 HZ3 TRP 99 17.572 4.923 -5.469 730 HH2 TRP 99 HH2 TRP 99 16.093 4.997 -3.462 731 H GLN 100 H GLN 100 23.353 12.351 -4.882 732 HA GLN 100 HA GLN 100 23.898 12.292 -7.700 733 HB2 GLN 100 HB2 GLN 100 25.589 13.442 -5.455 734 HB3 GLN 100 HB3 GLN 100 25.749 13.793 -7.187 735 HG2 GLN 100 HG2 GLN 100 23.353 14.684 -7.113 736 HG3 GLN 100 HG3 GLN 100 23.403 14.495 -5.363 737 HE21 GLN 100 HE22 GLN 100 22.910 16.864 -5.492 738 HE22 GLN 100 HE21 GLN 100 24.312 17.957 -5.578 739 H LEU 101 H LEU 101 25.328 11.112 -8.886 740 HA LEU 101 HA LEU 101 27.513 9.542 -7.661 741 HB2 LEU 101 HB2 LEU 101 25.194 8.376 -9.275 742 HB3 LEU 101 HB3 LEU 101 26.727 7.540 -9.081 743 HG LEU 101 HG LEU 101 24.806 8.201 -6.807 744 HD11 LEU 101 HD11 LEU 101 24.392 5.844 -6.734 745 HD12 LEU 101 HD12 LEU 101 24.070 6.421 -8.376 746 HD13 LEU 101 HD13 LEU 101 25.581 5.529 -8.018 747 HD21 LEU 101 HD21 LEU 101 27.424 6.623 -6.803 748 HD22 LEU 101 HD22 LEU 101 27.143 8.165 -5.968 749 HD23 LEU 101 HD23 LEU 101 26.260 6.731 -5.456 750 H GLU 102 H GLU 102 28.867 8.504 -9.503 751 HA GLU 102 HA GLU 102 29.461 10.516 -11.517 752 HB2 GLU 102 HB2 GLU 102 31.268 9.075 -12.153 753 HB3 GLU 102 HB3 GLU 102 31.228 9.282 -10.402 754 HG2 GLU 102 HG2 GLU 102 30.049 7.024 -10.275 755 HG3 GLU 102 HG3 GLU 102 30.413 6.819 -11.994 756 H ASP 103 H ASP 103 30.005 9.454 -13.811 757 HA ASP 103 HA ASP 103 27.392 8.393 -14.824 758 HB2 ASP 103 HB2 ASP 103 27.701 10.737 -15.338 759 HB3 ASP 103 HB3 ASP 103 29.245 10.396 -16.124 760 HA PRO 104 HA PRO 104 30.367 5.128 -15.914 761 HB2 PRO 104 HB2 PRO 104 27.808 3.647 -16.363 762 HB3 PRO 104 HB3 PRO 104 29.305 3.117 -15.526 763 HG2 PRO 104 HG2 PRO 104 27.130 3.853 -14.100 764 HG3 PRO 104 HG3 PRO 104 28.756 4.440 -13.604 765 HD2 PRO 104 HD2 PRO 104 26.665 5.882 -15.289 766 HD3 PRO 104 HD3 PRO 104 27.571 6.467 -13.861 767 H ASP 105 H ASP 105 27.955 6.510 -17.953 768 HA ASP 105 HA ASP 105 28.075 4.958 -20.296 769 HB2 ASP 105 HB2 ASP 105 26.447 6.693 -19.854 770 HB3 ASP 105 HB3 ASP 105 27.708 7.931 -19.836 771 H GLY 106 H GLY 106 29.921 4.257 -21.203 772 HA2 GLY 106 HA2 GLY 106 31.763 4.392 -22.606 773 HA3 GLY 106 HA3 GLY 106 31.781 6.146 -22.437 774 H GLN 107 H GLN 107 31.754 4.402 -19.430 775 HA GLN 107 HA GLN 107 34.592 5.165 -18.946 776 HB2 GLN 107 HB2 GLN 107 32.533 4.227 -16.931 777 HB3 GLN 107 HB3 GLN 107 34.124 4.906 -16.593 778 HG2 GLN 107 HG2 GLN 107 31.771 6.344 -17.877 779 HG3 GLN 107 HG3 GLN 107 32.227 6.407 -16.184 780 HE21 GLN 107 HE22 GLN 107 31.898 8.725 -17.176 781 HE22 GLN 107 HE21 GLN 107 33.421 9.539 -17.571 782 H SER 108 H SER 108 33.205 2.560 -17.103 783 HA SER 108 HA SER 108 34.454 0.368 -18.549 784 HB2 SER 108 HB2 SER 108 36.052 -0.273 -16.881 785 HB3 SER 108 HB3 SER 108 36.385 1.418 -17.278 786 HG SER 108 HG SER 108 36.387 1.153 -15.035 787 H LEU 109 H LEU 109 34.006 -1.725 -17.433 788 HA LEU 109 HA LEU 109 31.332 -1.822 -16.369 789 HB2 LEU 109 HB2 LEU 109 33.505 -3.952 -16.199 790 HB3 LEU 109 HB3 LEU 109 31.765 -4.186 -16.040 791 HG LEU 109 HG LEU 109 33.283 -3.396 -18.559 792 HD11 LEU 109 HD11 LEU 109 33.441 -5.734 -17.843 793 HD12 LEU 109 HD12 LEU 109 31.668 -5.860 -17.824 794 HD13 LEU 109 HD13 LEU 109 32.520 -5.572 -19.359 795 HD21 LEU 109 HD21 LEU 109 31.093 -3.601 -19.737 796 HD22 LEU 109 HD22 LEU 109 30.277 -3.676 -18.158 797 HD23 LEU 109 HD23 LEU 109 31.158 -2.218 -18.638 798 H GLU 110 H GLU 110 34.495 -1.894 -14.791 799 HA GLU 110 HA GLU 110 33.593 -2.262 -12.103 800 HB2 GLU 110 HB2 GLU 110 35.947 -2.389 -12.867 801 HB3 GLU 110 HB3 GLU 110 35.969 -0.636 -13.111 802 HG2 GLU 110 HG2 GLU 110 35.579 -0.274 -10.703 803 HG3 GLU 110 HG3 GLU 110 35.422 -2.016 -10.448 804 H VAL 111 H VAL 111 33.773 0.768 -14.029 805 HA VAL 111 HA VAL 111 32.805 2.415 -11.823 806 HB VAL 111 HB VAL 111 32.990 2.881 -14.802 807 HG11 VAL 111 HG11 VAL 111 32.058 4.775 -12.619 808 HG12 VAL 111 HG12 VAL 111 32.585 5.301 -14.226 809 HG13 VAL 111 HG13 VAL 111 31.154 4.274 -14.064 810 HG21 VAL 111 HG21 VAL 111 34.806 4.408 -14.145 811 HG22 VAL 111 HG22 VAL 111 34.492 4.082 -12.425 812 HG23 VAL 111 HG23 VAL 111 35.126 2.805 -13.480 813 H PHE 112 H PHE 112 31.133 0.698 -14.540 814 HA PHE 112 HA PHE 112 28.486 1.616 -13.816 815 HB2 PHE 112 HB2 PHE 112 29.578 -0.791 -15.268 816 HB3 PHE 112 HB3 PHE 112 27.922 -0.796 -14.695 817 HD1 PHE 112 HD2 PHE 112 26.223 0.734 -15.563 818 HD2 PHE 112 HD1 PHE 112 30.209 0.627 -17.179 819 HE1 PHE 112 HE2 PHE 112 25.429 1.923 -17.601 820 HE2 PHE 112 HE1 PHE 112 29.428 1.852 -19.188 821 HZ PHE 112 HZ PHE 112 27.051 2.532 -19.376 822 H ARG 113 H ARG 113 30.318 -1.254 -12.693 823 HA ARG 113 HA ARG 113 28.382 -2.214 -10.804 824 HB2 ARG 113 HB2 ARG 113 31.414 -2.419 -10.887 825 HB3 ARG 113 HB3 ARG 113 30.408 -3.310 -9.741 826 HG2 ARG 113 HG2 ARG 113 29.302 -4.535 -11.486 827 HG3 ARG 113 HG3 ARG 113 30.017 -3.542 -12.751 828 HD2 ARG 113 HD2 ARG 113 32.279 -4.302 -11.994 829 HD3 ARG 113 HD3 ARG 113 31.477 -5.446 -10.898 830 HE ARG 113 HE ARG 113 30.331 -6.272 -13.124 831 HH11 ARG 113 HH11 ARG 113 33.752 -5.421 -12.837 832 HH12 ARG 113 HH12 ARG 113 34.191 -6.493 -14.131 833 HH21 ARG 113 HH21 ARG 113 30.959 -7.617 -14.577 834 HH22 ARG 113 HH22 ARG 113 32.626 -7.752 -15.133 835 H THR 114 H THR 114 30.999 0.153 -10.395 836 HA THR 114 HA THR 114 30.681 0.616 -7.586 837 HB THR 114 HB THR 114 31.711 2.467 -9.776 838 HG1 THR 114 HG1 THR 114 32.956 0.642 -9.579 839 HG21 THR 114 HG21 THR 114 32.961 3.561 -7.907 840 HG22 THR 114 HG22 THR 114 31.218 3.838 -7.852 841 HG23 THR 114 HG23 THR 114 31.962 2.648 -6.749 842 H VAL 115 H VAL 115 29.044 2.169 -10.375 843 HA VAL 115 HA VAL 115 27.332 3.823 -8.665 844 HB VAL 115 HB VAL 115 27.333 3.094 -11.601 845 HG11 VAL 115 HG11 VAL 115 25.282 4.895 -10.231 846 HG12 VAL 115 HG12 VAL 115 25.529 4.735 -11.980 847 HG13 VAL 115 HG13 VAL 115 24.937 3.356 -11.061 848 HG21 VAL 115 HG21 VAL 115 27.730 5.598 -11.749 849 HG22 VAL 115 HG22 VAL 115 27.795 5.639 -9.984 850 HG23 VAL 115 HG23 VAL 115 29.005 4.711 -10.893 851 H ARG 116 H ARG 116 26.766 0.741 -10.406 852 HA ARG 116 HA ARG 116 24.121 0.272 -9.725 853 HB2 ARG 116 HB2 ARG 116 25.513 -1.061 -11.314 854 HB3 ARG 116 HB3 ARG 116 26.391 -1.781 -9.958 855 HG2 ARG 116 HG2 ARG 116 24.331 -2.831 -9.140 856 HG3 ARG 116 HG3 ARG 116 23.407 -2.036 -10.419 857 HD2 ARG 116 HD2 ARG 116 23.735 -4.386 -10.957 858 HD3 ARG 116 HD3 ARG 116 24.473 -3.322 -12.133 859 HE ARG 116 HE ARG 116 26.350 -4.577 -11.845 860 HH11 ARG 116 HH11 ARG 116 25.002 -4.580 -8.576 861 HH12 ARG 116 HH12 ARG 116 26.189 -5.736 -8.061 862 HH21 ARG 116 HH21 ARG 116 27.645 -6.111 -11.149 863 HH22 ARG 116 HH22 ARG 116 27.670 -6.541 -9.453 864 H GLY 117 H GLY 117 26.912 -0.727 -7.694 865 HA2 GLY 117 HA2 GLY 117 25.402 -1.937 -5.606 866 HA3 GLY 117 HA3 GLY 117 27.027 -1.258 -5.446 867 H GLN 118 H GLN 118 26.332 1.513 -6.019 868 HA GLN 118 HA GLN 118 25.281 2.243 -3.385 869 HB2 GLN 118 HB2 GLN 118 26.221 3.914 -5.753 870 HB3 GLN 118 HB3 GLN 118 25.689 4.591 -4.200 871 HG2 GLN 118 HG2 GLN 118 27.460 3.403 -3.000 872 HG3 GLN 118 HG3 GLN 118 27.980 2.587 -4.479 873 HE21 GLN 118 HE22 GLN 118 29.109 3.809 -6.121 874 HE22 GLN 118 HE21 GLN 118 29.825 5.373 -5.699 875 H VAL 119 H VAL 119 24.051 2.645 -6.761 876 HA VAL 119 HA VAL 119 21.524 3.760 -6.045 877 HB VAL 119 HB VAL 119 22.104 1.822 -8.332 878 HG11 VAL 119 HG11 VAL 119 20.145 2.977 -9.392 879 HG12 VAL 119 HG12 VAL 119 19.698 2.006 -7.986 880 HG13 VAL 119 HG13 VAL 119 19.822 3.777 -7.838 881 HG21 VAL 119 HG21 VAL 119 23.509 3.882 -8.437 882 HG22 VAL 119 HG22 VAL 119 22.301 3.842 -9.712 883 HG23 VAL 119 HG23 VAL 119 22.044 4.874 -8.283 884 H LYS 120 H LYS 120 22.475 0.275 -6.146 885 HA LYS 120 HA LYS 120 20.003 -0.843 -5.293 886 HB2 LYS 120 HB2 LYS 120 21.999 -2.138 -6.091 887 HB3 LYS 120 HB3 LYS 120 22.844 -1.761 -4.600 888 HG2 LYS 120 HG2 LYS 120 21.029 -2.907 -3.301 889 HG3 LYS 120 HG3 LYS 120 20.244 -3.326 -4.821 890 HD2 LYS 120 HD2 LYS 120 22.408 -4.554 -5.459 891 HD3 LYS 120 HD3 LYS 120 22.988 -4.200 -3.820 892 HE2 LYS 120 HE2 LYS 120 20.830 -5.289 -2.959 893 HE3 LYS 120 HE3 LYS 120 20.532 -5.834 -4.612 894 HZ1 LYS 120 HZ1 LYS 120 22.921 -6.559 -2.960 895 HZ2 LYS 120 HZ2 LYS 120 21.684 -7.558 -3.308 896 HZ3 LYS 120 HZ3 LYS 120 22.686 -7.063 -4.500 897 H GLU 121 H GLU 121 22.804 0.072 -3.166 898 HA GLU 121 HA GLU 121 21.344 -0.541 -0.783 899 HB2 GLU 121 HB2 GLU 121 23.184 0.071 0.406 900 HB3 GLU 121 HB3 GLU 121 23.919 -0.278 -1.165 901 HG2 GLU 121 HG2 GLU 121 23.995 2.137 -1.658 902 HG3 GLU 121 HG3 GLU 121 23.184 2.479 -0.132 903 H ARG 122 H ARG 122 21.513 2.570 -2.505 904 HA ARG 122 HA ARG 122 20.079 3.989 -0.430 905 HB2 ARG 122 HB2 ARG 122 20.168 4.454 -3.447 906 HB3 ARG 122 HB3 ARG 122 19.523 5.581 -2.264 907 HG2 ARG 122 HG2 ARG 122 22.428 4.729 -2.191 908 HG3 ARG 122 HG3 ARG 122 21.851 6.012 -3.236 909 HD2 ARG 122 HD2 ARG 122 22.705 7.106 -1.357 910 HD3 ARG 122 HD3 ARG 122 20.955 7.212 -1.211 911 HE ARG 122 HE ARG 122 21.095 6.061 0.785 912 HH11 ARG 122 HH11 ARG 122 24.192 5.552 -0.811 913 HH12 ARG 122 HH12 ARG 122 24.724 4.436 0.445 914 HH21 ARG 122 HH21 ARG 122 22.007 4.829 2.450 915 HH22 ARG 122 HH22 ARG 122 23.628 4.227 2.258 916 H VAL 123 H VAL 123 18.828 2.261 -3.362 917 HA VAL 123 HA VAL 123 16.086 2.569 -2.627 918 HB VAL 123 HB VAL 123 17.565 0.522 -4.316 919 HG11 VAL 123 HG11 VAL 123 15.673 -0.732 -3.388 920 HG12 VAL 123 HG12 VAL 123 14.569 0.586 -3.859 921 HG13 VAL 123 HG13 VAL 123 15.459 -0.366 -5.086 922 HG21 VAL 123 HG21 VAL 123 17.349 2.723 -5.262 923 HG22 VAL 123 HG22 VAL 123 16.296 1.603 -6.133 924 HG23 VAL 123 HG23 VAL 123 15.589 2.736 -4.958 925 H GLU 124 H GLU 124 18.279 -0.182 -1.689 926 HA GLU 124 HA GLU 124 16.200 -1.519 -0.218 927 HB2 GLU 124 HB2 GLU 124 19.186 -1.529 0.328 928 HB3 GLU 124 HB3 GLU 124 17.970 -2.641 1.011 929 HG2 GLU 124 HG2 GLU 124 17.387 -3.413 -1.225 930 HG3 GLU 124 HG3 GLU 124 18.703 -2.456 -1.916 931 H ASN 125 H ASN 125 18.337 1.115 0.783 932 HA ASN 125 HA ASN 125 17.340 0.985 3.459 933 HB2 ASN 125 HB2 ASN 125 19.126 2.225 3.874 934 HB3 ASN 125 HB3 ASN 125 19.453 2.294 2.154 935 HD21 ASN 125 HD22 ASN 125 18.358 4.068 0.914 936 HD22 ASN 125 HD21 ASN 125 18.237 5.619 1.751 937 H LEU 126 H LEU 126 16.149 2.551 0.606 938 HA LEU 126 HA LEU 126 14.252 4.278 1.998 939 HB2 LEU 126 HB2 LEU 126 15.216 4.966 -0.119 940 HB3 LEU 126 HB3 LEU 126 14.686 3.485 -0.910 941 HG LEU 126 HG LEU 126 12.325 4.147 -0.664 942 HD11 LEU 126 HD11 LEU 126 12.484 5.581 1.377 943 HD12 LEU 126 HD12 LEU 126 13.437 6.763 0.450 944 HD13 LEU 126 HD13 LEU 126 11.744 6.440 0.029 945 HD21 LEU 126 HD21 LEU 126 14.145 6.215 -1.931 946 HD22 LEU 126 HD22 LEU 126 13.539 4.725 -2.690 947 HD23 LEU 126 HD23 LEU 126 12.407 6.029 -2.274 948 H ILE 127 H ILE 127 13.931 1.186 0.100 949 HA ILE 127 HA ILE 127 11.082 1.123 0.530 950 HB ILE 127 HB ILE 127 11.141 -1.227 -0.095 951 HG12 ILE 127 HG12 ILE 127 14.147 -0.954 0.116 952 HG13 ILE 127 HG13 ILE 127 13.084 -2.103 0.921 953 HG21 ILE 127 HG21 ILE 127 11.802 -0.846 -2.400 954 HG22 ILE 127 HG22 ILE 127 11.188 0.681 -1.758 955 HG23 ILE 127 HG23 ILE 127 12.941 0.441 -1.925 956 HD11 ILE 127 HD11 ILE 127 12.629 -3.149 -1.314 957 HD12 ILE 127 HD12 ILE 127 13.847 -2.051 -2.021 958 HD13 ILE 127 HD13 ILE 127 14.325 -3.238 -0.798 959 H ALA 128 H ALA 128 13.708 0.084 2.639 960 HA ALA 128 HA ALA 128 12.026 -1.403 4.382 961 HB1 ALA 128 HB1 ALA 128 14.485 -1.634 4.301 962 HB2 ALA 128 HB2 ALA 128 14.675 0.026 4.924 963 HB3 ALA 128 HB3 ALA 128 13.950 -1.236 5.941 964 H LYS 129 H LYS 129 12.290 2.070 3.984 965 HA LYS 129 HA LYS 129 10.872 2.515 6.586 966 HB2 LYS 129 HB2 LYS 129 11.408 4.855 6.368 967 HB3 LYS 129 HB3 LYS 129 12.836 3.812 6.433 968 HG2 LYS 129 HG2 LYS 129 13.226 4.126 4.048 969 HG3 LYS 129 HG3 LYS 129 11.715 5.029 3.876 970 HD2 LYS 129 HD2 LYS 129 13.536 6.590 3.887 971 HD3 LYS 129 HD3 LYS 129 12.640 6.786 5.405 972 HE2 LYS 129 HE2 LYS 129 14.357 5.384 6.574 973 HE3 LYS 129 HE3 LYS 129 15.229 5.187 5.052 974 HZ1 LYS 129 HZ1 LYS 129 14.772 7.788 6.448 975 HZ2 LYS 129 HZ2 LYS 129 16.187 6.979 6.398 976 HZ3 LYS 129 HZ3 LYS 129 15.580 7.626 5.031 977 H ILE 130 H ILE 130 10.369 2.986 3.115 978 HA ILE 130 HA ILE 130 7.644 4.000 3.761 979 HB ILE 130 HB ILE 130 7.421 4.698 1.403 980 HG12 ILE 130 HG12 ILE 130 9.469 5.187 0.137 981 HG13 ILE 130 HG13 ILE 130 10.408 4.226 1.267 982 HG21 ILE 130 HG21 ILE 130 9.669 6.031 2.938 983 HG22 ILE 130 HG22 ILE 130 8.523 6.765 1.781 984 HG23 ILE 130 HG23 ILE 130 7.937 6.183 3.328 985 HD11 ILE 130 HD11 ILE 130 9.128 2.207 0.576 986 HD12 ILE 130 HD12 ILE 130 8.165 3.221 -0.527 987 HD13 ILE 130 HD13 ILE 130 9.908 3.002 -0.803 988 H SER 131 H SER 131 8.668 0.939 3.406 989 HA SER 131 HA SER 131 6.687 -0.247 1.756 990 HB2 SER 131 HB2 SER 131 6.964 -2.224 3.226 991 HB3 SER 131 HB3 SER 131 8.497 -1.544 2.659 992 HG SER 131 HG SER 131 7.324 -0.833 5.159 Start of MODEL 8 1 H MET 1 H1 MET 1 2.382 0.273 1.834 2 HA MET 1 HA MET 1 3.173 -0.120 -0.264 3 HB2 MET 1 HB2 MET 1 1.449 -1.598 -1.100 4 HB3 MET 1 HB3 MET 1 0.272 -0.287 -1.195 5 HG2 MET 1 HG2 MET 1 1.534 0.815 -2.949 6 HG3 MET 1 HG3 MET 1 2.872 -0.315 -2.774 7 HE1 MET 1 HE1 MET 1 1.750 -3.489 -4.600 8 HE2 MET 1 HE2 MET 1 3.114 -2.529 -3.981 9 HE3 MET 1 HE3 MET 1 1.897 -3.185 -2.855 10 H LYS 2 H LYS 2 4.179 1.636 -0.893 11 HA LYS 2 HA LYS 2 2.641 4.072 -1.708 12 HB2 LYS 2 HB2 LYS 2 5.167 3.955 -0.005 13 HB3 LYS 2 HB3 LYS 2 4.652 5.403 -0.862 14 HG2 LYS 2 HG2 LYS 2 2.474 5.365 0.311 15 HG3 LYS 2 HG3 LYS 2 2.988 3.935 1.226 16 HD2 LYS 2 HD2 LYS 2 4.796 5.207 2.280 17 HD3 LYS 2 HD3 LYS 2 4.377 6.645 1.323 18 HE2 LYS 2 HE2 LYS 2 2.144 6.717 2.344 19 HE3 LYS 2 HE3 LYS 2 2.454 5.222 3.234 20 HZ1 LYS 2 HZ1 LYS 2 2.791 7.266 4.584 21 HZ2 LYS 2 HZ2 LYS 2 4.157 6.375 4.511 22 HZ3 LYS 2 HZ3 LYS 2 4.020 7.736 3.605 23 H LYS 3 H LYS 3 3.962 5.456 -3.179 24 HA LYS 3 HA LYS 3 5.290 3.689 -5.214 25 HB2 LYS 3 HB2 LYS 3 3.763 6.280 -5.659 26 HB3 LYS 3 HB3 LYS 3 4.560 5.356 -6.900 27 HG2 LYS 3 HG2 LYS 3 2.402 4.672 -7.179 28 HG3 LYS 3 HG3 LYS 3 3.087 3.373 -6.220 29 HD2 LYS 3 HD2 LYS 3 0.818 3.885 -5.479 30 HD3 LYS 3 HD3 LYS 3 1.958 4.242 -4.194 31 HE2 LYS 3 HE2 LYS 3 1.936 6.680 -5.127 32 HE3 LYS 3 HE3 LYS 3 0.496 6.181 -6.023 33 HZ1 LYS 3 HZ1 LYS 3 -0.419 5.528 -3.729 34 HZ2 LYS 3 HZ2 LYS 3 0.917 6.288 -3.083 35 HZ3 LYS 3 HZ3 LYS 3 -0.182 7.141 -3.936 36 H VAL 4 H VAL 4 7.142 4.268 -6.194 37 HA VAL 4 HA VAL 4 8.565 6.701 -5.198 38 HB VAL 4 HB VAL 4 10.047 4.102 -5.567 39 HG11 VAL 4 HG11 VAL 4 10.879 6.746 -4.341 40 HG12 VAL 4 HG12 VAL 4 11.850 5.261 -4.409 41 HG13 VAL 4 HG13 VAL 4 11.433 6.083 -5.897 42 HG21 VAL 4 HG21 VAL 4 10.287 4.039 -3.107 43 HG22 VAL 4 HG22 VAL 4 9.068 5.326 -2.972 44 HG23 VAL 4 HG23 VAL 4 8.631 3.743 -3.642 45 H MET 5 H MET 5 9.780 7.818 -6.680 46 HA MET 5 HA MET 5 9.950 6.737 -9.444 47 HB2 MET 5 HB2 MET 5 8.008 8.056 -9.581 48 HB3 MET 5 HB3 MET 5 8.707 9.342 -8.596 49 HG2 MET 5 HG2 MET 5 8.577 10.029 -10.906 50 HG3 MET 5 HG3 MET 5 10.247 9.948 -10.375 51 HE1 MET 5 HE1 MET 5 7.463 8.291 -12.668 52 HE2 MET 5 HE2 MET 5 8.270 9.735 -13.317 53 HE3 MET 5 HE3 MET 5 8.505 8.177 -14.107 54 H PHE 6 H PHE 6 11.759 7.093 -10.433 55 HA PHE 6 HA PHE 6 13.938 8.575 -8.987 56 HB2 PHE 6 HB2 PHE 6 14.207 6.267 -10.931 57 HB3 PHE 6 HB3 PHE 6 15.453 6.945 -9.900 58 HD1 PHE 6 HD2 PHE 6 15.250 6.646 -7.346 59 HD2 PHE 6 HD1 PHE 6 12.822 4.506 -10.191 60 HE1 PHE 6 HE2 PHE 6 14.596 5.034 -5.573 61 HE2 PHE 6 HE1 PHE 6 12.169 2.910 -8.421 62 HZ PHE 6 HZ PHE 6 12.979 3.212 -6.091 63 H VAL 7 H VAL 7 14.339 10.505 -9.874 64 HA VAL 7 HA VAL 7 14.291 10.971 -12.795 65 HB VAL 7 HB VAL 7 14.121 12.722 -10.394 66 HG11 VAL 7 HG11 VAL 7 15.584 13.799 -12.843 67 HG12 VAL 7 HG12 VAL 7 14.947 14.741 -11.493 68 HG13 VAL 7 HG13 VAL 7 16.262 13.622 -11.200 69 HG21 VAL 7 HG21 VAL 7 12.720 14.026 -11.905 70 HG22 VAL 7 HG22 VAL 7 13.231 13.047 -13.303 71 HG23 VAL 7 HG23 VAL 7 12.263 12.329 -11.968 72 H CYS 8 H CYS 8 16.034 11.494 -14.006 73 HA CYS 8 HA CYS 8 18.711 11.892 -12.825 74 HB2 CYS 8 HB2 CYS 8 18.474 9.451 -13.217 75 HB3 CYS 8 HB3 CYS 8 18.120 9.732 -14.921 76 HG CYS 8 HG CYS 8 20.869 10.365 -13.114 77 H LYS 9 H LYS 9 20.195 12.492 -15.083 78 HA LYS 9 HA LYS 9 18.776 14.714 -16.332 79 HB2 LYS 9 HB2 LYS 9 21.345 13.353 -17.264 80 HB3 LYS 9 HB3 LYS 9 20.652 14.840 -17.926 81 HG2 LYS 9 HG2 LYS 9 20.828 15.807 -15.539 82 HG3 LYS 9 HG3 LYS 9 21.849 14.411 -15.171 83 HD2 LYS 9 HD2 LYS 9 22.324 16.600 -17.236 84 HD3 LYS 9 HD3 LYS 9 23.266 16.273 -15.781 85 HE2 LYS 9 HE2 LYS 9 24.015 14.087 -16.789 86 HE3 LYS 9 HE3 LYS 9 23.102 14.456 -18.258 87 HZ1 LYS 9 HZ1 LYS 9 24.516 16.442 -18.561 88 HZ2 LYS 9 HZ2 LYS 9 25.362 16.108 -17.203 89 HZ3 LYS 9 HZ3 LYS 9 25.448 15.109 -18.486 90 H ARG 10 H ARG 10 19.914 11.741 -17.888 91 HA ARG 10 HA ARG 10 17.785 12.037 -19.978 92 HB2 ARG 10 HB2 ARG 10 19.261 11.297 -21.623 93 HB3 ARG 10 HB3 ARG 10 20.058 12.559 -20.725 94 HG2 ARG 10 HG2 ARG 10 20.637 9.579 -20.457 95 HG3 ARG 10 HG3 ARG 10 21.531 10.730 -21.437 96 HD2 ARG 10 HD2 ARG 10 22.164 11.986 -19.348 97 HD3 ARG 10 HD3 ARG 10 21.344 10.704 -18.417 98 HE ARG 10 HE ARG 10 23.316 9.634 -18.394 99 HH11 ARG 10 HH21 ARG 10 23.467 11.356 -21.487 100 HH12 ARG 10 HH22 ARG 10 24.911 10.494 -21.936 101 HH21 ARG 10 HH12 ARG 10 25.172 8.687 -19.061 102 HH22 ARG 10 HH11 ARG 10 25.766 8.989 -20.693 103 H ASN 11 H ASN 11 18.071 10.216 -17.448 104 HA ASN 11 HA ASN 11 17.453 8.138 -16.727 105 HB2 ASN 11 HB2 ASN 11 15.430 9.353 -17.316 106 HB3 ASN 11 HB3 ASN 11 15.404 8.639 -18.910 107 HD21 ASN 11 HD22 ASN 11 15.815 7.039 -15.571 108 HD22 ASN 11 HD21 ASN 11 14.458 5.969 -15.928 109 H SER 12 H SER 12 19.639 7.934 -18.559 110 HA SER 12 HA SER 12 19.164 5.608 -20.250 111 HB2 SER 12 HB2 SER 12 21.631 5.916 -20.710 112 HB3 SER 12 HB3 SER 12 20.615 7.336 -21.056 113 HG SER 12 HG SER 12 22.597 7.685 -19.704 114 H CYS 13 H CYS 13 20.944 6.360 -17.298 115 HA CYS 13 HA CYS 13 21.014 3.489 -16.462 116 HB2 CYS 13 HB2 CYS 13 23.151 4.299 -17.590 117 HB3 CYS 13 HB3 CYS 13 23.381 5.439 -16.264 118 HG CYS 13 HG CYS 13 24.927 3.232 -16.073 119 H ARG 14 H ARG 14 22.472 4.260 -13.978 120 HA ARG 14 HA ARG 14 21.888 4.682 -11.775 121 HB2 ARG 14 HB2 ARG 14 21.386 7.390 -13.114 122 HB3 ARG 14 HB3 ARG 14 21.434 7.162 -11.354 123 HG2 ARG 14 HG2 ARG 14 23.722 6.297 -11.505 124 HG3 ARG 14 HG3 ARG 14 23.733 6.532 -13.257 125 HD2 ARG 14 HD2 ARG 14 23.243 8.792 -11.269 126 HD3 ARG 14 HD3 ARG 14 24.855 8.314 -11.804 127 HE ARG 14 HE ARG 14 23.305 8.777 -14.151 128 HH11 ARG 14 HH21 ARG 14 24.785 10.681 -11.579 129 HH12 ARG 14 HH22 ARG 14 24.549 12.175 -12.453 130 HH21 ARG 14 HH11 ARG 14 23.581 10.623 -15.352 131 HH22 ARG 14 HH12 ARG 14 23.933 12.130 -14.542 132 H SER 15 H SER 15 19.326 6.811 -12.750 133 HA SER 15 HA SER 15 17.227 5.894 -11.145 134 HB2 SER 15 HB2 SER 15 15.766 6.995 -12.840 135 HB3 SER 15 HB3 SER 15 17.178 7.958 -12.470 136 HG SER 15 HG SER 15 18.183 7.016 -14.463 137 H GLN 16 H GLN 16 18.077 4.579 -14.376 138 HA GLN 16 HA GLN 16 15.898 2.685 -14.486 139 HB2 GLN 16 HB2 GLN 16 18.658 2.665 -15.790 140 HB3 GLN 16 HB3 GLN 16 17.369 1.546 -16.216 141 HG2 GLN 16 HG2 GLN 16 17.022 4.576 -16.407 142 HG3 GLN 16 HG3 GLN 16 17.700 3.610 -17.697 143 HE21 GLN 16 HE22 GLN 16 15.621 4.960 -18.452 144 HE22 GLN 16 HE21 GLN 16 14.146 4.004 -18.529 145 H MET 17 H MET 17 19.226 2.355 -13.118 146 HA MET 17 HA MET 17 18.919 -0.435 -12.331 147 HB2 MET 17 HB2 MET 17 20.726 1.771 -11.233 148 HB3 MET 17 HB3 MET 17 20.793 0.081 -10.751 149 HG2 MET 17 HG2 MET 17 21.384 -0.590 -13.045 150 HG3 MET 17 HG3 MET 17 21.341 1.099 -13.563 151 HE1 MET 17 HE1 MET 17 23.693 -1.350 -13.434 152 HE2 MET 17 HE2 MET 17 23.868 0.111 -14.437 153 HE3 MET 17 HE3 MET 17 25.141 -0.328 -13.262 154 H ALA 18 H ALA 18 18.117 2.683 -10.749 155 HA ALA 18 HA ALA 18 17.408 1.559 -8.209 156 HB1 ALA 18 HB1 ALA 18 17.843 4.016 -8.770 157 HB2 ALA 18 HB2 ALA 18 16.234 4.060 -9.506 158 HB3 ALA 18 HB3 ALA 18 16.417 3.707 -7.772 159 H GLU 19 H GLU 19 15.336 2.257 -11.062 160 HA GLU 19 HA GLU 19 12.978 0.967 -10.005 161 HB2 GLU 19 HB2 GLU 19 13.050 2.519 -11.926 162 HB3 GLU 19 HB3 GLU 19 13.930 1.311 -12.878 163 HG2 GLU 19 HG2 GLU 19 11.993 -0.207 -12.760 164 HG3 GLU 19 HG3 GLU 19 11.140 0.936 -11.711 165 H GLY 20 H GLY 20 15.762 -0.295 -11.853 166 HA2 GLY 20 HA2 GLY 20 15.085 -2.968 -12.209 167 HA3 GLY 20 HA3 GLY 20 16.717 -2.362 -11.917 168 H PHE 21 H PHE 21 16.711 -1.633 -9.233 169 HA PHE 21 HA PHE 21 16.416 -4.259 -7.902 170 HB2 PHE 21 HB2 PHE 21 17.366 -1.505 -6.969 171 HB3 PHE 21 HB3 PHE 21 17.272 -2.904 -5.902 172 HD1 PHE 21 HD2 PHE 21 18.396 -5.121 -6.762 173 HD2 PHE 21 HD1 PHE 21 19.428 -1.149 -8.094 174 HE1 PHE 21 HE2 PHE 21 20.641 -5.929 -7.430 175 HE2 PHE 21 HE1 PHE 21 21.654 -1.953 -8.773 176 HZ PHE 21 HZ PHE 21 22.271 -4.371 -8.446 177 H ALA 22 H ALA 22 14.716 -1.098 -7.653 178 HA ALA 22 HA ALA 22 13.160 -1.942 -5.406 179 HB1 ALA 22 HB1 ALA 22 11.829 0.020 -5.852 180 HB2 ALA 22 HB2 ALA 22 13.530 0.417 -6.135 181 HB3 ALA 22 HB3 ALA 22 12.482 0.129 -7.526 182 H LYS 23 H LYS 23 12.530 -2.462 -8.904 183 HA LYS 23 HA LYS 23 9.829 -3.396 -8.557 184 HB2 LYS 23 HB2 LYS 23 9.986 -4.221 -10.788 185 HB3 LYS 23 HB3 LYS 23 10.883 -2.698 -10.703 186 HG2 LYS 23 HG2 LYS 23 12.957 -4.170 -10.358 187 HG3 LYS 23 HG3 LYS 23 11.979 -5.530 -10.893 188 HD2 LYS 23 HD2 LYS 23 12.574 -3.006 -12.520 189 HD3 LYS 23 HD3 LYS 23 13.413 -4.560 -12.660 190 HE2 LYS 23 HE2 LYS 23 11.212 -5.644 -13.243 191 HE3 LYS 23 HE3 LYS 23 10.471 -4.039 -13.280 192 HZ1 LYS 23 HZ1 LYS 23 12.739 -4.943 -15.031 193 HZ2 LYS 23 HZ2 LYS 23 11.185 -4.752 -15.509 194 HZ3 LYS 23 HZ3 LYS 23 12.064 -3.433 -15.079 195 H THR 24 H THR 24 12.880 -5.052 -8.136 196 HA THR 24 HA THR 24 11.594 -7.683 -7.693 197 HB THR 24 HB THR 24 13.813 -8.575 -7.453 198 HG1 THR 24 HG1 THR 24 15.601 -7.234 -7.565 199 HG21 THR 24 HG21 THR 24 14.017 -6.584 -9.737 200 HG22 THR 24 HG22 THR 24 14.634 -8.244 -9.653 201 HG23 THR 24 HG23 THR 24 12.894 -7.974 -9.805 202 H LEU 25 H LEU 25 13.711 -5.546 -5.721 203 HA LEU 25 HA LEU 25 13.301 -7.075 -3.308 204 HB2 LEU 25 HB2 LEU 25 14.384 -4.235 -3.613 205 HB3 LEU 25 HB3 LEU 25 14.648 -5.290 -2.237 206 HG LEU 25 HG LEU 25 15.713 -5.745 -5.071 207 HD11 LEU 25 HD11 LEU 25 17.220 -5.203 -2.521 208 HD12 LEU 25 HD12 LEU 25 17.832 -5.180 -4.187 209 HD13 LEU 25 HD13 LEU 25 16.726 -3.901 -3.633 210 HD21 LEU 25 HD21 LEU 25 16.118 -7.384 -2.532 211 HD22 LEU 25 HD22 LEU 25 15.318 -7.923 -4.028 212 HD23 LEU 25 HD23 LEU 25 17.052 -7.573 -4.035 213 H GLY 26 H GLY 26 11.551 -4.395 -4.678 214 HA2 GLY 26 HA2 GLY 26 9.907 -3.957 -2.243 215 HA3 GLY 26 HA3 GLY 26 9.994 -2.974 -3.707 216 H ALA 27 H ALA 27 9.721 -6.221 -4.679 217 HA ALA 27 HA ALA 27 7.257 -5.845 -5.947 218 HB1 ALA 27 HB1 ALA 27 7.311 -8.290 -6.314 219 HB2 ALA 27 HB2 ALA 27 8.906 -7.572 -6.564 220 HB3 ALA 27 HB3 ALA 27 8.564 -8.462 -5.068 221 H GLY 28 H GLY 28 5.310 -5.434 -5.070 222 HA2 GLY 28 HA2 GLY 28 3.292 -6.034 -4.025 223 HA3 GLY 28 HA3 GLY 28 4.121 -7.279 -3.083 224 H LYS 29 H LYS 29 6.174 -4.955 -2.504 225 HA LYS 29 HA LYS 29 4.807 -3.711 -0.160 226 HB2 LYS 29 HB2 LYS 29 7.687 -3.745 -1.159 227 HB3 LYS 29 HB3 LYS 29 7.146 -2.762 0.189 228 HG2 LYS 29 HG2 LYS 29 6.973 -4.500 1.630 229 HG3 LYS 29 HG3 LYS 29 6.341 -5.603 0.404 230 HD2 LYS 29 HD2 LYS 29 8.411 -6.496 1.077 231 HD3 LYS 29 HD3 LYS 29 8.661 -5.832 -0.542 232 HE2 LYS 29 HE2 LYS 29 9.714 -3.798 0.483 233 HE3 LYS 29 HE3 LYS 29 9.426 -4.471 2.088 234 HZ1 LYS 29 HZ1 LYS 29 11.190 -5.716 0.004 235 HZ2 LYS 29 HZ2 LYS 29 11.696 -4.987 1.385 236 HZ3 LYS 29 HZ3 LYS 29 10.859 -6.383 1.467 237 H ILE 30 H ILE 30 6.314 -2.807 -3.263 238 HA ILE 30 HA ILE 30 4.944 -0.176 -3.152 239 HB ILE 30 HB ILE 30 7.007 0.996 -3.809 240 HG12 ILE 30 HG12 ILE 30 9.214 0.108 -3.511 241 HG13 ILE 30 HG13 ILE 30 8.591 -1.486 -3.096 242 HG21 ILE 30 HG21 ILE 30 6.370 0.865 -1.412 243 HG22 ILE 30 HG22 ILE 30 7.447 -0.547 -1.221 244 HG23 ILE 30 HG23 ILE 30 8.114 1.019 -1.677 245 HD11 ILE 30 HD11 ILE 30 8.052 -1.952 -5.380 246 HD12 ILE 30 HD12 ILE 30 8.135 -0.223 -5.822 247 HD13 ILE 30 HD13 ILE 30 9.609 -1.110 -5.430 248 H ALA 31 H ALA 31 5.301 1.095 -5.203 249 HA ALA 31 HA ALA 31 5.611 -0.601 -7.623 250 HB1 ALA 31 HB1 ALA 31 3.191 -0.246 -7.295 251 HB2 ALA 31 HB2 ALA 31 3.450 1.508 -7.258 252 HB3 ALA 31 HB3 ALA 31 3.786 0.595 -8.741 253 H VAL 32 H VAL 32 6.875 0.392 -9.271 254 HA VAL 32 HA VAL 32 8.037 3.050 -8.622 255 HB VAL 32 HB VAL 32 10.192 1.814 -9.429 256 HG11 VAL 32 HG11 VAL 32 10.759 1.530 -7.030 257 HG12 VAL 32 HG12 VAL 32 9.922 3.022 -7.389 258 HG13 VAL 32 HG13 VAL 32 9.036 1.688 -6.622 259 HG21 VAL 32 HG21 VAL 32 8.868 -0.543 -8.069 260 HG22 VAL 32 HG22 VAL 32 9.163 -0.405 -9.818 261 HG23 VAL 32 HG23 VAL 32 10.523 -0.414 -8.692 262 H THR 33 H THR 33 9.045 4.169 -10.111 263 HA THR 33 HA THR 33 9.001 3.370 -12.980 264 HB THR 33 HB THR 33 7.929 6.041 -12.005 265 HG1 THR 33 HG1 THR 33 5.848 5.227 -12.387 266 HG21 THR 33 HG21 THR 33 7.548 4.556 -14.654 267 HG22 THR 33 HG22 THR 33 6.883 6.152 -14.232 268 HG23 THR 33 HG23 THR 33 8.630 5.946 -14.404 269 H SER 34 H SER 34 10.670 4.524 -14.214 270 HA SER 34 HA SER 34 12.184 6.601 -12.708 271 HB2 SER 34 HB2 SER 34 14.231 5.946 -13.695 272 HB3 SER 34 HB3 SER 34 13.552 4.554 -12.849 273 HG SER 34 HG SER 34 12.937 3.683 -14.796 274 H CYS 35 H CYS 35 13.072 8.307 -13.904 275 HA CYS 35 HA CYS 35 12.382 8.670 -16.708 276 HB2 CYS 35 HB2 CYS 35 10.890 10.511 -16.437 277 HB3 CYS 35 HB3 CYS 35 10.271 9.190 -15.427 278 HG CYS 35 HG CYS 35 11.264 10.046 -13.167 279 H GLY 36 H GLY 36 12.971 11.145 -17.266 280 HA2 GLY 36 HA2 GLY 36 14.948 12.256 -15.380 281 HA3 GLY 36 HA3 GLY 36 15.537 11.914 -17.023 282 H LEU 37 H LEU 37 15.666 14.499 -16.018 283 HA LEU 37 HA LEU 37 13.296 16.000 -16.783 284 HB2 LEU 37 HB2 LEU 37 14.704 18.015 -16.731 285 HB3 LEU 37 HB3 LEU 37 14.539 17.135 -15.229 286 HG LEU 37 HG LEU 37 16.935 16.417 -16.915 287 HD11 LEU 37 HD11 LEU 37 18.244 18.336 -16.068 288 HD12 LEU 37 HD12 LEU 37 16.934 18.874 -17.132 289 HD13 LEU 37 HD13 LEU 37 16.770 19.041 -15.371 290 HD21 LEU 37 HD21 LEU 37 17.986 16.248 -14.712 291 HD22 LEU 37 HD22 LEU 37 16.594 17.064 -13.958 292 HD23 LEU 37 HD23 LEU 37 16.408 15.445 -14.629 293 H GLU 38 H GLU 38 15.613 14.464 -18.585 294 HA GLU 38 HA GLU 38 14.309 15.312 -21.064 295 HB2 GLU 38 HB2 GLU 38 16.365 15.565 -22.335 296 HB3 GLU 38 HB3 GLU 38 16.228 16.796 -21.086 297 HG2 GLU 38 HG2 GLU 38 17.873 15.652 -19.693 298 HG3 GLU 38 HG3 GLU 38 17.952 14.295 -20.834 299 H SER 39 H SER 39 15.156 13.703 -22.887 300 HA SER 39 HA SER 39 15.507 10.972 -21.689 301 HB2 SER 39 HB2 SER 39 13.109 11.430 -22.161 302 HB3 SER 39 HB3 SER 39 13.536 11.678 -23.874 303 HG SER 39 HG SER 39 12.992 9.527 -23.679 304 H SER 40 H SER 40 16.733 9.616 -22.820 305 HA SER 40 HA SER 40 17.502 10.248 -25.628 306 HB2 SER 40 HB2 SER 40 19.348 11.049 -24.256 307 HB3 SER 40 HB3 SER 40 19.514 9.459 -23.502 308 HG SER 40 HG SER 40 19.914 10.174 -26.240 309 H ARG 41 H ARG 41 18.900 7.573 -23.854 310 HA ARG 41 HA ARG 41 16.856 5.635 -24.499 311 HB2 ARG 41 HB2 ARG 41 18.071 4.222 -25.985 312 HB3 ARG 41 HB3 ARG 41 18.035 5.813 -26.705 313 HG2 ARG 41 HG2 ARG 41 20.425 4.495 -25.330 314 HG3 ARG 41 HG3 ARG 41 20.170 4.714 -27.058 315 HD2 ARG 41 HD2 ARG 41 20.209 7.206 -26.695 316 HD3 ARG 41 HD3 ARG 41 20.675 6.893 -25.003 317 HE ARG 41 HE ARG 41 22.446 5.474 -26.725 318 HH11 ARG 41 HH11 ARG 41 21.788 8.797 -25.804 319 HH12 ARG 41 HH12 ARG 41 23.426 9.305 -26.120 320 HH21 ARG 41 HH21 ARG 41 24.513 6.186 -27.114 321 HH22 ARG 41 HH22 ARG 41 24.939 7.845 -26.836 322 H VAL 42 H VAL 42 17.218 3.599 -23.412 323 HA VAL 42 HA VAL 42 18.890 3.699 -21.074 324 HB VAL 42 HB VAL 42 16.979 1.833 -22.191 325 HG11 VAL 42 HG11 VAL 42 17.777 -0.220 -21.178 326 HG12 VAL 42 HG12 VAL 42 18.793 0.242 -22.553 327 HG13 VAL 42 HG13 VAL 42 19.372 0.498 -20.885 328 HG21 VAL 42 HG21 VAL 42 16.646 1.372 -19.817 329 HG22 VAL 42 HG22 VAL 42 18.229 2.073 -19.434 330 HG23 VAL 42 HG23 VAL 42 16.905 3.124 -20.028 331 H HIS 43 H HIS 43 20.869 2.977 -20.582 332 HA HIS 43 HA HIS 43 22.725 2.703 -22.842 333 HB2 HIS 43 HB2 HIS 43 23.154 4.042 -20.714 334 HB3 HIS 43 HB3 HIS 43 23.345 2.502 -19.868 335 HD2 HIS 43 HD2 HIS 43 25.101 4.914 -22.211 336 HE1 HIS 43 HE1 HIS 43 27.780 1.646 -21.731 337 HE2 HIS 43 HE2 HIS 43 27.508 3.993 -22.684 338 HA PRO 44 HA PRO 44 22.044 -1.581 -22.853 339 HB2 PRO 44 HB2 PRO 44 24.022 -2.568 -24.491 340 HB3 PRO 44 HB3 PRO 44 22.692 -1.515 -25.075 341 HG2 PRO 44 HG2 PRO 44 25.501 -0.662 -24.281 342 HG3 PRO 44 HG3 PRO 44 24.609 -0.271 -25.789 343 HD2 PRO 44 HD2 PRO 44 24.658 1.435 -23.679 344 HD3 PRO 44 HD3 PRO 44 23.173 1.228 -24.668 345 H THR 45 H THR 45 25.256 -0.462 -21.793 346 HA THR 45 HA THR 45 25.997 -2.936 -20.482 347 HB THR 45 HB THR 45 26.994 -0.123 -19.999 348 HG1 THR 45 HG1 THR 45 28.662 -0.849 -21.419 349 HG21 THR 45 HG21 THR 45 27.704 -1.547 -18.161 350 HG22 THR 45 HG22 THR 45 28.179 -2.839 -19.292 351 HG23 THR 45 HG23 THR 45 29.073 -1.292 -19.239 352 H ALA 46 H ALA 46 23.877 -0.256 -19.520 353 HA ALA 46 HA ALA 46 23.824 -0.777 -16.709 354 HB1 ALA 46 HB1 ALA 46 21.485 0.060 -18.501 355 HB2 ALA 46 HB2 ALA 46 21.662 0.369 -16.762 356 HB3 ALA 46 HB3 ALA 46 22.743 1.184 -17.909 357 H ILE 47 H ILE 47 21.868 -2.164 -19.365 358 HA ILE 47 HA ILE 47 20.374 -4.062 -17.802 359 HB ILE 47 HB ILE 47 21.298 -4.133 -20.695 360 HG12 ILE 47 HG12 ILE 47 18.425 -3.662 -20.071 361 HG13 ILE 47 HG13 ILE 47 19.474 -2.355 -19.549 362 HG21 ILE 47 HG21 ILE 47 19.199 -5.854 -19.309 363 HG22 ILE 47 HG22 ILE 47 19.436 -5.749 -21.071 364 HG23 ILE 47 HG23 ILE 47 20.714 -6.406 -20.055 365 HD11 ILE 47 HD11 ILE 47 19.715 -3.466 -22.358 366 HD12 ILE 47 HD12 ILE 47 18.531 -2.227 -21.931 367 HD13 ILE 47 HD13 ILE 47 20.260 -1.897 -21.673 368 H ALA 48 H ALA 48 23.527 -4.402 -19.541 369 HA ALA 48 HA ALA 48 23.945 -7.134 -18.894 370 HB1 ALA 48 HB1 ALA 48 26.282 -6.690 -19.445 371 HB2 ALA 48 HB2 ALA 48 25.213 -5.847 -20.591 372 HB3 ALA 48 HB3 ALA 48 26.023 -4.943 -19.284 373 H MET 49 H MET 49 24.763 -4.218 -17.029 374 HA MET 49 HA MET 49 26.138 -5.639 -14.901 375 HB2 MET 49 HB2 MET 49 25.021 -2.824 -15.029 376 HB3 MET 49 HB3 MET 49 26.100 -3.434 -13.761 377 HG2 MET 49 HG2 MET 49 26.981 -3.668 -16.640 378 HG3 MET 49 HG3 MET 49 26.990 -2.107 -15.850 379 HE1 MET 49 HE1 MET 49 28.974 -5.069 -16.752 380 HE2 MET 49 HE2 MET 49 30.007 -5.466 -15.368 381 HE3 MET 49 HE3 MET 49 28.279 -5.898 -15.341 382 H MET 50 H MET 50 22.742 -4.700 -15.418 383 HA MET 50 HA MET 50 21.938 -5.591 -12.730 384 HB2 MET 50 HB2 MET 50 20.342 -5.010 -15.256 385 HB3 MET 50 HB3 MET 50 19.628 -5.443 -13.707 386 HG2 MET 50 HG2 MET 50 21.263 -2.960 -14.329 387 HG3 MET 50 HG3 MET 50 19.549 -3.041 -13.980 388 HE1 MET 50 HE1 MET 50 18.636 -3.946 -11.710 389 HE2 MET 50 HE2 MET 50 19.854 -5.182 -11.278 390 HE3 MET 50 HE3 MET 50 19.488 -3.847 -10.164 391 H GLU 51 H GLU 51 22.265 -7.149 -15.952 392 HA GLU 51 HA GLU 51 21.022 -9.602 -15.136 393 HB2 GLU 51 HB2 GLU 51 23.032 -8.946 -17.317 394 HB3 GLU 51 HB3 GLU 51 22.434 -10.583 -17.033 395 HG2 GLU 51 HG2 GLU 51 20.105 -9.800 -17.327 396 HG3 GLU 51 HG3 GLU 51 20.692 -8.189 -17.730 397 H GLU 52 H GLU 52 24.283 -8.356 -14.418 398 HA GLU 52 HA GLU 52 25.477 -10.846 -13.640 399 HB2 GLU 52 HB2 GLU 52 25.875 -8.128 -12.336 400 HB3 GLU 52 HB3 GLU 52 26.917 -9.535 -12.164 401 HG2 GLU 52 HG2 GLU 52 27.175 -9.399 -14.757 402 HG3 GLU 52 HG3 GLU 52 26.561 -7.747 -14.564 403 H VAL 53 H VAL 53 23.091 -8.845 -12.022 404 HA VAL 53 HA VAL 53 23.117 -10.603 -9.605 405 HB VAL 53 HB VAL 53 21.800 -8.848 -8.486 406 HG11 VAL 53 HG11 VAL 53 23.643 -7.287 -8.141 407 HG12 VAL 53 HG12 VAL 53 24.260 -8.947 -8.259 408 HG13 VAL 53 HG13 VAL 53 24.437 -7.835 -9.633 409 HG21 VAL 53 HG21 VAL 53 21.632 -6.604 -9.419 410 HG22 VAL 53 HG22 VAL 53 22.441 -7.095 -10.902 411 HG23 VAL 53 HG23 VAL 53 20.828 -7.739 -10.508 412 H GLY 54 H GLY 54 21.830 -10.906 -12.453 413 HA2 GLY 54 HA2 GLY 54 20.131 -12.220 -13.224 414 HA3 GLY 54 HA3 GLY 54 19.655 -12.552 -11.559 415 H ILE 55 H ILE 55 19.705 -9.228 -12.754 416 HA ILE 55 HA ILE 55 16.722 -9.121 -12.556 417 HB ILE 55 HB ILE 55 18.850 -7.062 -11.930 418 HG12 ILE 55 HG12 ILE 55 16.828 -8.560 -10.210 419 HG13 ILE 55 HG13 ILE 55 18.571 -8.755 -10.187 420 HG21 ILE 55 HG21 ILE 55 15.821 -6.705 -11.803 421 HG22 ILE 55 HG22 ILE 55 17.052 -5.538 -11.293 422 HG23 ILE 55 HG23 ILE 55 16.902 -5.925 -12.990 423 HD11 ILE 55 HD11 ILE 55 17.018 -6.339 -9.196 424 HD12 ILE 55 HD12 ILE 55 17.979 -7.488 -8.260 425 HD13 ILE 55 HD13 ILE 55 18.789 -6.379 -9.383 426 H ASP 56 H ASP 56 15.527 -8.133 -14.090 427 HA ASP 56 HA ASP 56 16.889 -7.513 -16.673 428 HB2 ASP 56 HB2 ASP 56 15.493 -9.460 -16.761 429 HB3 ASP 56 HB3 ASP 56 14.128 -8.576 -16.070 430 H ILE 57 H ILE 57 16.984 -5.528 -17.300 431 HA ILE 57 HA ILE 57 14.625 -3.743 -17.001 432 HB ILE 57 HB ILE 57 16.038 -1.766 -16.821 433 HG12 ILE 57 HG12 ILE 57 18.413 -3.512 -16.106 434 HG13 ILE 57 HG13 ILE 57 18.128 -2.990 -17.763 435 HG21 ILE 57 HG21 ILE 57 15.054 -2.839 -14.794 436 HG22 ILE 57 HG22 ILE 57 16.590 -3.710 -14.542 437 HG23 ILE 57 HG23 ILE 57 16.529 -1.931 -14.455 438 HD11 ILE 57 HD11 ILE 57 18.465 -1.089 -15.414 439 HD12 ILE 57 HD12 ILE 57 19.672 -1.451 -16.658 440 HD13 ILE 57 HD13 ILE 57 18.163 -0.638 -17.112 441 H SER 58 H SER 58 15.650 -5.605 -19.197 442 HA SER 58 HA SER 58 16.505 -3.858 -21.370 443 HB2 SER 58 HB2 SER 58 16.998 -6.326 -21.135 444 HB3 SER 58 HB3 SER 58 15.299 -6.644 -21.543 445 HG SER 58 HG SER 58 16.695 -6.703 -23.394 446 H GLY 59 H GLY 59 13.380 -5.031 -20.209 447 HA2 GLY 59 HA2 GLY 59 11.805 -4.145 -22.460 448 HA3 GLY 59 HA3 GLY 59 11.207 -4.660 -20.884 449 H GLN 60 H GLN 60 13.451 -2.077 -20.567 450 HA GLN 60 HA GLN 60 11.379 0.044 -20.639 451 HB2 GLN 60 HB2 GLN 60 12.187 0.855 -18.405 452 HB3 GLN 60 HB3 GLN 60 11.279 -0.654 -18.362 453 HG2 GLN 60 HG2 GLN 60 13.414 -1.930 -18.209 454 HG3 GLN 60 HG3 GLN 60 14.314 -0.401 -18.186 455 HE21 GLN 60 HE22 GLN 60 14.049 0.981 -16.241 456 HE22 GLN 60 HE21 GLN 60 13.479 0.243 -14.754 457 H THR 61 H THR 61 12.254 2.214 -20.954 458 HA THR 61 HA THR 61 15.121 2.479 -21.366 459 HB THR 61 HB THR 61 14.246 1.699 -23.544 460 HG1 THR 61 HG1 THR 61 15.261 3.369 -24.699 461 HG21 THR 61 HG21 THR 61 12.935 3.171 -24.961 462 HG22 THR 61 HG22 THR 61 12.000 2.825 -23.498 463 HG23 THR 61 HG23 THR 61 12.827 4.389 -23.675 464 H SER 62 H SER 62 15.254 4.912 -22.316 465 HA SER 62 HA SER 62 14.747 6.617 -20.116 466 HB2 SER 62 HB2 SER 62 15.181 7.171 -23.025 467 HB3 SER 62 HB3 SER 62 15.287 8.402 -21.721 468 HG SER 62 HG SER 62 17.213 7.660 -21.192 469 H ASP 63 H ASP 63 13.031 7.839 -19.534 470 HA ASP 63 HA ASP 63 11.149 8.844 -21.598 471 HB2 ASP 63 HB2 ASP 63 10.326 7.339 -19.100 472 HB3 ASP 63 HB3 ASP 63 9.270 8.539 -19.849 473 HA PRO 64 HA PRO 64 11.897 12.567 -19.403 474 HB2 PRO 64 HB2 PRO 64 10.288 14.336 -20.672 475 HB3 PRO 64 HB3 PRO 64 11.567 13.428 -21.534 476 HG2 PRO 64 HG2 PRO 64 8.605 12.753 -21.353 477 HG3 PRO 64 HG3 PRO 64 9.626 12.844 -22.821 478 HD2 PRO 64 HD2 PRO 64 9.095 10.486 -21.493 479 HD3 PRO 64 HD3 PRO 64 10.629 10.786 -22.366 480 H ILE 65 H ILE 65 11.338 13.857 -17.711 481 HA ILE 65 HA ILE 65 9.374 13.182 -15.850 482 HB ILE 65 HB ILE 65 11.557 14.484 -15.616 483 HG12 ILE 65 HG12 ILE 65 9.118 15.500 -14.164 484 HG13 ILE 65 HG13 ILE 65 10.081 14.056 -13.773 485 HG21 ILE 65 HG21 ILE 65 11.551 16.917 -15.710 486 HG22 ILE 65 HG22 ILE 65 11.052 16.314 -17.293 487 HG23 ILE 65 HG23 ILE 65 9.844 16.957 -16.148 488 HD11 ILE 65 HD11 ILE 65 12.084 15.650 -13.514 489 HD12 ILE 65 HD12 ILE 65 10.882 16.962 -13.505 490 HD13 ILE 65 HD13 ILE 65 10.833 15.715 -12.256 491 H GLU 66 H GLU 66 9.212 15.615 -18.411 492 HA GLU 66 HA GLU 66 6.859 16.952 -17.630 493 HB2 GLU 66 HB2 GLU 66 7.946 16.465 -20.430 494 HB3 GLU 66 HB3 GLU 66 6.703 17.653 -20.020 495 HG2 GLU 66 HG2 GLU 66 8.323 18.753 -18.449 496 HG3 GLU 66 HG3 GLU 66 9.581 17.650 -19.018 497 H ASN 67 H ASN 67 7.022 13.748 -19.084 498 HA ASN 67 HA ASN 67 4.136 13.813 -19.776 499 HB2 ASN 67 HB2 ASN 67 4.541 12.139 -21.164 500 HB3 ASN 67 HB3 ASN 67 6.240 12.516 -20.973 501 HD21 ASN 67 HD22 ASN 67 7.264 11.294 -18.897 502 HD22 ASN 67 HD21 ASN 67 6.648 9.681 -18.633 503 H PHE 68 H PHE 68 5.875 13.271 -16.923 504 HA PHE 68 HA PHE 68 4.090 11.118 -15.916 505 HB2 PHE 68 HB2 PHE 68 6.847 12.096 -15.147 506 HB3 PHE 68 HB3 PHE 68 5.928 11.024 -14.122 507 HD1 PHE 68 HD1 PHE 68 4.745 8.969 -15.680 508 HD2 PHE 68 HD2 PHE 68 8.522 10.953 -16.304 509 HE1 PHE 68 HE1 PHE 68 5.578 6.997 -16.915 510 HE2 PHE 68 HE2 PHE 68 9.352 8.958 -17.536 511 HZ PHE 68 HZ PHE 68 7.882 6.977 -17.843 512 H ASN 69 H ASN 69 3.846 11.176 -13.454 513 HA ASN 69 HA ASN 69 2.570 13.788 -12.713 514 HB2 ASN 69 HB2 ASN 69 0.684 12.272 -11.846 515 HB3 ASN 69 HB3 ASN 69 0.815 12.555 -13.580 516 HD21 ASN 69 HD22 ASN 69 2.066 10.159 -11.178 517 HD22 ASN 69 HD21 ASN 69 1.716 8.767 -12.199 518 H ALA 70 H ALA 70 4.188 14.380 -11.218 519 HA ALA 70 HA ALA 70 5.328 12.758 -9.277 520 HB1 ALA 70 HB1 ALA 70 4.604 15.672 -8.892 521 HB2 ALA 70 HB2 ALA 70 5.873 14.769 -8.070 522 HB3 ALA 70 HB3 ALA 70 6.020 15.109 -9.812 523 H ASP 71 H ASP 71 2.169 14.321 -9.209 524 HA ASP 71 HA ASP 71 1.471 14.214 -6.498 525 HB2 ASP 71 HB2 ASP 71 0.254 15.342 -8.389 526 HB3 ASP 71 HB3 ASP 71 -0.313 13.756 -8.922 527 H ASP 72 H ASP 72 1.683 11.520 -8.738 528 HA ASP 72 HA ASP 72 0.317 9.697 -6.809 529 HB2 ASP 72 HB2 ASP 72 1.035 9.230 -9.703 530 HB3 ASP 72 HB3 ASP 72 0.248 8.072 -8.659 531 H TYR 73 H TYR 73 3.377 10.801 -7.121 532 HA TYR 73 HA TYR 73 4.590 8.158 -6.423 533 HB2 TYR 73 HB2 TYR 73 6.143 10.586 -7.266 534 HB3 TYR 73 HB3 TYR 73 6.691 8.922 -7.135 535 HD1 TYR 73 HD1 TYR 73 4.475 7.513 -8.713 536 HD2 TYR 73 HD2 TYR 73 6.701 11.139 -9.449 537 HE1 TYR 73 HE1 TYR 73 3.992 7.323 -11.136 538 HE2 TYR 73 HE2 TYR 73 6.168 10.970 -11.865 539 HH TYR 73 HH TYR 73 4.216 8.289 -13.220 540 H ASP 74 H ASP 74 4.092 8.077 -4.240 541 HA ASP 74 HA ASP 74 4.001 10.198 -2.404 542 HB2 ASP 74 HB2 ASP 74 4.971 7.351 -1.902 543 HB3 ASP 74 HB3 ASP 74 4.381 8.469 -0.674 544 H VAL 75 H VAL 75 6.820 8.386 -3.548 545 HA VAL 75 HA VAL 75 8.603 10.401 -2.230 546 HB VAL 75 HB VAL 75 9.268 7.514 -2.840 547 HG11 VAL 75 HG11 VAL 75 11.318 8.055 -1.463 548 HG12 VAL 75 HG12 VAL 75 11.249 8.845 -3.034 549 HG13 VAL 75 HG13 VAL 75 10.874 9.765 -1.572 550 HG21 VAL 75 HG21 VAL 75 7.785 7.460 -0.978 551 HG22 VAL 75 HG22 VAL 75 9.419 7.354 -0.306 552 HG23 VAL 75 HG23 VAL 75 8.529 8.889 -0.238 553 H VAL 76 H VAL 76 10.044 11.438 -3.535 554 HA VAL 76 HA VAL 76 10.551 10.368 -6.292 555 HB VAL 76 HB VAL 76 10.084 13.248 -5.500 556 HG11 VAL 76 HG11 VAL 76 11.113 12.191 -8.182 557 HG12 VAL 76 HG12 VAL 76 10.674 13.875 -7.795 558 HG13 VAL 76 HG13 VAL 76 12.069 13.153 -7.028 559 HG21 VAL 76 HG21 VAL 76 8.412 13.146 -7.346 560 HG22 VAL 76 HG22 VAL 76 8.808 11.426 -7.596 561 HG23 VAL 76 HG23 VAL 76 8.048 11.960 -6.079 562 H ILE 77 H ILE 77 12.607 10.172 -6.851 563 HA ILE 77 HA ILE 77 14.729 11.206 -4.992 564 HB ILE 77 HB ILE 77 14.842 8.709 -6.694 565 HG12 ILE 77 HG12 ILE 77 13.095 8.248 -5.069 566 HG13 ILE 77 HG13 ILE 77 14.530 7.307 -4.740 567 HG21 ILE 77 HG21 ILE 77 16.739 8.113 -5.233 568 HG22 ILE 77 HG22 ILE 77 17.040 9.593 -6.134 569 HG23 ILE 77 HG23 ILE 77 16.618 9.691 -4.418 570 HD11 ILE 77 HD11 ILE 77 15.130 8.720 -2.850 571 HD12 ILE 77 HD12 ILE 77 13.791 9.836 -3.206 572 HD13 ILE 77 HD13 ILE 77 13.454 8.176 -2.698 573 H SER 78 H SER 78 16.363 12.353 -5.961 574 HA SER 78 HA SER 78 16.505 12.404 -8.959 575 HB2 SER 78 HB2 SER 78 16.189 14.600 -7.901 576 HB3 SER 78 HB3 SER 78 17.702 14.372 -6.988 577 HG SER 78 HG SER 78 18.103 15.500 -8.942 578 H LEU 79 H LEU 79 18.270 11.675 -9.950 579 HA LEU 79 HA LEU 79 20.713 10.917 -8.406 580 HB2 LEU 79 HB2 LEU 79 19.440 9.232 -10.614 581 HB3 LEU 79 HB3 LEU 79 20.912 8.896 -9.703 582 HG LEU 79 HG LEU 79 19.262 8.952 -7.602 583 HD11 LEU 79 HD11 LEU 79 17.105 7.873 -8.167 584 HD12 LEU 79 HD12 LEU 79 17.188 9.497 -8.850 585 HD13 LEU 79 HD13 LEU 79 17.451 8.109 -9.906 586 HD21 LEU 79 HD21 LEU 79 20.634 7.030 -8.302 587 HD22 LEU 79 HD22 LEU 79 19.016 6.516 -7.816 588 HD23 LEU 79 HD23 LEU 79 19.425 6.608 -9.542 589 H CYS 80 H CYS 80 20.409 13.355 -9.638 590 HA CYS 80 HA CYS 80 21.512 13.199 -12.380 591 HB2 CYS 80 HB2 CYS 80 20.678 15.607 -10.698 592 HB3 CYS 80 HB3 CYS 80 21.114 15.624 -12.415 593 HG CYS 80 HG CYS 80 18.539 14.280 -10.833 594 H GLY 81 H GLY 81 22.610 14.463 -9.210 595 HA2 GLY 81 HA2 GLY 81 24.840 14.773 -8.471 596 HA3 GLY 81 HA3 GLY 81 25.444 14.399 -10.078 597 H CYS 82 H CYS 82 23.671 16.875 -8.232 598 HA CYS 82 HA CYS 82 23.435 19.110 -8.345 599 HB2 CYS 82 HB2 CYS 82 26.209 19.022 -9.592 600 HB3 CYS 82 HB3 CYS 82 25.412 20.484 -9.003 601 HG CYS 82 HG CYS 82 27.217 19.690 -7.257 602 H GLY 83 H GLY 83 23.514 21.144 -9.838 603 HA2 GLY 83 HA2 GLY 83 22.816 22.233 -11.752 604 HA3 GLY 83 HA3 GLY 83 23.056 20.740 -12.667 605 H VAL 84 H VAL 84 20.972 20.098 -10.103 606 HA VAL 84 HA VAL 84 18.458 20.600 -11.624 607 HB VAL 84 HB VAL 84 19.361 17.867 -10.617 608 HG11 VAL 84 HG11 VAL 84 17.307 17.023 -11.707 609 HG12 VAL 84 HG12 VAL 84 16.908 18.132 -10.411 610 HG13 VAL 84 HG13 VAL 84 16.824 18.690 -12.106 611 HG21 VAL 84 HG21 VAL 84 19.261 17.216 -13.035 612 HG22 VAL 84 HG22 VAL 84 19.058 18.926 -13.454 613 HG23 VAL 84 HG23 VAL 84 20.550 18.347 -12.668 614 H ASN 85 H ASN 85 16.818 21.212 -10.263 615 HA ASN 85 HA ASN 85 16.851 20.171 -7.466 616 HB2 ASN 85 HB2 ASN 85 17.852 22.619 -7.932 617 HB3 ASN 85 HB3 ASN 85 16.152 23.076 -7.912 618 HD21 ASN 85 HD22 ASN 85 18.621 21.206 -6.050 619 HD22 ASN 85 HD21 ASN 85 17.984 21.668 -4.481 620 H LEU 86 H LEU 86 15.021 20.232 -10.166 621 HA LEU 86 HA LEU 86 12.768 20.150 -10.694 622 HB2 LEU 86 HB2 LEU 86 12.817 18.442 -8.189 623 HB3 LEU 86 HB3 LEU 86 11.637 18.372 -9.505 624 HG LEU 86 HG LEU 86 14.526 17.508 -9.619 625 HD11 LEU 86 HD11 LEU 86 11.987 15.914 -10.096 626 HD12 LEU 86 HD12 LEU 86 13.604 15.319 -9.691 627 HD13 LEU 86 HD13 LEU 86 12.633 16.139 -8.449 628 HD21 LEU 86 HD21 LEU 86 13.800 16.689 -11.932 629 HD22 LEU 86 HD22 LEU 86 12.344 17.691 -11.737 630 HD23 LEU 86 HD23 LEU 86 13.955 18.447 -11.805 631 HA PRO 87 HA PRO 87 11.373 23.529 -7.762 632 HB2 PRO 87 HB2 PRO 87 10.545 24.555 -10.483 633 HB3 PRO 87 HB3 PRO 87 11.057 25.483 -9.036 634 HG2 PRO 87 HG2 PRO 87 12.836 25.019 -11.012 635 HG3 PRO 87 HG3 PRO 87 13.334 24.774 -9.303 636 HD2 PRO 87 HD2 PRO 87 12.491 22.695 -11.329 637 HD3 PRO 87 HD3 PRO 87 13.849 22.674 -10.172 638 HA PRO 88 HA PRO 88 6.902 22.840 -9.330 639 HB2 PRO 88 HB2 PRO 88 6.905 20.263 -10.820 640 HB3 PRO 88 HB3 PRO 88 6.143 21.816 -11.248 641 HG2 PRO 88 HG2 PRO 88 8.349 20.827 -12.510 642 HG3 PRO 88 HG3 PRO 88 8.142 22.601 -12.222 643 HD2 PRO 88 HD2 PRO 88 9.745 20.587 -10.619 644 HD3 PRO 88 HD3 PRO 88 10.195 22.230 -11.180 645 H GLU 89 H GLU 89 5.200 20.627 -9.273 646 HA GLU 89 HA GLU 89 5.017 19.721 -6.648 647 HB2 GLU 89 HB2 GLU 89 3.499 17.962 -7.606 648 HB3 GLU 89 HB3 GLU 89 3.136 19.621 -8.078 649 HG2 GLU 89 HG2 GLU 89 4.111 19.290 -10.287 650 HG3 GLU 89 HG3 GLU 89 4.702 17.698 -9.848 651 H TRP 90 H TRP 90 7.300 18.590 -8.916 652 HA TRP 90 HA TRP 90 7.824 15.922 -8.084 653 HB2 TRP 90 HB2 TRP 90 9.468 18.086 -9.379 654 HB3 TRP 90 HB3 TRP 90 10.079 16.449 -9.059 655 HD1 TRP 90 HD1 TRP 90 7.583 18.315 -11.298 656 HE1 TRP 90 HE1 TRP 90 6.486 16.697 -12.944 657 HE3 TRP 90 HE3 TRP 90 9.971 14.046 -9.888 658 HZ2 TRP 90 HZ2 TRP 90 6.600 13.860 -13.543 659 HZ3 TRP 90 HZ3 TRP 90 9.667 11.964 -11.186 660 HH2 TRP 90 HH2 TRP 90 7.976 11.848 -12.998 661 H VAL 91 H VAL 91 8.446 18.858 -6.321 662 HA VAL 91 HA VAL 91 9.949 17.232 -4.298 663 HB VAL 91 HB VAL 91 11.117 19.192 -3.542 664 HG11 VAL 91 HG11 VAL 91 12.614 19.509 -5.442 665 HG12 VAL 91 HG12 VAL 91 12.206 17.814 -5.165 666 HG13 VAL 91 HG13 VAL 91 11.437 18.691 -6.494 667 HG21 VAL 91 HG21 VAL 91 9.822 20.692 -5.863 668 HG22 VAL 91 HG22 VAL 91 9.489 20.974 -4.142 669 HG23 VAL 91 HG23 VAL 91 11.098 21.304 -4.801 670 H THR 92 H THR 92 6.908 18.358 -4.761 671 HA THR 92 HA THR 92 6.493 19.290 -1.967 672 HB THR 92 HB THR 92 4.239 19.813 -2.615 673 HG1 THR 92 HG1 THR 92 3.425 19.277 -4.558 674 HG21 THR 92 HG21 THR 92 6.006 21.476 -3.218 675 HG22 THR 92 HG22 THR 92 6.111 20.751 -4.839 676 HG23 THR 92 HG23 THR 92 4.606 21.522 -4.301 677 H GLN 93 H GLN 93 6.865 16.338 -3.280 678 HA GLN 93 HA GLN 93 4.581 14.922 -2.162 679 HB2 GLN 93 HB2 GLN 93 7.173 13.795 -3.282 680 HB3 GLN 93 HB3 GLN 93 5.652 12.936 -3.007 681 HG2 GLN 93 HG2 GLN 93 6.221 15.065 -5.088 682 HG3 GLN 93 HG3 GLN 93 5.778 13.398 -5.363 683 HE21 GLN 93 HE22 GLN 93 4.554 16.406 -5.676 684 HE22 GLN 93 HE21 GLN 93 2.861 16.108 -5.295 685 H GLU 94 H GLU 94 5.348 12.777 -0.870 686 HA GLU 94 HA GLU 94 5.639 13.887 1.760 687 HB2 GLU 94 HB2 GLU 94 4.247 11.925 1.250 688 HB3 GLU 94 HB3 GLU 94 5.692 10.970 0.882 689 HG2 GLU 94 HG2 GLU 94 6.495 11.178 3.157 690 HG3 GLU 94 HG3 GLU 94 5.157 12.256 3.577 691 H ILE 95 H ILE 95 7.966 12.113 -0.282 692 HA ILE 95 HA ILE 95 10.151 13.180 1.435 693 HB ILE 95 HB ILE 95 10.160 10.324 0.417 694 HG12 ILE 95 HG12 ILE 95 9.737 11.255 3.275 695 HG13 ILE 95 HG13 ILE 95 8.557 10.453 2.234 696 HG21 ILE 95 HG21 ILE 95 12.411 11.377 0.532 697 HG22 ILE 95 HG22 ILE 95 12.129 11.770 2.240 698 HG23 ILE 95 HG23 ILE 95 12.252 10.088 1.698 699 HD11 ILE 95 HD11 ILE 95 9.338 8.758 3.662 700 HD12 ILE 95 HD12 ILE 95 10.148 8.465 2.112 701 HD13 ILE 95 HD13 ILE 95 11.035 9.222 3.458 702 H PHE 96 H PHE 96 11.747 14.095 0.292 703 HA PHE 96 HA PHE 96 12.197 13.235 -2.493 704 HB2 PHE 96 HB2 PHE 96 11.102 15.356 -2.761 705 HB3 PHE 96 HB3 PHE 96 12.176 16.112 -1.583 706 HD1 PHE 96 HD2 PHE 96 11.964 14.723 -5.053 707 HD2 PHE 96 HD1 PHE 96 14.470 16.727 -2.157 708 HE1 PHE 96 HE2 PHE 96 13.699 15.082 -6.779 709 HE2 PHE 96 HE1 PHE 96 16.153 17.162 -3.927 710 HZ PHE 96 HZ PHE 96 15.777 16.337 -6.230 711 H GLU 97 H GLU 97 14.283 12.734 -2.962 712 HA GLU 97 HA GLU 97 16.458 13.632 -1.130 713 HB2 GLU 97 HB2 GLU 97 15.971 10.767 -2.012 714 HB3 GLU 97 HB3 GLU 97 17.440 11.337 -1.246 715 HG2 GLU 97 HG2 GLU 97 14.680 11.321 0.024 716 HG3 GLU 97 HG3 GLU 97 15.971 10.172 0.326 717 H ASP 98 H ASP 98 18.570 13.596 -2.054 718 HA ASP 98 HA ASP 98 18.706 13.315 -5.034 719 HB2 ASP 98 HB2 ASP 98 18.631 15.655 -4.485 720 HB3 ASP 98 HB3 ASP 98 19.891 15.467 -3.266 721 H TRP 99 H TRP 99 19.608 11.356 -5.169 722 HA TRP 99 HA TRP 99 21.910 10.546 -3.472 723 HB2 TRP 99 HB2 TRP 99 20.285 9.012 -5.523 724 HB3 TRP 99 HB3 TRP 99 21.544 8.347 -4.496 725 HD1 TRP 99 HD1 TRP 99 19.806 10.335 -2.084 726 HE1 TRP 99 HE1 TRP 99 17.895 9.073 -0.919 727 HE3 TRP 99 HE3 TRP 99 19.332 6.404 -5.325 728 HZ2 TRP 99 HZ2 TRP 99 16.324 6.710 -1.367 729 HZ3 TRP 99 HZ3 TRP 99 17.557 4.704 -4.985 730 HH2 TRP 99 HH2 TRP 99 16.049 4.838 -3.002 731 H GLN 100 H GLN 100 23.422 12.034 -4.339 732 HA GLN 100 HA GLN 100 23.980 12.189 -7.147 733 HB2 GLN 100 HB2 GLN 100 25.686 13.042 -4.773 734 HB3 GLN 100 HB3 GLN 100 25.943 13.500 -6.466 735 HG2 GLN 100 HG2 GLN 100 23.615 14.527 -6.447 736 HG3 GLN 100 HG3 GLN 100 23.552 14.226 -4.711 737 HE21 GLN 100 HE22 GLN 100 23.134 16.718 -5.187 738 HE22 GLN 100 HE21 GLN 100 24.587 17.728 -5.041 739 H LEU 101 H LEU 101 24.907 10.699 -8.392 740 HA LEU 101 HA LEU 101 27.305 9.203 -7.549 741 HB2 LEU 101 HB2 LEU 101 24.735 7.952 -8.645 742 HB3 LEU 101 HB3 LEU 101 26.291 7.136 -8.656 743 HG LEU 101 HG LEU 101 24.786 7.959 -6.130 744 HD11 LEU 101 HD11 LEU 101 23.697 6.175 -7.415 745 HD12 LEU 101 HD12 LEU 101 25.206 5.216 -7.358 746 HD13 LEU 101 HD13 LEU 101 24.328 5.609 -5.861 747 HD21 LEU 101 HD21 LEU 101 26.423 6.507 -4.983 748 HD22 LEU 101 HD22 LEU 101 27.300 6.257 -6.511 749 HD23 LEU 101 HD23 LEU 101 27.243 7.863 -5.751 750 H GLU 102 H GLU 102 28.604 8.630 -9.439 751 HA GLU 102 HA GLU 102 28.319 10.513 -11.592 752 HB2 GLU 102 HB2 GLU 102 30.306 9.520 -12.499 753 HB3 GLU 102 HB3 GLU 102 30.509 9.851 -10.773 754 HG2 GLU 102 HG2 GLU 102 30.031 7.387 -10.345 755 HG3 GLU 102 HG3 GLU 102 30.082 7.135 -12.093 756 H ASP 103 H ASP 103 28.239 10.012 -13.805 757 HA ASP 103 HA ASP 103 26.187 8.013 -14.404 758 HB2 ASP 103 HB2 ASP 103 26.147 10.406 -15.177 759 HB3 ASP 103 HB3 ASP 103 27.366 9.977 -16.362 760 HA PRO 104 HA PRO 104 29.588 5.254 -15.385 761 HB2 PRO 104 HB2 PRO 104 27.394 3.374 -16.077 762 HB3 PRO 104 HB3 PRO 104 28.837 3.109 -15.034 763 HG2 PRO 104 HG2 PRO 104 26.429 3.495 -13.895 764 HG3 PRO 104 HG3 PRO 104 27.838 4.428 -13.286 765 HD2 PRO 104 HD2 PRO 104 25.781 5.321 -15.358 766 HD3 PRO 104 HD3 PRO 104 26.254 6.114 -13.838 767 H ASP 105 H ASP 105 27.367 6.288 -17.767 768 HA ASP 105 HA ASP 105 27.889 4.765 -20.073 769 HB2 ASP 105 HB2 ASP 105 26.166 6.417 -19.971 770 HB3 ASP 105 HB3 ASP 105 27.323 7.686 -19.558 771 H GLY 106 H GLY 106 29.826 4.182 -20.836 772 HA2 GLY 106 HA2 GLY 106 31.841 4.375 -21.940 773 HA3 GLY 106 HA3 GLY 106 31.701 6.131 -21.871 774 H GLN 107 H GLN 107 31.473 4.575 -18.776 775 HA GLN 107 HA GLN 107 34.123 5.642 -18.012 776 HB2 GLN 107 HB2 GLN 107 32.010 4.373 -16.257 777 HB3 GLN 107 HB3 GLN 107 33.466 5.210 -15.716 778 HG2 GLN 107 HG2 GLN 107 31.122 6.446 -17.203 779 HG3 GLN 107 HG3 GLN 107 31.390 6.491 -15.466 780 HE21 GLN 107 HE22 GLN 107 30.914 8.805 -16.438 781 HE22 GLN 107 HE21 GLN 107 32.376 9.781 -16.638 782 H SER 108 H SER 108 32.889 2.739 -16.487 783 HA SER 108 HA SER 108 34.432 0.761 -17.896 784 HB2 SER 108 HB2 SER 108 35.525 1.844 -15.262 785 HB3 SER 108 HB3 SER 108 35.814 0.168 -15.763 786 HG SER 108 HG SER 108 36.383 2.319 -17.507 787 H LEU 109 H LEU 109 34.036 -1.417 -16.917 788 HA LEU 109 HA LEU 109 31.367 -1.639 -15.897 789 HB2 LEU 109 HB2 LEU 109 33.587 -3.723 -15.759 790 HB3 LEU 109 HB3 LEU 109 31.854 -4.011 -15.623 791 HG LEU 109 HG LEU 109 33.356 -3.110 -18.115 792 HD11 LEU 109 HD11 LEU 109 32.666 -5.308 -18.954 793 HD12 LEU 109 HD12 LEU 109 33.602 -5.468 -17.453 794 HD13 LEU 109 HD13 LEU 109 31.834 -5.654 -17.415 795 HD21 LEU 109 HD21 LEU 109 31.172 -2.032 -18.162 796 HD22 LEU 109 HD22 LEU 109 31.181 -3.388 -19.293 797 HD23 LEU 109 HD23 LEU 109 30.371 -3.554 -17.721 798 H GLU 110 H GLU 110 34.470 -1.786 -14.177 799 HA GLU 110 HA GLU 110 33.392 -2.249 -11.575 800 HB2 GLU 110 HB2 GLU 110 35.474 -1.421 -10.694 801 HB3 GLU 110 HB3 GLU 110 35.773 -2.419 -12.117 802 HG2 GLU 110 HG2 GLU 110 36.053 -0.338 -13.488 803 HG3 GLU 110 HG3 GLU 110 35.838 0.625 -12.023 804 H VAL 111 H VAL 111 33.411 0.749 -13.434 805 HA VAL 111 HA VAL 111 32.504 2.411 -11.184 806 HB VAL 111 HB VAL 111 32.592 2.938 -14.163 807 HG11 VAL 111 HG11 VAL 111 30.819 4.330 -13.296 808 HG12 VAL 111 HG12 VAL 111 31.810 4.789 -11.884 809 HG13 VAL 111 HG13 VAL 111 32.246 5.334 -13.520 810 HG21 VAL 111 HG21 VAL 111 34.287 3.977 -11.852 811 HG22 VAL 111 HG22 VAL 111 34.812 2.794 -13.068 812 HG23 VAL 111 HG23 VAL 111 34.453 4.453 -13.556 813 H PHE 112 H PHE 112 30.923 0.706 -13.962 814 HA PHE 112 HA PHE 112 28.227 1.512 -13.288 815 HB2 PHE 112 HB2 PHE 112 29.468 -0.847 -14.720 816 HB3 PHE 112 HB3 PHE 112 27.788 -0.904 -14.230 817 HD1 PHE 112 HD2 PHE 112 26.093 0.488 -15.221 818 HD2 PHE 112 HD1 PHE 112 30.183 0.706 -16.536 819 HE1 PHE 112 HE2 PHE 112 25.346 1.478 -17.399 820 HE2 PHE 112 HE1 PHE 112 29.453 1.762 -18.654 821 HZ PHE 112 HZ PHE 112 27.040 2.176 -19.064 822 H ARG 113 H ARG 113 30.178 -1.305 -12.201 823 HA ARG 113 HA ARG 113 28.207 -2.391 -10.409 824 HB2 ARG 113 HB2 ARG 113 31.241 -2.574 -10.444 825 HB3 ARG 113 HB3 ARG 113 30.206 -3.570 -9.413 826 HG2 ARG 113 HG2 ARG 113 29.152 -4.609 -11.364 827 HG3 ARG 113 HG3 ARG 113 30.008 -3.537 -12.462 828 HD2 ARG 113 HD2 ARG 113 32.161 -4.419 -11.654 829 HD3 ARG 113 HD3 ARG 113 31.290 -5.572 -10.618 830 HE ARG 113 HE ARG 113 30.244 -6.431 -12.801 831 HH11 ARG 113 HH11 ARG 113 33.600 -5.317 -12.632 832 HH12 ARG 113 HH12 ARG 113 34.087 -6.357 -13.935 833 HH21 ARG 113 HH21 ARG 113 30.979 -7.782 -14.326 834 HH22 ARG 113 HH22 ARG 113 32.637 -7.715 -14.895 835 H THR 114 H THR 114 30.817 -0.036 -9.817 836 HA THR 114 HA THR 114 30.371 0.335 -7.001 837 HB THR 114 HB THR 114 31.494 2.204 -9.132 838 HG1 THR 114 HG1 THR 114 32.797 0.488 -8.838 839 HG21 THR 114 HG21 THR 114 32.602 3.379 -7.226 840 HG22 THR 114 HG22 THR 114 30.860 3.646 -7.311 841 HG23 THR 114 HG23 THR 114 31.534 2.508 -6.107 842 H VAL 115 H VAL 115 28.848 1.933 -9.820 843 HA VAL 115 HA VAL 115 27.133 3.632 -8.179 844 HB VAL 115 HB VAL 115 27.182 2.896 -11.131 845 HG11 VAL 115 HG11 VAL 115 24.818 3.376 -10.625 846 HG12 VAL 115 HG12 VAL 115 25.288 4.858 -9.749 847 HG13 VAL 115 HG13 VAL 115 25.555 4.714 -11.500 848 HG21 VAL 115 HG21 VAL 115 27.785 5.432 -9.517 849 HG22 VAL 115 HG22 VAL 115 28.984 4.386 -10.307 850 HG23 VAL 115 HG23 VAL 115 27.849 5.319 -11.275 851 H ARG 116 H ARG 116 26.527 0.593 -9.966 852 HA ARG 116 HA ARG 116 23.867 0.104 -9.349 853 HB2 ARG 116 HB2 ARG 116 25.387 -1.219 -10.864 854 HB3 ARG 116 HB3 ARG 116 26.164 -1.919 -9.447 855 HG2 ARG 116 HG2 ARG 116 23.891 -2.860 -8.792 856 HG3 ARG 116 HG3 ARG 116 23.291 -2.280 -10.355 857 HD2 ARG 116 HD2 ARG 116 23.818 -4.612 -10.583 858 HD3 ARG 116 HD3 ARG 116 25.035 -3.683 -11.472 859 HE ARG 116 HE ARG 116 25.739 -4.394 -8.676 860 HH11 ARG 116 HH11 ARG 116 25.846 -5.692 -11.919 861 HH12 ARG 116 HH12 ARG 116 27.446 -6.370 -11.724 862 HH21 ARG 116 HH21 ARG 116 27.644 -5.564 -8.368 863 HH22 ARG 116 HH22 ARG 116 28.267 -6.517 -9.677 864 H GLY 117 H GLY 117 26.634 -0.908 -7.275 865 HA2 GLY 117 HA2 GLY 117 25.083 -2.135 -5.235 866 HA3 GLY 117 HA3 GLY 117 26.704 -1.470 -5.026 867 H GLN 118 H GLN 118 26.131 1.289 -5.527 868 HA GLN 118 HA GLN 118 25.006 2.028 -2.938 869 HB2 GLN 118 HB2 GLN 118 26.070 3.660 -5.283 870 HB3 GLN 118 HB3 GLN 118 25.468 4.378 -3.778 871 HG2 GLN 118 HG2 GLN 118 27.145 3.194 -2.456 872 HG3 GLN 118 HG3 GLN 118 27.719 2.314 -3.876 873 HE21 GLN 118 HE22 GLN 118 28.852 3.514 -5.575 874 HE22 GLN 118 HE21 GLN 118 29.640 5.038 -5.149 875 H VAL 119 H VAL 119 23.851 2.435 -6.343 876 HA VAL 119 HA VAL 119 21.324 3.593 -5.693 877 HB VAL 119 HB VAL 119 22.017 1.681 -7.964 878 HG11 VAL 119 HG11 VAL 119 19.602 3.451 -7.472 879 HG12 VAL 119 HG12 VAL 119 20.033 2.788 -9.067 880 HG13 VAL 119 HG13 VAL 119 19.625 1.686 -7.741 881 HG21 VAL 119 HG21 VAL 119 23.303 3.818 -8.030 882 HG22 VAL 119 HG22 VAL 119 22.129 3.729 -9.332 883 HG23 VAL 119 HG23 VAL 119 21.780 4.726 -7.895 884 H LYS 120 H LYS 120 22.220 0.098 -5.842 885 HA LYS 120 HA LYS 120 19.702 -0.988 -5.098 886 HB2 LYS 120 HB2 LYS 120 21.721 -2.286 -5.903 887 HB3 LYS 120 HB3 LYS 120 22.486 -2.023 -4.345 888 HG2 LYS 120 HG2 LYS 120 20.528 -3.175 -3.236 889 HG3 LYS 120 HG3 LYS 120 19.883 -3.510 -4.842 890 HD2 LYS 120 HD2 LYS 120 22.036 -4.772 -5.349 891 HD3 LYS 120 HD3 LYS 120 22.530 -4.473 -3.667 892 HE2 LYS 120 HE2 LYS 120 20.333 -5.542 -2.938 893 HE3 LYS 120 HE3 LYS 120 20.064 -6.010 -4.625 894 HZ1 LYS 120 HZ1 LYS 120 21.120 -7.823 -3.371 895 HZ2 LYS 120 HZ2 LYS 120 22.176 -7.302 -4.506 896 HZ3 LYS 120 HZ3 LYS 120 22.372 -6.878 -2.934 897 H GLU 121 H GLU 121 22.480 -0.203 -2.900 898 HA GLU 121 HA GLU 121 20.967 -0.841 -0.548 899 HB2 GLU 121 HB2 GLU 121 22.806 -0.344 0.664 900 HB3 GLU 121 HB3 GLU 121 23.569 -0.601 -0.906 901 HG2 GLU 121 HG2 GLU 121 23.604 1.877 -1.244 902 HG3 GLU 121 HG3 GLU 121 22.906 2.091 0.359 903 H ARG 122 H ARG 122 21.255 2.329 -2.190 904 HA ARG 122 HA ARG 122 19.742 3.570 -0.050 905 HB2 ARG 122 HB2 ARG 122 20.238 4.517 -2.897 906 HB3 ARG 122 HB3 ARG 122 19.381 5.422 -1.632 907 HG2 ARG 122 HG2 ARG 122 21.518 4.943 -0.163 908 HG3 ARG 122 HG3 ARG 122 22.311 4.647 -1.715 909 HD2 ARG 122 HD2 ARG 122 21.551 6.910 -2.465 910 HD3 ARG 122 HD3 ARG 122 20.809 7.135 -0.862 911 HE ARG 122 HE ARG 122 23.717 6.507 -0.985 912 HH11 ARG 122 HH11 ARG 122 21.333 9.006 -0.380 913 HH12 ARG 122 HH12 ARG 122 22.510 10.085 0.317 914 HH21 ARG 122 HH21 ARG 122 25.163 7.926 -0.094 915 HH22 ARG 122 HH22 ARG 122 24.626 9.474 0.479 916 H VAL 123 H VAL 123 18.645 2.005 -3.102 917 HA VAL 123 HA VAL 123 15.855 2.417 -2.538 918 HB VAL 123 HB VAL 123 17.354 0.309 -4.127 919 HG11 VAL 123 HG11 VAL 123 15.400 -0.895 -3.261 920 HG12 VAL 123 HG12 VAL 123 14.343 0.440 -3.791 921 HG13 VAL 123 HG13 VAL 123 15.252 -0.556 -4.975 922 HG21 VAL 123 HG21 VAL 123 16.186 1.381 -6.015 923 HG22 VAL 123 HG22 VAL 123 15.437 2.535 -4.896 924 HG23 VAL 123 HG23 VAL 123 17.211 2.505 -5.117 925 H GLU 124 H GLU 124 17.924 -0.395 -1.491 926 HA GLU 124 HA GLU 124 15.766 -1.644 -0.060 927 HB2 GLU 124 HB2 GLU 124 18.747 -1.753 0.512 928 HB3 GLU 124 HB3 GLU 124 17.501 -2.810 1.207 929 HG2 GLU 124 HG2 GLU 124 16.890 -3.601 -1.011 930 HG3 GLU 124 HG3 GLU 124 18.204 -2.663 -1.728 931 H ASN 125 H ASN 125 18.009 0.877 0.981 932 HA ASN 125 HA ASN 125 16.956 0.813 3.643 933 HB2 ASN 125 HB2 ASN 125 18.851 1.993 4.003 934 HB3 ASN 125 HB3 ASN 125 19.117 2.130 2.273 935 HD21 ASN 125 HD22 ASN 125 18.117 3.887 1.096 936 HD22 ASN 125 HD21 ASN 125 18.030 5.437 1.938 937 H LEU 126 H LEU 126 15.949 2.503 0.738 938 HA LEU 126 HA LEU 126 14.105 4.289 2.102 939 HB2 LEU 126 HB2 LEU 126 15.075 4.931 -0.026 940 HB3 LEU 126 HB3 LEU 126 14.519 3.449 -0.799 941 HG LEU 126 HG LEU 126 12.167 4.159 -0.581 942 HD11 LEU 126 HD11 LEU 126 13.320 6.778 0.497 943 HD12 LEU 126 HD12 LEU 126 11.612 6.453 0.095 944 HD13 LEU 126 HD13 LEU 126 12.358 5.617 1.445 945 HD21 LEU 126 HD21 LEU 126 13.408 4.677 -2.602 946 HD22 LEU 126 HD22 LEU 126 12.288 6.001 -2.215 947 HD23 LEU 126 HD23 LEU 126 14.031 6.171 -1.871 948 H ILE 127 H ILE 127 13.618 1.226 0.193 949 HA ILE 127 HA ILE 127 10.782 1.351 0.544 950 HB ILE 127 HB ILE 127 10.679 -1.001 -0.067 951 HG12 ILE 127 HG12 ILE 127 13.698 -0.981 0.197 952 HG13 ILE 127 HG13 ILE 127 12.520 -2.080 0.917 953 HG21 ILE 127 HG21 ILE 127 10.867 0.910 -1.714 954 HG22 ILE 127 HG22 ILE 127 12.606 0.580 -1.845 955 HG23 ILE 127 HG23 ILE 127 11.416 -0.634 -2.367 956 HD11 ILE 127 HD11 ILE 127 13.698 -3.231 -0.818 957 HD12 ILE 127 HD12 ILE 127 12.040 -2.950 -1.394 958 HD13 ILE 127 HD13 ILE 127 13.386 -1.938 -1.985 959 H ALA 128 H ALA 128 13.229 -0.028 2.732 960 HA ALA 128 HA ALA 128 11.339 -1.267 4.440 961 HB1 ALA 128 HB1 ALA 128 13.780 -1.708 4.457 962 HB2 ALA 128 HB2 ALA 128 14.084 -0.070 5.086 963 HB3 ALA 128 HB3 ALA 128 13.207 -1.258 6.076 964 H LYS 129 H LYS 129 12.080 2.146 4.063 965 HA LYS 129 HA LYS 129 10.793 2.981 6.601 966 HB2 LYS 129 HB2 LYS 129 11.768 4.590 4.201 967 HB3 LYS 129 HB3 LYS 129 11.140 5.267 5.700 968 HG2 LYS 129 HG2 LYS 129 12.981 4.339 6.989 969 HG3 LYS 129 HG3 LYS 129 13.605 3.489 5.566 970 HD2 LYS 129 HD2 LYS 129 13.884 5.691 4.403 971 HD3 LYS 129 HD3 LYS 129 13.403 6.520 5.887 972 HE2 LYS 129 HE2 LYS 129 15.810 4.660 5.578 973 HE3 LYS 129 HE3 LYS 129 15.874 6.420 5.472 974 HZ1 LYS 129 HZ1 LYS 129 15.085 6.533 7.790 975 HZ2 LYS 129 HZ2 LYS 129 15.080 4.896 7.914 976 HZ3 LYS 129 HZ3 LYS 129 16.481 5.698 7.693 977 H ILE 130 H ILE 130 9.945 2.909 3.139 978 HA ILE 130 HA ILE 130 7.306 4.109 3.812 979 HB ILE 130 HB ILE 130 7.162 4.881 1.515 980 HG12 ILE 130 HG12 ILE 130 9.261 5.077 0.181 981 HG13 ILE 130 HG13 ILE 130 10.020 3.884 1.223 982 HG21 ILE 130 HG21 ILE 130 9.707 5.779 2.917 983 HG22 ILE 130 HG22 ILE 130 8.639 6.717 1.848 984 HG23 ILE 130 HG23 ILE 130 8.061 6.217 3.436 985 HD11 ILE 130 HD11 ILE 130 7.565 3.380 -0.497 986 HD12 ILE 130 HD12 ILE 130 9.238 2.962 -0.926 987 HD13 ILE 130 HD13 ILE 130 8.470 2.166 0.448 988 H SER 131 H SER 131 8.252 0.989 3.259 989 HA SER 131 HA SER 131 6.291 -0.082 1.505 990 HB2 SER 131 HB2 SER 131 7.599 -1.209 3.995 991 HB3 SER 131 HB3 SER 131 6.501 -2.144 2.956 992 HG SER 131 HG SER 131 8.949 -0.882 2.236 Start of MODEL 9 1 H MET 1 H1 MET 1 2.777 0.176 2.146 2 HA MET 1 HA MET 1 3.571 -0.221 0.047 3 HB2 MET 1 HB2 MET 1 1.847 -1.727 -0.775 4 HB3 MET 1 HB3 MET 1 0.669 -0.412 -0.888 5 HG2 MET 1 HG2 MET 1 1.962 0.678 -2.640 6 HG3 MET 1 HG3 MET 1 3.282 -0.467 -2.444 7 HE1 MET 1 HE1 MET 1 3.488 -2.721 -3.562 8 HE2 MET 1 HE2 MET 1 2.203 -3.345 -2.499 9 HE3 MET 1 HE3 MET 1 2.130 -3.643 -4.249 10 H LYS 2 H LYS 2 4.535 1.570 -0.600 11 HA LYS 2 HA LYS 2 2.927 3.970 -1.401 12 HB2 LYS 2 HB2 LYS 2 5.536 3.969 0.176 13 HB3 LYS 2 HB3 LYS 2 4.825 5.391 -0.584 14 HG2 LYS 2 HG2 LYS 2 2.760 5.113 0.750 15 HG3 LYS 2 HG3 LYS 2 3.475 3.721 1.576 16 HD2 LYS 2 HD2 LYS 2 5.257 5.151 2.507 17 HD3 LYS 2 HD3 LYS 2 4.576 6.561 1.662 18 HE2 LYS 2 HE2 LYS 2 2.444 6.270 2.892 19 HE3 LYS 2 HE3 LYS 2 3.091 4.849 3.723 20 HZ1 LYS 2 HZ1 LYS 2 4.746 6.288 4.788 21 HZ2 LYS 2 HZ2 LYS 2 4.229 7.602 3.947 22 HZ3 LYS 2 HZ3 LYS 2 3.259 6.905 5.070 23 H LYS 3 H LYS 3 4.110 5.351 -2.972 24 HA LYS 3 HA LYS 3 5.530 3.575 -4.931 25 HB2 LYS 3 HB2 LYS 3 3.849 6.048 -5.517 26 HB3 LYS 3 HB3 LYS 3 4.699 5.078 -6.697 27 HG2 LYS 3 HG2 LYS 3 2.633 4.134 -6.907 28 HG3 LYS 3 HG3 LYS 3 3.377 3.043 -5.747 29 HD2 LYS 3 HD2 LYS 3 1.077 3.478 -5.107 30 HD3 LYS 3 HD3 LYS 3 2.144 4.193 -3.897 31 HE2 LYS 3 HE2 LYS 3 1.945 6.311 -5.515 32 HE3 LYS 3 HE3 LYS 3 0.449 5.526 -6.017 33 HZ1 LYS 3 HZ1 LYS 3 0.076 7.077 -4.199 34 HZ2 LYS 3 HZ2 LYS 3 -0.214 5.568 -3.620 35 HZ3 LYS 3 HZ3 LYS 3 1.199 6.354 -3.252 36 H VAL 4 H VAL 4 7.309 4.159 -5.971 37 HA VAL 4 HA VAL 4 8.717 6.656 -5.076 38 HB VAL 4 HB VAL 4 10.189 4.066 -5.547 39 HG11 VAL 4 HG11 VAL 4 11.070 6.708 -4.346 40 HG12 VAL 4 HG12 VAL 4 12.051 5.232 -4.510 41 HG13 VAL 4 HG13 VAL 4 11.529 6.080 -5.950 42 HG21 VAL 4 HG21 VAL 4 9.368 5.304 -2.898 43 HG22 VAL 4 HG22 VAL 4 8.874 3.726 -3.535 44 HG23 VAL 4 HG23 VAL 4 10.563 4.001 -3.105 45 H MET 5 H MET 5 9.813 7.803 -6.621 46 HA MET 5 HA MET 5 9.885 6.721 -9.394 47 HB2 MET 5 HB2 MET 5 7.914 8.005 -9.440 48 HB3 MET 5 HB3 MET 5 8.631 9.318 -8.499 49 HG2 MET 5 HG2 MET 5 8.375 9.931 -10.830 50 HG3 MET 5 HG3 MET 5 10.055 9.965 -10.337 51 HE1 MET 5 HE1 MET 5 8.285 9.824 -13.255 52 HE2 MET 5 HE2 MET 5 8.477 8.272 -14.090 53 HE3 MET 5 HE3 MET 5 7.369 8.392 -12.716 54 H PHE 6 H PHE 6 11.641 7.145 -10.461 55 HA PHE 6 HA PHE 6 13.819 8.651 -9.063 56 HB2 PHE 6 HB2 PHE 6 14.078 6.461 -11.145 57 HB3 PHE 6 HB3 PHE 6 15.356 7.150 -10.150 58 HD1 PHE 6 HD1 PHE 6 15.319 6.715 -7.609 59 HD2 PHE 6 HD2 PHE 6 12.771 4.638 -10.389 60 HE1 PHE 6 HE1 PHE 6 14.747 5.073 -5.841 61 HE2 PHE 6 HE2 PHE 6 12.199 2.996 -8.623 62 HZ PHE 6 HZ PHE 6 13.132 3.246 -6.324 63 H VAL 7 H VAL 7 14.856 10.325 -10.004 64 HA VAL 7 HA VAL 7 14.358 10.979 -12.877 65 HB VAL 7 HB VAL 7 14.245 12.730 -10.437 66 HG11 VAL 7 HG11 VAL 7 14.693 14.750 -11.778 67 HG12 VAL 7 HG12 VAL 7 16.151 13.800 -11.556 68 HG13 VAL 7 HG13 VAL 7 15.283 13.765 -13.122 69 HG21 VAL 7 HG21 VAL 7 12.958 12.892 -13.203 70 HG22 VAL 7 HG22 VAL 7 12.259 12.020 -11.791 71 HG23 VAL 7 HG23 VAL 7 12.488 13.759 -11.719 72 H CYS 8 H CYS 8 16.069 11.145 -14.202 73 HA CYS 8 HA CYS 8 18.785 11.729 -13.085 74 HB2 CYS 8 HB2 CYS 8 18.423 9.300 -13.295 75 HB3 CYS 8 HB3 CYS 8 18.037 9.462 -15.013 76 HG CYS 8 HG CYS 8 20.417 8.398 -14.816 77 H LYS 9 H LYS 9 20.338 12.032 -15.136 78 HA LYS 9 HA LYS 9 19.711 14.511 -16.386 79 HB2 LYS 9 HB2 LYS 9 21.783 12.383 -17.024 80 HB3 LYS 9 HB3 LYS 9 21.690 13.923 -17.889 81 HG2 LYS 9 HG2 LYS 9 22.112 15.205 -15.907 82 HG3 LYS 9 HG3 LYS 9 21.896 13.812 -14.856 83 HD2 LYS 9 HD2 LYS 9 24.252 14.389 -15.060 84 HD3 LYS 9 HD3 LYS 9 23.940 12.769 -15.698 85 HE2 LYS 9 HE2 LYS 9 24.013 13.623 -18.011 86 HE3 LYS 9 HE3 LYS 9 24.209 15.281 -17.418 87 HZ1 LYS 9 HZ1 LYS 9 26.345 14.245 -18.061 88 HZ2 LYS 9 HZ2 LYS 9 26.361 14.637 -16.480 89 HZ3 LYS 9 HZ3 LYS 9 26.181 13.071 -16.932 90 H ARG 10 H ARG 10 19.826 11.422 -18.102 91 HA ARG 10 HA ARG 10 17.707 12.410 -20.004 92 HB2 ARG 10 HB2 ARG 10 18.990 11.654 -21.894 93 HB3 ARG 10 HB3 ARG 10 19.972 12.735 -20.915 94 HG2 ARG 10 HG2 ARG 10 20.855 10.506 -19.781 95 HG3 ARG 10 HG3 ARG 10 20.204 9.723 -21.224 96 HD2 ARG 10 HD2 ARG 10 22.180 12.027 -21.187 97 HD3 ARG 10 HD3 ARG 10 22.633 10.314 -21.287 98 HE ARG 10 HE ARG 10 21.346 10.147 -23.418 99 HH11 ARG 10 HH11 ARG 10 22.763 13.263 -22.626 100 HH12 ARG 10 HH12 ARG 10 22.747 13.771 -24.291 101 HH21 ARG 10 HH21 ARG 10 21.265 10.891 -25.458 102 HH22 ARG 10 HH22 ARG 10 21.942 12.447 -25.862 103 H ASN 11 H ASN 11 17.706 10.520 -17.728 104 HA ASN 11 HA ASN 11 17.190 8.411 -17.041 105 HB2 ASN 11 HB2 ASN 11 15.149 9.613 -17.618 106 HB3 ASN 11 HB3 ASN 11 15.113 8.915 -19.203 107 HD21 ASN 11 HD22 ASN 11 15.619 7.438 -15.825 108 HD22 ASN 11 HD21 ASN 11 14.274 6.376 -16.059 109 H SER 12 H SER 12 19.404 8.232 -18.663 110 HA SER 12 HA SER 12 19.131 5.768 -20.237 111 HB2 SER 12 HB2 SER 12 21.590 6.203 -20.641 112 HB3 SER 12 HB3 SER 12 20.491 7.485 -21.179 113 HG SER 12 HG SER 12 22.395 8.144 -19.805 114 H CYS 13 H CYS 13 20.769 6.856 -17.279 115 HA CYS 13 HA CYS 13 21.079 4.031 -16.351 116 HB2 CYS 13 HB2 CYS 13 23.106 5.008 -17.597 117 HB3 CYS 13 HB3 CYS 13 23.305 6.140 -16.261 118 HG CYS 13 HG CYS 13 25.017 4.073 -16.136 119 H ARG 14 H ARG 14 22.238 4.377 -13.968 120 HA ARG 14 HA ARG 14 21.666 4.591 -11.775 121 HB2 ARG 14 HB2 ARG 14 20.911 7.463 -12.436 122 HB3 ARG 14 HB3 ARG 14 21.370 6.807 -10.859 123 HG2 ARG 14 HG2 ARG 14 23.673 6.492 -11.603 124 HG3 ARG 14 HG3 ARG 14 23.243 6.995 -13.258 125 HD2 ARG 14 HD2 ARG 14 22.422 9.164 -12.339 126 HD3 ARG 14 HD3 ARG 14 23.017 8.705 -10.734 127 HE ARG 14 HE ARG 14 25.326 8.509 -12.065 128 HH11 ARG 14 HH12 ARG 14 22.932 11.074 -12.338 129 HH12 ARG 14 HH11 ARG 14 24.119 12.255 -12.835 130 HH21 ARG 14 HH21 ARG 14 26.756 10.094 -12.453 131 HH22 ARG 14 HH22 ARG 14 26.258 11.694 -12.948 132 H SER 15 H SER 15 19.101 6.731 -12.853 133 HA SER 15 HA SER 15 16.958 5.846 -11.303 134 HB2 SER 15 HB2 SER 15 15.529 6.846 -13.115 135 HB3 SER 15 HB3 SER 15 16.890 7.862 -12.686 136 HG SER 15 HG SER 15 18.027 7.013 -14.605 137 H GLN 16 H GLN 16 17.766 4.618 -14.541 138 HA GLN 16 HA GLN 16 15.644 2.688 -14.725 139 HB2 GLN 16 HB2 GLN 16 18.397 2.864 -16.048 140 HB3 GLN 16 HB3 GLN 16 17.149 1.783 -16.596 141 HG2 GLN 16 HG2 GLN 16 16.884 4.838 -16.564 142 HG3 GLN 16 HG3 GLN 16 17.394 3.874 -17.929 143 HE21 GLN 16 HE21 GLN 16 15.580 5.015 -18.995 144 HE22 GLN 16 HE22 GLN 16 13.972 4.281 -18.860 145 H MET 17 H MET 17 18.949 2.342 -13.380 146 HA MET 17 HA MET 17 18.693 -0.498 -12.731 147 HB2 MET 17 HB2 MET 17 20.470 1.672 -11.519 148 HB3 MET 17 HB3 MET 17 20.578 -0.041 -11.156 149 HG2 MET 17 HG2 MET 17 21.243 -0.525 -13.473 150 HG3 MET 17 HG3 MET 17 21.125 1.194 -13.877 151 HE1 MET 17 HE1 MET 17 23.650 -0.908 -14.101 152 HE2 MET 17 HE2 MET 17 23.766 0.746 -14.752 153 HE3 MET 17 HE3 MET 17 25.014 0.138 -13.634 154 H ALA 18 H ALA 18 17.899 2.555 -11.041 155 HA ALA 18 HA ALA 18 17.386 1.408 -8.479 156 HB1 ALA 18 HB1 ALA 18 16.085 3.900 -9.653 157 HB2 ALA 18 HB2 ALA 18 16.402 3.529 -7.950 158 HB3 ALA 18 HB3 ALA 18 17.750 3.860 -9.050 159 H GLU 19 H GLU 19 15.161 1.976 -11.239 160 HA GLU 19 HA GLU 19 12.866 0.716 -10.007 161 HB2 GLU 19 HB2 GLU 19 12.877 2.180 -12.053 162 HB3 GLU 19 HB3 GLU 19 13.600 0.841 -12.945 163 HG2 GLU 19 HG2 GLU 19 11.532 -0.536 -12.188 164 HG3 GLU 19 HG3 GLU 19 10.850 0.994 -11.640 165 H GLY 20 H GLY 20 15.590 -0.652 -11.895 166 HA2 GLY 20 HA2 GLY 20 14.750 -3.345 -12.017 167 HA3 GLY 20 HA3 GLY 20 16.427 -2.795 -11.935 168 H PHE 21 H PHE 21 16.757 -1.832 -9.398 169 HA PHE 21 HA PHE 21 16.625 -4.251 -7.782 170 HB2 PHE 21 HB2 PHE 21 17.429 -1.380 -7.157 171 HB3 PHE 21 HB3 PHE 21 17.478 -2.672 -5.955 172 HD1 PHE 21 HD1 PHE 21 18.622 -4.935 -6.787 173 HD2 PHE 21 HD2 PHE 21 19.435 -0.997 -8.352 174 HE1 PHE 21 HE1 PHE 21 20.814 -5.726 -7.609 175 HE2 PHE 21 HE2 PHE 21 21.620 -1.779 -9.170 176 HZ PHE 21 HZ PHE 21 22.316 -4.178 -8.817 177 H ALA 22 H ALA 22 14.793 -1.164 -7.610 178 HA ALA 22 HA ALA 22 13.332 -1.937 -5.288 179 HB1 ALA 22 HB1 ALA 22 12.551 -0.019 -7.520 180 HB2 ALA 22 HB2 ALA 22 11.893 -0.048 -5.848 181 HB3 ALA 22 HB3 ALA 22 13.579 0.378 -6.139 182 H LYS 23 H LYS 23 12.469 -2.515 -8.756 183 HA LYS 23 HA LYS 23 9.861 -3.592 -8.106 184 HB2 LYS 23 HB2 LYS 23 9.669 -4.127 -10.368 185 HB3 LYS 23 HB3 LYS 23 10.676 -2.676 -10.314 186 HG2 LYS 23 HG2 LYS 23 12.689 -4.284 -10.540 187 HG3 LYS 23 HG3 LYS 23 11.504 -5.536 -10.932 188 HD2 LYS 23 HD2 LYS 23 10.642 -3.960 -12.777 189 HD3 LYS 23 HD3 LYS 23 12.012 -2.913 -12.397 190 HE2 LYS 23 HE2 LYS 23 12.714 -4.138 -14.261 191 HE3 LYS 23 HE3 LYS 23 13.556 -4.893 -12.898 192 HZ1 LYS 23 HZ1 LYS 23 12.606 -6.517 -14.457 193 HZ2 LYS 23 HZ2 LYS 23 11.899 -6.709 -12.983 194 HZ3 LYS 23 HZ3 LYS 23 11.086 -5.966 -14.202 195 H THR 24 H THR 24 12.987 -4.995 -8.139 196 HA THR 24 HA THR 24 12.090 -7.782 -7.825 197 HB THR 24 HB THR 24 14.859 -6.634 -7.423 198 HG1 THR 24 HG1 THR 24 14.504 -6.177 -9.494 199 HG21 THR 24 HG21 THR 24 13.923 -9.441 -8.173 200 HG22 THR 24 HG22 THR 24 15.613 -8.898 -8.064 201 HG23 THR 24 HG23 THR 24 14.624 -8.967 -6.608 202 H LEU 25 H LEU 25 13.807 -5.458 -5.666 203 HA LEU 25 HA LEU 25 13.665 -7.299 -3.381 204 HB2 LEU 25 HB2 LEU 25 14.707 -4.431 -3.572 205 HB3 LEU 25 HB3 LEU 25 15.035 -5.544 -2.258 206 HG LEU 25 HG LEU 25 15.968 -5.895 -5.151 207 HD11 LEU 25 HD11 LEU 25 18.142 -5.307 -4.322 208 HD12 LEU 25 HD12 LEU 25 17.017 -4.035 -3.794 209 HD13 LEU 25 HD13 LEU 25 17.549 -5.290 -2.651 210 HD21 LEU 25 HD21 LEU 25 15.687 -8.097 -4.104 211 HD22 LEU 25 HD22 LEU 25 17.403 -7.691 -4.229 212 HD23 LEU 25 HD23 LEU 25 16.575 -7.545 -2.661 213 H GLY 26 H GLY 26 11.922 -4.448 -4.447 214 HA2 GLY 26 HA2 GLY 26 10.370 -4.194 -1.944 215 HA3 GLY 26 HA3 GLY 26 10.387 -3.123 -3.346 216 H ALA 27 H ALA 27 10.081 -6.291 -4.514 217 HA ALA 27 HA ALA 27 7.558 -5.982 -5.616 218 HB1 ALA 27 HB1 ALA 27 7.606 -8.443 -5.921 219 HB2 ALA 27 HB2 ALA 27 9.187 -7.726 -6.261 220 HB3 ALA 27 HB3 ALA 27 8.914 -8.568 -4.724 221 H GLY 28 H GLY 28 5.651 -5.547 -4.645 222 HA2 GLY 28 HA2 GLY 28 3.682 -6.160 -3.516 223 HA3 GLY 28 HA3 GLY 28 4.563 -7.355 -2.567 224 H LYS 29 H LYS 29 6.621 -5.018 -2.084 225 HA LYS 29 HA LYS 29 5.244 -3.693 0.215 226 HB2 LYS 29 HB2 LYS 29 8.163 -3.681 -0.695 227 HB3 LYS 29 HB3 LYS 29 7.536 -2.796 0.689 228 HG2 LYS 29 HG2 LYS 29 7.631 -4.585 2.024 229 HG3 LYS 29 HG3 LYS 29 6.633 -5.522 0.930 230 HD2 LYS 29 HD2 LYS 29 8.562 -6.793 1.088 231 HD3 LYS 29 HD3 LYS 29 8.792 -5.945 -0.446 232 HE2 LYS 29 HE2 LYS 29 10.280 -4.296 0.711 233 HE3 LYS 29 HE3 LYS 29 9.955 -5.091 2.256 234 HZ1 LYS 29 HZ1 LYS 29 11.392 -6.354 -0.047 235 HZ2 LYS 29 HZ2 LYS 29 12.054 -5.892 1.374 236 HZ3 LYS 29 HZ3 LYS 29 10.999 -7.131 1.348 237 H ILE 30 H ILE 30 6.665 -2.912 -2.955 238 HA ILE 30 HA ILE 30 5.332 -0.252 -2.849 239 HB ILE 30 HB ILE 30 7.366 0.880 -3.614 240 HG12 ILE 30 HG12 ILE 30 9.579 -0.023 -3.396 241 HG13 ILE 30 HG13 ILE 30 8.965 -1.599 -2.916 242 HG21 ILE 30 HG21 ILE 30 6.837 0.806 -1.191 243 HG22 ILE 30 HG22 ILE 30 7.916 -0.609 -1.013 244 HG23 ILE 30 HG23 ILE 30 8.567 0.943 -1.534 245 HD11 ILE 30 HD11 ILE 30 9.880 -1.305 -5.282 246 HD12 ILE 30 HD12 ILE 30 8.319 -2.117 -5.154 247 HD13 ILE 30 HD13 ILE 30 8.413 -0.400 -5.658 248 H ALA 31 H ALA 31 5.616 0.968 -4.936 249 HA ALA 31 HA ALA 31 5.872 -0.752 -7.332 250 HB1 ALA 31 HB1 ALA 31 3.956 0.336 -8.416 251 HB2 ALA 31 HB2 ALA 31 3.451 -0.526 -6.948 252 HB3 ALA 31 HB3 ALA 31 3.603 1.238 -6.933 253 H VAL 32 H VAL 32 6.896 0.347 -9.117 254 HA VAL 32 HA VAL 32 8.042 3.018 -8.493 255 HB VAL 32 HB VAL 32 10.159 1.850 -9.486 256 HG11 VAL 32 HG11 VAL 32 9.263 1.561 -6.596 257 HG12 VAL 32 HG12 VAL 32 10.944 1.529 -7.183 258 HG13 VAL 32 HG13 VAL 32 9.992 2.986 -7.371 259 HG21 VAL 32 HG21 VAL 32 9.002 -0.566 -8.071 260 HG22 VAL 32 HG22 VAL 32 9.152 -0.399 -9.839 261 HG23 VAL 32 HG23 VAL 32 10.595 -0.400 -8.820 262 H THR 33 H THR 33 8.862 4.218 -10.039 263 HA THR 33 HA THR 33 8.628 3.408 -12.892 264 HB THR 33 HB THR 33 7.710 6.115 -11.863 265 HG1 THR 33 HG1 THR 33 5.593 5.335 -12.213 266 HG21 THR 33 HG21 THR 33 7.195 4.665 -14.504 267 HG22 THR 33 HG22 THR 33 6.590 6.279 -14.056 268 HG23 THR 33 HG23 THR 33 8.320 6.021 -14.289 269 H SER 34 H SER 34 10.284 4.336 -14.203 270 HA SER 34 HA SER 34 12.257 6.149 -12.884 271 HB2 SER 34 HB2 SER 34 13.050 3.895 -13.424 272 HB3 SER 34 HB3 SER 34 12.592 4.137 -15.129 273 HG SER 34 HG SER 34 14.828 4.645 -14.646 274 H CYS 35 H CYS 35 12.814 8.044 -13.847 275 HA CYS 35 HA CYS 35 12.188 8.629 -16.650 276 HB2 CYS 35 HB2 CYS 35 10.720 10.439 -16.287 277 HB3 CYS 35 HB3 CYS 35 10.100 9.094 -15.322 278 HG CYS 35 HG CYS 35 11.394 9.891 -13.094 279 H GLY 36 H GLY 36 12.755 11.150 -16.983 280 HA2 GLY 36 HA2 GLY 36 14.866 12.159 -15.179 281 HA3 GLY 36 HA3 GLY 36 15.366 11.826 -16.852 282 H LEU 37 H LEU 37 15.641 14.421 -16.061 283 HA LEU 37 HA LEU 37 13.243 15.955 -16.564 284 HB2 LEU 37 HB2 LEU 37 14.674 17.896 -16.946 285 HB3 LEU 37 HB3 LEU 37 14.821 17.143 -15.377 286 HG LEU 37 HG LEU 37 16.802 16.195 -17.437 287 HD11 LEU 37 HD11 LEU 37 16.991 18.973 -16.178 288 HD12 LEU 37 HD12 LEU 37 18.279 18.137 -17.078 289 HD13 LEU 37 HD13 LEU 37 16.793 18.618 -17.910 290 HD21 LEU 37 HD21 LEU 37 18.293 16.260 -15.491 291 HD22 LEU 37 HD22 LEU 37 17.052 17.119 -14.553 292 HD23 LEU 37 HD23 LEU 37 16.782 15.441 -15.043 293 H GLU 38 H GLU 38 15.111 14.165 -18.613 294 HA GLU 38 HA GLU 38 13.455 14.784 -20.891 295 HB2 GLU 38 HB2 GLU 38 15.240 15.182 -22.521 296 HB3 GLU 38 HB3 GLU 38 15.115 16.480 -21.337 297 HG2 GLU 38 HG2 GLU 38 17.083 15.622 -20.138 298 HG3 GLU 38 HG3 GLU 38 17.210 14.270 -21.276 299 H SER 39 H SER 39 13.891 13.173 -22.685 300 HA SER 39 HA SER 39 14.900 10.574 -21.618 301 HB2 SER 39 HB2 SER 39 13.437 9.578 -23.390 302 HB3 SER 39 HB3 SER 39 12.572 10.424 -22.094 303 HG SER 39 HG SER 39 11.849 10.921 -24.310 304 H SER 40 H SER 40 16.092 9.244 -22.931 305 HA SER 40 HA SER 40 16.952 10.156 -25.611 306 HB2 SER 40 HB2 SER 40 18.698 11.048 -24.239 307 HB3 SER 40 HB3 SER 40 18.881 9.525 -23.367 308 HG SER 40 HG SER 40 19.333 9.801 -26.191 309 H ARG 41 H ARG 41 18.276 7.516 -23.635 310 HA ARG 41 HA ARG 41 16.382 5.486 -24.371 311 HB2 ARG 41 HB2 ARG 41 18.138 4.026 -25.601 312 HB3 ARG 41 HB3 ARG 41 17.293 5.262 -26.492 313 HG2 ARG 41 HG2 ARG 41 19.588 5.154 -27.176 314 HG3 ARG 41 HG3 ARG 41 19.228 6.732 -26.508 315 HD2 ARG 41 HD2 ARG 41 20.434 6.230 -24.466 316 HD3 ARG 41 HD3 ARG 41 20.638 4.534 -24.924 317 HE ARG 41 HE ARG 41 22.124 6.884 -25.899 318 HH11 ARG 41 HH22 ARG 41 21.484 3.501 -26.617 319 HH12 ARG 41 HH21 ARG 41 22.941 3.349 -27.559 320 HH21 ARG 41 HH11 ARG 41 23.955 6.598 -27.111 321 HH22 ARG 41 HH12 ARG 41 24.296 5.053 -27.823 322 H VAL 42 H VAL 42 16.911 3.397 -23.254 323 HA VAL 42 HA VAL 42 18.465 3.718 -20.804 324 HB VAL 42 HB VAL 42 17.838 1.019 -22.104 325 HG11 VAL 42 HG11 VAL 42 19.525 0.874 -20.298 326 HG12 VAL 42 HG12 VAL 42 18.512 1.881 -19.237 327 HG13 VAL 42 HG13 VAL 42 17.990 0.255 -19.711 328 HG21 VAL 42 HG21 VAL 42 16.222 2.564 -20.061 329 HG22 VAL 42 HG22 VAL 42 15.725 2.187 -21.733 330 HG23 VAL 42 HG23 VAL 42 15.991 0.875 -20.572 331 H HIS 43 H HIS 43 20.653 3.306 -20.386 332 HA HIS 43 HA HIS 43 22.476 3.134 -22.660 333 HB2 HIS 43 HB2 HIS 43 22.872 4.268 -20.364 334 HB3 HIS 43 HB3 HIS 43 23.191 2.659 -19.740 335 HD2 HIS 43 HD2 HIS 43 24.742 5.512 -21.590 336 HE1 HIS 43 HE1 HIS 43 27.559 2.354 -22.006 337 HE2 HIS 43 HE2 HIS 43 27.153 4.853 -22.367 338 HA PRO 44 HA PRO 44 21.651 -1.127 -22.983 339 HB2 PRO 44 HB2 PRO 44 23.536 -2.021 -24.786 340 HB3 PRO 44 HB3 PRO 44 22.187 -0.917 -25.213 341 HG2 PRO 44 HG2 PRO 44 25.039 -0.148 -24.514 342 HG3 PRO 44 HG3 PRO 44 24.078 0.344 -25.949 343 HD2 PRO 44 HD2 PRO 44 24.250 1.918 -23.740 344 HD3 PRO 44 HD3 PRO 44 22.705 1.776 -24.648 345 H THR 45 H THR 45 24.934 -0.123 -22.024 346 HA THR 45 HA THR 45 25.743 -2.649 -20.878 347 HB THR 45 HB THR 45 26.707 0.148 -20.213 348 HG1 THR 45 HG1 THR 45 28.298 -0.366 -21.782 349 HG21 THR 45 HG21 THR 45 27.517 -1.437 -18.551 350 HG22 THR 45 HG22 THR 45 27.933 -2.618 -19.810 351 HG23 THR 45 HG23 THR 45 28.835 -1.078 -19.663 352 H ALA 46 H ALA 46 23.662 -0.020 -19.633 353 HA ALA 46 HA ALA 46 23.829 -0.773 -16.863 354 HB1 ALA 46 HB1 ALA 46 22.831 1.368 -17.722 355 HB2 ALA 46 HB2 ALA 46 21.478 0.433 -18.413 356 HB3 ALA 46 HB3 ALA 46 21.717 0.488 -16.655 357 H ILE 47 H ILE 47 21.666 -1.878 -19.493 358 HA ILE 47 HA ILE 47 20.161 -3.786 -17.936 359 HB ILE 47 HB ILE 47 20.900 -3.680 -20.891 360 HG12 ILE 47 HG12 ILE 47 18.076 -3.197 -20.115 361 HG13 ILE 47 HG13 ILE 47 19.166 -2.012 -19.421 362 HG21 ILE 47 HG21 ILE 47 20.311 -5.988 -20.381 363 HG22 ILE 47 HG22 ILE 47 18.853 -5.472 -19.512 364 HG23 ILE 47 HG23 ILE 47 18.991 -5.232 -21.271 365 HD11 ILE 47 HD11 ILE 47 20.012 -1.359 -21.544 366 HD12 ILE 47 HD12 ILE 47 19.170 -2.699 -22.379 367 HD13 ILE 47 HD13 ILE 47 18.245 -1.372 -21.652 368 H ALA 48 H ALA 48 23.249 -4.120 -19.745 369 HA ALA 48 HA ALA 48 23.627 -6.914 -19.227 370 HB1 ALA 48 HB1 ALA 48 24.836 -5.594 -20.934 371 HB2 ALA 48 HB2 ALA 48 25.711 -4.739 -19.634 372 HB3 ALA 48 HB3 ALA 48 25.939 -6.485 -19.858 373 H MET 49 H MET 49 24.526 -4.048 -17.355 374 HA MET 49 HA MET 49 25.966 -5.447 -15.275 375 HB2 MET 49 HB2 MET 49 24.819 -2.645 -15.464 376 HB3 MET 49 HB3 MET 49 25.851 -3.202 -14.140 377 HG2 MET 49 HG2 MET 49 26.800 -3.488 -17.004 378 HG3 MET 49 HG3 MET 49 26.875 -1.950 -16.183 379 HE1 MET 49 HE1 MET 49 28.935 -4.819 -17.189 380 HE2 MET 49 HE2 MET 49 29.719 -5.465 -15.731 381 HE3 MET 49 HE3 MET 49 27.992 -5.762 -16.013 382 H MET 50 H MET 50 22.543 -4.498 -15.630 383 HA MET 50 HA MET 50 21.856 -5.453 -12.939 384 HB2 MET 50 HB2 MET 50 20.160 -4.886 -15.407 385 HB3 MET 50 HB3 MET 50 19.515 -5.323 -13.825 386 HG2 MET 50 HG2 MET 50 21.093 -2.818 -14.508 387 HG3 MET 50 HG3 MET 50 19.382 -2.926 -14.127 388 HE1 MET 50 HE1 MET 50 19.923 -5.124 -11.388 389 HE2 MET 50 HE2 MET 50 19.430 -3.799 -10.311 390 HE3 MET 50 HE3 MET 50 18.592 -4.024 -11.855 391 H GLU 51 H GLU 51 22.055 -6.945 -16.195 392 HA GLU 51 HA GLU 51 20.934 -9.462 -15.373 393 HB2 GLU 51 HB2 GLU 51 22.659 -8.552 -17.680 394 HB3 GLU 51 HB3 GLU 51 22.304 -10.257 -17.452 395 HG2 GLU 51 HG2 GLU 51 20.060 -8.206 -17.540 396 HG3 GLU 51 HG3 GLU 51 20.774 -8.869 -19.004 397 H GLU 52 H GLU 52 24.136 -8.123 -14.730 398 HA GLU 52 HA GLU 52 25.471 -10.624 -14.162 399 HB2 GLU 52 HB2 GLU 52 25.805 -7.934 -12.793 400 HB3 GLU 52 HB3 GLU 52 26.864 -9.320 -12.596 401 HG2 GLU 52 HG2 GLU 52 27.238 -9.175 -15.156 402 HG3 GLU 52 HG3 GLU 52 26.568 -7.541 -15.014 403 H VAL 53 H VAL 53 23.107 -8.743 -12.348 404 HA VAL 53 HA VAL 53 23.260 -10.611 -10.020 405 HB VAL 53 HB VAL 53 21.973 -8.938 -8.764 406 HG11 VAL 53 HG11 VAL 53 23.797 -7.350 -8.452 407 HG12 VAL 53 HG12 VAL 53 24.439 -8.988 -8.664 408 HG13 VAL 53 HG13 VAL 53 24.522 -7.822 -10.002 409 HG21 VAL 53 HG21 VAL 53 21.690 -6.663 -9.568 410 HG22 VAL 53 HG22 VAL 53 22.434 -7.063 -11.125 411 HG23 VAL 53 HG23 VAL 53 20.859 -7.764 -10.669 412 H GLY 54 H GLY 54 21.847 -10.836 -12.811 413 HA2 GLY 54 HA2 GLY 54 20.093 -12.084 -13.572 414 HA3 GLY 54 HA3 GLY 54 19.747 -12.549 -11.905 415 H ILE 55 H ILE 55 19.660 -9.122 -12.710 416 HA ILE 55 HA ILE 55 16.682 -9.119 -12.387 417 HB ILE 55 HB ILE 55 18.760 -6.983 -11.873 418 HG12 ILE 55 HG12 ILE 55 16.821 -8.505 -10.071 419 HG13 ILE 55 HG13 ILE 55 18.567 -8.706 -10.117 420 HG21 ILE 55 HG21 ILE 55 16.893 -5.535 -11.186 421 HG22 ILE 55 HG22 ILE 55 16.719 -5.953 -12.876 422 HG23 ILE 55 HG23 ILE 55 15.716 -6.780 -11.659 423 HD11 ILE 55 HD11 ILE 55 18.067 -7.421 -8.176 424 HD12 ILE 55 HD12 ILE 55 18.819 -6.316 -9.348 425 HD13 ILE 55 HD13 ILE 55 17.056 -6.288 -9.076 426 H ASP 56 H ASP 56 15.573 -9.016 -14.200 427 HA ASP 56 HA ASP 56 16.814 -8.043 -16.670 428 HB2 ASP 56 HB2 ASP 56 15.515 -10.075 -16.722 429 HB3 ASP 56 HB3 ASP 56 14.095 -9.234 -16.087 430 H ILE 57 H ILE 57 16.844 -6.013 -17.219 431 HA ILE 57 HA ILE 57 14.360 -4.371 -16.969 432 HB ILE 57 HB ILE 57 15.674 -2.350 -16.913 433 HG12 ILE 57 HG12 ILE 57 18.167 -3.804 -16.092 434 HG13 ILE 57 HG13 ILE 57 17.839 -3.578 -17.804 435 HG21 ILE 57 HG21 ILE 57 16.298 -4.150 -14.555 436 HG22 ILE 57 HG22 ILE 57 16.286 -2.370 -14.546 437 HG23 ILE 57 HG23 ILE 57 14.782 -3.246 -14.820 438 HD11 ILE 57 HD11 ILE 57 19.247 -1.748 -16.888 439 HD12 ILE 57 HD12 ILE 57 17.719 -1.156 -17.569 440 HD13 ILE 57 HD13 ILE 57 17.926 -1.282 -15.802 441 H SER 58 H SER 58 15.607 -6.210 -19.168 442 HA SER 58 HA SER 58 16.526 -4.514 -21.291 443 HB2 SER 58 HB2 SER 58 16.230 -6.483 -22.718 444 HB3 SER 58 HB3 SER 58 17.033 -6.899 -21.199 445 HG SER 58 HG SER 58 15.166 -7.766 -20.415 446 H GLY 59 H GLY 59 13.269 -5.251 -20.260 447 HA2 GLY 59 HA2 GLY 59 11.950 -4.268 -22.671 448 HA3 GLY 59 HA3 GLY 59 11.203 -4.676 -21.126 449 H GLN 60 H GLN 60 13.718 -2.416 -20.463 450 HA GLN 60 HA GLN 60 11.720 -0.329 -19.972 451 HB2 GLN 60 HB2 GLN 60 14.680 -0.599 -19.415 452 HB3 GLN 60 HB3 GLN 60 13.841 0.937 -19.214 453 HG2 GLN 60 HG2 GLN 60 12.322 -0.011 -17.560 454 HG3 GLN 60 HG3 GLN 60 13.086 -1.600 -17.733 455 HE21 GLN 60 HE22 GLN 60 12.996 -0.223 -15.200 456 HE22 GLN 60 HE21 GLN 60 14.708 0.104 -14.817 457 H THR 61 H THR 61 11.847 1.739 -20.675 458 HA THR 61 HA THR 61 13.519 2.533 -22.980 459 HB THR 61 HB THR 61 11.562 3.823 -23.888 460 HG1 THR 61 HG1 THR 61 9.491 3.136 -23.285 461 HG21 THR 61 HG21 THR 61 12.295 1.680 -24.928 462 HG22 THR 61 HG22 THR 61 11.150 0.800 -23.894 463 HG23 THR 61 HG23 THR 61 10.554 1.958 -25.103 464 H SER 62 H SER 62 13.693 4.967 -23.049 465 HA SER 62 HA SER 62 13.563 6.020 -20.283 466 HB2 SER 62 HB2 SER 62 15.079 7.664 -20.854 467 HB3 SER 62 HB3 SER 62 15.667 6.167 -21.579 468 HG SER 62 HG SER 62 14.502 7.027 -23.571 469 H ASP 63 H ASP 63 12.418 7.737 -19.581 470 HA ASP 63 HA ASP 63 10.531 9.080 -21.475 471 HB2 ASP 63 HB2 ASP 63 9.824 7.628 -18.923 472 HB3 ASP 63 HB3 ASP 63 8.786 8.857 -19.642 473 HA PRO 64 HA PRO 64 11.664 12.675 -19.159 474 HB2 PRO 64 HB2 PRO 64 10.168 14.578 -20.339 475 HB3 PRO 64 HB3 PRO 64 11.355 13.613 -21.270 476 HG2 PRO 64 HG2 PRO 64 8.360 13.160 -21.043 477 HG3 PRO 64 HG3 PRO 64 9.356 13.220 -22.529 478 HD2 PRO 64 HD2 PRO 64 8.686 10.863 -21.245 479 HD3 PRO 64 HD3 PRO 64 10.197 11.081 -22.176 480 H ILE 65 H ILE 65 11.156 13.936 -17.438 481 HA ILE 65 HA ILE 65 9.236 13.178 -15.566 482 HB ILE 65 HB ILE 65 11.430 14.388 -15.257 483 HG12 ILE 65 HG12 ILE 65 9.035 15.501 -13.804 484 HG13 ILE 65 HG13 ILE 65 9.906 13.998 -13.424 485 HG21 ILE 65 HG21 ILE 65 11.000 16.294 -16.896 486 HG22 ILE 65 HG22 ILE 65 9.875 16.973 -15.698 487 HG23 ILE 65 HG23 ILE 65 11.579 16.804 -15.307 488 HD11 ILE 65 HD11 ILE 65 10.736 15.577 -11.876 489 HD12 ILE 65 HD12 ILE 65 11.988 15.510 -13.129 490 HD13 ILE 65 HD13 ILE 65 10.834 16.863 -13.093 491 H GLU 66 H GLU 66 9.064 15.801 -17.921 492 HA GLU 66 HA GLU 66 6.738 17.073 -16.885 493 HB2 GLU 66 HB2 GLU 66 6.684 18.232 -19.114 494 HB3 GLU 66 HB3 GLU 66 8.196 18.343 -18.219 495 HG2 GLU 66 HG2 GLU 66 9.306 16.772 -19.645 496 HG3 GLU 66 HG3 GLU 66 7.788 16.293 -20.419 497 H ASN 67 H ASN 67 6.800 14.083 -18.560 498 HA ASN 67 HA ASN 67 3.956 14.351 -19.382 499 HB2 ASN 67 HB2 ASN 67 4.311 12.728 -20.843 500 HB3 ASN 67 HB3 ASN 67 6.021 13.006 -20.593 501 HD21 ASN 67 HD22 ASN 67 6.979 11.595 -18.645 502 HD22 ASN 67 HD21 ASN 67 6.241 10.024 -18.427 503 H PHE 68 H PHE 68 5.619 13.526 -16.514 504 HA PHE 68 HA PHE 68 3.652 11.457 -15.703 505 HB2 PHE 68 HB2 PHE 68 6.429 12.212 -14.768 506 HB3 PHE 68 HB3 PHE 68 5.413 11.095 -13.887 507 HD1 PHE 68 HD2 PHE 68 4.214 9.264 -15.680 508 HD2 PHE 68 HD1 PHE 68 8.121 11.082 -15.917 509 HE1 PHE 68 HE2 PHE 68 5.032 7.339 -17.003 510 HE2 PHE 68 HE1 PHE 68 8.925 9.144 -17.253 511 HZ PHE 68 HZ PHE 68 7.393 7.266 -17.781 512 H ASN 69 H ASN 69 3.384 11.325 -13.273 513 HA ASN 69 HA ASN 69 2.109 13.858 -12.338 514 HB2 ASN 69 HB2 ASN 69 0.419 12.212 -11.337 515 HB3 ASN 69 HB3 ASN 69 0.404 12.458 -13.075 516 HD21 ASN 69 HD22 ASN 69 2.002 10.209 -10.718 517 HD22 ASN 69 HD21 ASN 69 1.718 8.783 -11.708 518 H ALA 70 H ALA 70 3.951 14.504 -11.047 519 HA ALA 70 HA ALA 70 5.259 13.024 -9.089 520 HB1 ALA 70 HB1 ALA 70 5.746 15.403 -9.712 521 HB2 ALA 70 HB2 ALA 70 4.319 15.894 -8.777 522 HB3 ALA 70 HB3 ALA 70 5.689 15.128 -7.962 523 H ASP 71 H ASP 71 2.022 14.450 -8.897 524 HA ASP 71 HA ASP 71 1.471 14.421 -6.165 525 HB2 ASP 71 HB2 ASP 71 0.110 15.440 -8.006 526 HB3 ASP 71 HB3 ASP 71 -0.382 13.820 -8.504 527 H ASP 72 H ASP 72 1.509 11.643 -8.341 528 HA ASP 72 HA ASP 72 0.138 9.900 -6.388 529 HB2 ASP 72 HB2 ASP 72 -0.204 9.672 -8.875 530 HB3 ASP 72 HB3 ASP 72 1.487 9.154 -8.992 531 H TYR 73 H TYR 73 3.432 10.775 -7.236 532 HA TYR 73 HA TYR 73 4.586 8.289 -6.193 533 HB2 TYR 73 HB2 TYR 73 5.944 10.793 -7.205 534 HB3 TYR 73 HB3 TYR 73 6.684 9.214 -6.939 535 HD1 TYR 73 HD1 TYR 73 4.504 7.459 -8.248 536 HD2 TYR 73 HD2 TYR 73 6.444 11.114 -9.485 537 HE1 TYR 73 HE1 TYR 73 4.053 6.898 -10.614 538 HE2 TYR 73 HE2 TYR 73 6.048 10.523 -11.855 539 HH TYR 73 HH TYR 73 5.076 8.947 -13.345 540 H ASP 74 H ASP 74 3.978 8.273 -4.079 541 HA ASP 74 HA ASP 74 4.100 10.162 -2.078 542 HB2 ASP 74 HB2 ASP 74 5.088 7.286 -1.883 543 HB3 ASP 74 HB3 ASP 74 4.538 8.278 -0.533 544 H VAL 75 H VAL 75 6.854 8.444 -3.506 545 HA VAL 75 HA VAL 75 8.683 10.392 -2.169 546 HB VAL 75 HB VAL 75 9.357 7.502 -2.766 547 HG11 VAL 75 HG11 VAL 75 11.428 8.041 -1.448 548 HG12 VAL 75 HG12 VAL 75 11.321 8.859 -3.000 549 HG13 VAL 75 HG13 VAL 75 10.972 9.750 -1.514 550 HG21 VAL 75 HG21 VAL 75 9.575 7.388 -0.216 551 HG22 VAL 75 HG22 VAL 75 8.645 8.901 -0.167 552 HG23 VAL 75 HG23 VAL 75 7.930 7.439 -0.866 553 H VAL 76 H VAL 76 10.070 11.438 -3.489 554 HA VAL 76 HA VAL 76 10.527 10.378 -6.258 555 HB VAL 76 HB VAL 76 10.142 13.243 -5.412 556 HG11 VAL 76 HG11 VAL 76 10.765 13.941 -7.669 557 HG12 VAL 76 HG12 VAL 76 12.137 13.164 -6.914 558 HG13 VAL 76 HG13 VAL 76 11.182 12.263 -8.110 559 HG21 VAL 76 HG21 VAL 76 8.094 12.004 -6.029 560 HG22 VAL 76 HG22 VAL 76 8.484 13.243 -7.235 561 HG23 VAL 76 HG23 VAL 76 8.854 11.534 -7.580 562 H ILE 77 H ILE 77 12.587 10.196 -6.875 563 HA ILE 77 HA ILE 77 14.745 11.113 -4.999 564 HB ILE 77 HB ILE 77 14.676 8.619 -6.707 565 HG12 ILE 77 HG12 ILE 77 13.025 8.267 -4.958 566 HG13 ILE 77 HG13 ILE 77 14.426 7.238 -4.740 567 HG21 ILE 77 HG21 ILE 77 16.947 9.436 -6.302 568 HG22 ILE 77 HG22 ILE 77 16.636 9.536 -4.564 569 HG23 ILE 77 HG23 ILE 77 16.653 7.961 -5.385 570 HD11 ILE 77 HD11 ILE 77 13.562 8.170 -2.622 571 HD12 ILE 77 HD12 ILE 77 15.248 8.612 -2.902 572 HD13 ILE 77 HD13 ILE 77 13.955 9.805 -3.167 573 H SER 78 H SER 78 16.231 12.395 -5.938 574 HA SER 78 HA SER 78 16.456 12.423 -8.926 575 HB2 SER 78 HB2 SER 78 16.102 14.618 -7.802 576 HB3 SER 78 HB3 SER 78 17.676 14.402 -6.985 577 HG SER 78 HG SER 78 17.869 15.545 -9.008 578 H LEU 79 H LEU 79 18.280 11.813 -9.900 579 HA LEU 79 HA LEU 79 20.656 10.973 -8.297 580 HB2 LEU 79 HB2 LEU 79 19.533 9.350 -10.622 581 HB3 LEU 79 HB3 LEU 79 20.900 8.978 -9.577 582 HG LEU 79 HG LEU 79 19.068 8.973 -7.643 583 HD11 LEU 79 HD11 LEU 79 17.139 9.652 -9.080 584 HD12 LEU 79 HD12 LEU 79 17.447 8.277 -10.150 585 HD13 LEU 79 HD13 LEU 79 16.930 8.021 -8.458 586 HD21 LEU 79 HD21 LEU 79 18.729 6.563 -8.009 587 HD22 LEU 79 HD22 LEU 79 19.294 6.719 -9.681 588 HD23 LEU 79 HD23 LEU 79 20.417 7.014 -8.322 589 H CYS 80 H CYS 80 20.397 13.442 -9.377 590 HA CYS 80 HA CYS 80 21.168 13.553 -12.170 591 HB2 CYS 80 HB2 CYS 80 21.081 16.000 -11.744 592 HB3 CYS 80 HB3 CYS 80 19.624 15.147 -11.175 593 HG CYS 80 HG CYS 80 20.139 17.023 -9.410 594 H GLY 81 H GLY 81 22.996 14.022 -9.139 595 HA2 GLY 81 HA2 GLY 81 25.362 14.159 -8.876 596 HA3 GLY 81 HA3 GLY 81 25.563 14.100 -10.635 597 H CYS 82 H CYS 82 23.593 16.275 -8.604 598 HA CYS 82 HA CYS 82 23.343 18.493 -8.461 599 HB2 CYS 82 HB2 CYS 82 25.827 18.304 -7.810 600 HB3 CYS 82 HB3 CYS 82 26.172 18.969 -9.418 601 HG CYS 82 HG CYS 82 26.317 20.872 -7.587 602 H GLY 83 H GLY 83 23.689 20.679 -9.898 603 HA2 GLY 83 HA2 GLY 83 23.186 21.782 -11.876 604 HA3 GLY 83 HA3 GLY 83 23.399 20.275 -12.766 605 H VAL 84 H VAL 84 21.168 19.656 -10.350 606 HA VAL 84 HA VAL 84 18.748 20.469 -11.877 607 HB VAL 84 HB VAL 84 19.241 17.613 -10.980 608 HG11 VAL 84 HG11 VAL 84 17.004 18.794 -12.663 609 HG12 VAL 84 HG12 VAL 84 17.210 17.074 -12.236 610 HG13 VAL 84 HG13 VAL 84 16.866 18.238 -10.976 611 HG21 VAL 84 HG21 VAL 84 20.704 17.990 -12.894 612 HG22 VAL 84 HG22 VAL 84 19.354 16.960 -13.344 613 HG23 VAL 84 HG23 VAL 84 19.341 18.674 -13.820 614 H ASN 85 H ASN 85 17.213 21.189 -10.467 615 HA ASN 85 HA ASN 85 17.349 20.330 -7.588 616 HB2 ASN 85 HB2 ASN 85 16.894 23.077 -8.822 617 HB3 ASN 85 HB3 ASN 85 16.709 22.724 -7.106 618 HD21 ASN 85 HD22 ASN 85 18.680 21.885 -5.924 619 HD22 ASN 85 HD21 ASN 85 20.240 22.440 -6.503 620 H LEU 86 H LEU 86 15.262 20.202 -10.230 621 HA LEU 86 HA LEU 86 12.992 20.123 -10.541 622 HB2 LEU 86 HB2 LEU 86 13.259 18.456 -8.008 623 HB3 LEU 86 HB3 LEU 86 11.895 18.422 -9.130 624 HG LEU 86 HG LEU 86 14.699 17.441 -9.653 625 HD11 LEU 86 HD11 LEU 86 12.051 15.969 -9.805 626 HD12 LEU 86 HD12 LEU 86 13.685 15.295 -9.649 627 HD13 LEU 86 HD13 LEU 86 12.922 16.128 -8.271 628 HD21 LEU 86 HD21 LEU 86 12.281 17.756 -11.483 629 HD22 LEU 86 HD22 LEU 86 13.911 18.432 -11.740 630 HD23 LEU 86 HD23 LEU 86 13.664 16.694 -11.859 631 HA PRO 87 HA PRO 87 11.887 23.646 -7.673 632 HB2 PRO 87 HB2 PRO 87 10.975 24.619 -10.386 633 HB3 PRO 87 HB3 PRO 87 11.588 25.569 -8.996 634 HG2 PRO 87 HG2 PRO 87 13.250 24.979 -11.031 635 HG3 PRO 87 HG3 PRO 87 13.821 24.768 -9.342 636 HD2 PRO 87 HD2 PRO 87 12.805 22.653 -11.260 637 HD3 PRO 87 HD3 PRO 87 14.226 22.630 -10.175 638 HA PRO 88 HA PRO 88 7.343 23.086 -9.039 639 HB2 PRO 88 HB2 PRO 88 7.163 20.506 -10.515 640 HB3 PRO 88 HB3 PRO 88 6.474 22.103 -10.931 641 HG2 PRO 88 HG2 PRO 88 8.580 20.997 -12.262 642 HG3 PRO 88 HG3 PRO 88 8.480 22.773 -11.964 643 HD2 PRO 88 HD2 PRO 88 10.025 20.688 -10.402 644 HD3 PRO 88 HD3 PRO 88 10.541 22.290 -11.008 645 H GLU 89 H GLU 89 5.554 20.948 -8.911 646 HA GLU 89 HA GLU 89 5.508 20.112 -6.221 647 HB2 GLU 89 HB2 GLU 89 3.690 18.583 -6.973 648 HB3 GLU 89 HB3 GLU 89 3.503 20.261 -7.476 649 HG2 GLU 89 HG2 GLU 89 4.271 19.725 -9.751 650 HG3 GLU 89 HG3 GLU 89 4.589 18.064 -9.281 651 H TRP 90 H TRP 90 7.551 18.838 -8.576 652 HA TRP 90 HA TRP 90 7.822 16.097 -7.789 653 HB2 TRP 90 HB2 TRP 90 9.650 18.091 -9.141 654 HB3 TRP 90 HB3 TRP 90 10.079 16.401 -8.840 655 HD1 TRP 90 HD1 TRP 90 7.754 18.514 -11.044 656 HE1 TRP 90 HE1 TRP 90 6.505 17.007 -12.690 657 HE3 TRP 90 HE3 TRP 90 9.536 13.999 -9.489 658 HZ2 TRP 90 HZ2 TRP 90 6.369 14.187 -13.321 659 HZ3 TRP 90 HZ3 TRP 90 9.004 11.953 -10.752 660 HH2 TRP 90 HH2 TRP 90 7.430 12.024 -12.670 661 H VAL 91 H VAL 91 8.746 18.947 -6.056 662 HA VAL 91 HA VAL 91 10.263 17.228 -4.119 663 HB VAL 91 HB VAL 91 11.483 19.171 -3.355 664 HG11 VAL 91 HG11 VAL 91 12.936 19.479 -5.311 665 HG12 VAL 91 HG12 VAL 91 12.501 17.786 -5.041 666 HG13 VAL 91 HG13 VAL 91 11.715 18.701 -6.330 667 HG21 VAL 91 HG21 VAL 91 9.861 20.972 -3.907 668 HG22 VAL 91 HG22 VAL 91 11.473 21.294 -4.565 669 HG23 VAL 91 HG23 VAL 91 10.190 20.724 -5.637 670 H THR 92 H THR 92 7.240 18.459 -4.451 671 HA THR 92 HA THR 92 6.937 19.270 -1.603 672 HB THR 92 HB THR 92 4.747 20.042 -2.164 673 HG1 THR 92 HG1 THR 92 3.832 19.705 -4.101 674 HG21 THR 92 HG21 THR 92 6.635 21.575 -2.715 675 HG22 THR 92 HG22 THR 92 6.662 20.937 -4.372 676 HG23 THR 92 HG23 THR 92 5.234 21.805 -3.775 677 H GLN 93 H GLN 93 7.106 16.389 -3.070 678 HA GLN 93 HA GLN 93 4.744 15.061 -2.001 679 HB2 GLN 93 HB2 GLN 93 7.292 13.842 -3.143 680 HB3 GLN 93 HB3 GLN 93 5.745 13.037 -2.873 681 HG2 GLN 93 HG2 GLN 93 6.386 15.168 -4.932 682 HG3 GLN 93 HG3 GLN 93 5.868 13.522 -5.211 683 HE21 GLN 93 HE22 GLN 93 4.762 16.588 -5.486 684 HE22 GLN 93 HE21 GLN 93 3.057 16.337 -5.117 685 H GLU 94 H GLU 94 5.448 12.816 -0.767 686 HA GLU 94 HA GLU 94 5.763 13.886 1.890 687 HB2 GLU 94 HB2 GLU 94 4.258 12.043 1.426 688 HB3 GLU 94 HB3 GLU 94 5.604 10.993 0.980 689 HG2 GLU 94 HG2 GLU 94 6.508 11.046 3.201 690 HG3 GLU 94 HG3 GLU 94 5.347 12.280 3.717 691 H ILE 95 H ILE 95 8.017 12.051 -0.177 692 HA ILE 95 HA ILE 95 10.207 13.128 1.521 693 HB ILE 95 HB ILE 95 10.278 10.266 0.530 694 HG12 ILE 95 HG12 ILE 95 9.776 11.232 3.365 695 HG13 ILE 95 HG13 ILE 95 8.645 10.362 2.325 696 HG21 ILE 95 HG21 ILE 95 12.497 11.369 0.675 697 HG22 ILE 95 HG22 ILE 95 12.168 11.789 2.372 698 HG23 ILE 95 HG23 ILE 95 12.350 10.100 1.858 699 HD11 ILE 95 HD11 ILE 95 11.145 9.263 3.631 700 HD12 ILE 95 HD12 ILE 95 9.467 8.730 3.800 701 HD13 ILE 95 HD13 ILE 95 10.332 8.440 2.277 702 H PHE 96 H PHE 96 11.860 13.955 0.392 703 HA PHE 96 HA PHE 96 12.272 13.134 -2.414 704 HB2 PHE 96 HB2 PHE 96 11.221 15.272 -2.650 705 HB3 PHE 96 HB3 PHE 96 12.288 15.995 -1.446 706 HD1 PHE 96 HD2 PHE 96 12.141 14.626 -4.937 707 HD2 PHE 96 HD1 PHE 96 14.560 16.655 -1.982 708 HE1 PHE 96 HE2 PHE 96 13.910 15.001 -6.620 709 HE2 PHE 96 HE1 PHE 96 16.279 17.104 -3.704 710 HZ PHE 96 HZ PHE 96 15.967 16.273 -6.024 711 H GLU 97 H GLU 97 14.342 12.562 -2.865 712 HA GLU 97 HA GLU 97 16.535 13.423 -1.043 713 HB2 GLU 97 HB2 GLU 97 16.128 10.553 -1.950 714 HB3 GLU 97 HB3 GLU 97 17.528 11.200 -1.089 715 HG2 GLU 97 HG2 GLU 97 16.013 11.815 0.824 716 HG3 GLU 97 HG3 GLU 97 14.687 11.002 -0.019 717 H ASP 98 H ASP 98 18.649 13.375 -1.979 718 HA ASP 98 HA ASP 98 18.755 13.180 -4.959 719 HB2 ASP 98 HB2 ASP 98 18.676 15.505 -4.404 720 HB3 ASP 98 HB3 ASP 98 19.894 15.305 -3.139 721 H TRP 99 H TRP 99 19.855 11.389 -5.345 722 HA TRP 99 HA TRP 99 22.169 10.564 -3.650 723 HB2 TRP 99 HB2 TRP 99 20.672 9.014 -5.775 724 HB3 TRP 99 HB3 TRP 99 21.881 8.388 -4.668 725 HD1 TRP 99 HD1 TRP 99 20.087 10.116 -2.209 726 HE1 TRP 99 HE1 TRP 99 18.075 8.831 -1.228 727 HE3 TRP 99 HE3 TRP 99 19.606 6.514 -5.808 728 HZ2 TRP 99 HZ2 TRP 99 16.486 6.551 -1.927 729 HZ3 TRP 99 HZ3 TRP 99 17.810 4.800 -5.645 730 HH2 TRP 99 HH2 TRP 99 16.239 4.810 -3.705 731 H GLN 100 H GLN 100 23.734 12.030 -4.421 732 HA GLN 100 HA GLN 100 24.243 12.277 -7.281 733 HB2 GLN 100 HB2 GLN 100 25.800 13.295 -4.871 734 HB3 GLN 100 HB3 GLN 100 26.141 13.695 -6.562 735 HG2 GLN 100 HG2 GLN 100 23.772 14.620 -6.728 736 HG3 GLN 100 HG3 GLN 100 23.603 14.361 -4.993 737 HE21 GLN 100 HE22 GLN 100 23.099 16.741 -5.182 738 HE22 GLN 100 HE21 GLN 100 24.479 17.852 -5.071 739 H LEU 101 H LEU 101 25.046 10.587 -8.350 740 HA LEU 101 HA LEU 101 27.321 8.959 -7.234 741 HB2 LEU 101 HB2 LEU 101 25.139 8.108 -9.178 742 HB3 LEU 101 HB3 LEU 101 26.449 7.108 -8.557 743 HG LEU 101 HG LEU 101 24.068 8.152 -6.979 744 HD11 LEU 101 HD11 LEU 101 23.543 5.795 -6.750 745 HD12 LEU 101 HD12 LEU 101 23.662 6.238 -8.461 746 HD13 LEU 101 HD13 LEU 101 24.998 5.349 -7.677 747 HD21 LEU 101 HD21 LEU 101 24.954 6.816 -5.093 748 HD22 LEU 101 HD22 LEU 101 26.453 6.542 -6.019 749 HD23 LEU 101 HD23 LEU 101 26.014 8.170 -5.474 750 H GLU 102 H GLU 102 28.596 7.853 -8.956 751 HA GLU 102 HA GLU 102 29.854 9.623 -10.791 752 HB2 GLU 102 HB2 GLU 102 29.803 6.585 -10.550 753 HB3 GLU 102 HB3 GLU 102 30.899 7.484 -11.581 754 HG2 GLU 102 HG2 GLU 102 32.124 6.882 -9.677 755 HG3 GLU 102 HG3 GLU 102 31.836 8.614 -9.574 756 H ASP 103 H ASP 103 30.075 9.039 -13.132 757 HA ASP 103 HA ASP 103 27.392 8.589 -14.422 758 HB2 ASP 103 HB2 ASP 103 28.278 10.947 -14.316 759 HB3 ASP 103 HB3 ASP 103 29.542 10.458 -15.437 760 HA PRO 104 HA PRO 104 30.165 5.230 -15.711 761 HB2 PRO 104 HB2 PRO 104 27.567 3.964 -16.504 762 HB3 PRO 104 HB3 PRO 104 28.958 3.263 -15.608 763 HG2 PRO 104 HG2 PRO 104 26.763 4.008 -14.255 764 HG3 PRO 104 HG3 PRO 104 28.389 4.492 -13.645 765 HD2 PRO 104 HD2 PRO 104 26.483 6.126 -15.367 766 HD3 PRO 104 HD3 PRO 104 27.252 6.575 -13.819 767 H ASP 105 H ASP 105 28.113 6.952 -17.945 768 HA ASP 105 HA ASP 105 28.353 5.301 -20.239 769 HB2 ASP 105 HB2 ASP 105 26.740 7.080 -20.150 770 HB3 ASP 105 HB3 ASP 105 28.004 8.297 -19.959 771 H GLY 106 H GLY 106 30.145 4.576 -21.146 772 HA2 GLY 106 HA2 GLY 106 32.087 4.646 -22.424 773 HA3 GLY 106 HA3 GLY 106 32.193 6.391 -22.181 774 H GLN 107 H GLN 107 31.858 4.590 -19.248 775 HA GLN 107 HA GLN 107 34.664 5.221 -18.522 776 HB2 GLN 107 HB2 GLN 107 32.407 4.226 -16.764 777 HB3 GLN 107 HB3 GLN 107 33.979 4.806 -16.226 778 HG2 GLN 107 HG2 GLN 107 31.908 6.509 -17.675 779 HG3 GLN 107 HG3 GLN 107 32.039 6.326 -15.938 780 HE21 GLN 107 HE22 GLN 107 32.071 8.709 -16.248 781 HE22 GLN 107 HE21 GLN 107 33.668 9.464 -16.370 782 H SER 108 H SER 108 33.109 2.565 -16.932 783 HA SER 108 HA SER 108 34.311 0.353 -18.376 784 HB2 SER 108 HB2 SER 108 35.952 -0.319 -16.766 785 HB3 SER 108 HB3 SER 108 36.301 1.382 -17.089 786 HG SER 108 HG SER 108 36.318 1.023 -14.865 787 H LEU 109 H LEU 109 33.906 -1.693 -17.262 788 HA LEU 109 HA LEU 109 31.209 -1.737 -16.252 789 HB2 LEU 109 HB2 LEU 109 33.281 -3.976 -16.307 790 HB3 LEU 109 HB3 LEU 109 31.550 -4.129 -16.098 791 HG LEU 109 HG LEU 109 31.875 -4.749 -18.284 792 HD11 LEU 109 HD11 LEU 109 31.252 -1.804 -18.629 793 HD12 LEU 109 HD12 LEU 109 30.778 -3.139 -19.696 794 HD13 LEU 109 HD13 LEU 109 30.087 -3.020 -18.066 795 HD21 LEU 109 HD21 LEU 109 33.597 -2.383 -19.027 796 HD22 LEU 109 HD22 LEU 109 34.234 -3.975 -18.536 797 HD23 LEU 109 HD23 LEU 109 33.214 -3.821 -19.969 798 H GLU 110 H GLU 110 34.337 -1.721 -14.678 799 HA GLU 110 HA GLU 110 33.381 -2.312 -12.007 800 HB2 GLU 110 HB2 GLU 110 35.756 -2.442 -12.721 801 HB3 GLU 110 HB3 GLU 110 35.793 -0.683 -12.906 802 HG2 GLU 110 HG2 GLU 110 35.351 -0.402 -10.496 803 HG3 GLU 110 HG3 GLU 110 35.169 -2.147 -10.303 804 H VAL 111 H VAL 111 33.624 0.752 -13.876 805 HA VAL 111 HA VAL 111 32.644 2.377 -11.658 806 HB VAL 111 HB VAL 111 32.917 2.908 -14.622 807 HG11 VAL 111 HG11 VAL 111 31.124 4.362 -13.861 808 HG12 VAL 111 HG12 VAL 111 32.038 4.802 -12.398 809 HG13 VAL 111 HG13 VAL 111 32.600 5.318 -13.998 810 HG21 VAL 111 HG21 VAL 111 35.033 2.707 -13.305 811 HG22 VAL 111 HG22 VAL 111 34.779 4.354 -13.884 812 HG23 VAL 111 HG23 VAL 111 34.444 3.945 -12.184 813 H PHE 112 H PHE 112 31.016 0.716 -14.416 814 HA PHE 112 HA PHE 112 28.350 1.616 -13.719 815 HB2 PHE 112 HB2 PHE 112 29.474 -0.765 -15.201 816 HB3 PHE 112 HB3 PHE 112 27.805 -0.773 -14.664 817 HD1 PHE 112 HD2 PHE 112 26.115 0.701 -15.583 818 HD2 PHE 112 HD1 PHE 112 30.162 0.756 -17.049 819 HE1 PHE 112 HE2 PHE 112 25.369 1.966 -17.586 820 HE2 PHE 112 HE1 PHE 112 29.421 2.046 -19.034 821 HZ PHE 112 HZ PHE 112 27.034 2.688 -19.270 822 H ARG 113 H ARG 113 30.167 -1.306 -12.669 823 HA ARG 113 HA ARG 113 28.232 -2.276 -10.794 824 HB2 ARG 113 HB2 ARG 113 31.261 -2.532 -10.965 825 HB3 ARG 113 HB3 ARG 113 30.306 -3.389 -9.747 826 HG2 ARG 113 HG2 ARG 113 29.133 -4.674 -11.362 827 HG3 ARG 113 HG3 ARG 113 29.603 -3.630 -12.686 828 HD2 ARG 113 HD2 ARG 113 30.827 -5.690 -12.859 829 HD3 ARG 113 HD3 ARG 113 31.940 -4.380 -12.493 830 HE ARG 113 HE ARG 113 32.312 -5.230 -10.327 831 HH11 ARG 113 HH11 ARG 113 29.967 -7.319 -11.955 832 HH12 ARG 113 HH12 ARG 113 30.365 -8.663 -10.908 833 HH21 ARG 113 HH21 ARG 113 32.654 -6.957 -8.997 834 HH22 ARG 113 HH22 ARG 113 31.787 -8.436 -9.242 835 H THR 114 H THR 114 30.840 0.095 -10.321 836 HA THR 114 HA THR 114 30.457 0.582 -7.527 837 HB THR 114 HB THR 114 31.451 2.411 -9.746 838 HG1 THR 114 HG1 THR 114 32.770 0.659 -9.407 839 HG21 THR 114 HG21 THR 114 32.569 3.673 -7.915 840 HG22 THR 114 HG22 THR 114 30.817 3.873 -7.942 841 HG23 THR 114 HG23 THR 114 31.570 2.789 -6.736 842 H VAL 115 H VAL 115 28.872 2.216 -10.350 843 HA VAL 115 HA VAL 115 27.126 3.808 -8.656 844 HB VAL 115 HB VAL 115 27.049 3.039 -11.589 845 HG11 VAL 115 HG11 VAL 115 25.274 4.721 -11.906 846 HG12 VAL 115 HG12 VAL 115 24.681 3.362 -10.956 847 HG13 VAL 115 HG13 VAL 115 25.103 4.896 -10.140 848 HG21 VAL 115 HG21 VAL 115 28.773 4.619 -10.966 849 HG22 VAL 115 HG22 VAL 115 27.480 5.533 -11.768 850 HG23 VAL 115 HG23 VAL 115 27.624 5.583 -10.011 851 H ARG 116 H ARG 116 26.595 0.708 -10.363 852 HA ARG 116 HA ARG 116 23.928 0.245 -9.675 853 HB2 ARG 116 HB2 ARG 116 25.416 -1.070 -11.264 854 HB3 ARG 116 HB3 ARG 116 26.156 -1.845 -9.862 855 HG2 ARG 116 HG2 ARG 116 23.800 -2.615 -9.218 856 HG3 ARG 116 HG3 ARG 116 23.268 -2.026 -10.802 857 HD2 ARG 116 HD2 ARG 116 23.654 -4.380 -11.008 858 HD3 ARG 116 HD3 ARG 116 24.970 -3.546 -11.846 859 HE ARG 116 HE ARG 116 25.447 -4.306 -9.000 860 HH11 ARG 116 HH11 ARG 116 25.750 -5.534 -12.242 861 HH12 ARG 116 HH12 ARG 116 27.320 -6.254 -11.970 862 HH21 ARG 116 HH21 ARG 116 27.279 -5.538 -8.570 863 HH22 ARG 116 HH22 ARG 116 27.972 -6.494 -9.843 864 H GLY 117 H GLY 117 26.772 -0.733 -7.708 865 HA2 GLY 117 HA2 GLY 117 25.354 -1.975 -5.573 866 HA3 GLY 117 HA3 GLY 117 26.961 -1.243 -5.464 867 H GLN 118 H GLN 118 26.314 1.472 -5.979 868 HA GLN 118 HA GLN 118 25.262 2.306 -3.400 869 HB2 GLN 118 HB2 GLN 118 25.943 3.891 -5.909 870 HB3 GLN 118 HB3 GLN 118 25.486 4.604 -4.354 871 HG2 GLN 118 HG2 GLN 118 27.444 3.719 -3.256 872 HG3 GLN 118 HG3 GLN 118 27.884 2.747 -4.662 873 HE21 GLN 118 HE22 GLN 118 28.570 3.866 -6.637 874 HE22 GLN 118 HE21 GLN 118 29.162 5.535 -6.585 875 H VAL 119 H VAL 119 23.892 2.556 -6.755 876 HA VAL 119 HA VAL 119 21.347 3.583 -6.022 877 HB VAL 119 HB VAL 119 21.968 1.606 -8.262 878 HG11 VAL 119 HG11 VAL 119 19.921 2.630 -9.314 879 HG12 VAL 119 HG12 VAL 119 19.584 1.607 -7.913 880 HG13 VAL 119 HG13 VAL 119 19.563 3.383 -7.740 881 HG21 VAL 119 HG21 VAL 119 23.224 3.755 -8.461 882 HG22 VAL 119 HG22 VAL 119 21.999 3.580 -9.708 883 HG23 VAL 119 HG23 VAL 119 21.691 4.646 -8.313 884 H LYS 120 H LYS 120 22.360 0.123 -6.155 885 HA LYS 120 HA LYS 120 19.910 -1.037 -5.337 886 HB2 LYS 120 HB2 LYS 120 21.897 -2.299 -6.187 887 HB3 LYS 120 HB3 LYS 120 22.758 -1.965 -4.688 888 HG2 LYS 120 HG2 LYS 120 20.943 -3.158 -3.421 889 HG3 LYS 120 HG3 LYS 120 20.159 -3.529 -4.954 890 HD2 LYS 120 HD2 LYS 120 22.286 -4.764 -5.635 891 HD3 LYS 120 HD3 LYS 120 22.905 -4.443 -3.997 892 HE2 LYS 120 HE2 LYS 120 20.763 -5.511 -3.101 893 HE3 LYS 120 HE3 LYS 120 20.400 -6.024 -4.755 894 HZ1 LYS 120 HZ1 LYS 120 22.528 -7.287 -4.735 895 HZ2 LYS 120 HZ2 LYS 120 22.831 -6.816 -3.198 896 HZ3 LYS 120 HZ3 LYS 120 21.562 -7.788 -3.518 897 H GLU 121 H GLU 121 22.704 -0.148 -3.205 898 HA GLU 121 HA GLU 121 21.243 -0.781 -0.821 899 HB2 GLU 121 HB2 GLU 121 23.169 -0.475 0.222 900 HB3 GLU 121 HB3 GLU 121 23.869 -0.291 -1.367 901 HG2 GLU 121 HG2 GLU 121 24.772 1.481 -0.193 902 HG3 GLU 121 HG3 GLU 121 23.471 2.248 -1.088 903 H ARG 122 H ARG 122 21.491 2.340 -2.543 904 HA ARG 122 HA ARG 122 20.070 3.779 -0.507 905 HB2 ARG 122 HB2 ARG 122 20.254 4.213 -3.527 906 HB3 ARG 122 HB3 ARG 122 19.521 5.348 -2.408 907 HG2 ARG 122 HG2 ARG 122 22.444 4.573 -2.145 908 HG3 ARG 122 HG3 ARG 122 21.879 5.840 -3.224 909 HD2 ARG 122 HD2 ARG 122 22.564 6.945 -1.285 910 HD3 ARG 122 HD3 ARG 122 20.792 6.952 -1.226 911 HE ARG 122 HE ARG 122 22.050 4.685 0.192 912 HH11 ARG 122 HH21 ARG 122 21.101 8.036 0.749 913 HH12 ARG 122 HH22 ARG 122 21.139 7.809 2.474 914 HH21 ARG 122 HH11 ARG 122 22.042 4.465 2.191 915 HH22 ARG 122 HH12 ARG 122 21.666 5.771 3.329 916 H VAL 123 H VAL 123 18.813 2.034 -3.398 917 HA VAL 123 HA VAL 123 16.063 2.412 -2.692 918 HB VAL 123 HB VAL 123 17.522 0.339 -4.366 919 HG11 VAL 123 HG11 VAL 123 14.523 0.422 -3.894 920 HG12 VAL 123 HG12 VAL 123 15.404 -0.539 -5.122 921 HG13 VAL 123 HG13 VAL 123 15.630 -0.892 -3.419 922 HG21 VAL 123 HG21 VAL 123 17.292 2.576 -5.282 923 HG22 VAL 123 HG22 VAL 123 16.294 1.427 -6.182 924 HG23 VAL 123 HG23 VAL 123 15.526 2.530 -5.020 925 H GLU 124 H GLU 124 18.199 -0.394 -1.745 926 HA GLU 124 HA GLU 124 16.123 -1.656 -0.226 927 HB2 GLU 124 HB2 GLU 124 19.117 -1.707 0.248 928 HB3 GLU 124 HB3 GLU 124 17.905 -2.771 1.010 929 HG2 GLU 124 HG2 GLU 124 17.222 -3.598 -1.183 930 HG3 GLU 124 HG3 GLU 124 18.513 -2.679 -1.952 931 H ASN 125 H ASN 125 18.333 0.936 0.722 932 HA ASN 125 HA ASN 125 17.385 0.859 3.405 933 HB2 ASN 125 HB2 ASN 125 19.252 2.054 3.737 934 HB3 ASN 125 HB3 ASN 125 19.506 2.136 2.008 935 HD21 ASN 125 HD22 ASN 125 18.383 3.916 0.816 936 HD22 ASN 125 HD21 ASN 125 18.342 5.473 1.646 937 H LEU 126 H LEU 126 16.165 2.405 0.563 938 HA LEU 126 HA LEU 126 14.317 4.170 1.978 939 HB2 LEU 126 HB2 LEU 126 15.238 4.869 -0.151 940 HB3 LEU 126 HB3 LEU 126 14.716 3.381 -0.935 941 HG LEU 126 HG LEU 126 12.355 4.036 -0.680 942 HD11 LEU 126 HD11 LEU 126 12.514 5.483 1.347 943 HD12 LEU 126 HD12 LEU 126 13.478 6.661 0.422 944 HD13 LEU 126 HD13 LEU 126 11.780 6.348 0.005 945 HD21 LEU 126 HD21 LEU 126 13.557 4.607 -2.711 946 HD22 LEU 126 HD22 LEU 126 12.426 5.917 -2.287 947 HD23 LEU 126 HD23 LEU 126 14.166 6.097 -1.960 948 H ILE 127 H ILE 127 13.925 1.086 0.086 949 HA ILE 127 HA ILE 127 11.080 1.052 0.561 950 HB ILE 127 HB ILE 127 11.110 -1.295 -0.068 951 HG12 ILE 127 HG12 ILE 127 14.122 -1.068 0.104 952 HG13 ILE 127 HG13 ILE 127 13.049 -2.209 0.922 953 HG21 ILE 127 HG21 ILE 127 12.923 0.352 -1.909 954 HG22 ILE 127 HG22 ILE 127 11.750 -0.904 -2.379 955 HG23 ILE 127 HG23 ILE 127 11.183 0.637 -1.728 956 HD11 ILE 127 HD11 ILE 127 14.242 -3.352 -0.824 957 HD12 ILE 127 HD12 ILE 127 12.542 -3.226 -1.309 958 HD13 ILE 127 HD13 ILE 127 13.770 -2.146 -2.035 959 H ALA 128 H ALA 128 13.743 -0.041 2.611 960 HA ALA 128 HA ALA 128 12.103 -1.512 4.398 961 HB1 ALA 128 HB1 ALA 128 14.075 -1.319 5.913 962 HB2 ALA 128 HB2 ALA 128 14.569 -1.722 4.260 963 HB3 ALA 128 HB3 ALA 128 14.758 -0.058 4.865 964 H LYS 129 H LYS 129 12.416 1.967 4.024 965 HA LYS 129 HA LYS 129 11.039 2.414 6.644 966 HB2 LYS 129 HB2 LYS 129 11.613 4.740 6.447 967 HB3 LYS 129 HB3 LYS 129 13.025 3.679 6.490 968 HG2 LYS 129 HG2 LYS 129 13.393 4.020 4.102 969 HG3 LYS 129 HG3 LYS 129 11.922 4.997 3.976 970 HD2 LYS 129 HD2 LYS 129 12.912 6.640 5.578 971 HD3 LYS 129 HD3 LYS 129 14.390 5.659 5.654 972 HE2 LYS 129 HE2 LYS 129 14.726 5.984 3.210 973 HE3 LYS 129 HE3 LYS 129 13.248 6.958 3.132 974 HZ1 LYS 129 HZ1 LYS 129 14.336 8.561 4.662 975 HZ2 LYS 129 HZ2 LYS 129 15.715 7.677 4.645 976 HZ3 LYS 129 HZ3 LYS 129 15.178 8.393 3.264 977 H ILE 130 H ILE 130 10.471 2.896 3.194 978 HA ILE 130 HA ILE 130 7.783 3.970 3.900 979 HB ILE 130 HB ILE 130 7.527 4.757 1.608 980 HG12 ILE 130 HG12 ILE 130 9.510 5.135 0.217 981 HG13 ILE 130 HG13 ILE 130 10.465 4.091 1.251 982 HG21 ILE 130 HG21 ILE 130 9.978 5.850 3.022 983 HG22 ILE 130 HG22 ILE 130 8.844 6.703 1.951 984 HG23 ILE 130 HG23 ILE 130 8.299 6.139 3.528 985 HD11 ILE 130 HD11 ILE 130 9.766 2.983 -0.830 986 HD12 ILE 130 HD12 ILE 130 9.088 2.155 0.586 987 HD13 ILE 130 HD13 ILE 130 8.060 3.226 -0.397 988 H SER 131 H SER 131 8.701 0.888 3.466 989 HA SER 131 HA SER 131 6.704 -0.233 1.807 990 HB2 SER 131 HB2 SER 131 6.898 -2.227 3.269 991 HB3 SER 131 HB3 SER 131 8.458 -1.589 2.721 992 HG SER 131 HG SER 131 7.280 -0.839 5.203 Start of MODEL 10 1 H MET 1 H1 MET 1 2.904 0.295 2.170 2 HA MET 1 HA MET 1 3.621 -0.292 0.072 3 HB2 MET 1 HB2 MET 1 1.700 -1.799 -0.445 4 HB3 MET 1 HB3 MET 1 0.714 -0.384 -0.852 5 HG2 MET 1 HG2 MET 1 2.350 0.208 -2.649 6 HG3 MET 1 HG3 MET 1 3.333 -1.187 -2.191 7 HE1 MET 1 HE1 MET 1 3.439 -2.621 -4.320 8 HE2 MET 1 HE2 MET 1 2.128 -2.620 -5.518 9 HE3 MET 1 HE3 MET 1 2.893 -1.089 -5.041 10 H LYS 2 H LYS 2 4.573 1.494 -0.726 11 HA LYS 2 HA LYS 2 2.891 3.843 -1.564 12 HB2 LYS 2 HB2 LYS 2 5.489 3.901 0.032 13 HB3 LYS 2 HB3 LYS 2 4.847 5.299 -0.817 14 HG2 LYS 2 HG2 LYS 2 2.717 5.130 0.435 15 HG3 LYS 2 HG3 LYS 2 3.379 3.774 1.365 16 HD2 LYS 2 HD2 LYS 2 5.123 5.219 2.304 17 HD3 LYS 2 HD3 LYS 2 4.527 6.599 1.349 18 HE2 LYS 2 HE2 LYS 2 2.350 6.492 2.465 19 HE3 LYS 2 HE3 LYS 2 2.821 5.040 3.355 20 HZ1 LYS 2 HZ1 LYS 2 4.473 6.344 4.552 21 HZ2 LYS 2 HZ2 LYS 2 4.188 7.677 3.635 22 HZ3 LYS 2 HZ3 LYS 2 3.041 7.125 4.672 23 H LYS 3 H LYS 3 4.099 5.302 -3.083 24 HA LYS 3 HA LYS 3 5.432 3.578 -5.141 25 HB2 LYS 3 HB2 LYS 3 3.820 6.121 -5.591 26 HB3 LYS 3 HB3 LYS 3 4.617 5.178 -6.827 27 HG2 LYS 3 HG2 LYS 3 2.496 4.394 -7.045 28 HG3 LYS 3 HG3 LYS 3 3.226 3.168 -6.024 29 HD2 LYS 3 HD2 LYS 3 0.957 3.644 -5.288 30 HD3 LYS 3 HD3 LYS 3 2.089 4.131 -4.036 31 HE2 LYS 3 HE2 LYS 3 1.972 6.490 -5.158 32 HE3 LYS 3 HE3 LYS 3 0.538 5.878 -5.979 33 HZ1 LYS 3 HZ1 LYS 3 -0.109 6.987 -3.951 34 HZ2 LYS 3 HZ2 LYS 3 -0.334 5.392 -3.656 35 HZ3 LYS 3 HZ3 LYS 3 1.005 6.180 -3.060 36 H VAL 4 H VAL 4 7.233 4.157 -6.157 37 HA VAL 4 HA VAL 4 8.663 6.627 -5.244 38 HB VAL 4 HB VAL 4 10.120 4.019 -5.601 39 HG11 VAL 4 HG11 VAL 4 11.502 6.006 -6.011 40 HG12 VAL 4 HG12 VAL 4 10.992 6.692 -4.450 41 HG13 VAL 4 HG13 VAL 4 11.964 5.202 -4.528 42 HG21 VAL 4 HG21 VAL 4 10.424 4.042 -3.132 43 HG22 VAL 4 HG22 VAL 4 9.207 5.332 -3.019 44 HG23 VAL 4 HG23 VAL 4 8.762 3.726 -3.624 45 H MET 5 H MET 5 9.766 7.748 -6.782 46 HA MET 5 HA MET 5 9.872 6.623 -9.544 47 HB2 MET 5 HB2 MET 5 7.885 7.908 -9.591 48 HB3 MET 5 HB3 MET 5 8.623 9.235 -8.683 49 HG2 MET 5 HG2 MET 5 8.381 9.864 -10.995 50 HG3 MET 5 HG3 MET 5 10.077 9.776 -10.561 51 HE1 MET 5 HE1 MET 5 8.177 8.029 -14.185 52 HE2 MET 5 HE2 MET 5 7.162 8.169 -12.736 53 HE3 MET 5 HE3 MET 5 8.023 9.590 -13.376 54 H PHE 6 H PHE 6 11.636 7.020 -10.604 55 HA PHE 6 HA PHE 6 13.794 8.601 -9.252 56 HB2 PHE 6 HB2 PHE 6 14.096 6.379 -11.290 57 HB3 PHE 6 HB3 PHE 6 15.358 7.107 -10.303 58 HD1 PHE 6 HD1 PHE 6 15.305 6.735 -7.747 59 HD2 PHE 6 HD2 PHE 6 12.833 4.551 -10.511 60 HE1 PHE 6 HE1 PHE 6 14.754 5.114 -5.951 61 HE2 PHE 6 HE2 PHE 6 12.229 2.963 -8.693 62 HZ PHE 6 HZ PHE 6 13.159 3.267 -6.399 63 H VAL 7 H VAL 7 14.617 10.345 -10.179 64 HA VAL 7 HA VAL 7 14.185 10.905 -13.074 65 HB VAL 7 HB VAL 7 14.092 12.666 -10.661 66 HG11 VAL 7 HG11 VAL 7 16.107 13.652 -11.620 67 HG12 VAL 7 HG12 VAL 7 15.368 13.671 -13.248 68 HG13 VAL 7 HG13 VAL 7 14.733 14.685 -11.941 69 HG21 VAL 7 HG21 VAL 7 12.523 13.878 -12.072 70 HG22 VAL 7 HG22 VAL 7 12.960 12.896 -13.488 71 HG23 VAL 7 HG23 VAL 7 12.134 12.163 -12.073 72 H CYS 8 H CYS 8 15.876 10.907 -14.387 73 HA CYS 8 HA CYS 8 18.622 11.486 -13.313 74 HB2 CYS 8 HB2 CYS 8 18.515 9.130 -13.590 75 HB3 CYS 8 HB3 CYS 8 17.722 9.247 -15.159 76 HG CYS 8 HG CYS 8 20.281 8.321 -15.257 77 H LYS 9 H LYS 9 20.088 12.336 -15.164 78 HA LYS 9 HA LYS 9 18.706 14.607 -16.237 79 HB2 LYS 9 HB2 LYS 9 21.277 14.097 -15.583 80 HB3 LYS 9 HB3 LYS 9 21.443 13.957 -17.323 81 HG2 LYS 9 HG2 LYS 9 20.230 16.329 -15.808 82 HG3 LYS 9 HG3 LYS 9 21.910 16.225 -16.285 83 HD2 LYS 9 HD2 LYS 9 19.557 16.354 -18.236 84 HD3 LYS 9 HD3 LYS 9 20.587 17.693 -17.742 85 HE2 LYS 9 HE2 LYS 9 22.591 16.378 -18.614 86 HE3 LYS 9 HE3 LYS 9 21.446 15.229 -19.321 87 HZ1 LYS 9 HZ1 LYS 9 21.589 18.139 -19.965 88 HZ2 LYS 9 HZ2 LYS 9 22.065 16.923 -20.948 89 HZ3 LYS 9 HZ3 LYS 9 20.474 17.122 -20.594 90 H ARG 10 H ARG 10 19.901 11.729 -17.944 91 HA ARG 10 HA ARG 10 17.931 12.341 -20.127 92 HB2 ARG 10 HB2 ARG 10 19.298 11.758 -21.850 93 HB3 ARG 10 HB3 ARG 10 20.235 12.832 -20.848 94 HG2 ARG 10 HG2 ARG 10 20.591 9.793 -20.955 95 HG3 ARG 10 HG3 ARG 10 21.528 10.984 -21.850 96 HD2 ARG 10 HD2 ARG 10 22.156 11.997 -19.576 97 HD3 ARG 10 HD3 ARG 10 21.521 10.477 -18.872 98 HE ARG 10 HE ARG 10 23.385 9.902 -20.987 99 HH11 ARG 10 HH11 ARG 10 23.507 11.252 -17.743 100 HH12 ARG 10 HH12 ARG 10 25.123 10.642 -17.469 101 HH21 ARG 10 HH21 ARG 10 25.396 9.024 -20.468 102 HH22 ARG 10 HH22 ARG 10 26.130 9.502 -18.928 103 H ASN 11 H ASN 11 17.910 10.486 -17.760 104 HA ASN 11 HA ASN 11 17.338 8.359 -17.123 105 HB2 ASN 11 HB2 ASN 11 15.361 9.655 -17.636 106 HB3 ASN 11 HB3 ASN 11 15.284 9.020 -19.256 107 HD21 ASN 11 HD22 ASN 11 15.707 7.385 -15.931 108 HD22 ASN 11 HD21 ASN 11 14.313 6.406 -16.203 109 H SER 12 H SER 12 19.497 8.123 -18.984 110 HA SER 12 HA SER 12 19.027 5.563 -20.346 111 HB2 SER 12 HB2 SER 12 21.504 5.908 -20.855 112 HB3 SER 12 HB3 SER 12 20.457 7.250 -21.369 113 HG SER 12 HG SER 12 22.382 7.883 -20.091 114 H CYS 13 H CYS 13 20.588 6.770 -17.435 115 HA CYS 13 HA CYS 13 21.257 4.020 -16.478 116 HB2 CYS 13 HB2 CYS 13 23.576 4.890 -15.968 117 HB3 CYS 13 HB3 CYS 13 23.191 4.876 -17.687 118 HG CYS 13 HG CYS 13 22.616 7.367 -17.990 119 H ARG 14 H ARG 14 22.262 4.332 -14.131 120 HA ARG 14 HA ARG 14 21.645 4.443 -11.947 121 HB2 ARG 14 HB2 ARG 14 20.906 7.360 -12.458 122 HB3 ARG 14 HB3 ARG 14 21.381 6.603 -10.927 123 HG2 ARG 14 HG2 ARG 14 23.651 6.143 -12.010 124 HG3 ARG 14 HG3 ARG 14 23.111 7.155 -13.360 125 HD2 ARG 14 HD2 ARG 14 22.543 8.922 -11.499 126 HD3 ARG 14 HD3 ARG 14 23.562 7.948 -10.458 127 HE ARG 14 HE ARG 14 25.480 8.487 -11.801 128 HH11 ARG 14 HH11 ARG 14 22.665 10.341 -12.949 129 HH12 ARG 14 HH12 ARG 14 23.666 11.179 -14.108 130 HH21 ARG 14 HH21 ARG 14 26.588 9.846 -12.972 131 HH22 ARG 14 HH22 ARG 14 25.832 10.759 -14.278 132 H SER 15 H SER 15 19.122 6.640 -12.999 133 HA SER 15 HA SER 15 16.972 5.793 -11.458 134 HB2 SER 15 HB2 SER 15 15.546 6.784 -13.291 135 HB3 SER 15 HB3 SER 15 16.914 7.792 -12.852 136 HG SER 15 HG SER 15 18.069 6.858 -14.752 137 H GLN 16 H GLN 16 17.768 4.481 -14.671 138 HA GLN 16 HA GLN 16 15.581 2.586 -14.799 139 HB2 GLN 16 HB2 GLN 16 18.338 2.535 -16.139 140 HB3 GLN 16 HB3 GLN 16 16.975 1.535 -16.624 141 HG2 GLN 16 HG2 GLN 16 16.952 4.608 -16.711 142 HG3 GLN 16 HG3 GLN 16 17.383 3.565 -18.058 143 HE21 GLN 16 HE22 GLN 16 15.520 5.092 -18.809 144 HE22 GLN 16 HE21 GLN 16 13.930 4.314 -18.780 145 H MET 17 H MET 17 18.847 2.279 -13.441 146 HA MET 17 HA MET 17 18.585 -0.566 -12.738 147 HB2 MET 17 HB2 MET 17 20.579 1.589 -11.895 148 HB3 MET 17 HB3 MET 17 20.741 -0.126 -11.539 149 HG2 MET 17 HG2 MET 17 21.439 -0.644 -13.660 150 HG3 MET 17 HG3 MET 17 20.327 0.481 -14.418 151 HE1 MET 17 HE1 MET 17 23.401 0.821 -11.885 152 HE2 MET 17 HE2 MET 17 23.940 -0.182 -13.261 153 HE3 MET 17 HE3 MET 17 24.614 1.445 -13.025 154 H ALA 18 H ALA 18 18.078 2.564 -11.092 155 HA ALA 18 HA ALA 18 17.584 1.626 -8.461 156 HB1 ALA 18 HB1 ALA 18 17.886 4.032 -9.224 157 HB2 ALA 18 HB2 ALA 18 16.215 3.979 -9.815 158 HB3 ALA 18 HB3 ALA 18 16.555 3.746 -8.089 159 H GLU 19 H GLU 19 15.281 2.084 -11.177 160 HA GLU 19 HA GLU 19 13.013 0.897 -9.899 161 HB2 GLU 19 HB2 GLU 19 13.198 2.148 -12.174 162 HB3 GLU 19 HB3 GLU 19 13.623 0.573 -12.848 163 HG2 GLU 19 HG2 GLU 19 11.438 -0.245 -11.586 164 HG3 GLU 19 HG3 GLU 19 11.051 1.470 -11.512 165 H GLY 20 H GLY 20 15.712 -0.638 -11.671 166 HA2 GLY 20 HA2 GLY 20 14.873 -3.332 -11.697 167 HA3 GLY 20 HA3 GLY 20 16.543 -2.766 -11.641 168 H PHE 21 H PHE 21 16.983 -1.789 -9.131 169 HA PHE 21 HA PHE 21 16.896 -4.160 -7.466 170 HB2 PHE 21 HB2 PHE 21 17.171 -1.383 -6.309 171 HB3 PHE 21 HB3 PHE 21 17.876 -2.886 -5.743 172 HD1 PHE 21 HD1 PHE 21 19.607 -4.038 -7.472 173 HD2 PHE 21 HD2 PHE 21 18.475 0.110 -7.401 174 HE1 PHE 21 HE1 PHE 21 21.667 -3.447 -8.745 175 HE2 PHE 21 HE2 PHE 21 20.480 0.679 -8.770 176 HZ PHE 21 HZ PHE 21 22.051 -1.069 -9.416 177 H ALA 22 H ALA 22 14.888 -1.184 -7.495 178 HA ALA 22 HA ALA 22 13.389 -1.875 -5.176 179 HB1 ALA 22 HB1 ALA 22 12.631 -0.058 -7.496 180 HB2 ALA 22 HB2 ALA 22 11.972 -0.013 -5.826 181 HB3 ALA 22 HB3 ALA 22 13.656 0.414 -6.143 182 H LYS 23 H LYS 23 12.521 -2.469 -8.645 183 HA LYS 23 HA LYS 23 9.946 -3.593 -8.027 184 HB2 LYS 23 HB2 LYS 23 9.850 -4.231 -10.310 185 HB3 LYS 23 HB3 LYS 23 10.695 -2.682 -10.215 186 HG2 LYS 23 HG2 LYS 23 12.861 -4.135 -10.291 187 HG3 LYS 23 HG3 LYS 23 11.822 -5.421 -10.888 188 HD2 LYS 23 HD2 LYS 23 12.162 -2.645 -12.136 189 HD3 LYS 23 HD3 LYS 23 12.977 -4.116 -12.687 190 HE2 LYS 23 HE2 LYS 23 10.938 -5.116 -13.420 191 HE3 LYS 23 HE3 LYS 23 9.946 -3.873 -12.638 192 HZ1 LYS 23 HZ1 LYS 23 11.846 -3.282 -14.866 193 HZ2 LYS 23 HZ2 LYS 23 10.223 -3.476 -15.057 194 HZ3 LYS 23 HZ3 LYS 23 10.820 -2.219 -14.182 195 H THR 24 H THR 24 13.076 -4.970 -7.989 196 HA THR 24 HA THR 24 12.218 -7.762 -7.645 197 HB THR 24 HB THR 24 14.946 -6.565 -7.122 198 HG1 THR 24 HG1 THR 24 14.660 -6.121 -9.210 199 HG21 THR 24 HG21 THR 24 14.677 -8.897 -6.295 200 HG22 THR 24 HG22 THR 24 14.082 -9.386 -7.899 201 HG23 THR 24 HG23 THR 24 15.756 -8.827 -7.692 202 H LEU 25 H LEU 25 13.879 -5.404 -5.454 203 HA LEU 25 HA LEU 25 13.674 -7.228 -3.174 204 HB2 LEU 25 HB2 LEU 25 14.709 -4.356 -3.352 205 HB3 LEU 25 HB3 LEU 25 15.003 -5.457 -2.019 206 HG LEU 25 HG LEU 25 15.992 -5.891 -4.882 207 HD11 LEU 25 HD11 LEU 25 18.116 -5.193 -4.117 208 HD12 LEU 25 HD12 LEU 25 16.979 -3.945 -3.553 209 HD13 LEU 25 HD13 LEU 25 17.581 -5.178 -2.424 210 HD21 LEU 25 HD21 LEU 25 16.580 -7.408 -2.311 211 HD22 LEU 25 HD22 LEU 25 15.730 -8.040 -3.736 212 HD23 LEU 25 HD23 LEU 25 17.444 -7.614 -3.850 213 H GLY 26 H GLY 26 12.008 -4.331 -4.257 214 HA2 GLY 26 HA2 GLY 26 10.379 -4.076 -1.804 215 HA3 GLY 26 HA3 GLY 26 10.455 -2.982 -3.187 216 H ALA 27 H ALA 27 10.131 -6.225 -4.285 217 HA ALA 27 HA ALA 27 7.712 -5.815 -5.569 218 HB1 ALA 27 HB1 ALA 27 7.649 -8.283 -5.814 219 HB2 ALA 27 HB2 ALA 27 9.287 -7.662 -6.049 220 HB3 ALA 27 HB3 ALA 27 8.858 -8.445 -4.520 221 H GLY 28 H GLY 28 5.774 -5.275 -4.784 222 HA2 GLY 28 HA2 GLY 28 3.721 -5.567 -3.719 223 HA3 GLY 28 HA3 GLY 28 4.389 -6.866 -2.730 224 H LYS 29 H LYS 29 6.685 -4.873 -2.040 225 HA LYS 29 HA LYS 29 5.452 -3.486 0.267 226 HB2 LYS 29 HB2 LYS 29 8.303 -3.446 -0.840 227 HB3 LYS 29 HB3 LYS 29 7.773 -2.679 0.650 228 HG2 LYS 29 HG2 LYS 29 7.174 -4.829 1.619 229 HG3 LYS 29 HG3 LYS 29 7.517 -5.666 0.107 230 HD2 LYS 29 HD2 LYS 29 9.348 -6.071 1.598 231 HD3 LYS 29 HD3 LYS 29 9.894 -5.092 0.251 232 HE2 LYS 29 HE2 LYS 29 10.921 -4.250 2.253 233 HE3 LYS 29 HE3 LYS 29 9.762 -3.041 1.691 234 HZ1 LYS 29 HZ1 LYS 29 8.207 -3.778 3.416 235 HZ2 LYS 29 HZ2 LYS 29 9.169 -5.051 3.834 236 HZ3 LYS 29 HZ3 LYS 29 9.645 -3.526 4.152 237 H ILE 30 H ILE 30 6.764 -2.706 -2.929 238 HA ILE 30 HA ILE 30 5.390 -0.085 -2.867 239 HB ILE 30 HB ILE 30 7.442 1.060 -3.760 240 HG12 ILE 30 HG12 ILE 30 9.654 0.248 -3.337 241 HG13 ILE 30 HG13 ILE 30 9.061 -1.285 -2.693 242 HG21 ILE 30 HG21 ILE 30 8.517 1.389 -1.652 243 HG22 ILE 30 HG22 ILE 30 6.773 1.232 -1.371 244 HG23 ILE 30 HG23 ILE 30 7.872 -0.119 -0.988 245 HD11 ILE 30 HD11 ILE 30 10.090 -1.298 -4.997 246 HD12 ILE 30 HD12 ILE 30 8.503 -2.056 -4.882 247 HD13 ILE 30 HD13 ILE 30 8.663 -0.419 -5.581 248 H ALA 31 H ALA 31 5.510 1.046 -4.965 249 HA ALA 31 HA ALA 31 5.870 -0.741 -7.332 250 HB1 ALA 31 HB1 ALA 31 3.482 -0.509 -7.121 251 HB2 ALA 31 HB2 ALA 31 3.606 1.246 -6.901 252 HB3 ALA 31 HB3 ALA 31 4.013 0.509 -8.463 253 H VAL 32 H VAL 32 6.969 0.238 -9.111 254 HA VAL 32 HA VAL 32 8.112 2.923 -8.584 255 HB VAL 32 HB VAL 32 10.250 1.711 -9.457 256 HG11 VAL 32 HG11 VAL 32 9.270 1.595 -6.590 257 HG12 VAL 32 HG12 VAL 32 10.971 1.505 -7.120 258 HG13 VAL 32 HG13 VAL 32 10.047 2.957 -7.433 259 HG21 VAL 32 HG21 VAL 32 9.243 -0.547 -9.735 260 HG22 VAL 32 HG22 VAL 32 10.664 -0.498 -8.690 261 HG23 VAL 32 HG23 VAL 32 9.053 -0.632 -7.965 262 H THR 33 H THR 33 8.918 4.082 -10.132 263 HA THR 33 HA THR 33 8.730 3.188 -12.971 264 HB THR 33 HB THR 33 7.698 5.872 -11.991 265 HG1 THR 33 HG1 THR 33 5.619 4.992 -12.307 266 HG21 THR 33 HG21 THR 33 7.257 4.355 -14.613 267 HG22 THR 33 HG22 THR 33 6.565 5.938 -14.190 268 HG23 THR 33 HG23 THR 33 8.302 5.779 -14.419 269 H SER 34 H SER 34 10.261 4.204 -14.345 270 HA SER 34 HA SER 34 12.253 6.054 -13.083 271 HB2 SER 34 HB2 SER 34 13.098 3.813 -13.620 272 HB3 SER 34 HB3 SER 34 12.619 4.035 -15.320 273 HG SER 34 HG SER 34 14.857 4.617 -14.807 274 H CYS 35 H CYS 35 12.777 7.934 -14.086 275 HA CYS 35 HA CYS 35 12.008 8.513 -16.857 276 HB2 CYS 35 HB2 CYS 35 10.565 10.327 -16.371 277 HB3 CYS 35 HB3 CYS 35 9.981 8.943 -15.422 278 HG CYS 35 HG CYS 35 11.384 9.677 -13.232 279 H GLY 36 H GLY 36 12.562 10.998 -17.285 280 HA2 GLY 36 HA2 GLY 36 14.585 12.106 -15.446 281 HA3 GLY 36 HA3 GLY 36 15.183 11.712 -17.065 282 H LEU 37 H LEU 37 15.378 14.283 -16.202 283 HA LEU 37 HA LEU 37 13.086 15.830 -17.118 284 HB2 LEU 37 HB2 LEU 37 14.568 17.783 -17.099 285 HB3 LEU 37 HB3 LEU 37 14.294 16.990 -15.573 286 HG LEU 37 HG LEU 37 16.777 16.202 -17.110 287 HD11 LEU 37 HD11 LEU 37 18.036 18.091 -16.128 288 HD12 LEU 37 HD12 LEU 37 16.792 18.682 -17.242 289 HD13 LEU 37 HD13 LEU 37 16.527 18.777 -15.486 290 HD21 LEU 37 HD21 LEU 37 16.269 15.101 -14.953 291 HD22 LEU 37 HD22 LEU 37 17.697 16.126 -14.775 292 HD23 LEU 37 HD23 LEU 37 16.119 16.676 -14.166 293 H GLU 38 H GLU 38 15.506 14.152 -18.724 294 HA GLU 38 HA GLU 38 14.355 14.919 -21.326 295 HB2 GLU 38 HB2 GLU 38 17.379 14.719 -20.947 296 HB3 GLU 38 HB3 GLU 38 16.517 14.972 -22.455 297 HG2 GLU 38 HG2 GLU 38 15.661 17.155 -21.599 298 HG3 GLU 38 HG3 GLU 38 16.639 16.939 -20.138 299 H SER 39 H SER 39 14.952 13.232 -22.999 300 HA SER 39 HA SER 39 15.510 10.540 -21.831 301 HB2 SER 39 HB2 SER 39 14.169 9.634 -23.715 302 HB3 SER 39 HB3 SER 39 13.231 10.605 -22.564 303 HG SER 39 HG SER 39 12.775 11.114 -24.798 304 H SER 40 H SER 40 16.735 9.113 -23.059 305 HA SER 40 HA SER 40 18.175 10.095 -25.474 306 HB2 SER 40 HB2 SER 40 19.731 10.655 -23.788 307 HB3 SER 40 HB3 SER 40 19.452 9.148 -22.907 308 HG SER 40 HG SER 40 20.864 9.532 -25.347 309 H ARG 41 H ARG 41 18.974 7.206 -23.672 310 HA ARG 41 HA ARG 41 17.089 5.387 -24.912 311 HB2 ARG 41 HB2 ARG 41 18.552 4.075 -26.217 312 HB3 ARG 41 HB3 ARG 41 18.880 5.712 -26.729 313 HG2 ARG 41 HG2 ARG 41 20.630 3.968 -24.942 314 HG3 ARG 41 HG3 ARG 41 20.905 4.390 -26.623 315 HD2 ARG 41 HD2 ARG 41 21.225 6.768 -25.983 316 HD3 ARG 41 HD3 ARG 41 20.995 6.311 -24.278 317 HE ARG 41 HE ARG 41 23.094 4.846 -25.737 318 HH11 ARG 41 HH11 ARG 41 22.608 7.677 -23.709 319 HH12 ARG 41 HH12 ARG 41 24.221 7.512 -22.992 320 HH21 ARG 41 HH21 ARG 41 25.157 4.862 -24.900 321 HH22 ARG 41 HH22 ARG 41 25.597 6.025 -23.673 322 H VAL 42 H VAL 42 17.115 3.303 -23.802 323 HA VAL 42 HA VAL 42 18.289 3.383 -21.141 324 HB VAL 42 HB VAL 42 16.468 1.603 -22.510 325 HG11 VAL 42 HG11 VAL 42 18.646 0.081 -21.051 326 HG12 VAL 42 HG12 VAL 42 17.062 -0.537 -21.574 327 HG13 VAL 42 HG13 VAL 42 18.243 -0.044 -22.789 328 HG21 VAL 42 HG21 VAL 42 15.917 1.032 -20.201 329 HG22 VAL 42 HG22 VAL 42 17.451 1.725 -19.652 330 HG23 VAL 42 HG23 VAL 42 16.176 2.789 -20.361 331 H HIS 43 H HIS 43 20.291 2.845 -20.437 332 HA HIS 43 HA HIS 43 22.296 2.566 -22.478 333 HB2 HIS 43 HB2 HIS 43 22.511 3.733 -20.206 334 HB3 HIS 43 HB3 HIS 43 22.761 2.129 -19.505 335 HD2 HIS 43 HD2 HIS 43 24.424 4.874 -21.443 336 HE1 HIS 43 HE1 HIS 43 27.154 1.628 -21.718 337 HE2 HIS 43 HE2 HIS 43 26.799 4.111 -22.228 338 HA PRO 44 HA PRO 44 21.712 -1.716 -22.811 339 HB2 PRO 44 HB2 PRO 44 23.694 -2.498 -24.565 340 HB3 PRO 44 HB3 PRO 44 22.310 -1.459 -25.033 341 HG2 PRO 44 HG2 PRO 44 25.095 -0.559 -24.223 342 HG3 PRO 44 HG3 PRO 44 24.170 -0.101 -25.688 343 HD2 PRO 44 HD2 PRO 44 24.170 1.462 -23.470 344 HD3 PRO 44 HD3 PRO 44 22.676 1.247 -24.438 345 H THR 45 H THR 45 24.878 -0.520 -21.713 346 HA THR 45 HA THR 45 25.804 -3.074 -20.654 347 HB THR 45 HB THR 45 26.731 -0.264 -19.986 348 HG1 THR 45 HG1 THR 45 28.336 -0.791 -21.576 349 HG21 THR 45 HG21 THR 45 28.013 -3.014 -19.649 350 HG22 THR 45 HG22 THR 45 28.893 -1.461 -19.495 351 HG23 THR 45 HG23 THR 45 27.601 -1.860 -18.364 352 H ALA 46 H ALA 46 23.772 -0.448 -19.368 353 HA ALA 46 HA ALA 46 23.852 -1.136 -16.619 354 HB1 ALA 46 HB1 ALA 46 22.693 0.864 -17.591 355 HB2 ALA 46 HB2 ALA 46 21.454 -0.222 -18.297 356 HB3 ALA 46 HB3 ALA 46 21.621 -0.065 -16.538 357 H ILE 47 H ILE 47 21.807 -2.491 -19.221 358 HA ILE 47 HA ILE 47 20.348 -4.388 -17.650 359 HB ILE 47 HB ILE 47 21.219 -4.394 -20.553 360 HG12 ILE 47 HG12 ILE 47 18.345 -3.970 -19.839 361 HG13 ILE 47 HG13 ILE 47 19.408 -2.667 -19.330 362 HG21 ILE 47 HG21 ILE 47 19.170 -6.204 -19.202 363 HG22 ILE 47 HG22 ILE 47 19.386 -6.034 -20.961 364 HG23 ILE 47 HG23 ILE 47 20.687 -6.703 -19.983 365 HD11 ILE 47 HD11 ILE 47 20.115 -2.151 -21.448 366 HD12 ILE 47 HD12 ILE 47 19.560 -3.701 -22.163 367 HD13 ILE 47 HD13 ILE 47 18.381 -2.481 -21.647 368 H ALA 48 H ALA 48 23.529 -4.706 -19.297 369 HA ALA 48 HA ALA 48 23.940 -7.468 -18.630 370 HB1 ALA 48 HB1 ALA 48 26.256 -7.012 -19.248 371 HB2 ALA 48 HB2 ALA 48 25.147 -6.237 -20.400 372 HB3 ALA 48 HB3 ALA 48 25.968 -5.260 -19.152 373 H MET 49 H MET 49 24.700 -4.472 -16.918 374 HA MET 49 HA MET 49 26.172 -5.728 -14.770 375 HB2 MET 49 HB2 MET 49 25.022 -2.938 -15.073 376 HB3 MET 49 HB3 MET 49 26.145 -3.421 -13.798 377 HG2 MET 49 HG2 MET 49 26.924 -3.897 -16.683 378 HG3 MET 49 HG3 MET 49 26.950 -2.273 -16.035 379 HE1 MET 49 HE1 MET 49 29.856 -5.701 -14.981 380 HE2 MET 49 HE2 MET 49 28.209 -5.849 -14.369 381 HE3 MET 49 HE3 MET 49 28.503 -5.786 -16.133 382 H MET 50 H MET 50 22.782 -4.799 -15.193 383 HA MET 50 HA MET 50 22.004 -5.553 -12.469 384 HB2 MET 50 HB2 MET 50 20.413 -5.205 -15.049 385 HB3 MET 50 HB3 MET 50 19.704 -5.515 -13.466 386 HG2 MET 50 HG2 MET 50 21.311 -3.063 -14.260 387 HG3 MET 50 HG3 MET 50 19.579 -3.151 -13.993 388 HE1 MET 50 HE1 MET 50 19.774 -5.024 -11.031 389 HE2 MET 50 HE2 MET 50 19.195 -3.551 -10.214 390 HE3 MET 50 HE3 MET 50 18.567 -3.963 -11.814 391 H GLU 51 H GLU 51 22.327 -7.280 -15.607 392 HA GLU 51 HA GLU 51 21.108 -9.679 -14.637 393 HB2 GLU 51 HB2 GLU 51 22.894 -8.998 -16.975 394 HB3 GLU 51 HB3 GLU 51 22.543 -10.680 -16.617 395 HG2 GLU 51 HG2 GLU 51 20.281 -8.675 -16.872 396 HG3 GLU 51 HG3 GLU 51 21.028 -9.401 -18.290 397 H GLU 52 H GLU 52 24.405 -8.461 -14.053 398 HA GLU 52 HA GLU 52 25.584 -10.939 -13.225 399 HB2 GLU 52 HB2 GLU 52 25.934 -8.267 -11.821 400 HB3 GLU 52 HB3 GLU 52 27.001 -9.663 -11.753 401 HG2 GLU 52 HG2 GLU 52 27.209 -9.291 -14.350 402 HG3 GLU 52 HG3 GLU 52 26.622 -7.667 -13.961 403 H VAL 53 H VAL 53 23.219 -8.882 -11.646 404 HA VAL 53 HA VAL 53 23.141 -10.600 -9.215 405 HB VAL 53 HB VAL 53 23.661 -8.333 -8.763 406 HG11 VAL 53 HG11 VAL 53 22.747 -7.123 -10.629 407 HG12 VAL 53 HG12 VAL 53 21.078 -7.522 -10.119 408 HG13 VAL 53 HG13 VAL 53 22.104 -6.455 -9.132 409 HG21 VAL 53 HG21 VAL 53 22.205 -9.553 -7.135 410 HG22 VAL 53 HG22 VAL 53 22.140 -7.786 -7.052 411 HG23 VAL 53 HG23 VAL 53 20.808 -8.675 -7.814 412 H GLY 54 H GLY 54 21.899 -10.853 -12.091 413 HA2 GLY 54 HA2 GLY 54 20.199 -12.120 -12.908 414 HA3 GLY 54 HA3 GLY 54 19.727 -12.500 -11.245 415 H ILE 55 H ILE 55 19.740 -9.141 -12.313 416 HA ILE 55 HA ILE 55 16.754 -9.087 -12.147 417 HB ILE 55 HB ILE 55 18.813 -6.933 -11.621 418 HG12 ILE 55 HG12 ILE 55 16.859 -8.380 -9.776 419 HG13 ILE 55 HG13 ILE 55 18.602 -8.626 -9.822 420 HG21 ILE 55 HG21 ILE 55 16.889 -5.501 -10.986 421 HG22 ILE 55 HG22 ILE 55 16.797 -5.935 -12.680 422 HG23 ILE 55 HG23 ILE 55 15.762 -6.769 -11.490 423 HD11 ILE 55 HD11 ILE 55 18.942 -6.247 -9.105 424 HD12 ILE 55 HD12 ILE 55 17.179 -6.119 -8.870 425 HD13 ILE 55 HD13 ILE 55 18.114 -7.274 -7.916 426 H ASP 56 H ASP 56 15.564 -8.437 -13.842 427 HA ASP 56 HA ASP 56 16.974 -7.670 -16.352 428 HB2 ASP 56 HB2 ASP 56 15.675 -9.679 -16.528 429 HB3 ASP 56 HB3 ASP 56 14.247 -8.878 -15.859 430 H ILE 57 H ILE 57 16.932 -5.657 -16.993 431 HA ILE 57 HA ILE 57 14.519 -3.966 -16.499 432 HB ILE 57 HB ILE 57 15.887 -1.958 -16.431 433 HG12 ILE 57 HG12 ILE 57 18.357 -3.719 -16.168 434 HG13 ILE 57 HG13 ILE 57 17.866 -2.963 -17.687 435 HG21 ILE 57 HG21 ILE 57 15.182 -3.146 -14.346 436 HG22 ILE 57 HG22 ILE 57 16.772 -3.939 -14.292 437 HG23 ILE 57 HG23 ILE 57 16.638 -2.173 -14.140 438 HD11 ILE 57 HD11 ILE 57 19.572 -1.622 -16.588 439 HD12 ILE 57 HD12 ILE 57 18.044 -0.727 -16.703 440 HD13 ILE 57 HD13 ILE 57 18.554 -1.432 -15.154 441 H SER 58 H SER 58 15.634 -5.764 -18.846 442 HA SER 58 HA SER 58 16.201 -3.923 -20.996 443 HB2 SER 58 HB2 SER 58 16.072 -5.884 -22.433 444 HB3 SER 58 HB3 SER 58 17.005 -6.247 -20.977 445 HG SER 58 HG SER 58 15.274 -7.336 -20.123 446 H GLY 59 H GLY 59 13.164 -5.018 -19.675 447 HA2 GLY 59 HA2 GLY 59 11.497 -4.275 -21.934 448 HA3 GLY 59 HA3 GLY 59 10.974 -4.587 -20.282 449 H GLN 60 H GLN 60 13.362 -2.236 -20.018 450 HA GLN 60 HA GLN 60 11.376 -0.023 -19.883 451 HB2 GLN 60 HB2 GLN 60 14.100 -0.419 -18.594 452 HB3 GLN 60 HB3 GLN 60 13.191 1.078 -18.528 453 HG2 GLN 60 HG2 GLN 60 11.564 0.253 -17.100 454 HG3 GLN 60 HG3 GLN 60 11.806 -1.427 -17.596 455 HE21 GLN 60 HE22 GLN 60 14.040 1.107 -16.215 456 HE22 GLN 60 HE21 GLN 60 14.635 0.013 -14.957 457 H THR 61 H THR 61 12.079 2.073 -20.561 458 HA THR 61 HA THR 61 14.425 2.420 -22.209 459 HB THR 61 HB THR 61 12.904 1.625 -23.915 460 HG1 THR 61 HG1 THR 61 13.199 3.356 -25.296 461 HG21 THR 61 HG21 THR 61 10.723 2.280 -22.962 462 HG22 THR 61 HG22 THR 61 11.126 3.997 -23.217 463 HG23 THR 61 HG23 THR 61 10.926 2.906 -24.605 464 H SER 62 H SER 62 14.164 4.896 -23.034 465 HA SER 62 HA SER 62 13.996 6.242 -20.399 466 HB2 SER 62 HB2 SER 62 15.474 7.871 -21.079 467 HB3 SER 62 HB3 SER 62 16.125 6.299 -21.572 468 HG SER 62 HG SER 62 15.102 6.889 -23.731 469 H ASP 63 H ASP 63 12.613 7.719 -19.826 470 HA ASP 63 HA ASP 63 10.820 8.963 -21.866 471 HB2 ASP 63 HB2 ASP 63 10.012 7.363 -19.433 472 HB3 ASP 63 HB3 ASP 63 8.934 8.531 -20.192 473 HA PRO 64 HA PRO 64 11.557 12.603 -19.607 474 HB2 PRO 64 HB2 PRO 64 9.904 14.387 -20.797 475 HB3 PRO 64 HB3 PRO 64 11.207 13.547 -21.693 476 HG2 PRO 64 HG2 PRO 64 8.264 12.772 -21.541 477 HG3 PRO 64 HG3 PRO 64 9.284 12.975 -23.003 478 HD2 PRO 64 HD2 PRO 64 8.867 10.528 -21.838 479 HD3 PRO 64 HD3 PRO 64 10.426 10.963 -22.609 480 H ILE 65 H ILE 65 11.046 13.742 -17.850 481 HA ILE 65 HA ILE 65 9.080 13.113 -15.992 482 HB ILE 65 HB ILE 65 11.291 14.353 -15.772 483 HG12 ILE 65 HG12 ILE 65 8.908 15.447 -14.286 484 HG13 ILE 65 HG13 ILE 65 9.833 13.974 -13.907 485 HG21 ILE 65 HG21 ILE 65 10.820 16.197 -17.450 486 HG22 ILE 65 HG22 ILE 65 9.669 16.888 -16.278 487 HG23 ILE 65 HG23 ILE 65 11.379 16.777 -15.881 488 HD11 ILE 65 HD11 ILE 65 10.647 15.611 -12.408 489 HD12 ILE 65 HD12 ILE 65 11.883 15.511 -13.671 490 HD13 ILE 65 HD13 ILE 65 10.716 16.862 -13.657 491 H GLU 66 H GLU 66 8.945 15.521 -18.553 492 HA GLU 66 HA GLU 66 6.663 16.993 -17.900 493 HB2 GLU 66 HB2 GLU 66 7.663 16.081 -20.638 494 HB3 GLU 66 HB3 GLU 66 6.469 17.350 -20.392 495 HG2 GLU 66 HG2 GLU 66 9.319 17.462 -19.321 496 HG3 GLU 66 HG3 GLU 66 8.788 18.168 -20.837 497 H ASN 67 H ASN 67 6.695 13.673 -19.146 498 HA ASN 67 HA ASN 67 3.785 13.782 -19.724 499 HB2 ASN 67 HB2 ASN 67 4.116 12.116 -21.154 500 HB3 ASN 67 HB3 ASN 67 5.826 12.495 -21.033 501 HD21 ASN 67 HD22 ASN 67 6.947 11.260 -19.033 502 HD22 ASN 67 HD21 ASN 67 6.360 9.636 -18.762 503 H PHE 68 H PHE 68 5.640 13.170 -16.965 504 HA PHE 68 HA PHE 68 3.918 10.974 -15.951 505 HB2 PHE 68 HB2 PHE 68 6.657 12.017 -15.209 506 HB3 PHE 68 HB3 PHE 68 5.784 10.896 -14.186 507 HD1 PHE 68 HD1 PHE 68 4.669 8.810 -15.663 508 HD2 PHE 68 HD2 PHE 68 8.300 10.969 -16.503 509 HE1 PHE 68 HE1 PHE 68 5.523 6.869 -16.933 510 HE2 PHE 68 HE2 PHE 68 9.150 9.018 -17.791 511 HZ PHE 68 HZ PHE 68 7.772 6.963 -17.999 512 H ASN 69 H ASN 69 3.657 10.984 -13.491 513 HA ASN 69 HA ASN 69 2.317 13.557 -12.733 514 HB2 ASN 69 HB2 ASN 69 0.475 12.040 -11.841 515 HB3 ASN 69 HB3 ASN 69 0.611 12.232 -13.580 516 HD21 ASN 69 HD22 ASN 69 1.900 9.965 -11.056 517 HD22 ASN 69 HD21 ASN 69 1.501 8.526 -11.987 518 H ALA 70 H ALA 70 4.012 14.195 -11.324 519 HA ALA 70 HA ALA 70 5.211 12.671 -9.344 520 HB1 ALA 70 HB1 ALA 70 4.418 15.575 -9.036 521 HB2 ALA 70 HB2 ALA 70 5.728 14.731 -8.211 522 HB3 ALA 70 HB3 ALA 70 5.827 15.013 -9.962 523 H ASP 71 H ASP 71 2.016 14.170 -9.243 524 HA ASP 71 HA ASP 71 1.407 14.109 -6.508 525 HB2 ASP 71 HB2 ASP 71 0.105 15.202 -8.348 526 HB3 ASP 71 HB3 ASP 71 -0.434 13.608 -8.882 527 H ASP 72 H ASP 72 1.584 11.359 -8.690 528 HA ASP 72 HA ASP 72 0.317 9.605 -6.637 529 HB2 ASP 72 HB2 ASP 72 -0.605 9.648 -9.033 530 HB3 ASP 72 HB3 ASP 72 0.886 8.818 -9.479 531 H TYR 73 H TYR 73 3.304 10.686 -7.085 532 HA TYR 73 HA TYR 73 4.581 8.049 -6.458 533 HB2 TYR 73 HB2 TYR 73 6.066 10.513 -7.325 534 HB3 TYR 73 HB3 TYR 73 6.645 8.856 -7.214 535 HD1 TYR 73 HD2 TYR 73 4.405 7.419 -8.743 536 HD2 TYR 73 HD1 TYR 73 6.583 11.064 -9.519 537 HE1 TYR 73 HE2 TYR 73 3.833 7.250 -11.150 538 HE2 TYR 73 HE1 TYR 73 5.970 10.914 -11.919 539 HH TYR 73 HH TYR 73 3.976 8.236 -13.230 540 H ASP 74 H ASP 74 4.175 7.939 -4.281 541 HA ASP 74 HA ASP 74 4.051 10.021 -2.407 542 HB2 ASP 74 HB2 ASP 74 5.092 7.179 -2.022 543 HB3 ASP 74 HB3 ASP 74 4.586 8.252 -0.724 544 H VAL 75 H VAL 75 6.908 8.321 -3.633 545 HA VAL 75 HA VAL 75 8.637 10.401 -2.355 546 HB VAL 75 HB VAL 75 9.380 7.509 -2.871 547 HG11 VAL 75 HG11 VAL 75 11.321 8.915 -3.112 548 HG12 VAL 75 HG12 VAL 75 10.939 9.805 -1.627 549 HG13 VAL 75 HG13 VAL 75 11.422 8.105 -1.552 550 HG21 VAL 75 HG21 VAL 75 9.550 7.497 -0.300 551 HG22 VAL 75 HG22 VAL 75 8.563 8.968 -0.340 552 HG23 VAL 75 HG23 VAL 75 7.924 7.452 -1.004 553 H VAL 76 H VAL 76 10.060 11.424 -3.699 554 HA VAL 76 HA VAL 76 10.505 10.332 -6.458 555 HB VAL 76 HB VAL 76 9.981 13.185 -5.650 556 HG11 VAL 76 HG11 VAL 76 11.966 13.195 -7.170 557 HG12 VAL 76 HG12 VAL 76 11.059 12.212 -8.341 558 HG13 VAL 76 HG13 VAL 76 10.546 13.872 -7.933 559 HG21 VAL 76 HG21 VAL 76 8.769 11.389 -7.792 560 HG22 VAL 76 HG22 VAL 76 8.001 11.832 -6.243 561 HG23 VAL 76 HG23 VAL 76 8.312 13.073 -7.462 562 H ILE 77 H ILE 77 12.566 10.207 -7.106 563 HA ILE 77 HA ILE 77 14.712 11.237 -5.274 564 HB ILE 77 HB ILE 77 14.767 8.734 -6.967 565 HG12 ILE 77 HG12 ILE 77 13.078 8.304 -5.278 566 HG13 ILE 77 HG13 ILE 77 14.519 7.346 -5.013 567 HG21 ILE 77 HG21 ILE 77 16.721 8.150 -5.581 568 HG22 ILE 77 HG22 ILE 77 16.993 9.633 -6.484 569 HG23 ILE 77 HG23 ILE 77 16.617 9.718 -4.755 570 HD11 ILE 77 HD11 ILE 77 13.531 8.208 -2.930 571 HD12 ILE 77 HD12 ILE 77 15.200 8.744 -3.144 572 HD13 ILE 77 HD13 ILE 77 13.857 9.870 -3.440 573 H SER 78 H SER 78 16.315 12.431 -6.252 574 HA SER 78 HA SER 78 16.449 12.444 -9.258 575 HB2 SER 78 HB2 SER 78 16.053 14.650 -8.298 576 HB3 SER 78 HB3 SER 78 17.549 14.508 -7.338 577 HG SER 78 HG SER 78 17.940 15.585 -9.351 578 H LEU 79 H LEU 79 18.240 11.791 -10.277 579 HA LEU 79 HA LEU 79 20.689 11.053 -8.716 580 HB2 LEU 79 HB2 LEU 79 19.432 9.344 -10.910 581 HB3 LEU 79 HB3 LEU 79 20.841 8.987 -9.915 582 HG LEU 79 HG LEU 79 19.103 9.118 -7.901 583 HD11 LEU 79 HD11 LEU 79 17.364 8.338 -10.295 584 HD12 LEU 79 HD12 LEU 79 16.925 8.117 -8.577 585 HD13 LEU 79 HD13 LEU 79 17.097 9.735 -9.249 586 HD21 LEU 79 HD21 LEU 79 18.730 6.700 -8.119 587 HD22 LEU 79 HD22 LEU 79 19.200 6.760 -9.829 588 HD23 LEU 79 HD23 LEU 79 20.398 7.115 -8.554 589 H CYS 80 H CYS 80 20.516 13.455 -9.878 590 HA CYS 80 HA CYS 80 21.718 13.272 -12.625 591 HB2 CYS 80 HB2 CYS 80 20.309 15.619 -11.282 592 HB3 CYS 80 HB3 CYS 80 20.767 15.471 -12.988 593 HG CYS 80 HG CYS 80 18.395 14.085 -11.196 594 H GLY 81 H GLY 81 22.632 14.261 -9.416 595 HA2 GLY 81 HA2 GLY 81 24.675 15.241 -8.711 596 HA3 GLY 81 HA3 GLY 81 25.089 15.597 -10.383 597 H CYS 82 H CYS 82 25.641 17.722 -9.380 598 HA CYS 82 HA CYS 82 23.601 19.604 -8.576 599 HB2 CYS 82 HB2 CYS 82 26.400 20.003 -9.724 600 HB3 CYS 82 HB3 CYS 82 25.389 21.306 -9.070 601 HG CYS 82 HG CYS 82 27.224 20.645 -7.304 602 H GLY 83 H GLY 83 22.933 21.530 -9.751 603 HA2 GLY 83 HA2 GLY 83 22.363 22.759 -11.673 604 HA3 GLY 83 HA3 GLY 83 22.908 21.442 -12.714 605 H VAL 84 H VAL 84 20.918 20.041 -10.435 606 HA VAL 84 HA VAL 84 18.362 20.536 -11.918 607 HB VAL 84 HB VAL 84 19.452 17.813 -11.089 608 HG11 VAL 84 HG11 VAL 84 17.438 16.885 -12.154 609 HG12 VAL 84 HG12 VAL 84 16.996 17.902 -10.795 610 HG13 VAL 84 HG13 VAL 84 16.816 18.530 -12.455 611 HG21 VAL 84 HG21 VAL 84 19.335 17.315 -13.534 612 HG22 VAL 84 HG22 VAL 84 18.928 19.012 -13.846 613 HG23 VAL 84 HG23 VAL 84 20.509 18.575 -13.160 614 H ASN 85 H ASN 85 16.764 21.118 -10.562 615 HA ASN 85 HA ASN 85 16.815 20.115 -7.743 616 HB2 ASN 85 HB2 ASN 85 17.801 22.532 -8.316 617 HB3 ASN 85 HB3 ASN 85 16.104 22.995 -8.329 618 HD21 ASN 85 HD22 ASN 85 18.572 21.240 -6.361 619 HD22 ASN 85 HD21 ASN 85 17.923 21.772 -4.820 620 H LEU 86 H LEU 86 14.922 20.127 -10.434 621 HA LEU 86 HA LEU 86 12.659 20.052 -10.906 622 HB2 LEU 86 HB2 LEU 86 12.759 18.360 -8.395 623 HB3 LEU 86 HB3 LEU 86 11.540 18.292 -9.676 624 HG LEU 86 HG LEU 86 14.424 17.423 -9.887 625 HD11 LEU 86 HD11 LEU 86 11.869 15.822 -10.252 626 HD12 LEU 86 HD12 LEU 86 13.509 15.230 -9.926 627 HD13 LEU 86 HD13 LEU 86 12.590 16.041 -8.636 628 HD21 LEU 86 HD21 LEU 86 13.597 16.591 -12.163 629 HD22 LEU 86 HD22 LEU 86 12.161 17.612 -11.920 630 HD23 LEU 86 HD23 LEU 86 13.783 18.345 -12.050 631 HA PRO 87 HA PRO 87 11.323 23.467 -7.998 632 HB2 PRO 87 HB2 PRO 87 10.459 24.458 -10.724 633 HB3 PRO 87 HB3 PRO 87 10.994 25.405 -9.303 634 HG2 PRO 87 HG2 PRO 87 12.737 24.904 -11.293 635 HG3 PRO 87 HG3 PRO 87 13.266 24.688 -9.592 636 HD2 PRO 87 HD2 PRO 87 12.377 22.578 -11.570 637 HD3 PRO 87 HD3 PRO 87 13.763 22.566 -10.442 638 HA PRO 88 HA PRO 88 6.837 22.756 -9.490 639 HB2 PRO 88 HB2 PRO 88 6.797 20.169 -10.960 640 HB3 PRO 88 HB3 PRO 88 6.052 21.725 -11.399 641 HG2 PRO 88 HG2 PRO 88 8.244 20.701 -12.667 642 HG3 PRO 88 HG3 PRO 88 8.044 22.474 -12.406 643 HD2 PRO 88 HD2 PRO 88 9.658 20.486 -10.796 644 HD3 PRO 88 HD3 PRO 88 10.099 22.122 -11.386 645 H GLU 89 H GLU 89 5.131 20.566 -9.384 646 HA GLU 89 HA GLU 89 4.997 19.681 -6.741 647 HB2 GLU 89 HB2 GLU 89 3.403 17.967 -7.640 648 HB3 GLU 89 HB3 GLU 89 3.077 19.628 -8.124 649 HG2 GLU 89 HG2 GLU 89 3.997 19.230 -10.352 650 HG3 GLU 89 HG3 GLU 89 4.536 17.624 -9.896 651 H TRP 90 H TRP 90 7.229 18.528 -9.024 652 HA TRP 90 HA TRP 90 7.724 15.838 -8.187 653 HB2 TRP 90 HB2 TRP 90 9.379 17.971 -9.517 654 HB3 TRP 90 HB3 TRP 90 9.966 16.329 -9.186 655 HD1 TRP 90 HD1 TRP 90 7.469 18.209 -11.407 656 HE1 TRP 90 HE1 TRP 90 6.345 16.592 -13.041 657 HE3 TRP 90 HE3 TRP 90 9.809 13.916 -9.990 658 HZ2 TRP 90 HZ2 TRP 90 6.423 13.756 -13.633 659 HZ3 TRP 90 HZ3 TRP 90 9.459 11.829 -11.260 660 HH2 TRP 90 HH2 TRP 90 7.778 11.727 -13.074 661 H VAL 91 H VAL 91 8.384 18.791 -6.472 662 HA VAL 91 HA VAL 91 9.905 17.177 -4.448 663 HB VAL 91 HB VAL 91 11.099 19.133 -3.735 664 HG11 VAL 91 HG11 VAL 91 12.570 19.410 -5.664 665 HG12 VAL 91 HG12 VAL 91 12.142 17.724 -5.356 666 HG13 VAL 91 HG13 VAL 91 11.367 18.596 -6.685 667 HG21 VAL 91 HG21 VAL 91 9.787 20.621 -6.049 668 HG22 VAL 91 HG22 VAL 91 9.473 20.916 -4.328 669 HG23 VAL 91 HG23 VAL 91 11.073 21.235 -5.002 670 H THR 92 H THR 92 6.870 18.288 -4.882 671 HA THR 92 HA THR 92 6.474 19.212 -2.084 672 HB THR 92 HB THR 92 4.219 19.751 -2.709 673 HG1 THR 92 HG1 THR 92 3.374 19.221 -4.634 674 HG21 THR 92 HG21 THR 92 6.084 20.705 -4.931 675 HG22 THR 92 HG22 THR 92 4.584 21.471 -4.381 676 HG23 THR 92 HG23 THR 92 5.988 21.405 -3.301 677 H GLN 93 H GLN 93 6.870 16.267 -3.396 678 HA GLN 93 HA GLN 93 4.583 14.845 -2.276 679 HB2 GLN 93 HB2 GLN 93 7.184 13.735 -3.399 680 HB3 GLN 93 HB3 GLN 93 5.684 12.850 -3.097 681 HG2 GLN 93 HG2 GLN 93 6.206 14.949 -5.218 682 HG3 GLN 93 HG3 GLN 93 5.760 13.276 -5.454 683 HE21 GLN 93 HE22 GLN 93 4.525 16.288 -5.790 684 HE22 GLN 93 HE21 GLN 93 2.840 15.983 -5.391 685 H GLU 94 H GLU 94 5.403 12.692 -0.974 686 HA GLU 94 HA GLU 94 5.661 13.851 1.645 687 HB2 GLU 94 HB2 GLU 94 4.297 11.866 1.191 688 HB3 GLU 94 HB3 GLU 94 5.748 10.927 0.816 689 HG2 GLU 94 HG2 GLU 94 6.578 11.155 3.065 690 HG3 GLU 94 HG3 GLU 94 5.261 12.255 3.498 691 H ILE 95 H ILE 95 8.012 12.055 -0.363 692 HA ILE 95 HA ILE 95 10.167 13.240 1.304 693 HB ILE 95 HB ILE 95 10.266 10.333 0.419 694 HG12 ILE 95 HG12 ILE 95 9.774 11.434 3.207 695 HG13 ILE 95 HG13 ILE 95 8.660 10.472 2.222 696 HG21 ILE 95 HG21 ILE 95 12.179 11.945 2.167 697 HG22 ILE 95 HG22 ILE 95 12.361 10.237 1.732 698 HG23 ILE 95 HG23 ILE 95 12.482 11.450 0.485 699 HD11 ILE 95 HD11 ILE 95 11.187 9.529 3.591 700 HD12 ILE 95 HD12 ILE 95 9.521 8.956 3.790 701 HD13 ILE 95 HD13 ILE 95 10.405 8.603 2.289 702 H PHE 96 H PHE 96 11.817 14.055 0.152 703 HA PHE 96 HA PHE 96 12.230 13.165 -2.631 704 HB2 PHE 96 HB2 PHE 96 11.170 15.310 -2.889 705 HB3 PHE 96 HB3 PHE 96 12.278 16.047 -1.731 706 HD1 PHE 96 HD1 PHE 96 11.966 14.703 -5.213 707 HD2 PHE 96 HD2 PHE 96 14.601 16.564 -2.332 708 HE1 PHE 96 HE1 PHE 96 13.670 15.054 -6.971 709 HE2 PHE 96 HE2 PHE 96 16.251 16.990 -4.126 710 HZ PHE 96 HZ PHE 96 15.793 16.238 -6.445 711 H GLU 97 H GLU 97 14.308 12.656 -3.126 712 HA GLU 97 HA GLU 97 16.502 13.541 -1.323 713 HB2 GLU 97 HB2 GLU 97 16.112 10.669 -2.257 714 HB3 GLU 97 HB3 GLU 97 17.526 11.321 -1.431 715 HG2 GLU 97 HG2 GLU 97 16.099 11.844 0.552 716 HG3 GLU 97 HG3 GLU 97 14.724 11.084 -0.262 717 H ASP 98 H ASP 98 18.571 13.653 -2.333 718 HA ASP 98 HA ASP 98 18.627 13.044 -5.231 719 HB2 ASP 98 HB2 ASP 98 19.854 14.915 -5.793 720 HB3 ASP 98 HB3 ASP 98 18.473 15.478 -4.872 721 H TRP 99 H TRP 99 19.943 11.517 -5.753 722 HA TRP 99 HA TRP 99 22.165 10.699 -3.915 723 HB2 TRP 99 HB2 TRP 99 20.637 9.069 -5.966 724 HB3 TRP 99 HB3 TRP 99 21.860 8.471 -4.860 725 HD1 TRP 99 HD1 TRP 99 20.158 10.315 -2.427 726 HE1 TRP 99 HE1 TRP 99 18.167 9.098 -1.343 727 HE3 TRP 99 HE3 TRP 99 19.532 6.587 -5.870 728 HZ2 TRP 99 HZ2 TRP 99 16.489 6.840 -1.938 729 HZ3 TRP 99 HZ3 TRP 99 17.708 4.922 -5.607 730 HH2 TRP 99 HH2 TRP 99 16.179 5.036 -3.638 731 H GLN 100 H GLN 100 23.706 12.114 -4.723 732 HA GLN 100 HA GLN 100 24.270 12.260 -7.585 733 HB2 GLN 100 HB2 GLN 100 25.823 13.417 -5.238 734 HB3 GLN 100 HB3 GLN 100 25.984 13.844 -6.951 735 HG2 GLN 100 HG2 GLN 100 23.466 14.526 -6.821 736 HG3 GLN 100 HG3 GLN 100 23.627 14.360 -5.081 737 HE21 GLN 100 HE22 GLN 100 22.987 16.661 -5.047 738 HE22 GLN 100 HE21 GLN 100 24.224 17.891 -5.381 739 H LEU 101 H LEU 101 25.592 10.951 -8.701 740 HA LEU 101 HA LEU 101 27.825 9.435 -7.442 741 HB2 LEU 101 HB2 LEU 101 25.414 8.246 -8.890 742 HB3 LEU 101 HB3 LEU 101 26.903 7.357 -8.640 743 HG LEU 101 HG LEU 101 25.079 8.332 -6.404 744 HD11 LEU 101 HD11 LEU 101 25.619 5.541 -7.460 745 HD12 LEU 101 HD12 LEU 101 24.516 6.008 -6.140 746 HD13 LEU 101 HD13 LEU 101 24.167 6.520 -7.798 747 HD21 LEU 101 HD21 LEU 101 27.437 8.194 -5.630 748 HD22 LEU 101 HD22 LEU 101 26.478 6.878 -4.966 749 HD23 LEU 101 HD23 LEU 101 27.575 6.569 -6.334 750 H GLU 102 H GLU 102 29.025 8.152 -9.164 751 HA GLU 102 HA GLU 102 29.972 9.730 -11.313 752 HB2 GLU 102 HB2 GLU 102 30.090 6.784 -10.593 753 HB3 GLU 102 HB3 GLU 102 30.783 7.339 -12.105 754 HG2 GLU 102 HG2 GLU 102 31.584 8.183 -9.325 755 HG3 GLU 102 HG3 GLU 102 32.474 7.140 -10.442 756 H ASP 103 H ASP 103 30.052 8.940 -13.545 757 HA ASP 103 HA ASP 103 27.308 8.366 -14.623 758 HB2 ASP 103 HB2 ASP 103 28.326 10.735 -14.729 759 HB3 ASP 103 HB3 ASP 103 29.368 10.110 -15.993 760 HA PRO 104 HA PRO 104 30.066 4.952 -15.813 761 HB2 PRO 104 HB2 PRO 104 27.451 3.553 -16.220 762 HB3 PRO 104 HB3 PRO 104 28.944 2.979 -15.397 763 HG2 PRO 104 HG2 PRO 104 26.839 3.790 -13.932 764 HG3 PRO 104 HG3 PRO 104 28.490 4.365 -13.503 765 HD2 PRO 104 HD2 PRO 104 26.397 5.799 -15.193 766 HD3 PRO 104 HD3 PRO 104 27.282 6.396 -13.767 767 H ASP 105 H ASP 105 27.735 6.439 -17.844 768 HA ASP 105 HA ASP 105 27.630 4.778 -20.114 769 HB2 ASP 105 HB2 ASP 105 26.142 6.657 -19.469 770 HB3 ASP 105 HB3 ASP 105 27.425 7.804 -19.851 771 H GLY 106 H GLY 106 29.535 3.971 -20.901 772 HA2 GLY 106 HA2 GLY 106 31.287 4.007 -22.463 773 HA3 GLY 106 HA3 GLY 106 31.350 5.766 -22.383 774 H GLN 107 H GLN 107 31.384 4.185 -19.282 775 HA GLN 107 HA GLN 107 34.242 4.875 -18.892 776 HB2 GLN 107 HB2 GLN 107 32.190 3.924 -16.877 777 HB3 GLN 107 HB3 GLN 107 33.807 4.525 -16.515 778 HG2 GLN 107 HG2 GLN 107 31.574 6.155 -17.787 779 HG3 GLN 107 HG3 GLN 107 31.925 6.056 -16.066 780 HE21 GLN 107 HE22 GLN 107 31.849 8.441 -16.640 781 HE22 GLN 107 HE21 GLN 107 33.430 9.191 -16.917 782 H SER 108 H SER 108 33.008 2.299 -16.961 783 HA SER 108 HA SER 108 34.096 0.079 -18.503 784 HB2 SER 108 HB2 SER 108 35.778 -0.592 -16.947 785 HB3 SER 108 HB3 SER 108 36.106 1.112 -17.305 786 HG SER 108 HG SER 108 36.210 0.752 -15.073 787 H LEU 109 H LEU 109 33.695 -1.995 -17.332 788 HA LEU 109 HA LEU 109 31.055 -2.091 -16.198 789 HB2 LEU 109 HB2 LEU 109 33.307 -4.148 -16.109 790 HB3 LEU 109 HB3 LEU 109 31.618 -4.474 -15.743 791 HG LEU 109 HG LEU 109 32.744 -3.661 -18.449 792 HD11 LEU 109 HD11 LEU 109 31.510 -6.249 -17.439 793 HD12 LEU 109 HD12 LEU 109 32.107 -5.937 -19.091 794 HD13 LEU 109 HD13 LEU 109 33.242 -5.946 -17.722 795 HD21 LEU 109 HD21 LEU 109 30.479 -4.065 -19.333 796 HD22 LEU 109 HD22 LEU 109 29.871 -4.321 -17.683 797 HD23 LEU 109 HD23 LEU 109 30.476 -2.727 -18.171 798 H GLU 110 H GLU 110 34.244 -2.108 -14.657 799 HA GLU 110 HA GLU 110 33.232 -2.515 -12.003 800 HB2 GLU 110 HB2 GLU 110 35.662 -2.713 -12.838 801 HB3 GLU 110 HB3 GLU 110 35.734 -0.954 -12.682 802 HG2 GLU 110 HG2 GLU 110 36.569 -1.693 -10.637 803 HG3 GLU 110 HG3 GLU 110 34.891 -1.333 -10.246 804 H VAL 111 H VAL 111 33.624 0.497 -13.910 805 HA VAL 111 HA VAL 111 32.769 2.218 -11.710 806 HB VAL 111 HB VAL 111 32.919 2.675 -14.696 807 HG11 VAL 111 HG11 VAL 111 32.693 5.110 -14.112 808 HG12 VAL 111 HG12 VAL 111 31.194 4.201 -13.897 809 HG13 VAL 111 HG13 VAL 111 32.177 4.640 -12.480 810 HG21 VAL 111 HG21 VAL 111 34.558 3.754 -12.350 811 HG22 VAL 111 HG22 VAL 111 35.088 2.462 -13.443 812 HG23 VAL 111 HG23 VAL 111 34.842 4.092 -14.071 813 H PHE 112 H PHE 112 31.007 0.451 -14.299 814 HA PHE 112 HA PHE 112 28.383 1.492 -13.575 815 HB2 PHE 112 HB2 PHE 112 29.425 -0.914 -15.032 816 HB3 PHE 112 HB3 PHE 112 27.805 -1.002 -14.357 817 HD1 PHE 112 HD1 PHE 112 25.995 0.487 -15.105 818 HD2 PHE 112 HD2 PHE 112 29.873 0.447 -16.997 819 HE1 PHE 112 HE1 PHE 112 25.047 1.649 -17.092 820 HE2 PHE 112 HE2 PHE 112 28.927 1.631 -18.958 821 HZ PHE 112 HZ PHE 112 26.527 2.253 -18.992 822 H ARG 113 H ARG 113 30.159 -1.415 -12.471 823 HA ARG 113 HA ARG 113 28.301 -2.294 -10.486 824 HB2 ARG 113 HB2 ARG 113 31.308 -2.576 -10.822 825 HB3 ARG 113 HB3 ARG 113 30.437 -3.390 -9.522 826 HG2 ARG 113 HG2 ARG 113 29.258 -4.788 -10.965 827 HG3 ARG 113 HG3 ARG 113 29.423 -3.719 -12.352 828 HD2 ARG 113 HD2 ARG 113 30.756 -5.775 -12.615 829 HD3 ARG 113 HD3 ARG 113 31.739 -4.325 -12.658 830 HE ARG 113 HE ARG 113 32.751 -4.853 -10.629 831 HH11 ARG 113 HH11 ARG 113 30.295 -7.336 -11.287 832 HH12 ARG 113 HH12 ARG 113 31.032 -8.419 -10.132 833 HH21 ARG 113 HH21 ARG 113 33.552 -6.235 -9.232 834 HH22 ARG 113 HH22 ARG 113 32.831 -7.802 -8.948 835 H THR 114 H THR 114 30.946 0.051 -10.206 836 HA THR 114 HA THR 114 30.741 0.569 -7.397 837 HB THR 114 HB THR 114 31.665 2.343 -9.693 838 HG1 THR 114 HG1 THR 114 32.926 0.537 -9.440 839 HG21 THR 114 HG21 THR 114 32.973 3.560 -7.936 840 HG22 THR 114 HG22 THR 114 31.232 3.837 -7.841 841 HG23 THR 114 HG23 THR 114 32.018 2.717 -6.692 842 H VAL 115 H VAL 115 29.063 2.189 -10.142 843 HA VAL 115 HA VAL 115 27.416 3.848 -8.390 844 HB VAL 115 HB VAL 115 27.237 3.101 -11.325 845 HG11 VAL 115 HG11 VAL 115 25.541 5.158 -9.831 846 HG12 VAL 115 HG12 VAL 115 25.627 4.949 -11.592 847 HG13 VAL 115 HG13 VAL 115 24.930 3.668 -10.605 848 HG21 VAL 115 HG21 VAL 115 29.124 4.534 -10.767 849 HG22 VAL 115 HG22 VAL 115 27.896 5.543 -11.551 850 HG23 VAL 115 HG23 VAL 115 28.086 5.600 -9.794 851 H ARG 116 H ARG 116 26.738 0.796 -10.128 852 HA ARG 116 HA ARG 116 24.075 0.357 -9.482 853 HB2 ARG 116 HB2 ARG 116 25.596 -1.032 -10.981 854 HB3 ARG 116 HB3 ARG 116 26.314 -1.738 -9.540 855 HG2 ARG 116 HG2 ARG 116 23.896 -2.547 -8.964 856 HG3 ARG 116 HG3 ARG 116 23.511 -2.070 -10.632 857 HD2 ARG 116 HD2 ARG 116 23.943 -4.409 -10.619 858 HD3 ARG 116 HD3 ARG 116 25.289 -3.592 -11.440 859 HE ARG 116 HE ARG 116 25.702 -4.095 -8.553 860 HH11 ARG 116 HH11 ARG 116 25.910 -5.737 -11.625 861 HH12 ARG 116 HH12 ARG 116 27.448 -6.487 -11.252 862 HH21 ARG 116 HH21 ARG 116 27.504 -5.334 -7.989 863 HH22 ARG 116 HH22 ARG 116 28.127 -6.477 -9.136 864 H GLY 117 H GLY 117 26.828 -0.706 -7.456 865 HA2 GLY 117 HA2 GLY 117 25.321 -1.876 -5.350 866 HA3 GLY 117 HA3 GLY 117 26.956 -1.223 -5.196 867 H GLN 118 H GLN 118 26.309 1.557 -5.758 868 HA GLN 118 HA GLN 118 25.278 2.320 -3.122 869 HB2 GLN 118 HB2 GLN 118 26.275 3.960 -5.481 870 HB3 GLN 118 HB3 GLN 118 25.735 4.644 -3.932 871 HG2 GLN 118 HG2 GLN 118 27.460 3.425 -2.708 872 HG3 GLN 118 HG3 GLN 118 27.960 2.552 -4.157 873 HE21 GLN 118 HE22 GLN 118 29.145 3.682 -5.830 874 HE22 GLN 118 HE21 GLN 118 29.950 5.208 -5.435 875 H VAL 119 H VAL 119 24.072 2.830 -6.507 876 HA VAL 119 HA VAL 119 21.564 3.975 -5.740 877 HB VAL 119 HB VAL 119 22.078 2.147 -8.118 878 HG11 VAL 119 HG11 VAL 119 20.206 3.366 -9.176 879 HG12 VAL 119 HG12 VAL 119 19.634 2.592 -7.689 880 HG13 VAL 119 HG13 VAL 119 19.976 4.329 -7.693 881 HG21 VAL 119 HG21 VAL 119 22.252 5.180 -7.926 882 HG22 VAL 119 HG22 VAL 119 23.624 4.074 -8.179 883 HG23 VAL 119 HG23 VAL 119 22.390 4.219 -9.419 884 H LYS 120 H LYS 120 22.467 0.514 -6.012 885 HA LYS 120 HA LYS 120 19.975 -0.652 -5.249 886 HB2 LYS 120 HB2 LYS 120 21.886 -1.914 -6.160 887 HB3 LYS 120 HB3 LYS 120 22.827 -1.602 -4.704 888 HG2 LYS 120 HG2 LYS 120 21.259 -2.816 -3.328 889 HG3 LYS 120 HG3 LYS 120 20.137 -3.019 -4.682 890 HD2 LYS 120 HD2 LYS 120 21.732 -4.459 -5.840 891 HD3 LYS 120 HD3 LYS 120 22.950 -4.215 -4.574 892 HE2 LYS 120 HE2 LYS 120 20.165 -5.184 -3.880 893 HE3 LYS 120 HE3 LYS 120 21.359 -6.347 -4.518 894 HZ1 LYS 120 HZ1 LYS 120 22.834 -5.628 -2.614 895 HZ2 LYS 120 HZ2 LYS 120 21.563 -4.764 -1.993 896 HZ3 LYS 120 HZ3 LYS 120 21.467 -6.382 -2.128 897 H GLU 121 H GLU 121 22.758 0.148 -3.050 898 HA GLU 121 HA GLU 121 21.188 -0.543 -0.743 899 HB2 GLU 121 HB2 GLU 121 23.007 -0.187 0.480 900 HB3 GLU 121 HB3 GLU 121 23.808 -0.219 -1.066 901 HG2 GLU 121 HG2 GLU 121 24.787 1.622 -0.112 902 HG3 GLU 121 HG3 GLU 121 23.493 2.402 -1.010 903 H ARG 122 H ARG 122 21.502 2.591 -2.405 904 HA ARG 122 HA ARG 122 20.043 4.038 -0.413 905 HB2 ARG 122 HB2 ARG 122 20.209 4.429 -3.439 906 HB3 ARG 122 HB3 ARG 122 19.478 5.577 -2.328 907 HG2 ARG 122 HG2 ARG 122 22.402 4.812 -2.089 908 HG3 ARG 122 HG3 ARG 122 21.822 6.073 -3.174 909 HD2 ARG 122 HD2 ARG 122 22.569 7.154 -1.245 910 HD3 ARG 122 HD3 ARG 122 20.790 7.212 -1.171 911 HE ARG 122 HE ARG 122 22.055 4.929 0.240 912 HH11 ARG 122 HH11 ARG 122 21.021 8.258 0.801 913 HH12 ARG 122 HH12 ARG 122 21.045 8.022 2.525 914 HH21 ARG 122 HH21 ARG 122 22.055 4.710 2.242 915 HH22 ARG 122 HH22 ARG 122 21.630 5.995 3.383 916 H VAL 123 H VAL 123 18.797 2.245 -3.303 917 HA VAL 123 HA VAL 123 16.050 2.586 -2.573 918 HB VAL 123 HB VAL 123 17.500 0.482 -4.208 919 HG11 VAL 123 HG11 VAL 123 14.495 0.674 -3.810 920 HG12 VAL 123 HG12 VAL 123 15.377 -0.353 -4.985 921 HG13 VAL 123 HG13 VAL 123 15.541 -0.667 -3.271 922 HG21 VAL 123 HG21 VAL 123 17.361 2.708 -5.181 923 HG22 VAL 123 HG22 VAL 123 16.341 1.575 -6.079 924 HG23 VAL 123 HG23 VAL 123 15.591 2.726 -4.945 925 H GLU 124 H GLU 124 18.215 -0.223 -1.641 926 HA GLU 124 HA GLU 124 16.164 -1.458 -0.072 927 HB2 GLU 124 HB2 GLU 124 19.156 -1.490 0.424 928 HB3 GLU 124 HB3 GLU 124 17.945 -2.607 1.106 929 HG2 GLU 124 HG2 GLU 124 17.360 -3.411 -1.082 930 HG3 GLU 124 HG3 GLU 124 18.559 -2.375 -1.845 931 H ASN 125 H ASN 125 18.333 1.177 0.819 932 HA ASN 125 HA ASN 125 17.393 1.132 3.522 933 HB2 ASN 125 HB2 ASN 125 19.258 2.338 3.835 934 HB3 ASN 125 HB3 ASN 125 19.518 2.420 2.109 935 HD21 ASN 125 HD22 ASN 125 18.370 4.171 0.906 936 HD22 ASN 125 HD21 ASN 125 18.275 5.726 1.734 937 H LEU 126 H LEU 126 16.182 2.639 0.637 938 HA LEU 126 HA LEU 126 14.346 4.435 2.020 939 HB2 LEU 126 HB2 LEU 126 15.243 5.045 -0.151 940 HB3 LEU 126 HB3 LEU 126 14.693 3.538 -0.870 941 HG LEU 126 HG LEU 126 12.335 4.212 -0.587 942 HD11 LEU 126 HD11 LEU 126 12.553 5.726 1.392 943 HD12 LEU 126 HD12 LEU 126 13.465 6.878 0.384 944 HD13 LEU 126 HD13 LEU 126 11.761 6.519 0.036 945 HD21 LEU 126 HD21 LEU 126 13.510 4.701 -2.663 946 HD22 LEU 126 HD22 LEU 126 12.372 6.011 -2.284 947 HD23 LEU 126 HD23 LEU 126 14.116 6.230 -1.988 948 H ILE 127 H ILE 127 13.946 1.267 0.258 949 HA ILE 127 HA ILE 127 11.110 1.283 0.716 950 HB ILE 127 HB ILE 127 11.094 -1.076 0.160 951 HG12 ILE 127 HG12 ILE 127 14.100 -0.944 0.355 952 HG13 ILE 127 HG13 ILE 127 12.966 -2.075 1.106 953 HG21 ILE 127 HG21 ILE 127 12.910 0.517 -1.722 954 HG22 ILE 127 HG22 ILE 127 11.742 -0.749 -2.174 955 HG23 ILE 127 HG23 ILE 127 11.165 0.797 -1.543 956 HD11 ILE 127 HD11 ILE 127 12.524 -3.043 -1.150 957 HD12 ILE 127 HD12 ILE 127 13.780 -1.964 -1.815 958 HD13 ILE 127 HD13 ILE 127 14.208 -3.199 -0.614 959 H ALA 128 H ALA 128 13.708 0.205 2.853 960 HA ALA 128 HA ALA 128 11.948 -1.109 4.667 961 HB1 ALA 128 HB1 ALA 128 14.652 0.253 5.145 962 HB2 ALA 128 HB2 ALA 128 13.877 -0.917 6.238 963 HB3 ALA 128 HB3 ALA 128 14.404 -1.430 4.623 964 H LYS 129 H LYS 129 12.468 2.300 4.075 965 HA LYS 129 HA LYS 129 11.257 3.204 6.625 966 HB2 LYS 129 HB2 LYS 129 12.179 4.741 4.156 967 HB3 LYS 129 HB3 LYS 129 11.545 5.470 5.630 968 HG2 LYS 129 HG2 LYS 129 13.406 4.574 6.946 969 HG3 LYS 129 HG3 LYS 129 14.044 3.734 5.525 970 HD2 LYS 129 HD2 LYS 129 14.238 5.958 4.349 971 HD3 LYS 129 HD3 LYS 129 13.766 6.762 5.850 972 HE2 LYS 129 HE2 LYS 129 16.210 4.962 5.483 973 HE3 LYS 129 HE3 LYS 129 16.231 6.728 5.387 974 HZ1 LYS 129 HZ1 LYS 129 15.482 6.802 7.721 975 HZ2 LYS 129 HZ2 LYS 129 15.517 5.165 7.822 976 HZ3 LYS 129 HZ3 LYS 129 16.897 5.998 7.593 977 H ILE 130 H ILE 130 10.363 3.132 3.158 978 HA ILE 130 HA ILE 130 7.699 4.226 3.915 979 HB ILE 130 HB ILE 130 7.467 4.998 1.598 980 HG12 ILE 130 HG12 ILE 130 9.444 5.341 0.220 981 HG13 ILE 130 HG13 ILE 130 10.436 4.397 1.315 982 HG21 ILE 130 HG21 ILE 130 9.898 6.065 3.079 983 HG22 ILE 130 HG22 ILE 130 8.827 6.934 1.954 984 HG23 ILE 130 HG23 ILE 130 8.204 6.396 3.511 985 HD11 ILE 130 HD11 ILE 130 8.083 3.366 -0.323 986 HD12 ILE 130 HD12 ILE 130 9.803 3.160 -0.716 987 HD13 ILE 130 HD13 ILE 130 9.132 2.371 0.718 988 H SER 131 H SER 131 8.639 1.161 3.463 989 HA SER 131 HA SER 131 6.564 -0.006 1.874 990 HB2 SER 131 HB2 SER 131 8.528 -1.161 2.812 991 HB3 SER 131 HB3 SER 131 7.829 -1.030 4.439 992 HG SER 131 HG SER 131 5.998 -2.265 3.553 Start of MODEL 11 1 H MET 1 H1 MET 1 2.703 0.462 2.054 2 HA MET 1 HA MET 1 3.360 -0.091 -0.068 3 HB2 MET 1 HB2 MET 1 1.341 -1.518 -0.559 4 HB3 MET 1 HB3 MET 1 0.445 -0.050 -0.979 5 HG2 MET 1 HG2 MET 1 2.113 0.432 -2.775 6 HG3 MET 1 HG3 MET 1 3.038 -0.986 -2.279 7 HE1 MET 1 HE1 MET 1 1.902 -2.544 -5.542 8 HE2 MET 1 HE2 MET 1 2.706 -1.010 -5.148 9 HE3 MET 1 HE3 MET 1 3.166 -2.500 -4.291 10 H LYS 2 H LYS 2 4.351 1.617 -0.871 11 HA LYS 2 HA LYS 2 2.801 4.056 -1.680 12 HB2 LYS 2 HB2 LYS 2 5.341 3.911 -0.017 13 HB3 LYS 2 HB3 LYS 2 5.013 5.307 -1.027 14 HG2 LYS 2 HG2 LYS 2 2.820 5.638 0.083 15 HG3 LYS 2 HG3 LYS 2 3.168 4.274 1.161 16 HD2 LYS 2 HD2 LYS 2 5.047 5.460 2.165 17 HD3 LYS 2 HD3 LYS 2 4.960 6.732 0.946 18 HE2 LYS 2 HE2 LYS 2 4.023 7.611 2.953 19 HE3 LYS 2 HE3 LYS 2 2.716 7.414 1.784 20 HZ1 LYS 2 HZ1 LYS 2 2.043 5.372 2.974 21 HZ2 LYS 2 HZ2 LYS 2 3.296 5.519 4.026 22 HZ3 LYS 2 HZ3 LYS 2 2.093 6.621 4.013 23 H LYS 3 H LYS 3 3.981 5.379 -3.274 24 HA LYS 3 HA LYS 3 5.340 3.600 -5.272 25 HB2 LYS 3 HB2 LYS 3 3.767 6.155 -5.795 26 HB3 LYS 3 HB3 LYS 3 4.583 5.191 -6.999 27 HG2 LYS 3 HG2 LYS 3 2.430 4.449 -7.253 28 HG3 LYS 3 HG3 LYS 3 3.129 3.211 -6.218 29 HD2 LYS 3 HD2 LYS 3 0.861 3.725 -5.509 30 HD3 LYS 3 HD3 LYS 3 1.983 4.213 -4.246 31 HE2 LYS 3 HE2 LYS 3 1.924 6.558 -5.377 32 HE3 LYS 3 HE3 LYS 3 0.512 5.960 -6.251 33 HZ1 LYS 3 HZ1 LYS 3 0.869 6.300 -3.322 34 HZ2 LYS 3 HZ2 LYS 3 -0.217 7.081 -4.271 35 HZ3 LYS 3 HZ3 LYS 3 -0.449 5.495 -3.948 36 H VAL 4 H VAL 4 7.176 4.178 -6.255 37 HA VAL 4 HA VAL 4 8.590 6.649 -5.319 38 HB VAL 4 HB VAL 4 10.075 4.052 -5.686 39 HG11 VAL 4 HG11 VAL 4 11.886 5.248 -4.570 40 HG12 VAL 4 HG12 VAL 4 11.439 6.046 -6.069 41 HG13 VAL 4 HG13 VAL 4 10.897 6.727 -4.515 42 HG21 VAL 4 HG21 VAL 4 9.134 5.323 -3.092 43 HG22 VAL 4 HG22 VAL 4 8.682 3.733 -3.729 44 HG23 VAL 4 HG23 VAL 4 10.348 4.033 -3.231 45 H MET 5 H MET 5 9.720 7.780 -6.841 46 HA MET 5 HA MET 5 9.825 6.677 -9.608 47 HB2 MET 5 HB2 MET 5 7.844 7.969 -9.662 48 HB3 MET 5 HB3 MET 5 8.580 9.284 -8.736 49 HG2 MET 5 HG2 MET 5 8.363 9.922 -11.061 50 HG3 MET 5 HG3 MET 5 10.047 9.838 -10.601 51 HE1 MET 5 HE1 MET 5 8.222 8.139 -14.271 52 HE2 MET 5 HE2 MET 5 7.176 8.339 -12.844 53 HE3 MET 5 HE3 MET 5 8.121 9.708 -13.478 54 H PHE 6 H PHE 6 11.608 7.069 -10.653 55 HA PHE 6 HA PHE 6 13.744 8.638 -9.262 56 HB2 PHE 6 HB2 PHE 6 14.076 6.424 -11.307 57 HB3 PHE 6 HB3 PHE 6 15.322 7.154 -10.299 58 HD1 PHE 6 HD2 PHE 6 15.225 6.776 -7.748 59 HD2 PHE 6 HD1 PHE 6 12.842 4.571 -10.569 60 HE1 PHE 6 HE2 PHE 6 14.640 5.159 -5.957 61 HE2 PHE 6 HE1 PHE 6 12.247 2.951 -8.772 62 HZ PHE 6 HZ PHE 6 13.103 3.281 -6.448 63 H VAL 7 H VAL 7 14.701 10.336 -10.201 64 HA VAL 7 HA VAL 7 14.287 10.923 -13.100 65 HB VAL 7 HB VAL 7 14.183 12.697 -10.676 66 HG11 VAL 7 HG11 VAL 7 15.268 13.639 -13.375 67 HG12 VAL 7 HG12 VAL 7 14.624 14.697 -12.110 68 HG13 VAL 7 HG13 VAL 7 16.068 13.764 -11.784 69 HG21 VAL 7 HG21 VAL 7 12.873 12.843 -13.425 70 HG22 VAL 7 HG22 VAL 7 12.174 12.036 -11.987 71 HG23 VAL 7 HG23 VAL 7 12.450 13.774 -11.971 72 H CYS 8 H CYS 8 16.067 10.663 -14.306 73 HA CYS 8 HA CYS 8 18.731 11.438 -13.122 74 HB2 CYS 8 HB2 CYS 8 18.589 9.047 -13.359 75 HB3 CYS 8 HB3 CYS 8 18.047 9.173 -15.047 76 HG CYS 8 HG CYS 8 20.529 8.251 -14.923 77 H LYS 9 H LYS 9 20.302 12.239 -14.870 78 HA LYS 9 HA LYS 9 19.077 14.541 -15.966 79 HB2 LYS 9 HB2 LYS 9 21.532 14.124 -15.235 80 HB3 LYS 9 HB3 LYS 9 21.799 13.555 -16.887 81 HG2 LYS 9 HG2 LYS 9 20.811 15.837 -17.643 82 HG3 LYS 9 HG3 LYS 9 20.824 16.293 -15.937 83 HD2 LYS 9 HD2 LYS 9 22.759 17.233 -16.907 84 HD3 LYS 9 HD3 LYS 9 23.322 15.892 -15.905 85 HE2 LYS 9 HE2 LYS 9 23.574 14.471 -17.930 86 HE3 LYS 9 HE3 LYS 9 22.864 15.748 -18.933 87 HZ1 LYS 9 HZ1 LYS 9 25.298 15.780 -19.057 88 HZ2 LYS 9 HZ2 LYS 9 24.778 17.168 -18.378 89 HZ3 LYS 9 HZ3 LYS 9 25.443 15.998 -17.444 90 H ARG 10 H ARG 10 20.053 11.607 -17.711 91 HA ARG 10 HA ARG 10 18.182 12.411 -19.913 92 HB2 ARG 10 HB2 ARG 10 19.533 11.812 -21.676 93 HB3 ARG 10 HB3 ARG 10 20.447 12.896 -20.659 94 HG2 ARG 10 HG2 ARG 10 20.867 9.881 -20.875 95 HG3 ARG 10 HG3 ARG 10 21.810 11.144 -21.661 96 HD2 ARG 10 HD2 ARG 10 22.346 12.014 -19.305 97 HD3 ARG 10 HD3 ARG 10 21.719 10.445 -18.729 98 HE ARG 10 HE ARG 10 23.708 10.078 -20.797 99 HH11 ARG 10 HH11 ARG 10 23.505 10.917 -17.389 100 HH12 ARG 10 HH12 ARG 10 25.144 10.397 -17.072 101 HH21 ARG 10 HH21 ARG 10 25.839 9.357 -20.246 102 HH22 ARG 10 HH22 ARG 10 26.386 9.676 -18.600 103 H ASN 11 H ASN 11 17.978 10.526 -17.616 104 HA ASN 11 HA ASN 11 17.373 8.400 -17.044 105 HB2 ASN 11 HB2 ASN 11 15.392 9.681 -17.828 106 HB3 ASN 11 HB3 ASN 11 15.502 8.880 -19.382 107 HD21 ASN 11 HD22 ASN 11 15.752 7.451 -15.945 108 HD22 ASN 11 HD21 ASN 11 14.387 6.437 -16.232 109 H SER 12 H SER 12 19.690 8.175 -18.666 110 HA SER 12 HA SER 12 19.309 5.705 -20.223 111 HB2 SER 12 HB2 SER 12 21.777 6.092 -20.653 112 HB3 SER 12 HB3 SER 12 20.724 7.443 -21.127 113 HG SER 12 HG SER 12 22.631 8.010 -19.780 114 H CYS 13 H CYS 13 20.883 6.752 -17.222 115 HA CYS 13 HA CYS 13 21.176 3.915 -16.322 116 HB2 CYS 13 HB2 CYS 13 23.245 4.900 -17.467 117 HB3 CYS 13 HB3 CYS 13 23.377 6.044 -16.135 118 HG CYS 13 HG CYS 13 25.117 4.002 -15.939 119 H ARG 14 H ARG 14 22.196 4.200 -13.891 120 HA ARG 14 HA ARG 14 21.532 4.388 -11.719 121 HB2 ARG 14 HB2 ARG 14 21.227 7.333 -12.498 122 HB3 ARG 14 HB3 ARG 14 21.271 6.709 -10.842 123 HG2 ARG 14 HG2 ARG 14 23.487 5.663 -11.375 124 HG3 ARG 14 HG3 ARG 14 23.495 6.540 -12.911 125 HD2 ARG 14 HD2 ARG 14 23.323 7.787 -10.128 126 HD3 ARG 14 HD3 ARG 14 24.800 7.663 -11.086 127 HE ARG 14 HE ARG 14 22.520 9.524 -11.504 128 HH11 ARG 14 HH11 ARG 14 25.745 8.650 -12.616 129 HH12 ARG 14 HH12 ARG 14 25.586 9.710 -14.025 130 HH21 ARG 14 HH21 ARG 14 22.630 11.067 -13.012 131 HH22 ARG 14 HH22 ARG 14 24.036 11.196 -14.068 132 H SER 15 H SER 15 19.110 6.676 -12.862 133 HA SER 15 HA SER 15 16.900 5.868 -11.344 134 HB2 SER 15 HB2 SER 15 15.528 6.829 -13.234 135 HB3 SER 15 HB3 SER 15 16.875 7.852 -12.771 136 HG SER 15 HG SER 15 18.086 6.876 -14.634 137 H GLN 16 H GLN 16 17.819 4.552 -14.485 138 HA GLN 16 HA GLN 16 15.714 2.607 -14.732 139 HB2 GLN 16 HB2 GLN 16 18.515 2.801 -15.942 140 HB3 GLN 16 HB3 GLN 16 17.283 1.728 -16.542 141 HG2 GLN 16 HG2 GLN 16 17.013 4.790 -16.507 142 HG3 GLN 16 HG3 GLN 16 17.584 3.839 -17.860 143 HE21 GLN 16 HE22 GLN 16 15.812 4.990 -18.981 144 HE22 GLN 16 HE21 GLN 16 14.209 4.247 -18.931 145 H MET 17 H MET 17 18.983 2.312 -13.288 146 HA MET 17 HA MET 17 18.733 -0.514 -12.558 147 HB2 MET 17 HB2 MET 17 20.480 1.720 -11.407 148 HB3 MET 17 HB3 MET 17 20.578 0.029 -10.948 149 HG2 MET 17 HG2 MET 17 21.274 -0.594 -13.211 150 HG3 MET 17 HG3 MET 17 21.194 1.108 -13.714 151 HE1 MET 17 HE1 MET 17 25.072 0.076 -13.324 152 HE2 MET 17 HE2 MET 17 23.719 -0.967 -13.816 153 HE3 MET 17 HE3 MET 17 23.862 0.683 -14.484 154 H ALA 18 H ALA 18 17.913 2.581 -10.942 155 HA ALA 18 HA ALA 18 17.397 1.491 -8.361 156 HB1 ALA 18 HB1 ALA 18 17.733 3.929 -8.991 157 HB2 ALA 18 HB2 ALA 18 16.080 3.931 -9.629 158 HB3 ALA 18 HB3 ALA 18 16.363 3.616 -7.905 159 H GLU 19 H GLU 19 15.177 1.982 -11.147 160 HA GLU 19 HA GLU 19 12.886 0.721 -9.924 161 HB2 GLU 19 HB2 GLU 19 12.895 2.127 -12.012 162 HB3 GLU 19 HB3 GLU 19 13.675 0.789 -12.859 163 HG2 GLU 19 HG2 GLU 19 11.645 -0.645 -12.141 164 HG3 GLU 19 HG3 GLU 19 10.894 0.866 -11.626 165 H GLY 20 H GLY 20 15.663 -0.623 -11.747 166 HA2 GLY 20 HA2 GLY 20 14.954 -3.350 -11.858 167 HA3 GLY 20 HA3 GLY 20 16.598 -2.712 -11.740 168 H PHE 21 H PHE 21 16.749 -1.681 -9.163 169 HA PHE 21 HA PHE 21 16.686 -4.113 -7.537 170 HB2 PHE 21 HB2 PHE 21 17.357 -1.214 -6.900 171 HB3 PHE 21 HB3 PHE 21 17.422 -2.506 -5.701 172 HD1 PHE 21 HD1 PHE 21 18.669 -4.714 -6.459 173 HD2 PHE 21 HD2 PHE 21 19.348 -0.810 -8.158 174 HE1 PHE 21 HE1 PHE 21 20.836 -5.484 -7.361 175 HE2 PHE 21 HE2 PHE 21 21.528 -1.580 -9.041 176 HZ PHE 21 HZ PHE 21 22.250 -3.955 -8.668 177 H ALA 22 H ALA 22 14.760 -1.103 -7.442 178 HA ALA 22 HA ALA 22 13.244 -1.904 -5.168 179 HB1 ALA 22 HB1 ALA 22 11.818 -0.007 -5.780 180 HB2 ALA 22 HB2 ALA 22 13.520 0.418 -5.995 181 HB3 ALA 22 HB3 ALA 22 12.551 0.016 -7.416 182 H LYS 23 H LYS 23 12.543 -2.612 -8.650 183 HA LYS 23 HA LYS 23 9.889 -3.590 -8.156 184 HB2 LYS 23 HB2 LYS 23 9.979 -4.579 -10.339 185 HB3 LYS 23 HB3 LYS 23 10.783 -3.006 -10.390 186 HG2 LYS 23 HG2 LYS 23 12.975 -4.240 -10.155 187 HG3 LYS 23 HG3 LYS 23 12.115 -5.755 -10.357 188 HD2 LYS 23 HD2 LYS 23 12.154 -3.502 -12.418 189 HD3 LYS 23 HD3 LYS 23 13.259 -4.887 -12.396 190 HE2 LYS 23 HE2 LYS 23 11.258 -6.433 -12.468 191 HE3 LYS 23 HE3 LYS 23 10.223 -5.023 -12.718 192 HZ1 LYS 23 HZ1 LYS 23 11.454 -4.567 -14.787 193 HZ2 LYS 23 HZ2 LYS 23 12.453 -5.856 -14.543 194 HZ3 LYS 23 HZ3 LYS 23 10.858 -6.087 -14.829 195 H THR 24 H THR 24 12.974 -5.222 -7.869 196 HA THR 24 HA THR 24 11.786 -7.836 -7.216 197 HB THR 24 HB THR 24 14.662 -6.912 -7.097 198 HG1 THR 24 HG1 THR 24 13.299 -8.310 -9.176 199 HG21 THR 24 HG21 THR 24 14.410 -9.032 -5.896 200 HG22 THR 24 HG22 THR 24 13.471 -9.718 -7.242 201 HG23 THR 24 HG23 THR 24 15.192 -9.324 -7.454 202 H LEU 25 H LEU 25 13.767 -5.425 -5.395 203 HA LEU 25 HA LEU 25 13.565 -6.958 -2.909 204 HB2 LEU 25 HB2 LEU 25 14.582 -4.118 -3.396 205 HB3 LEU 25 HB3 LEU 25 14.922 -5.098 -1.975 206 HG LEU 25 HG LEU 25 15.868 -5.736 -4.815 207 HD11 LEU 25 HD11 LEU 25 17.491 -4.937 -2.416 208 HD12 LEU 25 HD12 LEU 25 18.002 -5.019 -4.114 209 HD13 LEU 25 HD13 LEU 25 16.892 -3.734 -3.580 210 HD21 LEU 25 HD21 LEU 25 16.451 -7.112 -2.161 211 HD22 LEU 25 HD22 LEU 25 15.592 -7.816 -3.554 212 HD23 LEU 25 HD23 LEU 25 17.307 -7.419 -3.691 213 H GLY 26 H GLY 26 11.723 -4.390 -4.356 214 HA2 GLY 26 HA2 GLY 26 10.092 -3.905 -1.917 215 HA3 GLY 26 HA3 GLY 26 10.182 -2.923 -3.382 216 H ALA 27 H ALA 27 9.930 -6.231 -4.240 217 HA ALA 27 HA ALA 27 7.556 -5.968 -5.638 218 HB1 ALA 27 HB1 ALA 27 7.541 -8.442 -5.697 219 HB2 ALA 27 HB2 ALA 27 9.182 -7.810 -5.925 220 HB3 ALA 27 HB3 ALA 27 8.708 -8.492 -4.361 221 H GLY 28 H GLY 28 5.603 -5.319 -4.889 222 HA2 GLY 28 HA2 GLY 28 3.500 -5.649 -3.917 223 HA3 GLY 28 HA3 GLY 28 4.154 -6.914 -2.874 224 H LYS 29 H LYS 29 6.393 -4.974 -2.076 225 HA LYS 29 HA LYS 29 5.089 -3.524 0.132 226 HB2 LYS 29 HB2 LYS 29 7.940 -3.636 -0.944 227 HB3 LYS 29 HB3 LYS 29 7.471 -2.626 0.405 228 HG2 LYS 29 HG2 LYS 29 7.225 -4.365 1.866 229 HG3 LYS 29 HG3 LYS 29 6.676 -5.492 0.626 230 HD2 LYS 29 HD2 LYS 29 8.756 -6.305 1.364 231 HD3 LYS 29 HD3 LYS 29 9.035 -5.633 -0.242 232 HE2 LYS 29 HE2 LYS 29 9.981 -3.563 0.822 233 HE3 LYS 29 HE3 LYS 29 9.657 -4.247 2.410 234 HZ1 LYS 29 HZ1 LYS 29 11.183 -6.091 1.876 235 HZ2 LYS 29 HZ2 LYS 29 11.524 -5.462 0.398 236 HZ3 LYS 29 HZ3 LYS 29 11.971 -4.676 1.776 237 H ILE 30 H ILE 30 6.487 -2.732 -3.036 238 HA ILE 30 HA ILE 30 5.136 -0.093 -2.994 239 HB ILE 30 HB ILE 30 7.199 1.068 -3.744 240 HG12 ILE 30 HG12 ILE 30 9.414 0.181 -3.370 241 HG13 ILE 30 HG13 ILE 30 8.770 -1.392 -2.916 242 HG21 ILE 30 HG21 ILE 30 8.317 1.220 -1.623 243 HG22 ILE 30 HG22 ILE 30 6.572 1.083 -1.342 244 HG23 ILE 30 HG23 ILE 30 7.647 -0.315 -1.066 245 HD11 ILE 30 HD11 ILE 30 8.373 -0.196 -5.683 246 HD12 ILE 30 HD12 ILE 30 9.820 -1.103 -5.237 247 HD13 ILE 30 HD13 ILE 30 8.257 -1.912 -5.195 248 H ALA 31 H ALA 31 5.411 1.073 -5.094 249 HA ALA 31 HA ALA 31 5.801 -0.717 -7.445 250 HB1 ALA 31 HB1 ALA 31 3.972 0.483 -8.637 251 HB2 ALA 31 HB2 ALA 31 3.398 -0.471 -7.263 252 HB3 ALA 31 HB3 ALA 31 3.544 1.289 -7.115 253 H VAL 32 H VAL 32 6.911 0.295 -9.230 254 HA VAL 32 HA VAL 32 8.062 2.964 -8.654 255 HB VAL 32 HB VAL 32 10.210 1.719 -9.549 256 HG11 VAL 32 HG11 VAL 32 10.052 3.029 -7.558 257 HG12 VAL 32 HG12 VAL 32 9.226 1.716 -6.677 258 HG13 VAL 32 HG13 VAL 32 10.922 1.555 -7.184 259 HG21 VAL 32 HG21 VAL 32 9.193 -0.534 -9.758 260 HG22 VAL 32 HG22 VAL 32 10.601 -0.471 -8.696 261 HG23 VAL 32 HG23 VAL 32 8.981 -0.562 -7.987 262 H THR 33 H THR 33 8.917 4.133 -10.180 263 HA THR 33 HA THR 33 8.747 3.279 -13.028 264 HB THR 33 HB THR 33 7.737 5.959 -12.023 265 HG1 THR 33 HG1 THR 33 5.660 5.127 -12.365 266 HG21 THR 33 HG21 THR 33 6.665 6.098 -14.239 267 HG22 THR 33 HG22 THR 33 8.407 5.899 -14.434 268 HG23 THR 33 HG23 THR 33 7.335 4.509 -14.685 269 H SER 34 H SER 34 10.367 4.227 -14.347 270 HA SER 34 HA SER 34 12.309 6.100 -13.057 271 HB2 SER 34 HB2 SER 34 13.196 3.873 -13.523 272 HB3 SER 34 HB3 SER 34 12.693 4.013 -15.222 273 HG SER 34 HG SER 34 14.905 4.614 -14.866 274 H CYS 35 H CYS 35 12.867 7.964 -14.068 275 HA CYS 35 HA CYS 35 12.199 8.512 -16.864 276 HB2 CYS 35 HB2 CYS 35 10.713 10.307 -16.469 277 HB3 CYS 35 HB3 CYS 35 10.126 8.944 -15.494 278 HG CYS 35 HG CYS 35 11.434 9.764 -13.281 279 H GLY 36 H GLY 36 12.736 11.017 -17.256 280 HA2 GLY 36 HA2 GLY 36 14.792 12.092 -15.422 281 HA3 GLY 36 HA3 GLY 36 15.329 11.769 -17.084 282 H LEU 37 H LEU 37 15.437 14.359 -16.049 283 HA LEU 37 HA LEU 37 13.069 15.828 -16.777 284 HB2 LEU 37 HB2 LEU 37 14.405 17.850 -16.738 285 HB3 LEU 37 HB3 LEU 37 14.391 16.934 -15.254 286 HG LEU 37 HG LEU 37 16.696 16.442 -17.157 287 HD11 LEU 37 HD11 LEU 37 16.529 18.911 -17.097 288 HD12 LEU 37 HD12 LEU 37 16.481 18.870 -15.319 289 HD13 LEU 37 HD13 LEU 37 17.940 18.345 -16.188 290 HD21 LEU 37 HD21 LEU 37 17.911 16.258 -14.992 291 HD22 LEU 37 HD22 LEU 37 16.416 16.685 -14.126 292 HD23 LEU 37 HD23 LEU 37 16.522 15.168 -15.027 293 H GLU 38 H GLU 38 15.344 14.312 -18.643 294 HA GLU 38 HA GLU 38 13.948 14.964 -21.066 295 HB2 GLU 38 HB2 GLU 38 15.901 15.505 -22.445 296 HB3 GLU 38 HB3 GLU 38 15.552 16.756 -21.260 297 HG2 GLU 38 HG2 GLU 38 17.399 16.021 -19.854 298 HG3 GLU 38 HG3 GLU 38 17.733 14.661 -20.947 299 H SER 39 H SER 39 14.795 13.441 -22.867 300 HA SER 39 HA SER 39 15.339 10.789 -21.575 301 HB2 SER 39 HB2 SER 39 12.959 11.229 -22.164 302 HB3 SER 39 HB3 SER 39 13.443 11.403 -23.862 303 HG SER 39 HG SER 39 12.892 9.262 -23.586 304 H SER 40 H SER 40 16.419 9.230 -22.740 305 HA SER 40 HA SER 40 17.432 9.825 -25.457 306 HB2 SER 40 HB2 SER 40 19.716 9.165 -24.908 307 HB3 SER 40 HB3 SER 40 19.220 10.618 -24.029 308 HG SER 40 HG SER 40 18.864 9.319 -22.173 309 H ARG 41 H ARG 41 18.713 7.200 -23.589 310 HA ARG 41 HA ARG 41 16.761 5.179 -24.257 311 HB2 ARG 41 HB2 ARG 41 18.061 3.794 -25.718 312 HB3 ARG 41 HB3 ARG 41 17.959 5.371 -26.466 313 HG2 ARG 41 HG2 ARG 41 20.398 4.193 -25.046 314 HG3 ARG 41 HG3 ARG 41 20.149 4.366 -26.776 315 HD2 ARG 41 HD2 ARG 41 20.059 6.898 -26.414 316 HD3 ARG 41 HD3 ARG 41 20.561 6.602 -24.753 317 HE ARG 41 HE ARG 41 22.701 6.046 -25.431 318 HH11 ARG 41 HH11 ARG 41 20.765 6.362 -28.353 319 HH12 ARG 41 HH12 ARG 41 22.172 6.371 -29.379 320 HH21 ARG 41 HH21 ARG 41 24.435 6.054 -26.811 321 HH22 ARG 41 HH22 ARG 41 24.189 6.202 -28.523 322 H VAL 42 H VAL 42 17.201 3.169 -23.056 323 HA VAL 42 HA VAL 42 18.817 3.500 -20.684 324 HB VAL 42 HB VAL 42 18.133 0.762 -21.837 325 HG11 VAL 42 HG11 VAL 42 18.205 0.152 -19.407 326 HG12 VAL 42 HG12 VAL 42 19.762 0.749 -19.968 327 HG13 VAL 42 HG13 VAL 42 18.704 1.807 -19.013 328 HG21 VAL 42 HG21 VAL 42 16.452 2.519 -20.033 329 HG22 VAL 42 HG22 VAL 42 16.027 1.904 -21.652 330 HG23 VAL 42 HG23 VAL 42 16.244 0.768 -20.312 331 H HIS 43 H HIS 43 20.953 3.139 -20.283 332 HA HIS 43 HA HIS 43 22.790 2.755 -22.500 333 HB2 HIS 43 HB2 HIS 43 23.149 4.028 -20.262 334 HB3 HIS 43 HB3 HIS 43 23.476 2.447 -19.554 335 HD2 HIS 43 HD2 HIS 43 25.012 5.226 -21.529 336 HE1 HIS 43 HE1 HIS 43 27.855 2.067 -21.756 337 HE2 HIS 43 HE2 HIS 43 27.434 4.555 -22.229 338 HA PRO 44 HA PRO 44 21.907 -1.507 -22.552 339 HB2 PRO 44 HB2 PRO 44 23.805 -2.542 -24.273 340 HB3 PRO 44 HB3 PRO 44 22.482 -1.452 -24.794 341 HG2 PRO 44 HG2 PRO 44 25.333 -0.682 -24.113 342 HG3 PRO 44 HG3 PRO 44 24.396 -0.259 -25.581 343 HD2 PRO 44 HD2 PRO 44 24.567 1.443 -23.467 344 HD3 PRO 44 HD3 PRO 44 23.039 1.274 -24.387 345 H THR 45 H THR 45 25.212 -0.501 -21.647 346 HA THR 45 HA THR 45 25.941 -2.949 -20.317 347 HB THR 45 HB THR 45 26.951 -0.134 -19.790 348 HG1 THR 45 HG1 THR 45 28.540 -0.722 -21.300 349 HG21 THR 45 HG21 THR 45 27.688 -1.657 -18.033 350 HG22 THR 45 HG22 THR 45 28.105 -2.909 -19.220 351 HG23 THR 45 HG23 THR 45 29.044 -1.395 -19.137 352 H ALA 46 H ALA 46 23.903 -0.208 -19.269 353 HA ALA 46 HA ALA 46 23.951 -0.819 -16.459 354 HB1 ALA 46 HB1 ALA 46 21.864 0.462 -16.376 355 HB2 ALA 46 HB2 ALA 46 23.005 1.277 -17.472 356 HB3 ALA 46 HB3 ALA 46 21.653 0.311 -18.128 357 H ILE 47 H ILE 47 21.830 -1.976 -19.097 358 HA ILE 47 HA ILE 47 20.262 -3.836 -17.544 359 HB ILE 47 HB ILE 47 21.066 -3.806 -20.476 360 HG12 ILE 47 HG12 ILE 47 18.237 -3.261 -19.752 361 HG13 ILE 47 HG13 ILE 47 19.343 -2.058 -19.108 362 HG21 ILE 47 HG21 ILE 47 20.423 -6.088 -19.910 363 HG22 ILE 47 HG22 ILE 47 18.947 -5.514 -19.110 364 HG23 ILE 47 HG23 ILE 47 19.154 -5.336 -20.870 365 HD11 ILE 47 HD11 ILE 47 19.381 -2.878 -22.033 366 HD12 ILE 47 HD12 ILE 47 18.406 -1.546 -21.381 367 HD13 ILE 47 HD13 ILE 47 20.174 -1.480 -21.244 368 H ALA 48 H ALA 48 23.360 -4.288 -19.341 369 HA ALA 48 HA ALA 48 23.650 -7.050 -18.725 370 HB1 ALA 48 HB1 ALA 48 25.975 -6.747 -19.340 371 HB2 ALA 48 HB2 ALA 48 24.934 -5.835 -20.455 372 HB3 ALA 48 HB3 ALA 48 25.834 -4.986 -19.169 373 H MET 49 H MET 49 24.603 -4.191 -16.864 374 HA MET 49 HA MET 49 25.978 -5.660 -14.774 375 HB2 MET 49 HB2 MET 49 24.949 -2.811 -14.869 376 HB3 MET 49 HB3 MET 49 26.032 -3.471 -13.625 377 HG2 MET 49 HG2 MET 49 26.873 -3.736 -16.505 378 HG3 MET 49 HG3 MET 49 26.917 -2.159 -15.751 379 HE1 MET 49 HE1 MET 49 28.088 -5.963 -15.201 380 HE2 MET 49 HE2 MET 49 28.826 -5.170 -16.616 381 HE3 MET 49 HE3 MET 49 29.827 -5.602 -15.211 382 H MET 50 H MET 50 22.589 -4.656 -15.215 383 HA MET 50 HA MET 50 21.812 -5.546 -12.523 384 HB2 MET 50 HB2 MET 50 20.190 -5.062 -15.058 385 HB3 MET 50 HB3 MET 50 19.501 -5.474 -13.494 386 HG2 MET 50 HG2 MET 50 21.066 -2.962 -14.186 387 HG3 MET 50 HG3 MET 50 19.349 -3.084 -13.843 388 HE1 MET 50 HE1 MET 50 19.309 -3.840 -9.994 389 HE2 MET 50 HE2 MET 50 18.471 -4.046 -11.541 390 HE3 MET 50 HE3 MET 50 19.752 -5.189 -11.062 391 H GLU 51 H GLU 51 22.052 -7.101 -15.756 392 HA GLU 51 HA GLU 51 20.858 -9.576 -14.958 393 HB2 GLU 51 HB2 GLU 51 22.838 -8.873 -17.148 394 HB3 GLU 51 HB3 GLU 51 22.239 -10.513 -16.895 395 HG2 GLU 51 HG2 GLU 51 19.906 -9.724 -17.145 396 HG3 GLU 51 HG3 GLU 51 20.487 -8.100 -17.492 397 H GLU 52 H GLU 52 24.114 -8.334 -14.223 398 HA GLU 52 HA GLU 52 25.268 -10.856 -13.420 399 HB2 GLU 52 HB2 GLU 52 25.730 -8.143 -12.139 400 HB3 GLU 52 HB3 GLU 52 26.756 -9.573 -12.008 401 HG2 GLU 52 HG2 GLU 52 26.955 -9.404 -14.602 402 HG3 GLU 52 HG3 GLU 52 26.377 -7.744 -14.380 403 H VAL 53 H VAL 53 22.850 -8.825 -11.913 404 HA VAL 53 HA VAL 53 22.935 -10.233 -9.308 405 HB VAL 53 HB VAL 53 20.798 -8.259 -10.102 406 HG11 VAL 53 HG11 VAL 53 20.672 -9.386 -7.871 407 HG12 VAL 53 HG12 VAL 53 22.278 -8.748 -7.479 408 HG13 VAL 53 HG13 VAL 53 20.902 -7.655 -7.725 409 HG21 VAL 53 HG21 VAL 53 22.832 -7.039 -10.749 410 HG22 VAL 53 HG22 VAL 53 22.181 -6.377 -9.256 411 HG23 VAL 53 HG23 VAL 53 23.597 -7.454 -9.199 412 H GLY 54 H GLY 54 21.712 -10.940 -12.349 413 HA2 GLY 54 HA2 GLY 54 20.089 -12.358 -13.148 414 HA3 GLY 54 HA3 GLY 54 19.696 -12.841 -11.492 415 H ILE 55 H ILE 55 19.603 -9.426 -12.210 416 HA ILE 55 HA ILE 55 16.636 -9.394 -11.941 417 HB ILE 55 HB ILE 55 18.783 -7.319 -11.412 418 HG12 ILE 55 HG12 ILE 55 16.714 -8.706 -9.638 419 HG13 ILE 55 HG13 ILE 55 18.451 -9.006 -9.643 420 HG21 ILE 55 HG21 ILE 55 17.044 -5.754 -10.791 421 HG22 ILE 55 HG22 ILE 55 16.824 -6.181 -12.471 422 HG23 ILE 55 HG23 ILE 55 15.767 -6.904 -11.224 423 HD11 ILE 55 HD11 ILE 55 18.793 -6.600 -8.888 424 HD12 ILE 55 HD12 ILE 55 17.025 -6.508 -8.655 425 HD13 ILE 55 HD13 ILE 55 17.974 -7.670 -7.731 426 H ASP 56 H ASP 56 15.363 -8.748 -13.563 427 HA ASP 56 HA ASP 56 16.665 -8.164 -16.161 428 HB2 ASP 56 HB2 ASP 56 15.234 -10.102 -16.068 429 HB3 ASP 56 HB3 ASP 56 13.886 -9.134 -15.458 430 H ILE 57 H ILE 57 16.725 -6.230 -16.976 431 HA ILE 57 HA ILE 57 14.356 -4.451 -16.775 432 HB ILE 57 HB ILE 57 15.711 -2.468 -16.696 433 HG12 ILE 57 HG12 ILE 57 18.169 -3.955 -15.810 434 HG13 ILE 57 HG13 ILE 57 17.878 -3.737 -17.526 435 HG21 ILE 57 HG21 ILE 57 16.292 -4.241 -14.297 436 HG22 ILE 57 HG22 ILE 57 16.243 -2.461 -14.324 437 HG23 ILE 57 HG23 ILE 57 14.765 -3.381 -14.609 438 HD11 ILE 57 HD11 ILE 57 17.951 -1.425 -15.539 439 HD12 ILE 57 HD12 ILE 57 19.301 -1.919 -16.569 440 HD13 ILE 57 HD13 ILE 57 17.809 -1.309 -17.309 441 H SER 58 H SER 58 15.605 -6.371 -18.950 442 HA SER 58 HA SER 58 16.688 -4.644 -20.971 443 HB2 SER 58 HB2 SER 58 16.631 -6.495 -22.429 444 HB3 SER 58 HB3 SER 58 17.010 -7.126 -20.816 445 HG SER 58 HG SER 58 15.418 -8.416 -21.814 446 H GLY 59 H GLY 59 13.373 -5.384 -20.171 447 HA2 GLY 59 HA2 GLY 59 12.173 -4.326 -22.594 448 HA3 GLY 59 HA3 GLY 59 11.357 -4.715 -21.079 449 H GLN 60 H GLN 60 13.866 -2.517 -20.294 450 HA GLN 60 HA GLN 60 11.945 -0.332 -19.952 451 HB2 GLN 60 HB2 GLN 60 14.876 -0.722 -19.291 452 HB3 GLN 60 HB3 GLN 60 14.098 0.854 -19.150 453 HG2 GLN 60 HG2 GLN 60 12.491 -0.004 -17.527 454 HG3 GLN 60 HG3 GLN 60 13.193 -1.625 -17.650 455 HE21 GLN 60 HE22 GLN 60 13.107 -0.303 -15.131 456 HE22 GLN 60 HE21 GLN 60 14.813 0.016 -14.714 457 H THR 61 H THR 61 12.425 1.810 -20.653 458 HA THR 61 HA THR 61 14.045 2.384 -22.965 459 HB THR 61 HB THR 61 12.129 3.582 -24.079 460 HG1 THR 61 HG1 THR 61 10.029 2.865 -23.596 461 HG21 THR 61 HG21 THR 61 12.959 1.389 -24.948 462 HG22 THR 61 HG22 THR 61 11.712 0.564 -23.982 463 HG23 THR 61 HG23 THR 61 11.245 1.673 -25.283 464 H SER 62 H SER 62 14.086 4.832 -23.131 465 HA SER 62 HA SER 62 13.915 5.993 -20.436 466 HB2 SER 62 HB2 SER 62 14.861 7.080 -23.049 467 HB3 SER 62 HB3 SER 62 15.019 7.893 -21.458 468 HG SER 62 HG SER 62 16.485 6.350 -20.830 469 H ASP 63 H ASP 63 12.612 7.654 -19.802 470 HA ASP 63 HA ASP 63 10.695 8.850 -21.740 471 HB2 ASP 63 HB2 ASP 63 9.930 7.380 -19.217 472 HB3 ASP 63 HB3 ASP 63 8.892 8.615 -19.938 473 HA PRO 64 HA PRO 64 11.701 12.515 -19.510 474 HB2 PRO 64 HB2 PRO 64 10.140 14.358 -20.725 475 HB3 PRO 64 HB3 PRO 64 11.378 13.422 -21.622 476 HG2 PRO 64 HG2 PRO 64 8.397 12.844 -21.418 477 HG3 PRO 64 HG3 PRO 64 9.402 12.944 -22.900 478 HD2 PRO 64 HD2 PRO 64 8.823 10.567 -21.630 479 HD3 PRO 64 HD3 PRO 64 10.363 10.853 -22.503 480 H ILE 65 H ILE 65 11.151 13.833 -17.815 481 HA ILE 65 HA ILE 65 9.239 13.102 -15.943 482 HB ILE 65 HB ILE 65 11.403 14.438 -15.726 483 HG12 ILE 65 HG12 ILE 65 9.004 15.395 -14.172 484 HG13 ILE 65 HG13 ILE 65 9.964 13.934 -13.856 485 HG21 ILE 65 HG21 ILE 65 9.644 16.898 -16.131 486 HG22 ILE 65 HG22 ILE 65 11.358 16.868 -15.743 487 HG23 ILE 65 HG23 ILE 65 10.824 16.306 -17.331 488 HD11 ILE 65 HD11 ILE 65 10.805 16.829 -13.532 489 HD12 ILE 65 HD12 ILE 65 10.751 15.560 -12.311 490 HD13 ILE 65 HD13 ILE 65 11.984 15.491 -13.579 491 H GLU 66 H GLU 66 8.979 15.566 -18.453 492 HA GLU 66 HA GLU 66 6.662 16.913 -17.567 493 HB2 GLU 66 HB2 GLU 66 7.646 16.487 -20.417 494 HB3 GLU 66 HB3 GLU 66 6.435 17.679 -19.918 495 HG2 GLU 66 HG2 GLU 66 8.141 18.709 -18.386 496 HG3 GLU 66 HG3 GLU 66 9.355 17.608 -19.051 497 H ASN 67 H ASN 67 6.776 13.759 -19.124 498 HA ASN 67 HA ASN 67 3.894 13.836 -19.776 499 HB2 ASN 67 HB2 ASN 67 4.296 12.162 -21.180 500 HB3 ASN 67 HB3 ASN 67 5.994 12.540 -20.988 501 HD21 ASN 67 HD22 ASN 67 7.047 11.300 -18.955 502 HD22 ASN 67 HD21 ASN 67 6.419 9.696 -18.666 503 H PHE 68 H PHE 68 5.658 13.238 -16.951 504 HA PHE 68 HA PHE 68 3.860 11.101 -15.945 505 HB2 PHE 68 HB2 PHE 68 6.637 12.056 -15.219 506 HB3 PHE 68 HB3 PHE 68 5.743 10.968 -14.194 507 HD1 PHE 68 HD2 PHE 68 4.485 8.981 -15.844 508 HD2 PHE 68 HD1 PHE 68 8.326 10.886 -16.326 509 HE1 PHE 68 HE2 PHE 68 5.304 7.007 -17.089 510 HE2 PHE 68 HE1 PHE 68 9.136 8.895 -17.575 511 HZ PHE 68 HZ PHE 68 7.638 6.953 -17.948 512 H ASN 69 H ASN 69 3.634 11.128 -13.480 513 HA ASN 69 HA ASN 69 2.409 13.750 -12.695 514 HB2 ASN 69 HB2 ASN 69 0.519 12.303 -11.801 515 HB3 ASN 69 HB3 ASN 69 0.636 12.522 -13.541 516 HD21 ASN 69 HD22 ASN 69 1.889 10.150 -11.084 517 HD22 ASN 69 HD21 ASN 69 1.410 8.752 -12.040 518 H ALA 70 H ALA 70 4.093 14.323 -11.241 519 HA ALA 70 HA ALA 70 5.219 12.704 -9.287 520 HB1 ALA 70 HB1 ALA 70 5.934 15.043 -9.857 521 HB2 ALA 70 HB2 ALA 70 4.540 15.631 -8.928 522 HB3 ALA 70 HB3 ALA 70 5.809 14.723 -8.113 523 H ASP 71 H ASP 71 2.091 14.329 -9.203 524 HA ASP 71 HA ASP 71 1.427 14.240 -6.480 525 HB2 ASP 71 HB2 ASP 71 0.198 15.397 -8.336 526 HB3 ASP 71 HB3 ASP 71 -0.391 13.821 -8.885 527 H ASP 72 H ASP 72 1.585 11.522 -8.703 528 HA ASP 72 HA ASP 72 0.316 9.771 -6.649 529 HB2 ASP 72 HB2 ASP 72 -0.771 9.885 -8.954 530 HB3 ASP 72 HB3 ASP 72 0.654 9.025 -9.541 531 H TYR 73 H TYR 73 3.276 10.776 -7.167 532 HA TYR 73 HA TYR 73 4.485 8.097 -6.584 533 HB2 TYR 73 HB2 TYR 73 6.064 10.500 -7.451 534 HB3 TYR 73 HB3 TYR 73 6.572 8.821 -7.355 535 HD1 TYR 73 HD1 TYR 73 4.322 7.454 -8.878 536 HD2 TYR 73 HD2 TYR 73 6.539 11.077 -9.642 537 HE1 TYR 73 HE1 TYR 73 3.735 7.311 -11.282 538 HE2 TYR 73 HE2 TYR 73 5.910 10.957 -12.028 539 HH TYR 73 HH TYR 73 3.870 8.315 -13.353 540 H ASP 74 H ASP 74 4.049 8.010 -4.408 541 HA ASP 74 HA ASP 74 3.964 10.128 -2.586 542 HB2 ASP 74 HB2 ASP 74 4.933 7.286 -2.067 543 HB3 ASP 74 HB3 ASP 74 4.328 8.409 -0.849 544 H VAL 75 H VAL 75 6.809 8.334 -3.723 545 HA VAL 75 HA VAL 75 8.540 10.411 -2.450 546 HB VAL 75 HB VAL 75 9.281 7.524 -2.989 547 HG11 VAL 75 HG11 VAL 75 11.318 8.098 -1.666 548 HG12 VAL 75 HG12 VAL 75 11.216 8.983 -3.187 549 HG13 VAL 75 HG13 VAL 75 10.817 9.792 -1.665 550 HG21 VAL 75 HG21 VAL 75 8.509 8.951 -0.415 551 HG22 VAL 75 HG22 VAL 75 7.793 7.486 -1.124 552 HG23 VAL 75 HG23 VAL 75 9.423 7.426 -0.449 553 H VAL 76 H VAL 76 9.940 11.446 -3.764 554 HA VAL 76 HA VAL 76 10.418 10.384 -6.528 555 HB VAL 76 HB VAL 76 9.930 13.234 -5.697 556 HG11 VAL 76 HG11 VAL 76 10.569 13.934 -7.965 557 HG12 VAL 76 HG12 VAL 76 11.957 13.245 -7.156 558 HG13 VAL 76 HG13 VAL 76 11.081 12.275 -8.363 559 HG21 VAL 76 HG21 VAL 76 8.761 11.500 -7.909 560 HG22 VAL 76 HG22 VAL 76 7.944 11.922 -6.379 561 HG23 VAL 76 HG23 VAL 76 8.320 13.186 -7.566 562 H ILE 77 H ILE 77 12.480 10.248 -7.146 563 HA ILE 77 HA ILE 77 14.618 11.219 -5.271 564 HB ILE 77 HB ILE 77 14.589 8.716 -6.968 565 HG12 ILE 77 HG12 ILE 77 12.932 8.343 -5.243 566 HG13 ILE 77 HG13 ILE 77 14.342 7.340 -5.003 567 HG21 ILE 77 HG21 ILE 77 16.527 9.633 -4.804 568 HG22 ILE 77 HG22 ILE 77 16.570 8.072 -5.654 569 HG23 ILE 77 HG23 ILE 77 16.854 9.561 -6.538 570 HD11 ILE 77 HD11 ILE 77 13.421 8.269 -2.909 571 HD12 ILE 77 HD12 ILE 77 15.115 8.705 -3.152 572 HD13 ILE 77 HD13 ILE 77 13.832 9.908 -3.441 573 H SER 78 H SER 78 16.162 12.460 -6.229 574 HA SER 78 HA SER 78 16.375 12.477 -9.216 575 HB2 SER 78 HB2 SER 78 16.010 14.688 -8.138 576 HB3 SER 78 HB3 SER 78 17.553 14.482 -7.281 577 HG SER 78 HG SER 78 17.862 15.591 -9.276 578 H LEU 79 H LEU 79 18.270 11.948 -10.170 579 HA LEU 79 HA LEU 79 20.609 11.080 -8.533 580 HB2 LEU 79 HB2 LEU 79 19.458 9.434 -10.827 581 HB3 LEU 79 HB3 LEU 79 20.813 9.044 -9.775 582 HG LEU 79 HG LEU 79 18.985 9.089 -7.846 583 HD11 LEU 79 HD11 LEU 79 16.822 8.168 -8.654 584 HD12 LEU 79 HD12 LEU 79 17.049 9.796 -9.272 585 HD13 LEU 79 HD13 LEU 79 17.343 8.423 -10.342 586 HD21 LEU 79 HD21 LEU 79 20.278 7.095 -8.535 587 HD22 LEU 79 HD22 LEU 79 18.583 6.693 -8.198 588 HD23 LEU 79 HD23 LEU 79 19.128 6.826 -9.875 589 H CYS 80 H CYS 80 20.460 13.514 -9.662 590 HA CYS 80 HA CYS 80 21.713 13.375 -12.385 591 HB2 CYS 80 HB2 CYS 80 20.249 15.658 -11.000 592 HB3 CYS 80 HB3 CYS 80 20.824 15.616 -12.677 593 HG CYS 80 HG CYS 80 18.351 14.109 -11.138 594 H GLY 81 H GLY 81 22.470 14.508 -9.126 595 HA2 GLY 81 HA2 GLY 81 24.490 15.468 -8.353 596 HA3 GLY 81 HA3 GLY 81 25.081 15.566 -10.005 597 H CYS 82 H CYS 82 25.725 17.726 -9.463 598 HA CYS 82 HA CYS 82 23.964 19.873 -8.819 599 HB2 CYS 82 HB2 CYS 82 26.576 19.878 -10.394 600 HB3 CYS 82 HB3 CYS 82 25.780 21.317 -9.738 601 HG CYS 82 HG CYS 82 27.821 20.689 -8.204 602 H GLY 83 H GLY 83 23.067 21.556 -10.099 603 HA2 GLY 83 HA2 GLY 83 22.404 22.619 -12.095 604 HA3 GLY 83 HA3 GLY 83 22.801 21.184 -13.033 605 H VAL 84 H VAL 84 20.934 20.075 -10.489 606 HA VAL 84 HA VAL 84 18.317 20.506 -11.891 607 HB VAL 84 HB VAL 84 19.402 17.817 -10.975 608 HG11 VAL 84 HG11 VAL 84 16.749 18.507 -12.314 609 HG12 VAL 84 HG12 VAL 84 17.353 16.873 -11.946 610 HG13 VAL 84 HG13 VAL 84 16.956 17.958 -10.628 611 HG21 VAL 84 HG21 VAL 84 19.226 17.207 -13.388 612 HG22 VAL 84 HG22 VAL 84 18.827 18.894 -13.771 613 HG23 VAL 84 HG23 VAL 84 20.420 18.467 -13.107 614 H ASN 85 H ASN 85 16.812 21.209 -10.523 615 HA ASN 85 HA ASN 85 16.886 20.341 -7.646 616 HB2 ASN 85 HB2 ASN 85 16.423 23.121 -8.801 617 HB3 ASN 85 HB3 ASN 85 16.171 22.695 -7.109 618 HD21 ASN 85 HD22 ASN 85 18.108 21.852 -5.877 619 HD22 ASN 85 HD21 ASN 85 19.685 22.447 -6.369 620 H LEU 86 H LEU 86 14.922 20.272 -10.388 621 HA LEU 86 HA LEU 86 12.659 20.063 -10.777 622 HB2 LEU 86 HB2 LEU 86 12.910 18.351 -8.285 623 HB3 LEU 86 HB3 LEU 86 11.644 18.255 -9.518 624 HG LEU 86 HG LEU 86 14.535 17.456 -9.845 625 HD11 LEU 86 HD11 LEU 86 13.633 15.254 -9.925 626 HD12 LEU 86 HD12 LEU 86 12.761 16.031 -8.577 627 HD13 LEU 86 HD13 LEU 86 11.979 15.845 -10.161 628 HD21 LEU 86 HD21 LEU 86 13.678 16.688 -12.127 629 HD22 LEU 86 HD22 LEU 86 12.213 17.646 -11.812 630 HD23 LEU 86 HD23 LEU 86 13.803 18.438 -11.966 631 HA PRO 87 HA PRO 87 11.284 23.191 -7.586 632 HB2 PRO 87 HB2 PRO 87 10.512 25.205 -9.351 633 HB3 PRO 87 HB3 PRO 87 12.113 25.025 -8.575 634 HG2 PRO 87 HG2 PRO 87 11.249 24.102 -11.331 635 HG3 PRO 87 HG3 PRO 87 12.731 25.001 -10.867 636 HD2 PRO 87 HD2 PRO 87 12.789 22.329 -11.232 637 HD3 PRO 87 HD3 PRO 87 13.702 23.073 -9.891 638 HA PRO 88 HA PRO 88 6.873 22.820 -9.339 639 HB2 PRO 88 HB2 PRO 88 6.807 20.263 -10.853 640 HB3 PRO 88 HB3 PRO 88 6.139 21.858 -11.296 641 HG2 PRO 88 HG2 PRO 88 8.328 20.740 -12.500 642 HG3 PRO 88 HG3 PRO 88 8.182 22.519 -12.250 643 HD2 PRO 88 HD2 PRO 88 9.665 20.485 -10.568 644 HD3 PRO 88 HD3 PRO 88 10.199 22.084 -11.167 645 H GLU 89 H GLU 89 5.168 20.601 -9.282 646 HA GLU 89 HA GLU 89 5.031 19.667 -6.656 647 HB2 GLU 89 HB2 GLU 89 3.477 17.939 -7.602 648 HB3 GLU 89 HB3 GLU 89 3.120 19.599 -8.065 649 HG2 GLU 89 HG2 GLU 89 4.066 19.261 -10.289 650 HG3 GLU 89 HG3 GLU 89 4.652 17.661 -9.852 651 H TRP 90 H TRP 90 7.314 18.587 -8.940 652 HA TRP 90 HA TRP 90 7.765 15.880 -8.136 653 HB2 TRP 90 HB2 TRP 90 9.454 17.975 -9.478 654 HB3 TRP 90 HB3 TRP 90 10.006 16.322 -9.156 655 HD1 TRP 90 HD1 TRP 90 7.469 18.246 -11.317 656 HE1 TRP 90 HE1 TRP 90 6.326 16.646 -12.959 657 HE3 TRP 90 HE3 TRP 90 9.865 13.937 -10.021 658 HZ2 TRP 90 HZ2 TRP 90 6.391 13.817 -13.579 659 HZ3 TRP 90 HZ3 TRP 90 9.496 11.871 -11.311 660 HH2 TRP 90 HH2 TRP 90 7.757 11.786 -13.078 661 H VAL 91 H VAL 91 8.448 18.781 -6.373 662 HA VAL 91 HA VAL 91 9.989 17.120 -4.403 663 HB VAL 91 HB VAL 91 11.174 19.083 -3.656 664 HG11 VAL 91 HG11 VAL 91 12.250 17.714 -5.273 665 HG12 VAL 91 HG12 VAL 91 11.442 18.546 -6.604 666 HG13 VAL 91 HG13 VAL 91 12.629 19.406 -5.602 667 HG21 VAL 91 HG21 VAL 91 11.135 21.202 -4.927 668 HG22 VAL 91 HG22 VAL 91 9.827 20.588 -5.947 669 HG23 VAL 91 HG23 VAL 91 9.553 20.872 -4.214 670 H THR 92 H THR 92 6.942 18.218 -4.777 671 HA THR 92 HA THR 92 6.584 19.129 -1.968 672 HB THR 92 HB THR 92 4.331 19.700 -2.580 673 HG1 THR 92 HG1 THR 92 3.490 19.227 -4.530 674 HG21 THR 92 HG21 THR 92 6.131 21.338 -3.160 675 HG22 THR 92 HG22 THR 92 6.196 20.653 -4.797 676 HG23 THR 92 HG23 THR 92 4.714 21.443 -4.220 677 H GLN 93 H GLN 93 6.944 16.183 -3.249 678 HA GLN 93 HA GLN 93 4.592 14.811 -2.196 679 HB2 GLN 93 HB2 GLN 93 7.165 13.647 -3.332 680 HB3 GLN 93 HB3 GLN 93 5.627 12.813 -3.081 681 HG2 GLN 93 HG2 GLN 93 6.232 14.989 -5.106 682 HG3 GLN 93 HG3 GLN 93 5.771 13.337 -5.422 683 HE21 GLN 93 HE22 GLN 93 4.562 16.325 -5.736 684 HE22 GLN 93 HE21 GLN 93 2.872 16.042 -5.338 685 H GLU 94 H GLU 94 5.499 12.518 -1.004 686 HA GLU 94 HA GLU 94 5.570 13.539 1.689 687 HB2 GLU 94 HB2 GLU 94 4.426 11.413 0.870 688 HB3 GLU 94 HB3 GLU 94 6.027 10.671 0.786 689 HG2 GLU 94 HG2 GLU 94 5.065 9.958 2.805 690 HG3 GLU 94 HG3 GLU 94 6.339 11.089 3.224 691 H ILE 95 H ILE 95 8.031 11.945 -0.338 692 HA ILE 95 HA ILE 95 10.149 13.145 1.353 693 HB ILE 95 HB ILE 95 10.250 10.231 0.469 694 HG12 ILE 95 HG12 ILE 95 9.922 11.395 3.258 695 HG13 ILE 95 HG13 ILE 95 8.747 10.433 2.360 696 HG21 ILE 95 HG21 ILE 95 12.274 11.863 2.070 697 HG22 ILE 95 HG22 ILE 95 12.408 10.136 1.677 698 HG23 ILE 95 HG23 ILE 95 12.480 11.304 0.392 699 HD11 ILE 95 HD11 ILE 95 10.459 8.531 2.374 700 HD12 ILE 95 HD12 ILE 95 11.338 9.480 3.593 701 HD13 ILE 95 HD13 ILE 95 9.681 8.943 3.919 702 H PHE 96 H PHE 96 11.846 13.935 0.203 703 HA PHE 96 HA PHE 96 12.201 13.092 -2.597 704 HB2 PHE 96 HB2 PHE 96 11.116 15.201 -2.878 705 HB3 PHE 96 HB3 PHE 96 12.165 15.967 -1.685 706 HD1 PHE 96 HD1 PHE 96 12.020 14.628 -5.195 707 HD2 PHE 96 HD2 PHE 96 14.434 16.636 -2.219 708 HE1 PHE 96 HE1 PHE 96 13.783 15.020 -6.870 709 HE2 PHE 96 HE2 PHE 96 16.141 17.125 -3.946 710 HZ PHE 96 HZ PHE 96 15.827 16.311 -6.274 711 H GLU 97 H GLU 97 14.286 12.701 -3.181 712 HA GLU 97 HA GLU 97 16.506 13.493 -1.365 713 HB2 GLU 97 HB2 GLU 97 16.121 10.657 -2.405 714 HB3 GLU 97 HB3 GLU 97 17.524 11.287 -1.545 715 HG2 GLU 97 HG2 GLU 97 16.088 11.738 0.446 716 HG3 GLU 97 HG3 GLU 97 14.725 10.994 -0.403 717 H ASP 98 H ASP 98 18.601 13.506 -2.385 718 HA ASP 98 HA ASP 98 18.620 13.254 -5.356 719 HB2 ASP 98 HB2 ASP 98 18.433 15.594 -4.882 720 HB3 ASP 98 HB3 ASP 98 19.737 15.512 -3.698 721 H TRP 99 H TRP 99 19.735 11.438 -5.621 722 HA TRP 99 HA TRP 99 22.056 10.740 -3.917 723 HB2 TRP 99 HB2 TRP 99 20.704 9.154 -6.115 724 HB3 TRP 99 HB3 TRP 99 21.900 8.559 -4.972 725 HD1 TRP 99 HD1 TRP 99 20.028 10.256 -2.573 726 HE1 TRP 99 HE1 TRP 99 18.023 8.971 -1.623 727 HE3 TRP 99 HE3 TRP 99 19.681 6.573 -6.104 728 HZ2 TRP 99 HZ2 TRP 99 16.412 6.715 -2.350 729 HZ3 TRP 99 HZ3 TRP 99 17.887 4.857 -5.955 730 HH2 TRP 99 HH2 TRP 99 16.247 4.918 -4.077 731 H GLN 100 H GLN 100 23.588 12.229 -4.566 732 HA GLN 100 HA GLN 100 24.286 12.581 -7.375 733 HB2 GLN 100 HB2 GLN 100 25.705 13.582 -4.870 734 HB3 GLN 100 HB3 GLN 100 25.965 14.131 -6.535 735 HG2 GLN 100 HG2 GLN 100 23.467 14.804 -6.529 736 HG3 GLN 100 HG3 GLN 100 23.495 14.528 -4.799 737 HE21 GLN 100 HE22 GLN 100 22.781 16.990 -5.575 738 HE22 GLN 100 HE21 GLN 100 24.101 18.147 -5.306 739 H LEU 101 H LEU 101 24.951 10.610 -8.192 740 HA LEU 101 HA LEU 101 27.369 9.246 -7.022 741 HB2 LEU 101 HB2 LEU 101 25.221 8.131 -8.842 742 HB3 LEU 101 HB3 LEU 101 26.572 7.245 -8.154 743 HG LEU 101 HG LEU 101 24.151 8.322 -6.653 744 HD11 LEU 101 HD11 LEU 101 23.761 6.322 -7.959 745 HD12 LEU 101 HD12 LEU 101 25.165 5.520 -7.215 746 HD13 LEU 101 HD13 LEU 101 23.737 5.950 -6.230 747 HD21 LEU 101 HD21 LEU 101 26.091 8.545 -5.173 748 HD22 LEU 101 HD22 LEU 101 25.104 7.173 -4.670 749 HD23 LEU 101 HD23 LEU 101 26.609 6.900 -5.588 750 H GLU 102 H GLU 102 28.582 7.983 -8.706 751 HA GLU 102 HA GLU 102 29.794 9.701 -10.637 752 HB2 GLU 102 HB2 GLU 102 29.855 6.689 -10.237 753 HB3 GLU 102 HB3 GLU 102 30.945 7.576 -11.281 754 HG2 GLU 102 HG2 GLU 102 32.109 7.004 -9.322 755 HG3 GLU 102 HG3 GLU 102 31.861 8.753 -9.303 756 H ASP 103 H ASP 103 30.038 9.043 -12.911 757 HA ASP 103 HA ASP 103 27.436 8.253 -14.179 758 HB2 ASP 103 HB2 ASP 103 28.157 10.698 -14.200 759 HB3 ASP 103 HB3 ASP 103 29.360 10.230 -15.402 760 HA PRO 104 HA PRO 104 30.406 5.055 -15.372 761 HB2 PRO 104 HB2 PRO 104 27.888 3.593 -16.045 762 HB3 PRO 104 HB3 PRO 104 29.331 3.033 -15.130 763 HG2 PRO 104 HG2 PRO 104 27.082 3.692 -13.806 764 HG3 PRO 104 HG3 PRO 104 28.676 4.304 -13.220 765 HD2 PRO 104 HD2 PRO 104 26.668 5.738 -15.012 766 HD3 PRO 104 HD3 PRO 104 27.401 6.295 -13.484 767 H ASP 105 H ASP 105 28.105 6.525 -17.476 768 HA ASP 105 HA ASP 105 28.277 5.018 -19.854 769 HB2 ASP 105 HB2 ASP 105 26.619 6.727 -19.376 770 HB3 ASP 105 HB3 ASP 105 27.866 7.976 -19.323 771 H GLY 106 H GLY 106 30.192 4.359 -20.689 772 HA2 GLY 106 HA2 GLY 106 32.052 4.579 -22.072 773 HA3 GLY 106 HA3 GLY 106 32.068 6.322 -21.824 774 H GLN 107 H GLN 107 31.930 4.494 -18.887 775 HA GLN 107 HA GLN 107 34.753 5.169 -18.273 776 HB2 GLN 107 HB2 GLN 107 32.600 4.129 -16.416 777 HB3 GLN 107 HB3 GLN 107 34.185 4.750 -15.952 778 HG2 GLN 107 HG2 GLN 107 31.982 6.390 -17.270 779 HG3 GLN 107 HG3 GLN 107 32.236 6.214 -15.544 780 HE21 GLN 107 HE22 GLN 107 32.138 8.610 -15.958 781 HE22 GLN 107 HE21 GLN 107 33.708 9.414 -16.115 782 H SER 108 H SER 108 33.374 2.499 -16.578 783 HA SER 108 HA SER 108 34.413 0.299 -18.157 784 HB2 SER 108 HB2 SER 108 35.930 1.252 -15.682 785 HB3 SER 108 HB3 SER 108 35.952 -0.445 -16.183 786 HG SER 108 HG SER 108 36.610 1.631 -17.996 787 H LEU 109 H LEU 109 33.961 -1.803 -17.048 788 HA LEU 109 HA LEU 109 31.323 -1.636 -15.925 789 HB2 LEU 109 HB2 LEU 109 33.237 -3.910 -16.483 790 HB3 LEU 109 HB3 LEU 109 31.748 -4.185 -15.580 791 HG LEU 109 HG LEU 109 30.367 -3.408 -17.404 792 HD11 LEU 109 HD11 LEU 109 32.920 -2.900 -18.976 793 HD12 LEU 109 HD12 LEU 109 31.277 -2.926 -19.650 794 HD13 LEU 109 HD13 LEU 109 31.709 -1.691 -18.467 795 HD21 LEU 109 HD21 LEU 109 32.488 -5.347 -18.420 796 HD22 LEU 109 HD22 LEU 109 31.135 -5.784 -17.352 797 HD23 LEU 109 HD23 LEU 109 30.809 -5.208 -19.000 798 H GLU 110 H GLU 110 34.446 -2.038 -14.311 799 HA GLU 110 HA GLU 110 33.380 -2.496 -11.684 800 HB2 GLU 110 HB2 GLU 110 35.514 -1.780 -10.846 801 HB3 GLU 110 HB3 GLU 110 35.736 -2.797 -12.262 802 HG2 GLU 110 HG2 GLU 110 36.104 -0.734 -13.657 803 HG3 GLU 110 HG3 GLU 110 35.970 0.245 -12.196 804 H VAL 111 H VAL 111 33.537 0.470 -13.570 805 HA VAL 111 HA VAL 111 32.746 2.190 -11.316 806 HB VAL 111 HB VAL 111 32.887 2.740 -14.296 807 HG11 VAL 111 HG11 VAL 111 31.309 4.302 -13.320 808 HG12 VAL 111 HG12 VAL 111 32.425 4.648 -11.970 809 HG13 VAL 111 HG13 VAL 111 32.839 5.131 -13.631 810 HG21 VAL 111 HG21 VAL 111 34.731 3.477 -11.985 811 HG22 VAL 111 HG22 VAL 111 35.106 2.325 -13.285 812 HG23 VAL 111 HG23 VAL 111 34.919 4.041 -13.659 813 H PHE 112 H PHE 112 31.076 0.559 -14.082 814 HA PHE 112 HA PHE 112 28.432 1.520 -13.388 815 HB2 PHE 112 HB2 PHE 112 29.496 -0.925 -14.823 816 HB3 PHE 112 HB3 PHE 112 27.815 -0.841 -14.336 817 HD1 PHE 112 HD2 PHE 112 26.232 0.688 -15.309 818 HD2 PHE 112 HD1 PHE 112 30.322 0.565 -16.663 819 HE1 PHE 112 HE2 PHE 112 25.583 1.903 -17.384 820 HE2 PHE 112 HE1 PHE 112 29.679 1.813 -18.704 821 HZ PHE 112 HZ PHE 112 27.321 2.521 -19.038 822 H ARG 113 H ARG 113 30.241 -1.384 -12.273 823 HA ARG 113 HA ARG 113 28.245 -2.325 -10.427 824 HB2 ARG 113 HB2 ARG 113 31.274 -2.631 -10.455 825 HB3 ARG 113 HB3 ARG 113 30.208 -3.531 -9.374 826 HG2 ARG 113 HG2 ARG 113 29.102 -4.633 -11.242 827 HG3 ARG 113 HG3 ARG 113 29.950 -3.636 -12.411 828 HD2 ARG 113 HD2 ARG 113 32.110 -4.538 -11.600 829 HD3 ARG 113 HD3 ARG 113 31.212 -5.647 -10.535 830 HE ARG 113 HE ARG 113 30.128 -6.528 -12.679 831 HH11 ARG 113 HH21 ARG 113 33.497 -5.442 -12.634 832 HH12 ARG 113 HH22 ARG 113 33.934 -6.506 -13.939 833 HH21 ARG 113 HH11 ARG 113 30.801 -7.902 -14.211 834 HH22 ARG 113 HH12 ARG 113 32.443 -7.861 -14.825 835 H THR 114 H THR 114 30.939 -0.044 -9.917 836 HA THR 114 HA THR 114 30.526 0.456 -7.131 837 HB THR 114 HB THR 114 31.621 2.250 -9.330 838 HG1 THR 114 HG1 THR 114 32.895 0.491 -8.989 839 HG21 THR 114 HG21 THR 114 31.011 3.737 -7.525 840 HG22 THR 114 HG22 THR 114 31.693 2.627 -6.309 841 HG23 THR 114 HG23 THR 114 32.752 3.477 -7.461 842 H VAL 115 H VAL 115 29.069 2.148 -9.970 843 HA VAL 115 HA VAL 115 27.310 3.780 -8.326 844 HB VAL 115 HB VAL 115 27.299 3.002 -11.259 845 HG11 VAL 115 HG11 VAL 115 25.635 4.794 -11.612 846 HG12 VAL 115 HG12 VAL 115 24.935 3.451 -10.706 847 HG13 VAL 115 HG13 VAL 115 25.414 4.947 -9.849 848 HG21 VAL 115 HG21 VAL 115 27.905 5.529 -9.652 849 HG22 VAL 115 HG22 VAL 115 29.076 4.511 -10.531 850 HG23 VAL 115 HG23 VAL 115 27.867 5.468 -11.411 851 H ARG 116 H ARG 116 26.696 0.697 -10.042 852 HA ARG 116 HA ARG 116 24.003 0.301 -9.421 853 HB2 ARG 116 HB2 ARG 116 25.457 -1.079 -10.938 854 HB3 ARG 116 HB3 ARG 116 26.234 -1.791 -9.522 855 HG2 ARG 116 HG2 ARG 116 23.927 -2.620 -8.821 856 HG3 ARG 116 HG3 ARG 116 23.345 -2.071 -10.405 857 HD2 ARG 116 HD2 ARG 116 23.792 -4.417 -10.586 858 HD3 ARG 116 HD3 ARG 116 25.066 -3.563 -11.468 859 HE ARG 116 HE ARG 116 25.685 -4.217 -8.638 860 HH11 ARG 116 HH21 ARG 116 25.747 -5.683 -11.798 861 HH12 ARG 116 HH22 ARG 116 27.339 -6.378 -11.582 862 HH21 ARG 116 HH11 ARG 116 27.534 -5.427 -8.257 863 HH22 ARG 116 HH12 ARG 116 28.135 -6.477 -9.505 864 H GLY 117 H GLY 117 26.763 -0.714 -7.352 865 HA2 GLY 117 HA2 GLY 117 25.250 -1.833 -5.227 866 HA3 GLY 117 HA3 GLY 117 26.871 -1.149 -5.080 867 H GLN 118 H GLN 118 26.243 1.585 -5.747 868 HA GLN 118 HA GLN 118 25.172 2.487 -3.191 869 HB2 GLN 118 HB2 GLN 118 25.994 4.004 -5.696 870 HB3 GLN 118 HB3 GLN 118 25.511 4.765 -4.172 871 HG2 GLN 118 HG2 GLN 118 27.413 3.825 -3.008 872 HG3 GLN 118 HG3 GLN 118 27.862 2.835 -4.394 873 HE21 GLN 118 HE22 GLN 118 28.647 3.923 -6.353 874 HE22 GLN 118 HE21 GLN 118 29.227 5.598 -6.307 875 H VAL 119 H VAL 119 23.908 2.715 -6.587 876 HA VAL 119 HA VAL 119 21.380 3.842 -5.933 877 HB VAL 119 HB VAL 119 21.986 1.805 -8.126 878 HG11 VAL 119 HG11 VAL 119 19.682 3.758 -7.751 879 HG12 VAL 119 HG12 VAL 119 20.027 2.885 -9.265 880 HG13 VAL 119 HG13 VAL 119 19.574 1.977 -7.823 881 HG21 VAL 119 HG21 VAL 119 23.369 3.896 -8.300 882 HG22 VAL 119 HG22 VAL 119 22.197 3.742 -9.601 883 HG23 VAL 119 HG23 VAL 119 21.867 4.855 -8.247 884 H LYS 120 H LYS 120 22.310 0.366 -5.969 885 HA LYS 120 HA LYS 120 19.834 -0.743 -5.106 886 HB2 LYS 120 HB2 LYS 120 21.740 -2.072 -5.938 887 HB3 LYS 120 HB3 LYS 120 22.707 -1.638 -4.528 888 HG2 LYS 120 HG2 LYS 120 21.059 -2.754 -3.045 889 HG3 LYS 120 HG3 LYS 120 20.067 -3.151 -4.453 890 HD2 LYS 120 HD2 LYS 120 21.977 -4.517 -5.337 891 HD3 LYS 120 HD3 LYS 120 22.906 -4.157 -3.879 892 HE2 LYS 120 HE2 LYS 120 20.090 -5.199 -3.574 893 HE3 LYS 120 HE3 LYS 120 21.320 -6.350 -4.141 894 HZ1 LYS 120 HZ1 LYS 120 21.185 -6.424 -1.731 895 HZ2 LYS 120 HZ2 LYS 120 22.633 -5.767 -2.104 896 HZ3 LYS 120 HZ3 LYS 120 21.387 -4.814 -1.576 897 H GLU 121 H GLU 121 22.653 0.257 -3.036 898 HA GLU 121 HA GLU 121 21.221 -0.357 -0.633 899 HB2 GLU 121 HB2 GLU 121 23.056 0.225 0.536 900 HB3 GLU 121 HB3 GLU 121 23.798 -0.077 -1.031 901 HG2 GLU 121 HG2 GLU 121 23.788 2.393 -1.457 902 HG3 GLU 121 HG3 GLU 121 23.116 2.652 0.148 903 H ARG 122 H ARG 122 21.357 2.746 -2.400 904 HA ARG 122 HA ARG 122 19.878 4.121 -0.315 905 HB2 ARG 122 HB2 ARG 122 20.014 4.698 -3.306 906 HB3 ARG 122 HB3 ARG 122 19.297 5.736 -2.075 907 HG2 ARG 122 HG2 ARG 122 22.231 5.039 -2.310 908 HG3 ARG 122 HG3 ARG 122 21.483 6.574 -2.710 909 HD2 ARG 122 HD2 ARG 122 21.775 5.316 0.037 910 HD3 ARG 122 HD3 ARG 122 22.661 6.702 -0.602 911 HE ARG 122 HE ARG 122 19.970 7.468 -0.747 912 HH11 ARG 122 HH21 ARG 122 22.254 6.719 1.810 913 HH12 ARG 122 HH22 ARG 122 21.376 7.636 2.995 914 HH21 ARG 122 HH11 ARG 122 18.843 8.617 0.863 915 HH22 ARG 122 HH12 ARG 122 19.543 8.704 2.456 916 H VAL 123 H VAL 123 18.704 2.347 -3.249 917 HA VAL 123 HA VAL 123 15.958 2.633 -2.561 918 HB VAL 123 HB VAL 123 17.476 0.571 -4.189 919 HG11 VAL 123 HG11 VAL 123 14.476 0.555 -3.713 920 HG12 VAL 123 HG12 VAL 123 15.373 -0.386 -4.944 921 HG13 VAL 123 HG13 VAL 123 15.625 -0.727 -3.242 922 HG21 VAL 123 HG21 VAL 123 15.402 2.666 -4.904 923 HG22 VAL 123 HG22 VAL 123 17.171 2.783 -5.152 924 HG23 VAL 123 HG23 VAL 123 16.236 1.569 -6.036 925 H GLU 124 H GLU 124 18.109 -0.152 -1.566 926 HA GLU 124 HA GLU 124 16.050 -1.392 -0.017 927 HB2 GLU 124 HB2 GLU 124 19.046 -1.363 0.478 928 HB3 GLU 124 HB3 GLU 124 17.862 -2.446 1.251 929 HG2 GLU 124 HG2 GLU 124 17.217 -3.342 -0.910 930 HG3 GLU 124 HG3 GLU 124 18.450 -2.365 -1.716 931 H ASN 125 H ASN 125 18.210 1.267 0.905 932 HA ASN 125 HA ASN 125 17.212 1.194 3.591 933 HB2 ASN 125 HB2 ASN 125 19.039 2.422 3.963 934 HB3 ASN 125 HB3 ASN 125 19.342 2.483 2.239 935 HD21 ASN 125 HD22 ASN 125 18.205 4.251 0.993 936 HD22 ASN 125 HD21 ASN 125 18.095 5.806 1.823 937 H LEU 126 H LEU 126 16.109 2.800 0.693 938 HA LEU 126 HA LEU 126 14.250 4.574 2.059 939 HB2 LEU 126 HB2 LEU 126 15.146 5.193 -0.109 940 HB3 LEU 126 HB3 LEU 126 14.642 3.670 -0.828 941 HG LEU 126 HG LEU 126 12.259 4.296 -0.583 942 HD11 LEU 126 HD11 LEU 126 11.636 6.600 -0.013 943 HD12 LEU 126 HD12 LEU 126 12.417 5.845 1.365 944 HD13 LEU 126 HD13 LEU 126 13.326 6.993 0.361 945 HD21 LEU 126 HD21 LEU 126 12.294 6.045 -2.322 946 HD22 LEU 126 HD22 LEU 126 14.026 6.313 -1.995 947 HD23 LEU 126 HD23 LEU 126 13.473 4.758 -2.647 948 H ILE 127 H ILE 127 13.812 1.445 0.241 949 HA ILE 127 HA ILE 127 10.985 1.525 0.650 950 HB ILE 127 HB ILE 127 10.912 -0.849 0.108 951 HG12 ILE 127 HG12 ILE 127 13.929 -0.772 0.328 952 HG13 ILE 127 HG13 ILE 127 12.768 -1.886 1.068 953 HG21 ILE 127 HG21 ILE 127 12.765 0.718 -1.750 954 HG22 ILE 127 HG22 ILE 127 11.589 -0.540 -2.215 955 HG23 ILE 127 HG23 ILE 127 11.019 1.014 -1.596 956 HD11 ILE 127 HD11 ILE 127 13.620 -1.766 -1.843 957 HD12 ILE 127 HD12 ILE 127 13.959 -3.040 -0.660 958 HD13 ILE 127 HD13 ILE 127 12.292 -2.786 -1.229 959 H ALA 128 H ALA 128 13.483 0.244 2.832 960 HA ALA 128 HA ALA 128 11.637 -0.971 4.608 961 HB1 ALA 128 HB1 ALA 128 14.377 0.274 5.156 962 HB2 ALA 128 HB2 ALA 128 13.535 -0.885 6.211 963 HB3 ALA 128 HB3 ALA 128 14.078 -1.393 4.603 964 H LYS 129 H LYS 129 12.318 2.430 4.098 965 HA LYS 129 HA LYS 129 11.105 3.342 6.639 966 HB2 LYS 129 HB2 LYS 129 12.042 4.868 4.173 967 HB3 LYS 129 HB3 LYS 129 11.453 5.603 5.660 968 HG2 LYS 129 HG2 LYS 129 13.301 4.729 6.945 969 HG3 LYS 129 HG3 LYS 129 13.876 3.767 5.572 970 HD2 LYS 129 HD2 LYS 129 14.269 5.828 4.257 971 HD3 LYS 129 HD3 LYS 129 13.757 6.820 5.626 972 HE2 LYS 129 HE2 LYS 129 16.120 4.871 5.598 973 HE3 LYS 129 HE3 LYS 129 16.245 6.611 5.314 974 HZ1 LYS 129 HZ1 LYS 129 16.759 6.125 7.620 975 HZ2 LYS 129 HZ2 LYS 129 15.377 6.987 7.578 976 HZ3 LYS 129 HZ3 LYS 129 15.334 5.374 7.867 977 H ILE 130 H ILE 130 10.167 3.113 3.214 978 HA ILE 130 HA ILE 130 7.535 4.345 3.903 979 HB ILE 130 HB ILE 130 7.357 5.083 1.590 980 HG12 ILE 130 HG12 ILE 130 9.432 5.266 0.221 981 HG13 ILE 130 HG13 ILE 130 10.213 4.100 1.272 982 HG21 ILE 130 HG21 ILE 130 8.848 6.935 1.854 983 HG22 ILE 130 HG22 ILE 130 8.281 6.472 3.459 984 HG23 ILE 130 HG23 ILE 130 9.921 6.017 2.934 985 HD11 ILE 130 HD11 ILE 130 8.671 2.356 0.539 986 HD12 ILE 130 HD12 ILE 130 7.730 3.551 -0.395 987 HD13 ILE 130 HD13 ILE 130 9.398 3.153 -0.859 988 H SER 131 H SER 131 8.506 1.243 3.382 989 HA SER 131 HA SER 131 6.493 0.122 1.700 990 HB2 SER 131 HB2 SER 131 7.864 -0.978 4.177 991 HB3 SER 131 HB3 SER 131 6.767 -1.923 3.144 992 HG SER 131 HG SER 131 9.189 -0.636 2.392 Start of MODEL 12 1 H MET 1 H1 MET 1 2.569 0.287 1.827 2 HA MET 1 HA MET 1 3.229 -0.208 -0.309 3 HB2 MET 1 HB2 MET 1 1.232 -1.636 -0.837 4 HB3 MET 1 HB3 MET 1 0.319 -0.171 -1.217 5 HG2 MET 1 HG2 MET 1 1.969 0.368 -3.012 6 HG3 MET 1 HG3 MET 1 2.910 -1.052 -2.556 7 HE1 MET 1 HE1 MET 1 1.759 -2.493 -5.872 8 HE2 MET 1 HE2 MET 1 2.534 -0.958 -5.412 9 HE3 MET 1 HE3 MET 1 3.036 -2.477 -4.633 10 H LYS 2 H LYS 2 4.238 1.532 -1.026 11 HA LYS 2 HA LYS 2 2.687 3.971 -1.841 12 HB2 LYS 2 HB2 LYS 2 5.230 3.824 -0.179 13 HB3 LYS 2 HB3 LYS 2 4.870 5.234 -1.164 14 HG2 LYS 2 HG2 LYS 2 2.696 5.532 -0.029 15 HG3 LYS 2 HG3 LYS 2 3.042 4.135 1.007 16 HD2 LYS 2 HD2 LYS 2 4.933 5.283 2.040 17 HD3 LYS 2 HD3 LYS 2 4.826 6.601 0.867 18 HE2 LYS 2 HE2 LYS 2 3.893 7.411 2.904 19 HE3 LYS 2 HE3 LYS 2 2.581 7.219 1.745 20 HZ1 LYS 2 HZ1 LYS 2 3.219 5.285 3.933 21 HZ2 LYS 2 HZ2 LYS 2 1.994 6.362 3.959 22 HZ3 LYS 2 HZ3 LYS 2 1.957 5.139 2.888 23 H LYS 3 H LYS 3 3.905 5.309 -3.425 24 HA LYS 3 HA LYS 3 5.353 3.525 -5.358 25 HB2 LYS 3 HB2 LYS 3 3.671 5.986 -5.991 26 HB3 LYS 3 HB3 LYS 3 4.569 5.029 -7.144 27 HG2 LYS 3 HG2 LYS 3 2.521 4.072 -7.433 28 HG3 LYS 3 HG3 LYS 3 3.231 2.987 -6.246 29 HD2 LYS 3 HD2 LYS 3 0.905 3.402 -5.673 30 HD3 LYS 3 HD3 LYS 3 1.931 4.132 -4.439 31 HE2 LYS 3 HE2 LYS 3 1.769 6.235 -6.073 32 HE3 LYS 3 HE3 LYS 3 0.294 5.441 -6.616 33 HZ1 LYS 3 HZ1 LYS 3 0.965 6.300 -3.842 34 HZ2 LYS 3 HZ2 LYS 3 -0.140 7.001 -4.820 35 HZ3 LYS 3 HZ3 LYS 3 -0.439 5.497 -4.231 36 H VAL 4 H VAL 4 7.164 4.126 -6.351 37 HA VAL 4 HA VAL 4 8.525 6.611 -5.373 38 HB VAL 4 HB VAL 4 10.036 4.033 -5.750 39 HG11 VAL 4 HG11 VAL 4 11.398 6.036 -6.041 40 HG12 VAL 4 HG12 VAL 4 10.815 6.679 -4.485 41 HG13 VAL 4 HG13 VAL 4 11.805 5.201 -4.558 42 HG21 VAL 4 HG21 VAL 4 8.598 3.645 -3.847 43 HG22 VAL 4 HG22 VAL 4 10.236 3.948 -3.284 44 HG23 VAL 4 HG23 VAL 4 9.008 5.227 -3.162 45 H MET 5 H MET 5 9.723 7.744 -6.835 46 HA MET 5 HA MET 5 9.927 6.688 -9.607 47 HB2 MET 5 HB2 MET 5 8.023 7.993 -9.819 48 HB3 MET 5 HB3 MET 5 8.638 9.262 -8.752 49 HG2 MET 5 HG2 MET 5 8.570 9.979 -11.074 50 HG3 MET 5 HG3 MET 5 10.203 10.021 -10.434 51 HE1 MET 5 HE1 MET 5 7.680 8.086 -12.823 52 HE2 MET 5 HE2 MET 5 8.294 9.652 -13.416 53 HE3 MET 5 HE3 MET 5 8.740 8.151 -14.242 54 H PHE 6 H PHE 6 11.732 7.032 -10.571 55 HA PHE 6 HA PHE 6 13.899 8.535 -9.138 56 HB2 PHE 6 HB2 PHE 6 14.232 6.252 -11.104 57 HB3 PHE 6 HB3 PHE 6 15.455 6.958 -10.053 58 HD1 PHE 6 HD1 PHE 6 15.287 6.593 -7.527 59 HD2 PHE 6 HD2 PHE 6 12.831 4.507 -10.390 60 HE1 PHE 6 HE1 PHE 6 14.605 4.982 -5.758 61 HE2 PHE 6 HE2 PHE 6 12.153 2.903 -8.624 62 HZ PHE 6 HZ PHE 6 12.977 3.180 -6.291 63 H VAL 7 H VAL 7 14.402 10.421 -10.030 64 HA VAL 7 HA VAL 7 14.273 10.861 -12.965 65 HB VAL 7 HB VAL 7 14.122 12.677 -10.583 66 HG11 VAL 7 HG11 VAL 7 15.259 13.583 -13.271 67 HG12 VAL 7 HG12 VAL 7 14.590 14.649 -12.016 68 HG13 VAL 7 HG13 VAL 7 16.034 13.717 -11.665 69 HG21 VAL 7 HG21 VAL 7 12.908 12.843 -13.375 70 HG22 VAL 7 HG22 VAL 7 12.166 11.918 -12.022 71 HG23 VAL 7 HG23 VAL 7 12.375 13.655 -11.874 72 H CYS 8 H CYS 8 16.034 10.887 -14.199 73 HA CYS 8 HA CYS 8 18.709 11.524 -12.981 74 HB2 CYS 8 HB2 CYS 8 18.584 9.152 -13.246 75 HB3 CYS 8 HB3 CYS 8 17.969 9.278 -14.905 76 HG CYS 8 HG CYS 8 20.440 8.322 -14.916 77 H LYS 9 H LYS 9 20.265 12.182 -14.953 78 HA LYS 9 HA LYS 9 19.022 14.511 -16.056 79 HB2 LYS 9 HB2 LYS 9 21.582 13.919 -15.553 80 HB3 LYS 9 HB3 LYS 9 21.602 13.511 -17.266 81 HG2 LYS 9 HG2 LYS 9 20.492 15.872 -17.604 82 HG3 LYS 9 HG3 LYS 9 20.900 16.138 -15.899 83 HD2 LYS 9 HD2 LYS 9 22.686 17.124 -17.076 84 HD3 LYS 9 HD3 LYS 9 23.312 15.589 -16.498 85 HE2 LYS 9 HE2 LYS 9 24.112 15.723 -18.691 86 HE3 LYS 9 HE3 LYS 9 22.742 14.627 -18.847 87 HZ1 LYS 9 HZ1 LYS 9 22.797 16.360 -20.589 88 HZ2 LYS 9 HZ2 LYS 9 21.419 16.516 -19.738 89 HZ3 LYS 9 HZ3 LYS 9 22.674 17.550 -19.485 90 H ARG 10 H ARG 10 20.113 11.609 -17.824 91 HA ARG 10 HA ARG 10 18.005 12.177 -19.892 92 HB2 ARG 10 HB2 ARG 10 19.289 11.585 -21.675 93 HB3 ARG 10 HB3 ARG 10 20.276 12.648 -20.713 94 HG2 ARG 10 HG2 ARG 10 20.600 9.619 -20.960 95 HG3 ARG 10 HG3 ARG 10 21.536 10.857 -21.783 96 HD2 ARG 10 HD2 ARG 10 22.218 11.705 -19.443 97 HD3 ARG 10 HD3 ARG 10 21.608 10.133 -18.857 98 HE ARG 10 HE ARG 10 23.490 9.888 -21.084 99 HH11 ARG 10 HH11 ARG 10 23.478 10.276 -17.551 100 HH12 ARG 10 HH12 ARG 10 25.132 9.662 -17.480 101 HH21 ARG 10 HH21 ARG 10 25.630 9.063 -20.705 102 HH22 ARG 10 HH22 ARG 10 26.208 9.184 -19.040 103 H ASN 11 H ASN 11 18.109 10.296 -17.478 104 HA ASN 11 HA ASN 11 17.386 8.220 -16.845 105 HB2 ASN 11 HB2 ASN 11 15.414 9.528 -17.447 106 HB3 ASN 11 HB3 ASN 11 15.415 8.857 -19.064 107 HD21 ASN 11 HD22 ASN 11 15.654 7.139 -15.753 108 HD22 ASN 11 HD21 ASN 11 14.295 6.118 -16.206 109 H SER 12 H SER 12 19.607 7.978 -18.565 110 HA SER 12 HA SER 12 19.150 5.492 -20.097 111 HB2 SER 12 HB2 SER 12 21.587 5.904 -20.672 112 HB3 SER 12 HB3 SER 12 20.487 7.233 -21.112 113 HG SER 12 HG SER 12 22.458 7.840 -19.862 114 H CYS 13 H CYS 13 21.066 6.650 -17.336 115 HA CYS 13 HA CYS 13 21.292 3.862 -16.264 116 HB2 CYS 13 HB2 CYS 13 23.323 4.786 -17.517 117 HB3 CYS 13 HB3 CYS 13 23.504 5.987 -16.227 118 HG CYS 13 HG CYS 13 25.219 3.920 -16.011 119 H ARG 14 H ARG 14 22.405 4.305 -13.868 120 HA ARG 14 HA ARG 14 21.752 4.555 -11.699 121 HB2 ARG 14 HB2 ARG 14 20.908 7.399 -12.366 122 HB3 ARG 14 HB3 ARG 14 21.449 6.755 -10.813 123 HG2 ARG 14 HG2 ARG 14 23.737 6.499 -11.728 124 HG3 ARG 14 HG3 ARG 14 23.179 7.126 -13.290 125 HD2 ARG 14 HD2 ARG 14 22.341 9.187 -12.072 126 HD3 ARG 14 HD3 ARG 14 23.187 8.614 -10.625 127 HE ARG 14 HE ARG 14 25.304 8.628 -12.116 128 HH11 ARG 14 HH11 ARG 14 22.780 11.096 -12.472 129 HH12 ARG 14 HH12 ARG 14 23.827 12.078 -13.474 130 HH21 ARG 14 HH21 ARG 14 26.587 10.116 -12.970 131 HH22 ARG 14 HH22 ARG 14 25.977 11.632 -13.591 132 H SER 15 H SER 15 19.212 6.624 -12.922 133 HA SER 15 HA SER 15 17.080 5.746 -11.333 134 HB2 SER 15 HB2 SER 15 15.646 6.839 -13.045 135 HB3 SER 15 HB3 SER 15 17.051 7.798 -12.663 136 HG SER 15 HG SER 15 18.073 6.879 -14.652 137 H GLN 16 H GLN 16 17.936 4.474 -14.556 138 HA GLN 16 HA GLN 16 15.738 2.625 -14.735 139 HB2 GLN 16 HB2 GLN 16 18.492 2.625 -16.061 140 HB3 GLN 16 HB3 GLN 16 17.165 1.577 -16.548 141 HG2 GLN 16 HG2 GLN 16 16.919 4.633 -16.569 142 HG3 GLN 16 HG3 GLN 16 17.536 3.701 -17.921 143 HE21 GLN 16 HE22 GLN 16 15.551 5.065 -18.735 144 HE22 GLN 16 HE21 GLN 16 14.041 4.149 -18.794 145 H MET 17 H MET 17 19.013 2.248 -13.319 146 HA MET 17 HA MET 17 18.711 -0.584 -12.630 147 HB2 MET 17 HB2 MET 17 20.530 1.587 -11.464 148 HB3 MET 17 HB3 MET 17 20.605 -0.123 -11.064 149 HG2 MET 17 HG2 MET 17 21.208 -0.674 -13.384 150 HG3 MET 17 HG3 MET 17 21.158 1.041 -13.820 151 HE1 MET 17 HE1 MET 17 23.525 -1.232 -14.000 152 HE2 MET 17 HE2 MET 17 23.770 0.381 -14.721 153 HE3 MET 17 HE3 MET 17 24.980 -0.294 -13.594 154 H ALA 18 H ALA 18 18.045 2.518 -10.946 155 HA ALA 18 HA ALA 18 17.349 1.419 -8.413 156 HB1 ALA 18 HB1 ALA 18 17.758 3.869 -9.020 157 HB2 ALA 18 HB2 ALA 18 16.130 3.894 -9.717 158 HB3 ALA 18 HB3 ALA 18 16.351 3.563 -7.987 159 H GLU 19 H GLU 19 15.273 2.021 -11.286 160 HA GLU 19 HA GLU 19 12.869 0.892 -10.222 161 HB2 GLU 19 HB2 GLU 19 13.155 2.312 -12.268 162 HB3 GLU 19 HB3 GLU 19 13.863 0.921 -13.100 163 HG2 GLU 19 HG2 GLU 19 11.738 -0.336 -12.723 164 HG3 GLU 19 HG3 GLU 19 11.051 1.095 -11.935 165 H GLY 20 H GLY 20 15.609 -0.674 -11.941 166 HA2 GLY 20 HA2 GLY 20 14.617 -3.329 -11.990 167 HA3 GLY 20 HA3 GLY 20 16.319 -2.863 -11.951 168 H PHE 21 H PHE 21 16.660 -1.789 -9.393 169 HA PHE 21 HA PHE 21 16.539 -4.171 -7.731 170 HB2 PHE 21 HB2 PHE 21 17.263 -1.269 -7.154 171 HB3 PHE 21 HB3 PHE 21 17.311 -2.529 -5.922 172 HD1 PHE 21 HD1 PHE 21 18.535 -4.776 -6.632 173 HD2 PHE 21 HD2 PHE 21 19.297 -0.879 -8.326 174 HE1 PHE 21 HE1 PHE 21 20.733 -5.560 -7.438 175 HE2 PHE 21 HE2 PHE 21 21.500 -1.659 -9.117 176 HZ PHE 21 HZ PHE 21 22.215 -4.034 -8.691 177 H ALA 22 H ALA 22 14.702 -1.088 -7.607 178 HA ALA 22 HA ALA 22 13.183 -1.879 -5.330 179 HB1 ALA 22 HB1 ALA 22 13.537 0.460 -6.141 180 HB2 ALA 22 HB2 ALA 22 12.508 0.119 -7.531 181 HB3 ALA 22 HB3 ALA 22 11.836 0.079 -5.862 182 H LYS 23 H LYS 23 12.390 -2.414 -8.838 183 HA LYS 23 HA LYS 23 9.746 -3.416 -8.241 184 HB2 LYS 23 HB2 LYS 23 9.613 -4.060 -10.478 185 HB3 LYS 23 HB3 LYS 23 10.643 -2.633 -10.482 186 HG2 LYS 23 HG2 LYS 23 12.638 -4.249 -10.555 187 HG3 LYS 23 HG3 LYS 23 11.467 -5.544 -10.836 188 HD2 LYS 23 HD2 LYS 23 10.635 -4.146 -12.852 189 HD3 LYS 23 HD3 LYS 23 12.029 -3.094 -12.563 190 HE2 LYS 23 HE2 LYS 23 12.716 -4.590 -14.265 191 HE3 LYS 23 HE3 LYS 23 13.535 -5.126 -12.803 192 HZ1 LYS 23 HZ1 LYS 23 12.601 -7.006 -14.032 193 HZ2 LYS 23 HZ2 LYS 23 11.829 -6.905 -12.601 194 HZ3 LYS 23 HZ3 LYS 23 11.090 -6.385 -13.969 195 H THR 24 H THR 24 12.846 -4.929 -8.171 196 HA THR 24 HA THR 24 11.839 -7.664 -7.827 197 HB THR 24 HB THR 24 14.660 -6.639 -7.398 198 HG1 THR 24 HG1 THR 24 14.357 -6.160 -9.465 199 HG21 THR 24 HG21 THR 24 13.586 -9.393 -8.157 200 HG22 THR 24 HG22 THR 24 15.296 -8.941 -8.035 201 HG23 THR 24 HG23 THR 24 14.291 -8.950 -6.582 202 H LEU 25 H LEU 25 13.576 -5.357 -5.674 203 HA LEU 25 HA LEU 25 13.335 -7.143 -3.350 204 HB2 LEU 25 HB2 LEU 25 14.450 -4.309 -3.571 205 HB3 LEU 25 HB3 LEU 25 14.723 -5.419 -2.234 206 HG LEU 25 HG LEU 25 15.713 -5.833 -5.101 207 HD11 LEU 25 HD11 LEU 25 17.267 -5.259 -2.581 208 HD12 LEU 25 HD12 LEU 25 17.873 -5.292 -4.252 209 HD13 LEU 25 HD13 LEU 25 16.778 -3.988 -3.730 210 HD21 LEU 25 HD21 LEU 25 15.347 -8.008 -4.051 211 HD22 LEU 25 HD22 LEU 25 17.076 -7.660 -4.109 212 HD23 LEU 25 HD23 LEU 25 16.191 -7.467 -2.581 213 H GLY 26 H GLY 26 11.620 -4.371 -4.594 214 HA2 GLY 26 HA2 GLY 26 9.947 -4.058 -2.165 215 HA3 GLY 26 HA3 GLY 26 10.045 -3.001 -3.575 216 H ALA 27 H ALA 27 9.824 -6.230 -4.655 217 HA ALA 27 HA ALA 27 7.429 -5.949 -6.003 218 HB1 ALA 27 HB1 ALA 27 8.611 -8.515 -4.843 219 HB2 ALA 27 HB2 ALA 27 7.435 -8.418 -6.175 220 HB3 ALA 27 HB3 ALA 27 9.064 -7.763 -6.384 221 H GLY 28 H GLY 28 5.469 -5.389 -5.232 222 HA2 GLY 28 HA2 GLY 28 3.374 -5.795 -4.268 223 HA3 GLY 28 HA3 GLY 28 4.060 -7.065 -3.255 224 H LYS 29 H LYS 29 6.256 -5.092 -2.414 225 HA LYS 29 HA LYS 29 4.907 -3.704 -0.181 226 HB2 LYS 29 HB2 LYS 29 7.780 -3.772 -1.204 227 HB3 LYS 29 HB3 LYS 29 7.263 -2.799 0.156 228 HG2 LYS 29 HG2 LYS 29 7.074 -4.554 1.583 229 HG3 LYS 29 HG3 LYS 29 6.449 -5.646 0.342 230 HD2 LYS 29 HD2 LYS 29 8.514 -6.559 0.988 231 HD3 LYS 29 HD3 LYS 29 8.791 -5.830 -0.597 232 HE2 LYS 29 HE2 LYS 29 9.816 -3.829 0.530 233 HE3 LYS 29 HE3 LYS 29 9.483 -4.560 2.099 234 HZ1 LYS 29 HZ1 LYS 29 11.778 -5.036 1.434 235 HZ2 LYS 29 HZ2 LYS 29 10.952 -6.438 1.475 236 HZ3 LYS 29 HZ3 LYS 29 11.306 -5.750 0.030 237 H ILE 30 H ILE 30 6.343 -2.844 -3.308 238 HA ILE 30 HA ILE 30 4.977 -0.215 -3.241 239 HB ILE 30 HB ILE 30 7.044 0.973 -3.914 240 HG12 ILE 30 HG12 ILE 30 9.263 0.107 -3.527 241 HG13 ILE 30 HG13 ILE 30 8.636 -1.483 -3.113 242 HG21 ILE 30 HG21 ILE 30 7.483 -0.474 -1.268 243 HG22 ILE 30 HG22 ILE 30 8.119 1.088 -1.775 244 HG23 ILE 30 HG23 ILE 30 6.380 0.911 -1.515 245 HD11 ILE 30 HD11 ILE 30 9.720 -1.095 -5.415 246 HD12 ILE 30 HD12 ILE 30 8.188 -1.979 -5.397 247 HD13 ILE 30 HD13 ILE 30 8.235 -0.256 -5.862 248 H ALA 31 H ALA 31 5.291 0.991 -5.322 249 HA ALA 31 HA ALA 31 5.757 -0.763 -7.680 250 HB1 ALA 31 HB1 ALA 31 3.934 0.376 -8.919 251 HB2 ALA 31 HB2 ALA 31 3.348 -0.581 -7.551 252 HB3 ALA 31 HB3 ALA 31 3.438 1.184 -7.417 253 H VAL 32 H VAL 32 6.892 0.282 -9.425 254 HA VAL 32 HA VAL 32 8.013 2.956 -8.785 255 HB VAL 32 HB VAL 32 10.189 1.747 -9.623 256 HG11 VAL 32 HG11 VAL 32 9.069 1.647 -6.796 257 HG12 VAL 32 HG12 VAL 32 10.785 1.494 -7.217 258 HG13 VAL 32 HG13 VAL 32 9.935 2.978 -7.590 259 HG21 VAL 32 HG21 VAL 32 8.947 -0.602 -8.180 260 HG22 VAL 32 HG22 VAL 32 9.177 -0.500 -9.944 261 HG23 VAL 32 HG23 VAL 32 10.575 -0.455 -8.868 262 H THR 33 H THR 33 8.989 4.091 -10.289 263 HA THR 33 HA THR 33 8.913 3.298 -13.158 264 HB THR 33 HB THR 33 7.792 5.930 -12.121 265 HG1 THR 33 HG1 THR 33 6.282 3.655 -12.944 266 HG21 THR 33 HG21 THR 33 8.466 5.960 -14.504 267 HG22 THR 33 HG22 THR 33 7.444 4.546 -14.819 268 HG23 THR 33 HG23 THR 33 6.714 6.092 -14.318 269 H SER 34 H SER 34 10.524 4.504 -14.408 270 HA SER 34 HA SER 34 12.046 6.573 -12.899 271 HB2 SER 34 HB2 SER 34 14.070 5.935 -13.957 272 HB3 SER 34 HB3 SER 34 13.418 4.547 -13.071 273 HG SER 34 HG SER 34 12.756 3.653 -14.982 274 H CYS 35 H CYS 35 12.857 8.315 -14.058 275 HA CYS 35 HA CYS 35 12.235 8.672 -16.870 276 HB2 CYS 35 HB2 CYS 35 10.713 10.484 -16.698 277 HB3 CYS 35 HB3 CYS 35 10.081 9.200 -15.664 278 HG CYS 35 HG CYS 35 11.042 10.165 -13.411 279 H GLY 36 H GLY 36 12.806 11.236 -17.330 280 HA2 GLY 36 HA2 GLY 36 14.800 12.242 -15.392 281 HA3 GLY 36 HA3 GLY 36 15.403 11.915 -17.029 282 H LEU 37 H LEU 37 15.629 14.431 -15.999 283 HA LEU 37 HA LEU 37 13.444 16.118 -16.950 284 HB2 LEU 37 HB2 LEU 37 15.022 17.980 -16.817 285 HB3 LEU 37 HB3 LEU 37 14.698 17.144 -15.317 286 HG LEU 37 HG LEU 37 17.133 16.246 -16.873 287 HD11 LEU 37 HD11 LEU 37 17.050 18.821 -15.234 288 HD12 LEU 37 HD12 LEU 37 18.509 18.042 -15.895 289 HD13 LEU 37 HD13 LEU 37 17.297 18.712 -16.995 290 HD21 LEU 37 HD21 LEU 37 16.523 15.173 -14.722 291 HD22 LEU 37 HD22 LEU 37 18.043 16.058 -14.570 292 HD23 LEU 37 HD23 LEU 37 16.529 16.748 -13.928 293 H GLU 38 H GLU 38 15.705 14.263 -18.458 294 HA GLU 38 HA GLU 38 14.841 15.166 -21.123 295 HB2 GLU 38 HB2 GLU 38 17.765 14.450 -20.644 296 HB3 GLU 38 HB3 GLU 38 17.020 15.016 -22.122 297 HG2 GLU 38 HG2 GLU 38 16.669 17.250 -21.132 298 HG3 GLU 38 HG3 GLU 38 17.370 16.706 -19.605 299 H SER 39 H SER 39 15.216 13.333 -22.723 300 HA SER 39 HA SER 39 15.542 10.656 -21.448 301 HB2 SER 39 HB2 SER 39 13.704 9.795 -22.851 302 HB3 SER 39 HB3 SER 39 13.172 10.981 -21.641 303 HG SER 39 HG SER 39 12.294 11.283 -23.843 304 H SER 40 H SER 40 16.760 9.218 -22.570 305 HA SER 40 HA SER 40 17.278 9.720 -25.470 306 HB2 SER 40 HB2 SER 40 19.135 10.623 -24.194 307 HB3 SER 40 HB3 SER 40 19.415 9.050 -23.433 308 HG SER 40 HG SER 40 20.657 9.627 -25.447 309 H ARG 41 H ARG 41 18.828 7.106 -23.702 310 HA ARG 41 HA ARG 41 16.711 5.182 -24.201 311 HB2 ARG 41 HB2 ARG 41 17.799 3.722 -25.693 312 HB3 ARG 41 HB3 ARG 41 17.959 5.299 -26.424 313 HG2 ARG 41 HG2 ARG 41 20.130 3.735 -24.967 314 HG3 ARG 41 HG3 ARG 41 19.971 3.943 -26.691 315 HD2 ARG 41 HD2 ARG 41 20.647 6.134 -24.682 316 HD3 ARG 41 HD3 ARG 41 21.765 5.344 -25.773 317 HE ARG 41 HE ARG 41 19.952 7.509 -26.371 318 HH11 ARG 41 HH11 ARG 41 21.686 4.910 -27.990 319 HH12 ARG 41 HH12 ARG 41 21.633 5.736 -29.522 320 HH21 ARG 41 HH21 ARG 41 19.909 8.468 -28.326 321 HH22 ARG 41 HH22 ARG 41 20.650 7.702 -29.704 322 H VAL 42 H VAL 42 17.125 3.098 -23.052 323 HA VAL 42 HA VAL 42 18.671 3.405 -20.619 324 HB VAL 42 HB VAL 42 17.982 0.673 -21.797 325 HG11 VAL 42 HG11 VAL 42 17.993 0.057 -19.390 326 HG12 VAL 42 HG12 VAL 42 19.566 0.653 -19.895 327 HG13 VAL 42 HG13 VAL 42 18.486 1.703 -18.953 328 HG21 VAL 42 HG21 VAL 42 16.269 2.532 -20.127 329 HG22 VAL 42 HG22 VAL 42 15.909 1.786 -21.706 330 HG23 VAL 42 HG23 VAL 42 16.037 0.763 -20.271 331 H HIS 43 H HIS 43 20.829 2.991 -20.195 332 HA HIS 43 HA HIS 43 22.623 2.734 -22.460 333 HB2 HIS 43 HB2 HIS 43 23.081 3.883 -20.200 334 HB3 HIS 43 HB3 HIS 43 23.371 2.269 -19.545 335 HD2 HIS 43 HD2 HIS 43 24.922 5.017 -21.588 336 HE1 HIS 43 HE1 HIS 43 27.646 1.766 -21.917 337 HE2 HIS 43 HE2 HIS 43 27.276 4.254 -22.422 338 HA PRO 44 HA PRO 44 21.767 -1.505 -22.717 339 HB2 PRO 44 HB2 PRO 44 23.544 -2.417 -24.633 340 HB3 PRO 44 HB3 PRO 44 22.188 -1.297 -24.985 341 HG2 PRO 44 HG2 PRO 44 25.087 -0.576 -24.441 342 HG3 PRO 44 HG3 PRO 44 24.056 -0.044 -25.810 343 HD2 PRO 44 HD2 PRO 44 24.399 1.479 -23.580 344 HD3 PRO 44 HD3 PRO 44 22.818 1.415 -24.426 345 H THR 45 H THR 45 25.005 -0.465 -21.748 346 HA THR 45 HA THR 45 25.889 -3.069 -20.737 347 HB THR 45 HB THR 45 26.857 -0.266 -20.095 348 HG1 THR 45 HG1 THR 45 27.207 -0.927 -22.260 349 HG21 THR 45 HG21 THR 45 28.946 -1.473 -19.385 350 HG22 THR 45 HG22 THR 45 27.579 -1.696 -18.291 351 HG23 THR 45 HG23 THR 45 28.015 -2.999 -19.423 352 H ALA 46 H ALA 46 23.787 -0.497 -19.462 353 HA ALA 46 HA ALA 46 23.910 -1.310 -16.716 354 HB1 ALA 46 HB1 ALA 46 21.562 -0.109 -18.237 355 HB2 ALA 46 HB2 ALA 46 21.826 -0.060 -16.491 356 HB3 ALA 46 HB3 ALA 46 22.920 0.834 -17.564 357 H ILE 47 H ILE 47 21.928 -2.498 -19.462 358 HA ILE 47 HA ILE 47 20.326 -4.387 -18.009 359 HB ILE 47 HB ILE 47 21.373 -4.392 -20.871 360 HG12 ILE 47 HG12 ILE 47 19.003 -4.115 -21.483 361 HG13 ILE 47 HG13 ILE 47 18.540 -4.098 -19.790 362 HG21 ILE 47 HG21 ILE 47 21.116 -6.747 -20.303 363 HG22 ILE 47 HG22 ILE 47 19.536 -6.435 -19.557 364 HG23 ILE 47 HG23 ILE 47 19.758 -6.260 -21.308 365 HD11 ILE 47 HD11 ILE 47 20.311 -2.007 -21.125 366 HD12 ILE 47 HD12 ILE 47 18.563 -1.860 -20.894 367 HD13 ILE 47 HD13 ILE 47 19.628 -1.924 -19.483 368 H ALA 48 H ALA 48 23.614 -4.685 -19.410 369 HA ALA 48 HA ALA 48 23.956 -7.452 -18.668 370 HB1 ALA 48 HB1 ALA 48 26.306 -7.075 -19.193 371 HB2 ALA 48 HB2 ALA 48 25.270 -6.338 -20.429 372 HB3 ALA 48 HB3 ALA 48 26.060 -5.318 -19.196 373 H MET 49 H MET 49 24.800 -4.423 -17.023 374 HA MET 49 HA MET 49 26.092 -5.653 -14.757 375 HB2 MET 49 HB2 MET 49 24.909 -2.888 -15.163 376 HB3 MET 49 HB3 MET 49 25.943 -3.345 -13.798 377 HG2 MET 49 HG2 MET 49 26.936 -3.765 -16.626 378 HG3 MET 49 HG3 MET 49 26.910 -2.160 -15.918 379 HE1 MET 49 HE1 MET 49 28.838 -5.394 -16.377 380 HE2 MET 49 HE2 MET 49 29.874 -5.533 -14.935 381 HE3 MET 49 HE3 MET 49 28.150 -5.910 -14.822 382 H MET 50 H MET 50 22.675 -4.863 -15.380 383 HA MET 50 HA MET 50 21.897 -5.606 -12.635 384 HB2 MET 50 HB2 MET 50 20.276 -5.215 -15.184 385 HB3 MET 50 HB3 MET 50 19.597 -5.566 -13.592 386 HG2 MET 50 HG2 MET 50 21.179 -3.093 -14.375 387 HG3 MET 50 HG3 MET 50 19.459 -3.188 -14.048 388 HE1 MET 50 HE1 MET 50 18.542 -4.037 -11.766 389 HE2 MET 50 HE2 MET 50 19.798 -5.160 -11.175 390 HE3 MET 50 HE3 MET 50 19.323 -3.754 -10.198 391 H GLU 51 H GLU 51 22.239 -7.319 -15.787 392 HA GLU 51 HA GLU 51 21.069 -9.752 -14.826 393 HB2 GLU 51 HB2 GLU 51 23.018 -9.161 -17.078 394 HB3 GLU 51 HB3 GLU 51 22.507 -10.803 -16.687 395 HG2 GLU 51 HG2 GLU 51 20.126 -10.142 -16.978 396 HG3 GLU 51 HG3 GLU 51 20.636 -8.538 -17.492 397 H GLU 52 H GLU 52 24.337 -8.432 -14.273 398 HA GLU 52 HA GLU 52 25.602 -10.811 -13.322 399 HB2 GLU 52 HB2 GLU 52 25.821 -7.986 -12.219 400 HB3 GLU 52 HB3 GLU 52 26.886 -9.328 -11.814 401 HG2 GLU 52 HG2 GLU 52 27.363 -9.437 -14.377 402 HG3 GLU 52 HG3 GLU 52 26.722 -7.786 -14.393 403 H VAL 53 H VAL 53 23.147 -8.791 -11.796 404 HA VAL 53 HA VAL 53 23.226 -10.423 -9.297 405 HB VAL 53 HB VAL 53 21.924 -8.622 -8.241 406 HG11 VAL 53 HG11 VAL 53 24.518 -7.651 -9.509 407 HG12 VAL 53 HG12 VAL 53 23.757 -7.032 -8.027 408 HG13 VAL 53 HG13 VAL 53 24.393 -8.687 -8.072 409 HG21 VAL 53 HG21 VAL 53 22.476 -7.006 -10.769 410 HG22 VAL 53 HG22 VAL 53 20.874 -7.622 -10.270 411 HG23 VAL 53 HG23 VAL 53 21.721 -6.425 -9.288 412 H GLY 54 H GLY 54 21.885 -10.885 -12.094 413 HA2 GLY 54 HA2 GLY 54 20.159 -12.191 -12.790 414 HA3 GLY 54 HA3 GLY 54 19.760 -12.520 -11.098 415 H ILE 55 H ILE 55 19.713 -9.219 -12.337 416 HA ILE 55 HA ILE 55 16.714 -9.140 -12.170 417 HB ILE 55 HB ILE 55 18.791 -7.048 -11.499 418 HG12 ILE 55 HG12 ILE 55 16.683 -8.496 -9.838 419 HG13 ILE 55 HG13 ILE 55 18.421 -8.740 -9.745 420 HG21 ILE 55 HG21 ILE 55 16.908 -5.549 -10.952 421 HG22 ILE 55 HG22 ILE 55 16.886 -5.943 -12.658 422 HG23 ILE 55 HG23 ILE 55 15.750 -6.753 -11.543 423 HD11 ILE 55 HD11 ILE 55 16.890 -6.279 -8.842 424 HD12 ILE 55 HD12 ILE 55 17.821 -7.423 -7.867 425 HD13 ILE 55 HD13 ILE 55 18.669 -6.341 -8.987 426 H ASP 56 H ASP 56 15.585 -8.235 -13.820 427 HA ASP 56 HA ASP 56 17.080 -7.629 -16.314 428 HB2 ASP 56 HB2 ASP 56 15.225 -8.352 -17.514 429 HB3 ASP 56 HB3 ASP 56 15.437 -9.539 -16.237 430 H ILE 57 H ILE 57 16.995 -5.673 -17.257 431 HA ILE 57 HA ILE 57 14.701 -3.873 -16.657 432 HB ILE 57 HB ILE 57 16.042 -1.881 -16.676 433 HG12 ILE 57 HG12 ILE 57 18.574 -3.545 -16.423 434 HG13 ILE 57 HG13 ILE 57 18.002 -2.906 -17.965 435 HG21 ILE 57 HG21 ILE 57 16.911 -2.014 -14.407 436 HG22 ILE 57 HG22 ILE 57 15.437 -2.972 -14.529 437 HG23 ILE 57 HG23 ILE 57 17.014 -3.787 -14.502 438 HD11 ILE 57 HD11 ILE 57 18.713 -1.195 -15.555 439 HD12 ILE 57 HD12 ILE 57 19.665 -1.405 -17.032 440 HD13 ILE 57 HD13 ILE 57 18.078 -0.606 -17.115 441 H SER 58 H SER 58 15.764 -5.766 -18.908 442 HA SER 58 HA SER 58 16.452 -4.227 -21.168 443 HB2 SER 58 HB2 SER 58 15.038 -6.910 -21.213 444 HB3 SER 58 HB3 SER 58 16.206 -6.264 -22.385 445 HG SER 58 HG SER 58 17.169 -7.772 -20.921 446 H GLY 59 H GLY 59 13.273 -5.015 -19.877 447 HA2 GLY 59 HA2 GLY 59 11.757 -4.183 -22.235 448 HA3 GLY 59 HA3 GLY 59 11.126 -4.606 -20.641 449 H GLN 60 H GLN 60 13.522 -2.251 -20.122 450 HA GLN 60 HA GLN 60 11.471 -0.118 -19.873 451 HB2 GLN 60 HB2 GLN 60 14.241 -0.469 -18.674 452 HB3 GLN 60 HB3 GLN 60 13.315 1.026 -18.593 453 HG2 GLN 60 HG2 GLN 60 11.682 0.165 -17.198 454 HG3 GLN 60 HG3 GLN 60 11.981 -1.510 -17.666 455 HE21 GLN 60 HE22 GLN 60 14.200 1.049 -16.291 456 HE22 GLN 60 HE21 GLN 60 14.724 -0.001 -14.972 457 H THR 61 H THR 61 12.189 2.093 -20.447 458 HA THR 61 HA THR 61 13.984 2.483 -22.691 459 HB THR 61 HB THR 61 12.168 3.686 -23.953 460 HG1 THR 61 HG1 THR 61 10.018 3.073 -23.520 461 HG21 THR 61 HG21 THR 61 12.946 1.423 -24.671 462 HG22 THR 61 HG22 THR 61 11.631 0.699 -23.718 463 HG23 THR 61 HG23 THR 61 11.260 1.756 -25.095 464 H SER 62 H SER 62 14.121 4.920 -22.991 465 HA SER 62 HA SER 62 13.998 6.189 -20.356 466 HB2 SER 62 HB2 SER 62 14.862 7.186 -23.039 467 HB3 SER 62 HB3 SER 62 15.088 8.043 -21.477 468 HG SER 62 HG SER 62 16.453 6.330 -20.815 469 H ASP 63 H ASP 63 12.598 7.712 -19.679 470 HA ASP 63 HA ASP 63 10.711 8.979 -21.635 471 HB2 ASP 63 HB2 ASP 63 9.976 7.579 -19.055 472 HB3 ASP 63 HB3 ASP 63 8.931 8.777 -19.824 473 HA PRO 64 HA PRO 64 11.750 12.639 -19.412 474 HB2 PRO 64 HB2 PRO 64 10.180 14.490 -20.581 475 HB3 PRO 64 HB3 PRO 64 11.389 13.556 -21.517 476 HG2 PRO 64 HG2 PRO 64 8.410 13.015 -21.270 477 HG3 PRO 64 HG3 PRO 64 9.406 13.083 -22.759 478 HD2 PRO 64 HD2 PRO 64 8.791 10.723 -21.437 479 HD3 PRO 64 HD3 PRO 64 10.285 10.966 -22.385 480 H ILE 65 H ILE 65 11.263 13.776 -17.599 481 HA ILE 65 HA ILE 65 9.176 13.134 -15.824 482 HB ILE 65 HB ILE 65 11.437 14.174 -15.355 483 HG12 ILE 65 HG12 ILE 65 8.988 15.409 -14.080 484 HG13 ILE 65 HG13 ILE 65 9.788 13.894 -13.617 485 HG21 ILE 65 HG21 ILE 65 11.227 16.104 -17.024 486 HG22 ILE 65 HG22 ILE 65 10.097 16.864 -15.880 487 HG23 ILE 65 HG23 ILE 65 11.766 16.560 -15.399 488 HD11 ILE 65 HD11 ILE 65 11.884 15.396 -13.192 489 HD12 ILE 65 HD12 ILE 65 10.725 16.743 -13.219 490 HD13 ILE 65 HD13 ILE 65 10.552 15.453 -12.023 491 H GLU 66 H GLU 66 9.331 15.709 -18.234 492 HA GLU 66 HA GLU 66 7.147 17.277 -17.511 493 HB2 GLU 66 HB2 GLU 66 8.057 16.595 -20.338 494 HB3 GLU 66 HB3 GLU 66 7.101 18.000 -19.856 495 HG2 GLU 66 HG2 GLU 66 9.035 18.711 -18.370 496 HG3 GLU 66 HG3 GLU 66 9.998 17.420 -19.098 497 H ASN 67 H ASN 67 6.942 14.071 -18.957 498 HA ASN 67 HA ASN 67 4.104 14.462 -19.706 499 HB2 ASN 67 HB2 ASN 67 4.347 12.788 -21.130 500 HB3 ASN 67 HB3 ASN 67 6.069 13.030 -20.939 501 HD21 ASN 67 HD22 ASN 67 7.009 11.649 -18.913 502 HD22 ASN 67 HD21 ASN 67 6.264 10.081 -18.711 503 H PHE 68 H PHE 68 5.722 13.521 -16.836 504 HA PHE 68 HA PHE 68 3.644 11.548 -16.057 505 HB2 PHE 68 HB2 PHE 68 6.435 12.177 -15.056 506 HB3 PHE 68 HB3 PHE 68 5.345 11.075 -14.227 507 HD1 PHE 68 HD2 PHE 68 4.127 9.337 -16.087 508 HD2 PHE 68 HD1 PHE 68 8.120 10.969 -16.139 509 HE1 PHE 68 HE2 PHE 68 4.898 7.401 -17.416 510 HE2 PHE 68 HE1 PHE 68 8.878 9.018 -17.486 511 HZ PHE 68 HZ PHE 68 7.279 7.233 -18.114 512 H ASN 69 H ASN 69 3.326 11.432 -13.635 513 HA ASN 69 HA ASN 69 2.256 14.051 -12.684 514 HB2 ASN 69 HB2 ASN 69 0.556 12.488 -11.535 515 HB3 ASN 69 HB3 ASN 69 0.440 12.746 -13.265 516 HD21 ASN 69 HD22 ASN 69 2.204 10.390 -11.114 517 HD22 ASN 69 HD21 ASN 69 1.681 8.992 -12.049 518 H ALA 70 H ALA 70 3.853 14.810 -11.281 519 HA ALA 70 HA ALA 70 5.324 13.366 -9.388 520 HB1 ALA 70 HB1 ALA 70 4.063 16.124 -9.047 521 HB2 ALA 70 HB2 ALA 70 5.443 15.487 -8.141 522 HB3 ALA 70 HB3 ALA 70 5.595 15.801 -9.885 523 H ASP 71 H ASP 71 1.964 14.459 -9.205 524 HA ASP 71 HA ASP 71 1.473 14.337 -6.460 525 HB2 ASP 71 HB2 ASP 71 0.072 15.406 -8.229 526 HB3 ASP 71 HB3 ASP 71 -0.419 13.797 -8.773 527 H ASP 72 H ASP 72 1.431 11.638 -8.754 528 HA ASP 72 HA ASP 72 0.118 9.848 -6.804 529 HB2 ASP 72 HB2 ASP 72 -0.312 9.721 -9.297 530 HB3 ASP 72 HB3 ASP 72 1.345 9.108 -9.462 531 H TYR 73 H TYR 73 3.427 10.616 -7.788 532 HA TYR 73 HA TYR 73 4.522 8.133 -6.678 533 HB2 TYR 73 HB2 TYR 73 5.934 10.618 -7.672 534 HB3 TYR 73 HB3 TYR 73 6.668 9.056 -7.315 535 HD1 TYR 73 HD1 TYR 73 4.970 7.071 -8.648 536 HD2 TYR 73 HD2 TYR 73 6.136 11.023 -9.935 537 HE1 TYR 73 HE1 TYR 73 4.653 6.399 -11.022 538 HE2 TYR 73 HE2 TYR 73 5.952 10.302 -12.300 539 HH TYR 73 HH TYR 73 5.219 8.619 -13.761 540 H ASP 74 H ASP 74 3.835 8.156 -4.582 541 HA ASP 74 HA ASP 74 3.841 10.085 -2.631 542 HB2 ASP 74 HB2 ASP 74 4.795 7.211 -2.332 543 HB3 ASP 74 HB3 ASP 74 4.202 8.232 -1.021 544 H VAL 75 H VAL 75 6.686 8.366 -3.855 545 HA VAL 75 HA VAL 75 8.425 10.324 -2.418 546 HB VAL 75 HB VAL 75 9.121 7.428 -2.962 547 HG11 VAL 75 HG11 VAL 75 11.147 7.946 -1.599 548 HG12 VAL 75 HG12 VAL 75 11.101 8.818 -3.126 549 HG13 VAL 75 HG13 VAL 75 10.700 9.655 -1.618 550 HG21 VAL 75 HG21 VAL 75 9.223 7.321 -0.426 551 HG22 VAL 75 HG22 VAL 75 8.353 8.875 -0.400 552 HG23 VAL 75 HG23 VAL 75 7.597 7.438 -1.113 553 H VAL 76 H VAL 76 9.908 11.359 -3.675 554 HA VAL 76 HA VAL 76 10.450 10.307 -6.432 555 HB VAL 76 HB VAL 76 9.964 13.166 -5.617 556 HG11 VAL 76 HG11 VAL 76 11.981 13.132 -7.094 557 HG12 VAL 76 HG12 VAL 76 11.092 12.152 -8.281 558 HG13 VAL 76 HG13 VAL 76 10.596 13.822 -7.915 559 HG21 VAL 76 HG21 VAL 76 8.309 13.107 -7.423 560 HG22 VAL 76 HG22 VAL 76 8.766 11.427 -7.814 561 HG23 VAL 76 HG23 VAL 76 7.978 11.822 -6.264 562 H ILE 77 H ILE 77 12.507 10.105 -6.967 563 HA ILE 77 HA ILE 77 14.617 11.139 -5.100 564 HB ILE 77 HB ILE 77 14.721 8.646 -6.811 565 HG12 ILE 77 HG12 ILE 77 12.988 8.184 -5.173 566 HG13 ILE 77 HG13 ILE 77 14.429 7.244 -4.846 567 HG21 ILE 77 HG21 ILE 77 16.645 8.064 -5.385 568 HG22 ILE 77 HG22 ILE 77 16.915 9.564 -6.264 569 HG23 ILE 77 HG23 ILE 77 16.505 9.625 -4.545 570 HD11 ILE 77 HD11 ILE 77 13.716 9.791 -3.323 571 HD12 ILE 77 HD12 ILE 77 13.336 8.142 -2.809 572 HD13 ILE 77 HD13 ILE 77 15.023 8.641 -2.960 573 H SER 78 H SER 78 16.093 12.457 -6.071 574 HA SER 78 HA SER 78 16.294 12.422 -9.064 575 HB2 SER 78 HB2 SER 78 15.832 14.640 -8.036 576 HB3 SER 78 HB3 SER 78 17.410 14.538 -7.213 577 HG SER 78 HG SER 78 17.545 15.595 -9.286 578 H LEU 79 H LEU 79 18.186 11.957 -10.012 579 HA LEU 79 HA LEU 79 20.571 11.233 -8.373 580 HB2 LEU 79 HB2 LEU 79 19.489 9.572 -10.694 581 HB3 LEU 79 HB3 LEU 79 20.910 9.247 -9.699 582 HG LEU 79 HG LEU 79 19.108 9.198 -7.708 583 HD11 LEU 79 HD11 LEU 79 17.106 9.710 -9.098 584 HD12 LEU 79 HD12 LEU 79 17.474 8.339 -10.148 585 HD13 LEU 79 HD13 LEU 79 17.028 8.082 -8.436 586 HD21 LEU 79 HD21 LEU 79 20.569 7.319 -8.389 587 HD22 LEU 79 HD22 LEU 79 18.935 6.781 -7.975 588 HD23 LEU 79 HD23 LEU 79 19.403 6.897 -9.681 589 H CYS 80 H CYS 80 20.250 13.651 -9.335 590 HA CYS 80 HA CYS 80 21.800 13.874 -11.896 591 HB2 CYS 80 HB2 CYS 80 19.817 15.806 -10.640 592 HB3 CYS 80 HB3 CYS 80 20.605 15.941 -12.232 593 HG CYS 80 HG CYS 80 18.211 14.065 -11.065 594 H GLY 81 H GLY 81 23.865 14.483 -11.510 595 HA2 GLY 81 HA2 GLY 81 24.930 15.510 -9.102 596 HA3 GLY 81 HA3 GLY 81 25.737 15.499 -10.656 597 H CYS 82 H CYS 82 23.965 17.386 -8.388 598 HA CYS 82 HA CYS 82 23.844 19.510 -7.833 599 HB2 CYS 82 HB2 CYS 82 26.322 19.091 -7.981 600 HB3 CYS 82 HB3 CYS 82 26.310 19.870 -9.569 601 HG CYS 82 HG CYS 82 25.382 21.120 -6.613 602 H GLY 83 H GLY 83 24.089 19.444 -11.374 603 HA2 GLY 83 HA2 GLY 83 23.205 22.136 -11.798 604 HA3 GLY 83 HA3 GLY 83 23.236 20.831 -12.992 605 H VAL 84 H VAL 84 21.274 20.074 -10.284 606 HA VAL 84 HA VAL 84 18.727 20.780 -11.664 607 HB VAL 84 HB VAL 84 19.594 17.974 -10.853 608 HG11 VAL 84 HG11 VAL 84 17.030 18.877 -12.242 609 HG12 VAL 84 HG12 VAL 84 17.510 17.196 -11.907 610 HG13 VAL 84 HG13 VAL 84 17.143 18.263 -10.565 611 HG21 VAL 84 HG21 VAL 84 19.375 17.486 -13.324 612 HG22 VAL 84 HG22 VAL 84 19.272 19.237 -13.598 613 HG23 VAL 84 HG23 VAL 84 20.739 18.515 -12.877 614 H ASN 85 H ASN 85 17.067 21.221 -10.285 615 HA ASN 85 HA ASN 85 17.256 20.233 -7.465 616 HB2 ASN 85 HB2 ASN 85 18.052 22.697 -8.006 617 HB3 ASN 85 HB3 ASN 85 16.329 23.052 -8.104 618 HD21 ASN 85 HD22 ASN 85 18.783 21.462 -6.003 619 HD22 ASN 85 HD21 ASN 85 18.053 21.997 -4.495 620 H LEU 86 H LEU 86 15.284 20.120 -10.125 621 HA LEU 86 HA LEU 86 13.029 20.077 -10.566 622 HB2 LEU 86 HB2 LEU 86 13.154 18.327 -8.084 623 HB3 LEU 86 HB3 LEU 86 11.829 18.362 -9.248 624 HG LEU 86 HG LEU 86 14.618 17.320 -9.736 625 HD11 LEU 86 HD11 LEU 86 13.555 15.204 -9.803 626 HD12 LEU 86 HD12 LEU 86 12.809 16.012 -8.398 627 HD13 LEU 86 HD13 LEU 86 11.939 15.926 -9.943 628 HD21 LEU 86 HD21 LEU 86 12.231 17.692 -11.602 629 HD22 LEU 86 HD22 LEU 86 13.864 18.376 -11.819 630 HD23 LEU 86 HD23 LEU 86 13.614 16.636 -11.969 631 HA PRO 87 HA PRO 87 11.860 23.503 -7.608 632 HB2 PRO 87 HB2 PRO 87 11.037 24.607 -10.301 633 HB3 PRO 87 HB3 PRO 87 11.635 25.482 -8.855 634 HG2 PRO 87 HG2 PRO 87 13.332 24.946 -10.878 635 HG3 PRO 87 HG3 PRO 87 13.855 24.659 -9.187 636 HD2 PRO 87 HD2 PRO 87 12.848 22.643 -11.209 637 HD3 PRO 87 HD3 PRO 87 14.236 22.543 -10.093 638 HA PRO 88 HA PRO 88 7.334 23.051 -9.105 639 HB2 PRO 88 HB2 PRO 88 7.218 20.503 -10.644 640 HB3 PRO 88 HB3 PRO 88 6.481 22.086 -11.014 641 HG2 PRO 88 HG2 PRO 88 8.623 21.173 -12.403 642 HG3 PRO 88 HG3 PRO 88 8.493 22.906 -11.946 643 HD2 PRO 88 HD2 PRO 88 10.010 20.698 -10.513 644 HD3 PRO 88 HD3 PRO 88 10.567 22.325 -11.027 645 H GLU 89 H GLU 89 5.534 20.852 -9.035 646 HA GLU 89 HA GLU 89 5.586 20.098 -6.279 647 HB2 GLU 89 HB2 GLU 89 3.686 18.614 -6.882 648 HB3 GLU 89 HB3 GLU 89 3.479 20.302 -7.319 649 HG2 GLU 89 HG2 GLU 89 4.575 18.482 -9.450 650 HG3 GLU 89 HG3 GLU 89 2.904 18.233 -8.957 651 H TRP 90 H TRP 90 7.493 18.793 -8.680 652 HA TRP 90 HA TRP 90 7.719 16.034 -7.979 653 HB2 TRP 90 HB2 TRP 90 9.599 18.054 -9.213 654 HB3 TRP 90 HB3 TRP 90 9.991 16.341 -8.991 655 HD1 TRP 90 HD1 TRP 90 8.046 18.609 -11.311 656 HE1 TRP 90 HE1 TRP 90 6.752 17.233 -13.049 657 HE3 TRP 90 HE3 TRP 90 8.956 13.963 -9.456 658 HZ2 TRP 90 HZ2 TRP 90 6.327 14.423 -13.662 659 HZ3 TRP 90 HZ3 TRP 90 8.174 11.954 -10.650 660 HH2 TRP 90 HH2 TRP 90 6.900 12.172 -12.775 661 H VAL 91 H VAL 91 8.703 18.827 -6.157 662 HA VAL 91 HA VAL 91 10.210 17.042 -4.272 663 HB VAL 91 HB VAL 91 11.380 18.986 -3.427 664 HG11 VAL 91 HG11 VAL 91 11.629 18.599 -6.409 665 HG12 VAL 91 HG12 VAL 91 12.825 19.401 -5.374 666 HG13 VAL 91 HG13 VAL 91 12.451 17.697 -5.130 667 HG21 VAL 91 HG21 VAL 91 11.324 21.151 -4.549 668 HG22 VAL 91 HG22 VAL 91 10.090 20.585 -5.683 669 HG23 VAL 91 HG23 VAL 91 9.701 20.772 -3.961 670 H THR 92 H THR 92 7.167 18.288 -4.552 671 HA THR 92 HA THR 92 6.879 18.996 -1.678 672 HB THR 92 HB THR 92 4.711 19.852 -2.223 673 HG1 THR 92 HG1 THR 92 3.796 19.598 -4.164 674 HG21 THR 92 HG21 THR 92 6.678 21.330 -2.706 675 HG22 THR 92 HG22 THR 92 6.665 20.764 -4.390 676 HG23 THR 92 HG23 THR 92 5.280 21.669 -3.746 677 H GLN 93 H GLN 93 7.045 16.162 -3.149 678 HA GLN 93 HA GLN 93 4.627 14.842 -2.218 679 HB2 GLN 93 HB2 GLN 93 7.225 13.657 -3.282 680 HB3 GLN 93 HB3 GLN 93 5.674 12.827 -3.092 681 HG2 GLN 93 HG2 GLN 93 6.361 15.036 -5.057 682 HG3 GLN 93 HG3 GLN 93 5.881 13.391 -5.416 683 HE21 GLN 93 HE22 GLN 93 4.735 16.438 -5.660 684 HE22 GLN 93 HE21 GLN 93 3.028 16.150 -5.342 685 H GLU 94 H GLU 94 5.331 12.536 -1.005 686 HA GLU 94 HA GLU 94 5.430 13.494 1.695 687 HB2 GLU 94 HB2 GLU 94 4.220 11.431 0.834 688 HB3 GLU 94 HB3 GLU 94 5.790 10.626 0.758 689 HG2 GLU 94 HG2 GLU 94 4.760 9.921 2.747 690 HG3 GLU 94 HG3 GLU 94 6.085 10.978 3.198 691 H ILE 95 H ILE 95 7.883 11.845 -0.301 692 HA ILE 95 HA ILE 95 9.990 12.998 1.438 693 HB ILE 95 HB ILE 95 10.083 10.098 0.506 694 HG12 ILE 95 HG12 ILE 95 9.696 11.205 3.313 695 HG13 ILE 95 HG13 ILE 95 8.535 10.269 2.369 696 HG21 ILE 95 HG21 ILE 95 12.069 11.698 2.184 697 HG22 ILE 95 HG22 ILE 95 12.212 9.977 1.763 698 HG23 ILE 95 HG23 ILE 95 12.311 11.174 0.501 699 HD11 ILE 95 HD11 ILE 95 9.422 8.736 3.905 700 HD12 ILE 95 HD12 ILE 95 10.251 8.363 2.379 701 HD13 ILE 95 HD13 ILE 95 11.088 9.283 3.653 702 H PHE 96 H PHE 96 11.674 13.827 0.316 703 HA PHE 96 HA PHE 96 12.085 12.993 -2.475 704 HB2 PHE 96 HB2 PHE 96 11.006 15.096 -2.785 705 HB3 PHE 96 HB3 PHE 96 12.016 15.865 -1.560 706 HD1 PHE 96 HD2 PHE 96 11.979 14.522 -5.063 707 HD2 PHE 96 HD1 PHE 96 14.298 16.554 -2.027 708 HE1 PHE 96 HE2 PHE 96 13.781 14.940 -6.696 709 HE2 PHE 96 HE1 PHE 96 16.049 17.049 -3.706 710 HZ PHE 96 HZ PHE 96 15.801 16.236 -6.042 711 H GLU 97 H GLU 97 14.189 12.588 -3.016 712 HA GLU 97 HA GLU 97 16.357 13.424 -1.157 713 HB2 GLU 97 HB2 GLU 97 16.001 10.580 -2.179 714 HB3 GLU 97 HB3 GLU 97 17.386 11.221 -1.297 715 HG2 GLU 97 HG2 GLU 97 15.881 11.695 0.659 716 HG3 GLU 97 HG3 GLU 97 14.563 10.911 -0.222 717 H ASP 98 H ASP 98 18.483 13.395 -2.110 718 HA ASP 98 HA ASP 98 18.573 13.279 -5.092 719 HB2 ASP 98 HB2 ASP 98 18.426 15.587 -4.449 720 HB3 ASP 98 HB3 ASP 98 19.715 15.386 -3.254 721 H TRP 99 H TRP 99 19.669 11.475 -5.469 722 HA TRP 99 HA TRP 99 22.036 10.690 -3.820 723 HB2 TRP 99 HB2 TRP 99 20.419 9.058 -5.797 724 HB3 TRP 99 HB3 TRP 99 21.686 8.471 -4.734 725 HD1 TRP 99 HD1 TRP 99 19.967 10.358 -2.302 726 HE1 TRP 99 HE1 TRP 99 18.053 9.083 -1.142 727 HE3 TRP 99 HE3 TRP 99 19.439 6.504 -5.623 728 HZ2 TRP 99 HZ2 TRP 99 16.418 6.782 -1.673 729 HZ3 TRP 99 HZ3 TRP 99 17.671 4.799 -5.297 730 HH2 TRP 99 HH2 TRP 99 16.142 4.923 -3.328 731 H GLN 100 H GLN 100 23.455 12.229 -4.780 732 HA GLN 100 HA GLN 100 23.994 12.170 -7.634 733 HB2 GLN 100 HB2 GLN 100 25.566 13.418 -5.346 734 HB3 GLN 100 HB3 GLN 100 25.851 13.686 -7.077 735 HG2 GLN 100 HG2 GLN 100 23.469 14.555 -7.252 736 HG3 GLN 100 HG3 GLN 100 23.339 14.427 -5.504 737 HE21 GLN 100 HE22 GLN 100 22.840 16.751 -5.606 738 HE22 GLN 100 HE21 GLN 100 24.202 17.879 -5.643 739 H LEU 101 H LEU 101 25.329 10.894 -8.751 740 HA LEU 101 HA LEU 101 27.497 9.298 -7.492 741 HB2 LEU 101 HB2 LEU 101 25.104 8.188 -9.038 742 HB3 LEU 101 HB3 LEU 101 26.575 7.275 -8.774 743 HG LEU 101 HG LEU 101 24.689 8.201 -6.564 744 HD11 LEU 101 HD11 LEU 101 25.260 5.417 -7.631 745 HD12 LEU 101 HD12 LEU 101 24.110 5.876 -6.354 746 HD13 LEU 101 HD13 LEU 101 23.814 6.404 -8.014 747 HD21 LEU 101 HD21 LEU 101 27.019 8.049 -5.718 748 HD22 LEU 101 HD22 LEU 101 26.035 6.723 -5.114 749 HD23 LEU 101 HD23 LEU 101 27.177 6.434 -6.445 750 H GLU 102 H GLU 102 28.732 8.081 -9.258 751 HA GLU 102 HA GLU 102 29.702 9.809 -11.284 752 HB2 GLU 102 HB2 GLU 102 29.923 6.845 -10.690 753 HB3 GLU 102 HB3 GLU 102 30.638 7.486 -12.160 754 HG2 GLU 102 HG2 GLU 102 31.303 8.284 -9.319 755 HG3 GLU 102 HG3 GLU 102 32.283 7.308 -10.426 756 H ASP 103 H ASP 103 29.914 9.109 -13.545 757 HA ASP 103 HA ASP 103 27.279 8.359 -14.798 758 HB2 ASP 103 HB2 ASP 103 27.854 10.705 -15.124 759 HB3 ASP 103 HB3 ASP 103 29.437 10.258 -15.750 760 HA PRO 104 HA PRO 104 30.280 5.014 -15.675 761 HB2 PRO 104 HB2 PRO 104 27.739 3.532 -16.194 762 HB3 PRO 104 HB3 PRO 104 29.199 3.010 -15.292 763 HG2 PRO 104 HG2 PRO 104 26.992 3.771 -13.947 764 HG3 PRO 104 HG3 PRO 104 28.595 4.405 -13.437 765 HD2 PRO 104 HD2 PRO 104 26.549 5.757 -15.242 766 HD3 PRO 104 HD3 PRO 104 27.359 6.399 -13.794 767 H ASP 105 H ASP 105 27.935 6.351 -17.821 768 HA ASP 105 HA ASP 105 28.120 4.769 -20.131 769 HB2 ASP 105 HB2 ASP 105 26.476 6.520 -19.742 770 HB3 ASP 105 HB3 ASP 105 27.739 7.751 -19.716 771 H GLY 106 H GLY 106 29.995 4.082 -20.997 772 HA2 GLY 106 HA2 GLY 106 31.869 4.231 -22.368 773 HA3 GLY 106 HA3 GLY 106 31.883 5.985 -22.190 774 H GLN 107 H GLN 107 31.756 4.287 -19.172 775 HA GLN 107 HA GLN 107 34.590 4.977 -18.611 776 HB2 GLN 107 HB2 GLN 107 32.452 4.054 -16.675 777 HB3 GLN 107 HB3 GLN 107 34.048 4.685 -16.272 778 HG2 GLN 107 HG2 GLN 107 31.820 6.250 -17.646 779 HG3 GLN 107 HG3 GLN 107 32.139 6.213 -15.919 780 HE21 GLN 107 HE22 GLN 107 32.022 8.580 -16.604 781 HE22 GLN 107 HE21 GLN 107 33.598 9.343 -16.870 782 H SER 108 H SER 108 33.158 2.393 -16.798 783 HA SER 108 HA SER 108 34.341 0.158 -18.222 784 HB2 SER 108 HB2 SER 108 35.964 -0.435 -16.450 785 HB3 SER 108 HB3 SER 108 36.362 1.135 -17.162 786 HG SER 108 HG SER 108 36.458 1.359 -14.946 787 H LEU 109 H LEU 109 33.939 -1.898 -17.022 788 HA LEU 109 HA LEU 109 31.268 -1.940 -15.954 789 HB2 LEU 109 HB2 LEU 109 33.415 -4.086 -15.781 790 HB3 LEU 109 HB3 LEU 109 31.685 -4.315 -15.555 791 HG LEU 109 HG LEU 109 33.079 -3.555 -18.156 792 HD11 LEU 109 HD11 LEU 109 32.360 -5.780 -18.867 793 HD12 LEU 109 HD12 LEU 109 33.354 -5.873 -17.395 794 HD13 LEU 109 HD13 LEU 109 31.588 -6.056 -17.286 795 HD21 LEU 109 HD21 LEU 109 30.899 -2.461 -18.138 796 HD22 LEU 109 HD22 LEU 109 30.854 -3.862 -19.219 797 HD23 LEU 109 HD23 LEU 109 30.112 -3.955 -17.602 798 H GLU 110 H GLU 110 34.407 -2.058 -14.320 799 HA GLU 110 HA GLU 110 33.332 -2.364 -11.676 800 HB2 GLU 110 HB2 GLU 110 35.466 -1.591 -10.838 801 HB3 GLU 110 HB3 GLU 110 35.660 -2.779 -12.123 802 HG2 GLU 110 HG2 GLU 110 36.206 -0.985 -13.730 803 HG3 GLU 110 HG3 GLU 110 35.988 0.228 -12.460 804 H VAL 111 H VAL 111 33.621 0.580 -13.663 805 HA VAL 111 HA VAL 111 32.731 2.325 -11.475 806 HB VAL 111 HB VAL 111 32.994 2.751 -14.458 807 HG11 VAL 111 HG11 VAL 111 32.677 5.180 -13.939 808 HG12 VAL 111 HG12 VAL 111 31.202 4.232 -13.741 809 HG13 VAL 111 HG13 VAL 111 32.130 4.741 -12.308 810 HG21 VAL 111 HG21 VAL 111 34.504 3.922 -12.067 811 HG22 VAL 111 HG22 VAL 111 35.107 2.605 -13.088 812 HG23 VAL 111 HG23 VAL 111 34.858 4.206 -13.786 813 H PHE 112 H PHE 112 31.049 0.624 -14.200 814 HA PHE 112 HA PHE 112 28.404 1.571 -13.511 815 HB2 PHE 112 HB2 PHE 112 29.502 -0.882 -14.891 816 HB3 PHE 112 HB3 PHE 112 27.828 -0.850 -14.367 817 HD1 PHE 112 HD1 PHE 112 26.181 0.677 -15.318 818 HD2 PHE 112 HD2 PHE 112 30.204 0.466 -16.841 819 HE1 PHE 112 HE1 PHE 112 25.443 1.780 -17.424 820 HE2 PHE 112 HE2 PHE 112 29.478 1.608 -18.912 821 HZ PHE 112 HZ PHE 112 27.119 2.302 -19.181 822 H ARG 113 H ARG 113 30.217 -1.293 -12.337 823 HA ARG 113 HA ARG 113 28.273 -2.192 -10.428 824 HB2 ARG 113 HB2 ARG 113 31.303 -2.465 -10.587 825 HB3 ARG 113 HB3 ARG 113 30.336 -3.279 -9.351 826 HG2 ARG 113 HG2 ARG 113 29.163 -4.599 -10.941 827 HG3 ARG 113 HG3 ARG 113 29.665 -3.607 -12.296 828 HD2 ARG 113 HD2 ARG 113 30.851 -5.718 -12.347 829 HD3 ARG 113 HD3 ARG 113 31.964 -4.381 -12.100 830 HE ARG 113 HE ARG 113 32.383 -5.069 -9.885 831 HH11 ARG 113 HH12 ARG 113 30.039 -7.300 -11.322 832 HH12 ARG 113 HH11 ARG 113 30.451 -8.545 -10.167 833 HH21 ARG 113 HH21 ARG 113 32.731 -6.673 -8.413 834 HH22 ARG 113 HH22 ARG 113 31.872 -8.179 -8.536 835 H THR 114 H THR 114 30.926 0.146 -10.028 836 HA THR 114 HA THR 114 30.561 0.705 -7.252 837 HB THR 114 HB THR 114 31.595 2.453 -9.512 838 HG1 THR 114 HG1 THR 114 32.884 0.707 -9.144 839 HG21 THR 114 HG21 THR 114 31.013 3.991 -7.760 840 HG22 THR 114 HG22 THR 114 31.719 2.927 -6.515 841 HG23 THR 114 HG23 THR 114 32.761 3.736 -7.712 842 H VAL 115 H VAL 115 28.978 2.275 -10.082 843 HA VAL 115 HA VAL 115 27.230 3.919 -8.428 844 HB VAL 115 HB VAL 115 27.167 3.089 -11.349 845 HG11 VAL 115 HG11 VAL 115 25.466 4.822 -11.735 846 HG12 VAL 115 HG12 VAL 115 24.810 3.549 -10.714 847 HG13 VAL 115 HG13 VAL 115 25.311 5.100 -9.987 848 HG21 VAL 115 HG21 VAL 115 28.958 4.613 -10.785 849 HG22 VAL 115 HG22 VAL 115 27.706 5.573 -11.589 850 HG23 VAL 115 HG23 VAL 115 27.867 5.640 -9.834 851 H ARG 116 H ARG 116 26.654 0.812 -10.125 852 HA ARG 116 HA ARG 116 23.972 0.402 -9.494 853 HB2 ARG 116 HB2 ARG 116 25.441 -0.966 -11.032 854 HB3 ARG 116 HB3 ARG 116 26.175 -1.717 -9.619 855 HG2 ARG 116 HG2 ARG 116 23.776 -2.461 -8.980 856 HG3 ARG 116 HG3 ARG 116 23.307 -1.935 -10.603 857 HD2 ARG 116 HD2 ARG 116 23.708 -4.300 -10.688 858 HD3 ARG 116 HD3 ARG 116 25.051 -3.495 -11.523 859 HE ARG 116 HE ARG 116 25.457 -4.104 -8.633 860 HH11 ARG 116 HH11 ARG 116 25.779 -5.559 -11.778 861 HH12 ARG 116 HH12 ARG 116 27.343 -6.268 -11.438 862 HH21 ARG 116 HH21 ARG 116 27.286 -5.303 -8.107 863 HH22 ARG 116 HH22 ARG 116 27.983 -6.356 -9.299 864 H GLY 117 H GLY 117 26.746 -0.627 -7.442 865 HA2 GLY 117 HA2 GLY 117 25.229 -1.892 -5.388 866 HA3 GLY 117 HA3 GLY 117 26.834 -1.182 -5.195 867 H GLN 118 H GLN 118 26.143 1.562 -5.738 868 HA GLN 118 HA GLN 118 25.036 2.291 -3.138 869 HB2 GLN 118 HB2 GLN 118 26.037 3.932 -5.495 870 HB3 GLN 118 HB3 GLN 118 25.472 4.628 -3.964 871 HG2 GLN 118 HG2 GLN 118 27.196 3.427 -2.704 872 HG3 GLN 118 HG3 GLN 118 27.749 2.601 -4.163 873 HE21 GLN 118 HE22 GLN 118 28.926 3.803 -5.788 874 HE22 GLN 118 HE21 GLN 118 29.662 5.351 -5.347 875 H VAL 119 H VAL 119 23.865 2.655 -6.535 876 HA VAL 119 HA VAL 119 21.305 3.742 -5.891 877 HB VAL 119 HB VAL 119 22.018 1.800 -8.135 878 HG11 VAL 119 HG11 VAL 119 20.043 2.832 -9.278 879 HG12 VAL 119 HG12 VAL 119 19.596 1.855 -7.878 880 HG13 VAL 119 HG13 VAL 119 19.629 3.638 -7.742 881 HG21 VAL 119 HG21 VAL 119 21.811 4.849 -8.123 882 HG22 VAL 119 HG22 VAL 119 23.323 3.922 -8.228 883 HG23 VAL 119 HG23 VAL 119 22.156 3.815 -9.533 884 H LYS 120 H LYS 120 22.280 0.268 -6.044 885 HA LYS 120 HA LYS 120 19.802 -0.888 -5.256 886 HB2 LYS 120 HB2 LYS 120 21.744 -2.177 -6.092 887 HB3 LYS 120 HB3 LYS 120 22.668 -1.793 -4.643 888 HG2 LYS 120 HG2 LYS 120 20.973 -2.952 -3.243 889 HG3 LYS 120 HG3 LYS 120 20.042 -3.330 -4.692 890 HD2 LYS 120 HD2 LYS 120 22.004 -4.658 -5.529 891 HD3 LYS 120 HD3 LYS 120 22.874 -4.305 -4.036 892 HE2 LYS 120 HE2 LYS 120 20.064 -5.386 -3.827 893 HE3 LYS 120 HE3 LYS 120 21.315 -6.516 -4.377 894 HZ1 LYS 120 HZ1 LYS 120 21.128 -6.628 -1.973 895 HZ2 LYS 120 HZ2 LYS 120 22.576 -5.953 -2.306 896 HZ3 LYS 120 HZ3 LYS 120 21.311 -5.022 -1.785 897 H GLU 121 H GLU 121 22.586 -0.013 -3.092 898 HA GLU 121 HA GLU 121 21.114 -0.710 -0.735 899 HB2 GLU 121 HB2 GLU 121 22.954 -0.189 0.460 900 HB3 GLU 121 HB3 GLU 121 23.705 -0.403 -1.120 901 HG2 GLU 121 HG2 GLU 121 23.664 2.083 -1.426 902 HG3 GLU 121 HG3 GLU 121 22.992 2.256 0.187 903 H ARG 122 H ARG 122 21.296 2.466 -2.371 904 HA ARG 122 HA ARG 122 19.777 3.665 -0.211 905 HB2 ARG 122 HB2 ARG 122 20.245 4.642 -3.046 906 HB3 ARG 122 HB3 ARG 122 19.354 5.506 -1.777 907 HG2 ARG 122 HG2 ARG 122 21.485 5.106 -0.288 908 HG3 ARG 122 HG3 ARG 122 22.311 4.818 -1.825 909 HD2 ARG 122 HD2 ARG 122 21.526 7.057 -2.606 910 HD3 ARG 122 HD3 ARG 122 20.695 7.261 -1.042 911 HE ARG 122 HE ARG 122 23.657 6.820 -1.153 912 HH11 ARG 122 HH11 ARG 122 21.049 8.978 -0.218 913 HH12 ARG 122 HH12 ARG 122 22.125 10.050 0.632 914 HH21 ARG 122 HH21 ARG 122 24.961 8.215 -0.024 915 HH22 ARG 122 HH22 ARG 122 24.280 9.615 0.743 916 H VAL 123 H VAL 123 18.709 2.067 -3.258 917 HA VAL 123 HA VAL 123 15.919 2.426 -2.666 918 HB VAL 123 HB VAL 123 17.434 0.389 -4.338 919 HG11 VAL 123 HG11 VAL 123 15.333 -0.514 -5.125 920 HG12 VAL 123 HG12 VAL 123 15.566 -0.904 -3.429 921 HG13 VAL 123 HG13 VAL 123 14.431 0.399 -3.874 922 HG21 VAL 123 HG21 VAL 123 15.410 2.561 -4.983 923 HG22 VAL 123 HG22 VAL 123 17.176 2.624 -5.235 924 HG23 VAL 123 HG23 VAL 123 16.191 1.475 -6.152 925 H GLU 124 H GLU 124 18.014 -0.413 -1.691 926 HA GLU 124 HA GLU 124 15.915 -1.643 -0.191 927 HB2 GLU 124 HB2 GLU 124 18.898 -1.689 0.382 928 HB3 GLU 124 HB3 GLU 124 17.666 -2.794 1.048 929 HG2 GLU 124 HG2 GLU 124 17.106 -3.580 -1.161 930 HG3 GLU 124 HG3 GLU 124 18.347 -2.561 -1.890 931 H ASN 125 H ASN 125 18.111 0.946 0.814 932 HA ASN 125 HA ASN 125 17.082 0.855 3.488 933 HB2 ASN 125 HB2 ASN 125 18.938 2.088 3.849 934 HB3 ASN 125 HB3 ASN 125 19.209 2.213 2.120 935 HD21 ASN 125 HD22 ASN 125 18.159 3.946 0.925 936 HD22 ASN 125 HD21 ASN 125 18.043 5.500 1.760 937 H LEU 126 H LEU 126 16.025 2.530 0.590 938 HA LEU 126 HA LEU 126 14.154 4.282 1.960 939 HB2 LEU 126 HB2 LEU 126 15.094 4.929 -0.179 940 HB3 LEU 126 HB3 LEU 126 14.564 3.427 -0.936 941 HG LEU 126 HG LEU 126 12.203 4.090 -0.720 942 HD11 LEU 126 HD11 LEU 126 11.578 6.367 -0.057 943 HD12 LEU 126 HD12 LEU 126 12.348 5.556 1.299 944 HD13 LEU 126 HD13 LEU 126 13.269 6.744 0.345 945 HD21 LEU 126 HD21 LEU 126 12.282 5.933 -2.364 946 HD22 LEU 126 HD22 LEU 126 14.014 6.152 -2.007 947 HD23 LEU 126 HD23 LEU 126 13.439 4.640 -2.745 948 H ILE 127 H ILE 127 13.709 1.184 0.079 949 HA ILE 127 HA ILE 127 10.874 1.275 0.475 950 HB ILE 127 HB ILE 127 10.793 -1.088 -0.099 951 HG12 ILE 127 HG12 ILE 127 13.809 -1.025 0.135 952 HG13 ILE 127 HG13 ILE 127 12.644 -2.137 0.868 953 HG21 ILE 127 HG21 ILE 127 10.917 0.790 -1.778 954 HG22 ILE 127 HG22 ILE 127 12.666 0.483 -1.934 955 HG23 ILE 127 HG23 ILE 127 11.483 -0.757 -2.408 956 HD11 ILE 127 HD11 ILE 127 12.174 -3.030 -1.436 957 HD12 ILE 127 HD12 ILE 127 13.510 -2.011 -2.045 958 HD13 ILE 127 HD13 ILE 127 13.835 -3.290 -0.858 959 H ALA 128 H ALA 128 13.366 -0.064 2.641 960 HA ALA 128 HA ALA 128 11.512 -1.282 4.402 961 HB1 ALA 128 HB1 ALA 128 13.404 -1.215 6.016 962 HB2 ALA 128 HB2 ALA 128 13.947 -1.714 4.402 963 HB3 ALA 128 HB3 ALA 128 14.257 -0.058 4.971 964 H LYS 129 H LYS 129 12.208 2.125 3.950 965 HA LYS 129 HA LYS 129 10.972 2.999 6.497 966 HB2 LYS 129 HB2 LYS 129 11.918 4.561 4.053 967 HB3 LYS 129 HB3 LYS 129 11.321 5.278 5.547 968 HG2 LYS 129 HG2 LYS 129 13.161 4.395 6.827 969 HG3 LYS 129 HG3 LYS 129 13.750 3.450 5.450 970 HD2 LYS 129 HD2 LYS 129 14.134 5.527 4.160 971 HD3 LYS 129 HD3 LYS 129 13.599 6.502 5.534 972 HE2 LYS 129 HE2 LYS 129 15.998 4.608 5.508 973 HE3 LYS 129 HE3 LYS 129 16.082 6.348 5.255 974 HZ1 LYS 129 HZ1 LYS 129 15.180 5.046 7.778 975 HZ2 LYS 129 HZ2 LYS 129 16.587 5.835 7.551 976 HZ3 LYS 129 HZ3 LYS 129 15.186 6.665 7.517 977 H ILE 130 H ILE 130 10.059 2.853 3.048 978 HA ILE 130 HA ILE 130 7.421 4.059 3.751 979 HB ILE 130 HB ILE 130 7.264 4.864 1.460 980 HG12 ILE 130 HG12 ILE 130 9.361 5.085 0.114 981 HG13 ILE 130 HG13 ILE 130 10.127 3.889 1.146 982 HG21 ILE 130 HG21 ILE 130 8.162 6.192 3.380 983 HG22 ILE 130 HG22 ILE 130 9.809 5.761 2.867 984 HG23 ILE 130 HG23 ILE 130 8.758 6.706 1.798 985 HD11 ILE 130 HD11 ILE 130 8.589 2.167 0.354 986 HD12 ILE 130 HD12 ILE 130 7.675 3.389 -0.580 987 HD13 ILE 130 HD13 ILE 130 9.351 2.989 -1.014 988 H SER 131 H SER 131 8.389 0.971 3.177 989 HA SER 131 HA SER 131 6.384 -0.105 1.457 990 HB2 SER 131 HB2 SER 131 7.725 -1.251 3.924 991 HB3 SER 131 HB3 SER 131 6.634 -2.175 2.860 992 HG SER 131 HG SER 131 9.079 -0.897 2.173 Start of MODEL 13 1 H MET 1 H1 MET 1 2.328 -0.044 1.531 2 HA MET 1 HA MET 1 3.266 -0.418 -0.542 3 HB2 MET 1 HB2 MET 1 1.586 -1.899 -1.484 4 HB3 MET 1 HB3 MET 1 0.411 -0.588 -1.612 5 HG2 MET 1 HG2 MET 1 1.761 0.554 -3.283 6 HG3 MET 1 HG3 MET 1 3.084 -0.584 -3.065 7 HE1 MET 1 HE1 MET 1 2.002 -3.748 -4.976 8 HE2 MET 1 HE2 MET 1 3.364 -2.814 -4.335 9 HE3 MET 1 HE3 MET 1 2.122 -3.448 -3.229 10 H LYS 2 H LYS 2 4.262 1.401 -1.055 11 HA LYS 2 HA LYS 2 2.708 3.814 -1.919 12 HB2 LYS 2 HB2 LYS 2 5.200 3.777 -0.175 13 HB3 LYS 2 HB3 LYS 2 4.571 5.210 -0.971 14 HG2 LYS 2 HG2 LYS 2 2.403 4.949 0.219 15 HG3 LYS 2 HG3 LYS 2 3.064 3.554 1.094 16 HD2 LYS 2 HD2 LYS 2 4.805 4.988 2.102 17 HD3 LYS 2 HD3 LYS 2 4.176 6.394 1.214 18 HE2 LYS 2 HE2 LYS 2 2.003 6.186 2.341 19 HE3 LYS 2 HE3 LYS 2 2.532 4.719 3.174 20 HZ1 LYS 2 HZ1 LYS 2 4.162 6.033 4.390 21 HZ2 LYS 2 HZ2 LYS 2 3.827 7.388 3.530 22 HZ3 LYS 2 HZ3 LYS 2 2.710 6.763 4.558 23 H LYS 3 H LYS 3 4.059 5.239 -3.344 24 HA LYS 3 HA LYS 3 5.548 3.485 -5.271 25 HB2 LYS 3 HB2 LYS 3 3.901 5.970 -5.911 26 HB3 LYS 3 HB3 LYS 3 4.788 4.991 -7.051 27 HG2 LYS 3 HG2 LYS 3 2.715 4.086 -7.357 28 HG3 LYS 3 HG3 LYS 3 3.397 2.972 -6.185 29 HD2 LYS 3 HD2 LYS 3 1.076 3.436 -5.633 30 HD3 LYS 3 HD3 LYS 3 2.106 4.093 -4.366 31 HE2 LYS 3 HE2 LYS 3 2.006 6.265 -5.922 32 HE3 LYS 3 HE3 LYS 3 0.520 5.520 -6.507 33 HZ1 LYS 3 HZ1 LYS 3 -0.228 5.504 -4.122 34 HZ2 LYS 3 HZ2 LYS 3 1.187 6.274 -3.701 35 HZ3 LYS 3 HZ3 LYS 3 0.100 7.022 -4.660 36 H VAL 4 H VAL 4 7.376 4.110 -6.230 37 HA VAL 4 HA VAL 4 8.675 6.623 -5.253 38 HB VAL 4 HB VAL 4 10.259 4.083 -5.662 39 HG11 VAL 4 HG11 VAL 4 10.989 6.742 -4.414 40 HG12 VAL 4 HG12 VAL 4 12.018 5.294 -4.497 41 HG13 VAL 4 HG13 VAL 4 11.565 6.120 -5.974 42 HG21 VAL 4 HG21 VAL 4 10.503 4.011 -3.197 43 HG22 VAL 4 HG22 VAL 4 9.226 5.242 -3.055 44 HG23 VAL 4 HG23 VAL 4 8.868 3.645 -3.742 45 H MET 5 H MET 5 9.784 7.811 -6.729 46 HA MET 5 HA MET 5 9.922 6.794 -9.527 47 HB2 MET 5 HB2 MET 5 7.946 8.094 -9.527 48 HB3 MET 5 HB3 MET 5 8.693 9.371 -8.565 49 HG2 MET 5 HG2 MET 5 8.450 10.067 -10.867 50 HG3 MET 5 HG3 MET 5 10.143 10.005 -10.411 51 HE1 MET 5 HE1 MET 5 8.127 9.894 -13.258 52 HE2 MET 5 HE2 MET 5 8.326 8.370 -14.128 53 HE3 MET 5 HE3 MET 5 7.292 8.438 -12.688 54 H PHE 6 H PHE 6 11.734 7.105 -10.484 55 HA PHE 6 HA PHE 6 13.904 8.626 -9.069 56 HB2 PHE 6 HB2 PHE 6 14.190 6.365 -11.074 57 HB3 PHE 6 HB3 PHE 6 15.442 7.055 -10.051 58 HD1 PHE 6 HD2 PHE 6 15.292 6.711 -7.504 59 HD2 PHE 6 HD1 PHE 6 12.864 4.566 -10.342 60 HE1 PHE 6 HE2 PHE 6 14.680 5.085 -5.736 61 HE2 PHE 6 HE1 PHE 6 12.243 2.950 -8.566 62 HZ PHE 6 HZ PHE 6 13.088 3.256 -6.239 63 H VAL 7 H VAL 7 14.318 10.562 -9.913 64 HA VAL 7 HA VAL 7 14.262 11.046 -12.834 65 HB VAL 7 HB VAL 7 14.072 12.799 -10.441 66 HG11 VAL 7 HG11 VAL 7 16.164 13.741 -11.253 67 HG12 VAL 7 HG12 VAL 7 15.534 13.808 -12.924 68 HG13 VAL 7 HG13 VAL 7 14.841 14.816 -11.645 69 HG21 VAL 7 HG21 VAL 7 13.154 13.104 -13.343 70 HG22 VAL 7 HG22 VAL 7 12.213 12.332 -12.024 71 HG23 VAL 7 HG23 VAL 7 12.607 14.043 -11.934 72 H CYS 8 H CYS 8 15.996 11.283 -14.055 73 HA CYS 8 HA CYS 8 18.691 11.743 -12.846 74 HB2 CYS 8 HB2 CYS 8 18.576 9.387 -13.249 75 HB3 CYS 8 HB3 CYS 8 17.867 9.592 -14.859 76 HG CYS 8 HG CYS 8 20.380 8.629 -14.939 77 H LYS 9 H LYS 9 20.182 12.517 -14.886 78 HA LYS 9 HA LYS 9 18.796 14.834 -15.926 79 HB2 LYS 9 HB2 LYS 9 21.391 14.374 -15.509 80 HB3 LYS 9 HB3 LYS 9 21.377 13.931 -17.216 81 HG2 LYS 9 HG2 LYS 9 20.222 16.223 -17.617 82 HG3 LYS 9 HG3 LYS 9 20.521 16.543 -15.900 83 HD2 LYS 9 HD2 LYS 9 22.308 17.609 -17.001 84 HD3 LYS 9 HD3 LYS 9 22.980 16.136 -16.325 85 HE2 LYS 9 HE2 LYS 9 23.949 16.215 -18.431 86 HE3 LYS 9 HE3 LYS 9 22.625 15.077 -18.689 87 HZ1 LYS 9 HZ1 LYS 9 21.353 16.883 -19.763 88 HZ2 LYS 9 HZ2 LYS 9 22.514 17.986 -19.375 89 HZ3 LYS 9 HZ3 LYS 9 22.828 16.804 -20.449 90 H ARG 10 H ARG 10 20.033 12.020 -17.715 91 HA ARG 10 HA ARG 10 17.879 12.454 -19.762 92 HB2 ARG 10 HB2 ARG 10 19.232 11.962 -21.511 93 HB3 ARG 10 HB3 ARG 10 20.174 13.014 -20.495 94 HG2 ARG 10 HG2 ARG 10 20.561 9.988 -20.713 95 HG3 ARG 10 HG3 ARG 10 21.492 11.229 -21.553 96 HD2 ARG 10 HD2 ARG 10 22.150 12.126 -19.258 97 HD3 ARG 10 HD3 ARG 10 21.509 10.581 -18.611 98 HE ARG 10 HE ARG 10 23.352 10.102 -20.779 99 HH11 ARG 10 HH11 ARG 10 23.478 11.239 -17.459 100 HH12 ARG 10 HH12 ARG 10 25.064 10.547 -17.198 101 HH21 ARG 10 HH21 ARG 10 25.364 9.153 -20.291 102 HH22 ARG 10 HH22 ARG 10 26.107 9.585 -18.739 103 H ASN 11 H ASN 11 18.191 10.451 -17.368 104 HA ASN 11 HA ASN 11 17.498 8.340 -16.826 105 HB2 ASN 11 HB2 ASN 11 15.519 9.683 -17.243 106 HB3 ASN 11 HB3 ASN 11 15.425 9.124 -18.900 107 HD21 ASN 11 HD22 ASN 11 15.735 7.313 -15.657 108 HD22 ASN 11 HD21 ASN 11 14.383 6.279 -16.104 109 H SER 12 H SER 12 19.587 8.242 -18.833 110 HA SER 12 HA SER 12 19.129 5.716 -20.269 111 HB2 SER 12 HB2 SER 12 21.608 6.092 -20.754 112 HB3 SER 12 HB3 SER 12 20.545 7.421 -21.255 113 HG SER 12 HG SER 12 22.454 8.051 -19.962 114 H CYS 13 H CYS 13 20.661 6.882 -17.316 115 HA CYS 13 HA CYS 13 21.349 4.134 -16.377 116 HB2 CYS 13 HB2 CYS 13 23.686 4.990 -15.902 117 HB3 CYS 13 HB3 CYS 13 23.279 4.979 -17.616 118 HG CYS 13 HG CYS 13 22.708 7.479 -17.892 119 H ARG 14 H ARG 14 22.356 4.421 -14.033 120 HA ARG 14 HA ARG 14 21.760 4.571 -11.834 121 HB2 ARG 14 HB2 ARG 14 21.425 7.514 -12.584 122 HB3 ARG 14 HB3 ARG 14 21.416 6.887 -10.922 123 HG2 ARG 14 HG2 ARG 14 23.680 5.908 -11.349 124 HG3 ARG 14 HG3 ARG 14 23.717 6.753 -12.906 125 HD2 ARG 14 HD2 ARG 14 23.427 8.038 -10.147 126 HD3 ARG 14 HD3 ARG 14 24.917 7.984 -11.080 127 HE ARG 14 HE ARG 14 22.562 9.724 -11.533 128 HH11 ARG 14 HH11 ARG 14 25.755 8.878 -12.753 129 HH12 ARG 14 HH12 ARG 14 25.552 9.938 -14.151 130 HH21 ARG 14 HH21 ARG 14 22.564 11.212 -13.102 131 HH22 ARG 14 HH22 ARG 14 23.942 11.374 -14.184 132 H SER 15 H SER 15 19.306 6.845 -12.928 133 HA SER 15 HA SER 15 17.177 5.990 -11.300 134 HB2 SER 15 HB2 SER 15 15.727 7.095 -13.011 135 HB3 SER 15 HB3 SER 15 17.132 8.047 -12.600 136 HG SER 15 HG SER 15 18.172 7.170 -14.597 137 H GLN 16 H GLN 16 17.986 4.732 -14.533 138 HA GLN 16 HA GLN 16 15.818 2.848 -14.700 139 HB2 GLN 16 HB2 GLN 16 18.575 2.866 -16.023 140 HB3 GLN 16 HB3 GLN 16 17.266 1.792 -16.494 141 HG2 GLN 16 HG2 GLN 16 17.044 4.846 -16.602 142 HG3 GLN 16 HG3 GLN 16 17.576 3.841 -17.943 143 HE21 GLN 16 HE22 GLN 16 15.541 5.302 -18.623 144 HE22 GLN 16 HE21 GLN 16 14.034 4.388 -18.629 145 H MET 17 H MET 17 19.106 2.493 -13.316 146 HA MET 17 HA MET 17 18.798 -0.319 -12.570 147 HB2 MET 17 HB2 MET 17 20.688 1.903 -11.667 148 HB3 MET 17 HB3 MET 17 20.653 0.334 -10.891 149 HG2 MET 17 HG2 MET 17 21.242 -0.786 -12.992 150 HG3 MET 17 HG3 MET 17 21.324 0.785 -13.817 151 HE1 MET 17 HE1 MET 17 25.051 -0.742 -13.087 152 HE2 MET 17 HE2 MET 17 23.569 -1.730 -13.123 153 HE3 MET 17 HE3 MET 17 23.829 -0.487 -14.366 154 H ALA 18 H ALA 18 18.156 2.803 -10.888 155 HA ALA 18 HA ALA 18 17.528 1.666 -8.351 156 HB1 ALA 18 HB1 ALA 18 16.504 3.798 -7.878 157 HB2 ALA 18 HB2 ALA 18 17.930 4.107 -8.893 158 HB3 ALA 18 HB3 ALA 18 16.310 4.161 -9.610 159 H GLU 19 H GLU 19 15.403 2.309 -11.157 160 HA GLU 19 HA GLU 19 13.033 1.108 -10.081 161 HB2 GLU 19 HB2 GLU 19 13.236 2.568 -12.102 162 HB3 GLU 19 HB3 GLU 19 13.975 1.219 -12.978 163 HG2 GLU 19 HG2 GLU 19 11.903 -0.118 -12.602 164 HG3 GLU 19 HG3 GLU 19 11.183 1.259 -11.754 165 H GLY 20 H GLY 20 15.794 -0.386 -11.863 166 HA2 GLY 20 HA2 GLY 20 14.850 -3.056 -11.982 167 HA3 GLY 20 HA3 GLY 20 16.533 -2.548 -11.950 168 H PHE 21 H PHE 21 16.893 -1.569 -9.427 169 HA PHE 21 HA PHE 21 16.938 -3.954 -7.778 170 HB2 PHE 21 HB2 PHE 21 17.440 -1.020 -7.121 171 HB3 PHE 21 HB3 PHE 21 17.669 -2.325 -5.966 172 HD1 PHE 21 HD2 PHE 21 19.086 -4.424 -6.992 173 HD2 PHE 21 HD1 PHE 21 19.404 -0.299 -8.193 174 HE1 PHE 21 HE2 PHE 21 21.351 -4.864 -7.894 175 HE2 PHE 21 HE1 PHE 21 21.685 -0.737 -9.074 176 HZ PHE 21 HZ PHE 21 22.633 -3.032 -8.958 177 H ALA 22 H ALA 22 14.881 -1.003 -7.607 178 HA ALA 22 HA ALA 22 13.382 -1.959 -5.366 179 HB1 ALA 22 HB1 ALA 22 11.875 -0.103 -5.910 180 HB2 ALA 22 HB2 ALA 22 13.559 0.419 -6.081 181 HB3 ALA 22 HB3 ALA 22 12.624 0.046 -7.535 182 H LYS 23 H LYS 23 12.622 -2.305 -8.885 183 HA LYS 23 HA LYS 23 10.056 -3.503 -8.477 184 HB2 LYS 23 HB2 LYS 23 10.070 -3.983 -10.772 185 HB3 LYS 23 HB3 LYS 23 11.068 -2.529 -10.584 186 HG2 LYS 23 HG2 LYS 23 13.078 -3.989 -10.678 187 HG3 LYS 23 HG3 LYS 23 12.067 -5.364 -11.099 188 HD2 LYS 23 HD2 LYS 23 12.186 -2.754 -12.685 189 HD3 LYS 23 HD3 LYS 23 13.235 -4.117 -13.026 190 HE2 LYS 23 HE2 LYS 23 10.208 -4.408 -13.070 191 HE3 LYS 23 HE3 LYS 23 11.120 -3.814 -14.460 192 HZ1 LYS 23 HZ1 LYS 23 12.421 -5.881 -14.464 193 HZ2 LYS 23 HZ2 LYS 23 11.558 -6.482 -13.194 194 HZ3 LYS 23 HZ3 LYS 23 10.820 -6.210 -14.623 195 H THR 24 H THR 24 13.176 -4.864 -8.240 196 HA THR 24 HA THR 24 12.244 -7.676 -8.034 197 HB THR 24 HB THR 24 15.036 -6.617 -7.522 198 HG1 THR 24 HG1 THR 24 14.722 -6.048 -9.581 199 HG21 THR 24 HG21 THR 24 14.603 -8.972 -6.800 200 HG22 THR 24 HG22 THR 24 14.010 -9.351 -8.434 201 HG23 THR 24 HG23 THR 24 15.706 -8.905 -8.167 202 H LEU 25 H LEU 25 13.893 -5.328 -5.838 203 HA LEU 25 HA LEU 25 13.807 -7.208 -3.609 204 HB2 LEU 25 HB2 LEU 25 14.688 -4.292 -3.747 205 HB3 LEU 25 HB3 LEU 25 15.043 -5.380 -2.417 206 HG LEU 25 HG LEU 25 16.015 -5.835 -5.283 207 HD11 LEU 25 HD11 LEU 25 17.654 -4.919 -2.937 208 HD12 LEU 25 HD12 LEU 25 18.100 -4.950 -4.656 209 HD13 LEU 25 HD13 LEU 25 16.917 -3.759 -4.062 210 HD21 LEU 25 HD21 LEU 25 15.915 -7.929 -4.021 211 HD22 LEU 25 HD22 LEU 25 17.593 -7.412 -4.231 212 HD23 LEU 25 HD23 LEU 25 16.778 -7.174 -2.665 213 H GLY 26 H GLY 26 11.879 -4.449 -4.601 214 HA2 GLY 26 HA2 GLY 26 10.178 -4.548 -2.168 215 HA3 GLY 26 HA3 GLY 26 10.237 -3.300 -3.419 216 H ALA 27 H ALA 27 10.228 -6.477 -4.719 217 HA ALA 27 HA ALA 27 8.031 -6.036 -6.342 218 HB1 ALA 27 HB1 ALA 27 9.759 -7.774 -6.717 219 HB2 ALA 27 HB2 ALA 27 9.118 -8.720 -5.364 220 HB3 ALA 27 HB3 ALA 27 8.138 -8.463 -6.822 221 H GLY 28 H GLY 28 5.961 -5.597 -5.789 222 HA2 GLY 28 HA2 GLY 28 3.783 -6.287 -5.302 223 HA3 GLY 28 HA3 GLY 28 4.388 -7.677 -4.398 224 H LYS 29 H LYS 29 6.154 -5.310 -3.108 225 HA LYS 29 HA LYS 29 4.088 -4.329 -1.168 226 HB2 LYS 29 HB2 LYS 29 5.991 -3.795 0.321 227 HB3 LYS 29 HB3 LYS 29 5.651 -5.522 0.082 228 HG2 LYS 29 HG2 LYS 29 7.540 -5.550 -1.614 229 HG3 LYS 29 HG3 LYS 29 7.954 -3.910 -1.086 230 HD2 LYS 29 HD2 LYS 29 7.910 -6.456 0.607 231 HD3 LYS 29 HD3 LYS 29 9.354 -5.725 -0.103 232 HE2 LYS 29 HE2 LYS 29 9.029 -3.686 1.272 233 HE3 LYS 29 HE3 LYS 29 7.538 -4.372 1.952 234 HZ1 LYS 29 HZ1 LYS 29 9.409 -4.724 3.464 235 HZ2 LYS 29 HZ2 LYS 29 8.874 -6.170 2.933 236 HZ3 LYS 29 HZ3 LYS 29 10.256 -5.544 2.331 237 H ILE 30 H ILE 30 6.470 -3.262 -3.518 238 HA ILE 30 HA ILE 30 5.146 -0.635 -3.280 239 HB ILE 30 HB ILE 30 7.237 0.579 -3.806 240 HG12 ILE 30 HG12 ILE 30 9.400 -0.348 -3.445 241 HG13 ILE 30 HG13 ILE 30 8.740 -1.930 -3.045 242 HG21 ILE 30 HG21 ILE 30 7.391 -1.122 -1.278 243 HG22 ILE 30 HG22 ILE 30 8.200 0.419 -1.560 244 HG23 ILE 30 HG23 ILE 30 6.426 0.366 -1.478 245 HD11 ILE 30 HD11 ILE 30 8.236 -2.390 -5.342 246 HD12 ILE 30 HD12 ILE 30 8.469 -0.685 -5.812 247 HD13 ILE 30 HD13 ILE 30 9.850 -1.673 -5.311 248 H ALA 31 H ALA 31 5.578 0.776 -5.291 249 HA ALA 31 HA ALA 31 5.933 -0.826 -7.758 250 HB1 ALA 31 HB1 ALA 31 3.662 1.166 -7.368 251 HB2 ALA 31 HB2 ALA 31 4.072 0.319 -8.872 252 HB3 ALA 31 HB3 ALA 31 3.496 -0.600 -7.466 253 H VAL 32 H VAL 32 7.082 0.296 -9.415 254 HA VAL 32 HA VAL 32 8.144 2.964 -8.697 255 HB VAL 32 HB VAL 32 10.348 1.867 -9.494 256 HG11 VAL 32 HG11 VAL 32 9.234 1.289 -6.724 257 HG12 VAL 32 HG12 VAL 32 10.944 1.524 -7.163 258 HG13 VAL 32 HG13 VAL 32 9.825 2.859 -7.305 259 HG21 VAL 32 HG21 VAL 32 9.424 -0.372 -10.068 260 HG22 VAL 32 HG22 VAL 32 10.777 -0.407 -8.935 261 HG23 VAL 32 HG23 VAL 32 9.128 -0.650 -8.332 262 H THR 33 H THR 33 9.105 4.164 -10.177 263 HA THR 33 HA THR 33 9.014 3.438 -13.062 264 HB THR 33 HB THR 33 7.870 6.035 -11.962 265 HG1 THR 33 HG1 THR 33 5.821 5.151 -12.384 266 HG21 THR 33 HG21 THR 33 7.546 4.679 -14.683 267 HG22 THR 33 HG22 THR 33 6.798 6.214 -14.179 268 HG23 THR 33 HG23 THR 33 8.548 6.108 -14.361 269 H SER 34 H SER 34 10.587 4.681 -14.308 270 HA SER 34 HA SER 34 12.089 6.770 -12.807 271 HB2 SER 34 HB2 SER 34 14.137 6.143 -13.845 272 HB3 SER 34 HB3 SER 34 13.495 4.758 -12.954 273 HG SER 34 HG SER 34 12.852 3.835 -14.850 274 H CYS 35 H CYS 35 12.954 8.477 -13.980 275 HA CYS 35 HA CYS 35 12.273 8.866 -16.784 276 HB2 CYS 35 HB2 CYS 35 10.780 10.717 -16.487 277 HB3 CYS 35 HB3 CYS 35 10.150 9.352 -15.544 278 HG CYS 35 HG CYS 35 11.033 10.113 -13.233 279 H GLY 36 H GLY 36 12.875 11.362 -17.298 280 HA2 GLY 36 HA2 GLY 36 14.812 12.464 -15.363 281 HA3 GLY 36 HA3 GLY 36 15.456 12.103 -16.978 282 H LEU 37 H LEU 37 15.642 14.662 -16.101 283 HA LEU 37 HA LEU 37 13.311 16.225 -16.925 284 HB2 LEU 37 HB2 LEU 37 14.866 18.179 -16.892 285 HB3 LEU 37 HB3 LEU 37 14.501 17.390 -15.380 286 HG LEU 37 HG LEU 37 17.001 16.468 -16.794 287 HD11 LEU 37 HD11 LEU 37 17.161 18.926 -17.003 288 HD12 LEU 37 HD12 LEU 37 16.805 19.104 -15.268 289 HD13 LEU 37 HD13 LEU 37 18.310 18.317 -15.800 290 HD21 LEU 37 HD21 LEU 37 17.816 16.338 -14.461 291 HD22 LEU 37 HD22 LEU 37 16.311 17.096 -13.889 292 HD23 LEU 37 HD23 LEU 37 16.282 15.488 -14.599 293 H GLU 38 H GLU 38 15.550 14.529 -18.624 294 HA GLU 38 HA GLU 38 14.327 15.298 -21.145 295 HB2 GLU 38 HB2 GLU 38 16.418 15.553 -22.401 296 HB3 GLU 38 HB3 GLU 38 16.182 16.851 -21.234 297 HG2 GLU 38 HG2 GLU 38 17.771 15.815 -19.689 298 HG3 GLU 38 HG3 GLU 38 18.019 14.462 -20.815 299 H SER 39 H SER 39 15.201 13.639 -22.905 300 HA SER 39 HA SER 39 15.573 10.974 -21.591 301 HB2 SER 39 HB2 SER 39 14.069 10.044 -23.318 302 HB3 SER 39 HB3 SER 39 13.279 11.139 -22.173 303 HG SER 39 HG SER 39 12.671 11.532 -24.394 304 H SER 40 H SER 40 17.024 9.648 -22.408 305 HA SER 40 HA SER 40 18.309 10.159 -25.076 306 HB2 SER 40 HB2 SER 40 19.791 10.631 -23.214 307 HB3 SER 40 HB3 SER 40 19.443 9.050 -22.491 308 HG SER 40 HG SER 40 20.945 9.670 -24.829 309 H ARG 41 H ARG 41 19.512 7.376 -24.160 310 HA ARG 41 HA ARG 41 17.277 5.564 -24.949 311 HB2 ARG 41 HB2 ARG 41 18.715 4.216 -26.235 312 HB3 ARG 41 HB3 ARG 41 19.027 5.858 -26.767 313 HG2 ARG 41 HG2 ARG 41 20.807 4.140 -24.984 314 HG3 ARG 41 HG3 ARG 41 21.069 4.545 -26.675 315 HD2 ARG 41 HD2 ARG 41 21.358 6.950 -26.040 316 HD3 ARG 41 HD3 ARG 41 21.151 6.484 -24.339 317 HE ARG 41 HE ARG 41 23.288 5.120 -25.856 318 HH11 ARG 41 HH11 ARG 41 22.664 7.762 -23.602 319 HH12 ARG 41 HH12 ARG 41 24.265 7.590 -22.873 320 HH21 ARG 41 HH21 ARG 41 25.324 5.110 -24.949 321 HH22 ARG 41 HH22 ARG 41 25.698 6.185 -23.620 322 H VAL 42 H VAL 42 17.136 3.620 -23.710 323 HA VAL 42 HA VAL 42 18.379 3.677 -21.108 324 HB VAL 42 HB VAL 42 16.280 2.204 -22.179 325 HG11 VAL 42 HG11 VAL 42 16.695 -0.126 -21.794 326 HG12 VAL 42 HG12 VAL 42 17.734 0.454 -23.111 327 HG13 VAL 42 HG13 VAL 42 18.418 0.195 -21.483 328 HG21 VAL 42 HG21 VAL 42 16.116 1.304 -19.921 329 HG22 VAL 42 HG22 VAL 42 17.805 1.784 -19.605 330 HG23 VAL 42 HG23 VAL 42 16.540 3.026 -19.939 331 H HIS 43 H HIS 43 20.365 2.973 -20.413 332 HA HIS 43 HA HIS 43 22.273 2.618 -22.530 333 HB2 HIS 43 HB2 HIS 43 22.607 3.844 -20.331 334 HB3 HIS 43 HB3 HIS 43 22.808 2.269 -19.556 335 HD2 HIS 43 HD2 HIS 43 24.557 4.833 -21.681 336 HE1 HIS 43 HE1 HIS 43 27.221 1.522 -21.596 337 HE2 HIS 43 HE2 HIS 43 26.936 3.946 -22.329 338 HA PRO 44 HA PRO 44 21.754 -1.691 -22.811 339 HB2 PRO 44 HB2 PRO 44 23.794 -2.479 -24.482 340 HB3 PRO 44 HB3 PRO 44 22.414 -1.459 -25.016 341 HG2 PRO 44 HG2 PRO 44 25.175 -0.522 -24.143 342 HG3 PRO 44 HG3 PRO 44 24.277 -0.088 -25.634 343 HD2 PRO 44 HD2 PRO 44 24.222 1.496 -23.429 344 HD3 PRO 44 HD3 PRO 44 22.756 1.272 -24.438 345 H THR 45 H THR 45 24.911 -0.483 -21.676 346 HA THR 45 HA THR 45 25.742 -3.012 -20.505 347 HB THR 45 HB THR 45 26.717 -0.233 -19.817 348 HG1 THR 45 HG1 THR 45 27.657 -2.029 -21.824 349 HG21 THR 45 HG21 THR 45 27.962 -3.007 -19.568 350 HG22 THR 45 HG22 THR 45 28.852 -1.465 -19.370 351 HG23 THR 45 HG23 THR 45 27.552 -1.881 -18.255 352 H ALA 46 H ALA 46 23.733 -0.297 -19.356 353 HA ALA 46 HA ALA 46 23.692 -0.956 -16.592 354 HB1 ALA 46 HB1 ALA 46 21.375 0.027 -18.342 355 HB2 ALA 46 HB2 ALA 46 21.514 0.200 -16.578 356 HB3 ALA 46 HB3 ALA 46 22.642 1.073 -17.631 357 H ILE 47 H ILE 47 21.669 -2.217 -19.255 358 HA ILE 47 HA ILE 47 20.120 -4.089 -17.719 359 HB ILE 47 HB ILE 47 21.005 -4.094 -20.623 360 HG12 ILE 47 HG12 ILE 47 18.143 -3.579 -19.929 361 HG13 ILE 47 HG13 ILE 47 19.240 -2.303 -19.406 362 HG21 ILE 47 HG21 ILE 47 18.898 -5.818 -19.261 363 HG22 ILE 47 HG22 ILE 47 19.100 -5.660 -21.022 364 HG23 ILE 47 HG23 ILE 47 20.389 -6.371 -20.051 365 HD11 ILE 47 HD11 ILE 47 19.378 -3.356 -22.238 366 HD12 ILE 47 HD12 ILE 47 18.236 -2.096 -21.736 367 HD13 ILE 47 HD13 ILE 47 19.981 -1.821 -21.534 368 H ALA 48 H ALA 48 23.251 -4.505 -19.471 369 HA ALA 48 HA ALA 48 23.597 -7.260 -18.838 370 HB1 ALA 48 HB1 ALA 48 25.933 -6.882 -19.407 371 HB2 ALA 48 HB2 ALA 48 24.881 -6.018 -20.550 372 HB3 ALA 48 HB3 ALA 48 25.725 -5.127 -19.255 373 H MET 49 H MET 49 24.541 -4.359 -17.031 374 HA MET 49 HA MET 49 25.915 -5.765 -14.899 375 HB2 MET 49 HB2 MET 49 24.884 -2.919 -15.111 376 HB3 MET 49 HB3 MET 49 25.974 -3.503 -13.843 377 HG2 MET 49 HG2 MET 49 26.777 -3.893 -16.729 378 HG3 MET 49 HG3 MET 49 26.854 -2.297 -16.013 379 HE1 MET 49 HE1 MET 49 27.986 -6.108 -15.308 380 HE2 MET 49 HE2 MET 49 28.666 -5.420 -16.794 381 HE3 MET 49 HE3 MET 49 29.727 -5.779 -15.418 382 H MET 50 H MET 50 22.563 -4.868 -15.405 383 HA MET 50 HA MET 50 21.723 -5.583 -12.675 384 HB2 MET 50 HB2 MET 50 20.214 -5.144 -15.292 385 HB3 MET 50 HB3 MET 50 19.427 -5.532 -13.771 386 HG2 MET 50 HG2 MET 50 21.278 -3.218 -13.576 387 HG3 MET 50 HG3 MET 50 19.967 -2.996 -14.716 388 HE1 MET 50 HE1 MET 50 19.984 -5.022 -11.278 389 HE2 MET 50 HE2 MET 50 20.977 -3.570 -11.012 390 HE3 MET 50 HE3 MET 50 19.405 -3.730 -10.201 391 H GLU 51 H GLU 51 21.948 -7.246 -15.881 392 HA GLU 51 HA GLU 51 20.704 -9.643 -14.967 393 HB2 GLU 51 HB2 GLU 51 22.594 -9.051 -17.271 394 HB3 GLU 51 HB3 GLU 51 21.982 -10.675 -16.954 395 HG2 GLU 51 HG2 GLU 51 19.652 -9.847 -17.098 396 HG3 GLU 51 HG3 GLU 51 20.240 -8.251 -17.540 397 H GLU 52 H GLU 52 24.087 -8.575 -14.573 398 HA GLU 52 HA GLU 52 25.217 -11.065 -13.754 399 HB2 GLU 52 HB2 GLU 52 25.734 -8.333 -12.542 400 HB3 GLU 52 HB3 GLU 52 26.750 -9.765 -12.360 401 HG2 GLU 52 HG2 GLU 52 26.900 -9.670 -14.983 402 HG3 GLU 52 HG3 GLU 52 26.412 -7.978 -14.748 403 H VAL 53 H VAL 53 22.965 -8.964 -12.030 404 HA VAL 53 HA VAL 53 23.073 -10.722 -9.615 405 HB VAL 53 HB VAL 53 21.933 -8.929 -8.394 406 HG11 VAL 53 HG11 VAL 53 23.856 -7.448 -8.174 407 HG12 VAL 53 HG12 VAL 53 24.392 -9.127 -8.338 408 HG13 VAL 53 HG13 VAL 53 24.516 -8.016 -9.722 409 HG21 VAL 53 HG21 VAL 53 22.465 -7.142 -10.811 410 HG22 VAL 53 HG22 VAL 53 20.861 -7.743 -10.335 411 HG23 VAL 53 HG23 VAL 53 21.763 -6.673 -9.259 412 H GLY 54 H GLY 54 21.627 -11.009 -12.351 413 HA2 GLY 54 HA2 GLY 54 19.812 -12.195 -13.033 414 HA3 GLY 54 HA3 GLY 54 19.405 -12.507 -11.340 415 H ILE 55 H ILE 55 19.606 -9.175 -12.454 416 HA ILE 55 HA ILE 55 16.654 -8.870 -12.145 417 HB ILE 55 HB ILE 55 18.966 -6.949 -11.770 418 HG12 ILE 55 HG12 ILE 55 16.874 -8.146 -9.919 419 HG13 ILE 55 HG13 ILE 55 18.590 -8.517 -9.922 420 HG21 ILE 55 HG21 ILE 55 17.320 -5.226 -11.171 421 HG22 ILE 55 HG22 ILE 55 17.111 -5.702 -12.837 422 HG23 ILE 55 HG23 ILE 55 15.984 -6.318 -11.603 423 HD11 ILE 55 HD11 ILE 55 17.303 -5.922 -9.014 424 HD12 ILE 55 HD12 ILE 55 18.161 -7.117 -8.044 425 HD13 ILE 55 HD13 ILE 55 19.059 -6.142 -9.221 426 H ASP 56 H ASP 56 15.423 -7.998 -13.717 427 HA ASP 56 HA ASP 56 16.710 -7.479 -16.368 428 HB2 ASP 56 HB2 ASP 56 15.412 -9.506 -16.378 429 HB3 ASP 56 HB3 ASP 56 14.015 -8.672 -15.697 430 H ILE 57 H ILE 57 16.711 -5.477 -16.972 431 HA ILE 57 HA ILE 57 14.311 -3.758 -16.520 432 HB ILE 57 HB ILE 57 15.707 -1.777 -16.524 433 HG12 ILE 57 HG12 ILE 57 18.167 -3.548 -16.281 434 HG13 ILE 57 HG13 ILE 57 17.649 -2.802 -17.794 435 HG21 ILE 57 HG21 ILE 57 16.504 -1.956 -14.253 436 HG22 ILE 57 HG22 ILE 57 15.051 -2.949 -14.403 437 HG23 ILE 57 HG23 ILE 57 16.647 -3.726 -14.377 438 HD11 ILE 57 HD11 ILE 57 19.380 -1.445 -16.758 439 HD12 ILE 57 HD12 ILE 57 17.850 -0.552 -16.802 440 HD13 ILE 57 HD13 ILE 57 18.422 -1.271 -15.277 441 H SER 58 H SER 58 15.337 -5.641 -18.827 442 HA SER 58 HA SER 58 16.033 -3.914 -21.016 443 HB2 SER 58 HB2 SER 58 15.698 -5.887 -22.419 444 HB3 SER 58 HB3 SER 58 16.630 -6.282 -20.966 445 HG SER 58 HG SER 58 14.855 -7.217 -20.047 446 H GLY 59 H GLY 59 12.898 -4.701 -19.694 447 HA2 GLY 59 HA2 GLY 59 11.338 -3.824 -21.994 448 HA3 GLY 59 HA3 GLY 59 10.760 -4.136 -20.357 449 H GLN 60 H GLN 60 13.287 -1.944 -19.974 450 HA GLN 60 HA GLN 60 11.403 0.345 -19.778 451 HB2 GLN 60 HB2 GLN 60 14.126 -0.192 -18.537 452 HB3 GLN 60 HB3 GLN 60 13.274 1.344 -18.449 453 HG2 GLN 60 HG2 GLN 60 11.597 0.568 -17.062 454 HG3 GLN 60 HG3 GLN 60 11.799 -1.113 -17.543 455 HE21 GLN 60 HE22 GLN 60 14.199 1.285 -16.181 456 HE22 GLN 60 HE21 GLN 60 14.666 0.202 -14.871 457 H THR 61 H THR 61 12.216 2.477 -20.425 458 HA THR 61 HA THR 61 14.212 2.709 -22.497 459 HB THR 61 HB THR 61 12.632 3.941 -23.992 460 HG1 THR 61 HG1 THR 61 10.589 2.534 -22.614 461 HG21 THR 61 HG21 THR 61 13.352 1.663 -24.596 462 HG22 THR 61 HG22 THR 61 11.952 0.985 -23.738 463 HG23 THR 61 HG23 THR 61 11.713 2.017 -25.159 464 H SER 62 H SER 62 14.457 5.163 -22.894 465 HA SER 62 HA SER 62 14.283 6.478 -20.303 466 HB2 SER 62 HB2 SER 62 15.138 7.489 -22.976 467 HB3 SER 62 HB3 SER 62 15.447 8.270 -21.390 468 HG SER 62 HG SER 62 16.722 6.412 -20.853 469 H ASP 63 H ASP 63 12.808 7.930 -19.642 470 HA ASP 63 HA ASP 63 10.968 9.210 -21.643 471 HB2 ASP 63 HB2 ASP 63 10.174 7.697 -19.155 472 HB3 ASP 63 HB3 ASP 63 9.127 8.905 -19.900 473 HA PRO 64 HA PRO 64 11.791 12.876 -19.405 474 HB2 PRO 64 HB2 PRO 64 10.145 14.666 -20.581 475 HB3 PRO 64 HB3 PRO 64 11.406 13.790 -21.504 476 HG2 PRO 64 HG2 PRO 64 8.459 13.095 -21.273 477 HG3 PRO 64 HG3 PRO 64 9.445 13.231 -22.761 478 HD2 PRO 64 HD2 PRO 64 8.964 10.833 -21.496 479 HD3 PRO 64 HD3 PRO 64 10.478 11.176 -22.382 480 H ILE 65 H ILE 65 11.269 14.071 -17.627 481 HA ILE 65 HA ILE 65 9.280 13.372 -15.798 482 HB ILE 65 HB ILE 65 11.495 14.588 -15.495 483 HG12 ILE 65 HG12 ILE 65 9.060 15.614 -14.050 484 HG13 ILE 65 HG13 ILE 65 10.006 14.154 -13.672 485 HG21 ILE 65 HG21 ILE 65 11.047 16.497 -17.121 486 HG22 ILE 65 HG22 ILE 65 9.901 17.150 -15.920 487 HG23 ILE 65 HG23 ILE 65 11.613 17.000 -15.521 488 HD11 ILE 65 HD11 ILE 65 10.775 17.055 -13.306 489 HD12 ILE 65 HD12 ILE 65 10.738 15.759 -12.105 490 HD13 ILE 65 HD13 ILE 65 12.003 15.763 -13.350 491 H GLU 66 H GLU 66 9.187 15.871 -18.293 492 HA GLU 66 HA GLU 66 6.912 17.306 -17.488 493 HB2 GLU 66 HB2 GLU 66 7.868 16.728 -20.327 494 HB3 GLU 66 HB3 GLU 66 6.749 18.013 -19.855 495 HG2 GLU 66 HG2 GLU 66 8.543 18.966 -18.368 496 HG3 GLU 66 HG3 GLU 66 9.668 17.765 -19.013 497 H ASN 67 H ASN 67 6.911 14.095 -18.937 498 HA ASN 67 HA ASN 67 4.021 14.278 -19.575 499 HB2 ASN 67 HB2 ASN 67 4.342 12.637 -21.032 500 HB3 ASN 67 HB3 ASN 67 6.056 12.976 -20.875 501 HD21 ASN 67 HD22 ASN 67 7.116 11.653 -18.875 502 HD22 ASN 67 HD21 ASN 67 6.466 10.051 -18.638 503 H PHE 68 H PHE 68 5.787 13.574 -16.775 504 HA PHE 68 HA PHE 68 3.986 11.400 -15.854 505 HB2 PHE 68 HB2 PHE 68 6.745 12.340 -15.064 506 HB3 PHE 68 HB3 PHE 68 5.831 11.246 -14.058 507 HD1 PHE 68 HD1 PHE 68 4.614 9.240 -15.618 508 HD2 PHE 68 HD2 PHE 68 8.385 11.214 -16.308 509 HE1 PHE 68 HE1 PHE 68 5.396 7.287 -16.916 510 HE2 PHE 68 HE2 PHE 68 9.156 9.250 -17.616 511 HZ PHE 68 HZ PHE 68 7.672 7.285 -17.922 512 H ASN 69 H ASN 69 3.677 11.324 -13.425 513 HA ASN 69 HA ASN 69 2.338 13.885 -12.620 514 HB2 ASN 69 HB2 ASN 69 0.533 12.333 -11.731 515 HB3 ASN 69 HB3 ASN 69 0.665 12.524 -13.472 516 HD21 ASN 69 HD22 ASN 69 1.964 10.282 -10.930 517 HD22 ASN 69 HD21 ASN 69 1.621 8.839 -11.875 518 H ALA 70 H ALA 70 4.034 14.551 -11.230 519 HA ALA 70 HA ALA 70 5.303 13.148 -9.222 520 HB1 ALA 70 HB1 ALA 70 5.499 15.321 -8.044 521 HB2 ALA 70 HB2 ALA 70 5.803 15.487 -9.788 522 HB3 ALA 70 HB3 ALA 70 4.246 16.002 -9.100 523 H ASP 71 H ASP 71 2.007 14.430 -9.119 524 HA ASP 71 HA ASP 71 1.485 14.400 -6.355 525 HB2 ASP 71 HB2 ASP 71 0.135 15.479 -8.160 526 HB3 ASP 71 HB3 ASP 71 -0.400 13.878 -8.686 527 H ASP 72 H ASP 72 1.556 11.664 -8.568 528 HA ASP 72 HA ASP 72 0.182 9.872 -6.649 529 HB2 ASP 72 HB2 ASP 72 -0.129 9.704 -9.165 530 HB3 ASP 72 HB3 ASP 72 1.560 9.172 -9.247 531 H TYR 73 H TYR 73 3.486 10.763 -7.478 532 HA TYR 73 HA TYR 73 4.621 8.262 -6.472 533 HB2 TYR 73 HB2 TYR 73 6.062 10.785 -7.245 534 HB3 TYR 73 HB3 TYR 73 6.720 9.146 -7.143 535 HD1 TYR 73 HD1 TYR 73 4.542 7.658 -8.714 536 HD2 TYR 73 HD2 TYR 73 6.589 11.396 -9.425 537 HE1 TYR 73 HE1 TYR 73 3.992 7.507 -11.124 538 HE2 TYR 73 HE2 TYR 73 6.005 11.250 -11.828 539 HH TYR 73 HH TYR 73 4.106 8.529 -13.186 540 H ASP 74 H ASP 74 3.979 8.158 -4.353 541 HA ASP 74 HA ASP 74 4.028 10.009 -2.307 542 HB2 ASP 74 HB2 ASP 74 5.011 7.131 -2.151 543 HB3 ASP 74 HB3 ASP 74 4.431 8.097 -0.793 544 H VAL 75 H VAL 75 6.836 8.370 -3.723 545 HA VAL 75 HA VAL 75 8.608 10.289 -2.275 546 HB VAL 75 HB VAL 75 9.325 7.427 -2.946 547 HG11 VAL 75 HG11 VAL 75 10.880 9.661 -1.592 548 HG12 VAL 75 HG12 VAL 75 11.348 7.961 -1.525 549 HG13 VAL 75 HG13 VAL 75 11.293 8.795 -3.075 550 HG21 VAL 75 HG21 VAL 75 9.449 7.184 -0.434 551 HG22 VAL 75 HG22 VAL 75 8.568 8.725 -0.309 552 HG23 VAL 75 HG23 VAL 75 7.819 7.319 -1.094 553 H VAL 76 H VAL 76 10.045 11.366 -3.543 554 HA VAL 76 HA VAL 76 10.542 10.383 -6.335 555 HB VAL 76 HB VAL 76 10.060 13.211 -5.422 556 HG11 VAL 76 HG11 VAL 76 12.073 13.231 -6.907 557 HG12 VAL 76 HG12 VAL 76 11.156 12.332 -8.140 558 HG13 VAL 76 HG13 VAL 76 10.681 13.984 -7.652 559 HG21 VAL 76 HG21 VAL 76 8.413 13.181 -7.285 560 HG22 VAL 76 HG22 VAL 76 8.845 11.493 -7.639 561 HG23 VAL 76 HG23 VAL 76 8.057 11.922 -6.096 562 H ILE 77 H ILE 77 12.607 10.227 -6.925 563 HA ILE 77 HA ILE 77 14.735 11.200 -5.035 564 HB ILE 77 HB ILE 77 14.800 8.744 -6.796 565 HG12 ILE 77 HG12 ILE 77 13.107 8.286 -5.101 566 HG13 ILE 77 HG13 ILE 77 14.541 7.317 -4.847 567 HG21 ILE 77 HG21 ILE 77 16.760 8.125 -5.455 568 HG22 ILE 77 HG22 ILE 77 17.022 9.650 -6.287 569 HG23 ILE 77 HG23 ILE 77 16.653 9.653 -4.555 570 HD11 ILE 77 HD11 ILE 77 13.944 9.850 -3.263 571 HD12 ILE 77 HD12 ILE 77 13.536 8.211 -2.753 572 HD13 ILE 77 HD13 ILE 77 15.230 8.656 -2.956 573 H SER 78 H SER 78 16.339 12.401 -5.956 574 HA SER 78 HA SER 78 16.489 12.572 -8.945 575 HB2 SER 78 HB2 SER 78 16.144 14.720 -7.754 576 HB3 SER 78 HB3 SER 78 17.691 14.466 -6.909 577 HG SER 78 HG SER 78 18.019 15.688 -8.829 578 H LEU 79 H LEU 79 18.262 11.944 -9.969 579 HA LEU 79 HA LEU 79 20.723 11.106 -8.487 580 HB2 LEU 79 HB2 LEU 79 19.398 9.479 -10.707 581 HB3 LEU 79 HB3 LEU 79 20.851 9.093 -9.797 582 HG LEU 79 HG LEU 79 19.198 9.098 -7.697 583 HD11 LEU 79 HD11 LEU 79 17.130 9.760 -8.908 584 HD12 LEU 79 HD12 LEU 79 17.363 8.437 -10.056 585 HD13 LEU 79 HD13 LEU 79 17.004 8.105 -8.337 586 HD21 LEU 79 HD21 LEU 79 18.828 6.684 -8.064 587 HD22 LEU 79 HD22 LEU 79 19.273 6.867 -9.769 588 HD23 LEU 79 HD23 LEU 79 20.484 7.146 -8.486 589 H CYS 80 H CYS 80 20.551 13.562 -9.582 590 HA CYS 80 HA CYS 80 21.419 13.469 -12.441 591 HB2 CYS 80 HB2 CYS 80 20.522 15.773 -10.670 592 HB3 CYS 80 HB3 CYS 80 20.907 15.855 -12.400 593 HG CYS 80 HG CYS 80 18.444 14.409 -10.763 594 H GLY 81 H GLY 81 22.962 13.950 -9.350 595 HA2 GLY 81 HA2 GLY 81 25.226 14.383 -8.899 596 HA3 GLY 81 HA3 GLY 81 25.540 14.466 -10.633 597 H CYS 82 H CYS 82 23.417 16.386 -8.480 598 HA CYS 82 HA CYS 82 23.057 18.595 -8.212 599 HB2 CYS 82 HB2 CYS 82 25.541 18.421 -7.517 600 HB3 CYS 82 HB3 CYS 82 25.892 19.231 -9.050 601 HG CYS 82 HG CYS 82 25.947 20.981 -7.071 602 H GLY 83 H GLY 83 23.657 20.901 -9.590 603 HA2 GLY 83 HA2 GLY 83 23.104 22.103 -11.488 604 HA3 GLY 83 HA3 GLY 83 23.246 20.626 -12.451 605 H VAL 84 H VAL 84 21.071 20.047 -9.964 606 HA VAL 84 HA VAL 84 18.628 20.756 -11.513 607 HB VAL 84 HB VAL 84 19.374 17.918 -10.653 608 HG11 VAL 84 HG11 VAL 84 16.913 18.924 -12.158 609 HG12 VAL 84 HG12 VAL 84 17.317 17.227 -11.810 610 HG13 VAL 84 HG13 VAL 84 16.937 18.299 -10.483 611 HG21 VAL 84 HG21 VAL 84 19.295 17.407 -13.104 612 HG22 VAL 84 HG22 VAL 84 19.200 19.144 -13.436 613 HG23 VAL 84 HG23 VAL 84 20.636 18.442 -12.650 614 H ASN 85 H ASN 85 16.955 21.311 -10.158 615 HA ASN 85 HA ASN 85 16.984 20.228 -7.374 616 HB2 ASN 85 HB2 ASN 85 17.985 22.644 -7.810 617 HB3 ASN 85 HB3 ASN 85 16.291 23.129 -7.897 618 HD21 ASN 85 HD22 ASN 85 18.587 21.236 -5.841 619 HD22 ASN 85 HD21 ASN 85 17.881 21.777 -4.328 620 H LEU 86 H LEU 86 15.103 20.268 -10.074 621 HA LEU 86 HA LEU 86 12.841 20.166 -10.536 622 HB2 LEU 86 HB2 LEU 86 12.989 18.455 -8.036 623 HB3 LEU 86 HB3 LEU 86 11.713 18.418 -9.264 624 HG LEU 86 HG LEU 86 14.568 17.493 -9.617 625 HD11 LEU 86 HD11 LEU 86 11.942 15.972 -9.867 626 HD12 LEU 86 HD12 LEU 86 13.578 15.315 -9.692 627 HD13 LEU 86 HD13 LEU 86 12.781 16.106 -8.307 628 HD21 LEU 86 HD21 LEU 86 13.629 16.724 -11.866 629 HD22 LEU 86 HD22 LEU 86 12.211 17.753 -11.523 630 HD23 LEU 86 HD23 LEU 86 13.826 18.475 -11.730 631 HA PRO 87 HA PRO 87 11.536 23.383 -7.413 632 HB2 PRO 87 HB2 PRO 87 10.847 25.389 -9.217 633 HB3 PRO 87 HB3 PRO 87 12.437 25.170 -8.433 634 HG2 PRO 87 HG2 PRO 87 11.552 24.230 -11.174 635 HG3 PRO 87 HG3 PRO 87 13.070 25.072 -10.723 636 HD2 PRO 87 HD2 PRO 87 13.009 22.389 -11.036 637 HD3 PRO 87 HD3 PRO 87 13.961 23.122 -9.713 638 HA PRO 88 HA PRO 88 7.126 23.083 -9.157 639 HB2 PRO 88 HB2 PRO 88 6.983 20.516 -10.623 640 HB3 PRO 88 HB3 PRO 88 6.376 22.126 -11.102 641 HG2 PRO 88 HG2 PRO 88 8.520 20.908 -12.282 642 HG3 PRO 88 HG3 PRO 88 8.413 22.695 -12.083 643 HD2 PRO 88 HD2 PRO 88 9.875 20.683 -10.363 644 HD3 PRO 88 HD3 PRO 88 10.426 22.261 -11.001 645 H GLU 89 H GLU 89 5.381 20.849 -9.060 646 HA GLU 89 HA GLU 89 5.355 20.192 -6.314 647 HB2 GLU 89 HB2 GLU 89 3.620 18.497 -6.970 648 HB3 GLU 89 HB3 GLU 89 3.301 20.151 -7.447 649 HG2 GLU 89 HG2 GLU 89 4.649 18.393 -9.483 650 HG3 GLU 89 HG3 GLU 89 2.979 18.021 -9.068 651 H TRP 90 H TRP 90 7.388 18.780 -8.611 652 HA TRP 90 HA TRP 90 7.671 16.079 -7.850 653 HB2 TRP 90 HB2 TRP 90 9.507 18.124 -9.075 654 HB3 TRP 90 HB3 TRP 90 10.002 16.453 -8.777 655 HD1 TRP 90 HD1 TRP 90 7.611 18.485 -11.003 656 HE1 TRP 90 HE1 TRP 90 6.569 16.965 -12.774 657 HE3 TRP 90 HE3 TRP 90 9.759 14.067 -9.624 658 HZ2 TRP 90 HZ2 TRP 90 6.618 14.152 -13.474 659 HZ3 TRP 90 HZ3 TRP 90 9.444 12.054 -10.994 660 HH2 TRP 90 HH2 TRP 90 7.865 12.063 -12.907 661 H VAL 91 H VAL 91 8.734 18.869 -6.018 662 HA VAL 91 HA VAL 91 10.415 17.108 -4.257 663 HB VAL 91 HB VAL 91 11.384 19.215 -3.396 664 HG11 VAL 91 HG11 VAL 91 11.591 18.698 -6.353 665 HG12 VAL 91 HG12 VAL 91 12.717 19.699 -5.410 666 HG13 VAL 91 HG13 VAL 91 12.559 17.972 -5.054 667 HG21 VAL 91 HG21 VAL 91 9.442 20.753 -3.996 668 HG22 VAL 91 HG22 VAL 91 11.028 21.330 -4.537 669 HG23 VAL 91 HG23 VAL 91 9.919 20.597 -5.696 670 H THR 92 H THR 92 7.343 18.566 -4.186 671 HA THR 92 HA THR 92 7.344 18.722 -1.206 672 HB THR 92 HB THR 92 6.675 20.706 -2.465 673 HG1 THR 92 HG1 THR 92 4.912 21.145 -1.161 674 HG21 THR 92 HG21 THR 92 4.189 19.122 -3.225 675 HG22 THR 92 HG22 THR 92 4.496 20.850 -3.522 676 HG23 THR 92 HG23 THR 92 5.499 19.628 -4.313 677 H GLN 93 H GLN 93 7.241 16.236 -2.946 678 HA GLN 93 HA GLN 93 4.783 14.888 -2.096 679 HB2 GLN 93 HB2 GLN 93 7.388 13.765 -3.225 680 HB3 GLN 93 HB3 GLN 93 5.878 12.882 -2.971 681 HG2 GLN 93 HG2 GLN 93 6.441 15.081 -4.980 682 HG3 GLN 93 HG3 GLN 93 5.948 13.423 -5.294 683 HE21 GLN 93 HE22 GLN 93 4.786 16.475 -5.521 684 HE22 GLN 93 HE21 GLN 93 3.087 16.175 -5.141 685 H GLU 94 H GLU 94 5.378 12.631 -0.847 686 HA GLU 94 HA GLU 94 5.684 13.630 1.821 687 HB2 GLU 94 HB2 GLU 94 4.200 11.774 1.274 688 HB3 GLU 94 HB3 GLU 94 5.582 10.746 0.863 689 HG2 GLU 94 HG2 GLU 94 6.400 10.766 3.110 690 HG3 GLU 94 HG3 GLU 94 5.203 11.979 3.600 691 H ILE 95 H ILE 95 8.007 11.878 -0.233 692 HA ILE 95 HA ILE 95 10.155 12.912 1.537 693 HB ILE 95 HB ILE 95 10.237 10.068 0.481 694 HG12 ILE 95 HG12 ILE 95 9.759 10.996 3.339 695 HG13 ILE 95 HG13 ILE 95 8.607 10.158 2.292 696 HG21 ILE 95 HG21 ILE 95 12.315 9.867 1.803 697 HG22 ILE 95 HG22 ILE 95 12.469 11.159 0.634 698 HG23 ILE 95 HG23 ILE 95 12.151 11.549 2.338 699 HD11 ILE 95 HD11 ILE 95 10.254 8.218 2.202 700 HD12 ILE 95 HD12 ILE 95 11.102 9.007 3.554 701 HD13 ILE 95 HD13 ILE 95 9.416 8.502 3.741 702 H PHE 96 H PHE 96 11.842 13.766 0.447 703 HA PHE 96 HA PHE 96 12.253 13.032 -2.374 704 HB2 PHE 96 HB2 PHE 96 11.192 15.163 -2.567 705 HB3 PHE 96 HB3 PHE 96 12.237 15.862 -1.334 706 HD1 PHE 96 HD1 PHE 96 12.079 14.715 -4.904 707 HD2 PHE 96 HD2 PHE 96 14.554 16.463 -1.815 708 HE1 PHE 96 HE1 PHE 96 13.840 15.196 -6.561 709 HE2 PHE 96 HE2 PHE 96 16.271 17.014 -3.509 710 HZ PHE 96 HZ PHE 96 15.923 16.376 -5.887 711 H GLU 97 H GLU 97 14.340 12.603 -2.921 712 HA GLU 97 HA GLU 97 16.528 13.324 -1.040 713 HB2 GLU 97 HB2 GLU 97 16.192 10.530 -2.182 714 HB3 GLU 97 HB3 GLU 97 17.535 11.130 -1.213 715 HG2 GLU 97 HG2 GLU 97 15.957 11.475 0.711 716 HG3 GLU 97 HG3 GLU 97 14.671 10.742 -0.265 717 H ASP 98 H ASP 98 18.659 13.309 -2.018 718 HA ASP 98 HA ASP 98 18.742 13.202 -5.004 719 HB2 ASP 98 HB2 ASP 98 18.614 15.519 -4.406 720 HB3 ASP 98 HB3 ASP 98 19.872 15.332 -3.181 721 H TRP 99 H TRP 99 19.845 11.400 -5.389 722 HA TRP 99 HA TRP 99 22.167 10.589 -3.705 723 HB2 TRP 99 HB2 TRP 99 20.711 9.029 -5.858 724 HB3 TRP 99 HB3 TRP 99 21.917 8.414 -4.744 725 HD1 TRP 99 HD1 TRP 99 20.081 10.127 -2.309 726 HE1 TRP 99 HE1 TRP 99 18.056 8.853 -1.373 727 HE3 TRP 99 HE3 TRP 99 19.693 6.498 -5.891 728 HZ2 TRP 99 HZ2 TRP 99 16.437 6.604 -2.123 729 HZ3 TRP 99 HZ3 TRP 99 17.880 4.808 -5.775 730 HH2 TRP 99 HH2 TRP 99 16.252 4.840 -3.883 731 H GLN 100 H GLN 100 23.666 12.119 -4.460 732 HA GLN 100 HA GLN 100 24.298 12.319 -7.293 733 HB2 GLN 100 HB2 GLN 100 25.802 13.350 -4.847 734 HB3 GLN 100 HB3 GLN 100 26.145 13.759 -6.535 735 HG2 GLN 100 HG2 GLN 100 23.789 14.695 -6.713 736 HG3 GLN 100 HG3 GLN 100 23.586 14.395 -4.989 737 HE21 GLN 100 HE22 GLN 100 23.081 16.768 -5.112 738 HE22 GLN 100 HE21 GLN 100 24.447 17.878 -4.925 739 H LEU 101 H LEU 101 25.367 10.794 -8.384 740 HA LEU 101 HA LEU 101 27.628 9.235 -7.208 741 HB2 LEU 101 HB2 LEU 101 25.192 8.138 -8.665 742 HB3 LEU 101 HB3 LEU 101 26.659 7.213 -8.389 743 HG LEU 101 HG LEU 101 24.760 8.210 -6.225 744 HD11 LEU 101 HD11 LEU 101 25.364 5.425 -7.274 745 HD12 LEU 101 HD12 LEU 101 24.246 5.849 -5.950 746 HD13 LEU 101 HD13 LEU 101 23.895 6.380 -7.602 747 HD21 LEU 101 HD21 LEU 101 27.076 8.114 -5.347 748 HD22 LEU 101 HD22 LEU 101 26.106 6.788 -4.710 749 HD23 LEU 101 HD23 LEU 101 27.265 6.488 -6.030 750 H GLU 102 H GLU 102 28.739 7.956 -8.927 751 HA GLU 102 HA GLU 102 29.827 9.555 -10.976 752 HB2 GLU 102 HB2 GLU 102 29.771 6.552 -10.497 753 HB3 GLU 102 HB3 GLU 102 30.773 7.311 -11.717 754 HG2 GLU 102 HG2 GLU 102 32.107 6.775 -9.833 755 HG3 GLU 102 HG3 GLU 102 32.007 8.530 -9.988 756 H ASP 103 H ASP 103 29.955 8.853 -13.248 757 HA ASP 103 HA ASP 103 27.258 8.237 -14.417 758 HB2 ASP 103 HB2 ASP 103 28.199 10.638 -14.468 759 HB3 ASP 103 HB3 ASP 103 29.281 10.067 -15.729 760 HA PRO 104 HA PRO 104 30.072 4.893 -15.696 761 HB2 PRO 104 HB2 PRO 104 27.480 3.467 -16.100 762 HB3 PRO 104 HB3 PRO 104 28.988 2.897 -15.306 763 HG2 PRO 104 HG2 PRO 104 26.887 3.645 -13.811 764 HG3 PRO 104 HG3 PRO 104 28.529 4.249 -13.382 765 HD2 PRO 104 HD2 PRO 104 26.394 5.657 -15.041 766 HD3 PRO 104 HD3 PRO 104 27.272 6.251 -13.604 767 H ASP 105 H ASP 105 27.578 6.282 -17.648 768 HA ASP 105 HA ASP 105 27.576 4.732 -20.007 769 HB2 ASP 105 HB2 ASP 105 25.957 6.466 -19.350 770 HB3 ASP 105 HB3 ASP 105 27.194 7.709 -19.511 771 H GLY 106 H GLY 106 29.518 4.067 -20.837 772 HA2 GLY 106 HA2 GLY 106 31.244 4.293 -22.407 773 HA3 GLY 106 HA3 GLY 106 31.239 6.043 -22.207 774 H GLN 107 H GLN 107 31.349 4.306 -19.213 775 HA GLN 107 HA GLN 107 34.217 4.981 -18.824 776 HB2 GLN 107 HB2 GLN 107 32.185 3.986 -16.806 777 HB3 GLN 107 HB3 GLN 107 33.808 4.595 -16.462 778 HG2 GLN 107 HG2 GLN 107 31.511 6.203 -17.641 779 HG3 GLN 107 HG3 GLN 107 31.927 6.090 -15.937 780 HE21 GLN 107 HE22 GLN 107 31.764 8.496 -16.530 781 HE22 GLN 107 HE21 GLN 107 33.325 9.279 -16.844 782 H SER 108 H SER 108 33.027 2.381 -16.924 783 HA SER 108 HA SER 108 33.796 0.176 -18.634 784 HB2 SER 108 HB2 SER 108 36.034 0.998 -17.701 785 HB3 SER 108 HB3 SER 108 35.435 0.510 -16.096 786 HG SER 108 HG SER 108 36.668 -1.144 -17.235 787 H LEU 109 H LEU 109 33.579 -1.904 -17.366 788 HA LEU 109 HA LEU 109 30.944 -1.903 -16.177 789 HB2 LEU 109 HB2 LEU 109 33.088 -3.940 -16.778 790 HB3 LEU 109 HB3 LEU 109 31.671 -4.404 -15.818 791 HG LEU 109 HG LEU 109 30.148 -3.815 -17.598 792 HD11 LEU 109 HD11 LEU 109 30.924 -3.235 -19.878 793 HD12 LEU 109 HD12 LEU 109 31.228 -1.955 -18.701 794 HD13 LEU 109 HD13 LEU 109 32.570 -3.003 -19.242 795 HD21 LEU 109 HD21 LEU 109 32.453 -5.496 -18.656 796 HD22 LEU 109 HD22 LEU 109 31.174 -6.073 -17.569 797 HD23 LEU 109 HD23 LEU 109 30.766 -5.555 -19.214 798 H GLU 110 H GLU 110 34.176 -2.055 -14.739 799 HA GLU 110 HA GLU 110 33.326 -2.590 -12.038 800 HB2 GLU 110 HB2 GLU 110 35.665 -2.700 -12.864 801 HB3 GLU 110 HB3 GLU 110 35.682 -0.939 -13.050 802 HG2 GLU 110 HG2 GLU 110 35.367 -0.662 -10.620 803 HG3 GLU 110 HG3 GLU 110 35.205 -2.409 -10.417 804 H VAL 111 H VAL 111 33.363 0.417 -13.927 805 HA VAL 111 HA VAL 111 32.601 2.109 -11.655 806 HB VAL 111 HB VAL 111 32.606 2.634 -14.637 807 HG11 VAL 111 HG11 VAL 111 32.521 5.032 -14.017 808 HG12 VAL 111 HG12 VAL 111 31.026 4.180 -13.621 809 HG13 VAL 111 HG13 VAL 111 32.187 4.577 -12.333 810 HG21 VAL 111 HG21 VAL 111 34.507 3.460 -12.398 811 HG22 VAL 111 HG22 VAL 111 34.866 2.287 -13.682 812 HG23 VAL 111 HG23 VAL 111 34.628 3.987 -14.092 813 H PHE 112 H PHE 112 30.826 0.424 -14.320 814 HA PHE 112 HA PHE 112 28.209 1.382 -13.515 815 HB2 PHE 112 HB2 PHE 112 29.236 -1.037 -14.999 816 HB3 PHE 112 HB3 PHE 112 27.588 -1.030 -14.394 817 HD1 PHE 112 HD1 PHE 112 25.891 0.507 -15.202 818 HD2 PHE 112 HD2 PHE 112 29.846 0.408 -16.914 819 HE1 PHE 112 HE1 PHE 112 25.071 1.772 -17.184 820 HE2 PHE 112 HE2 PHE 112 29.030 1.683 -18.878 821 HZ PHE 112 HZ PHE 112 26.655 2.406 -18.978 822 H ARG 113 H ARG 113 30.008 -1.576 -12.530 823 HA ARG 113 HA ARG 113 28.138 -2.525 -10.575 824 HB2 ARG 113 HB2 ARG 113 31.177 -2.769 -10.758 825 HB3 ARG 113 HB3 ARG 113 30.189 -3.690 -9.619 826 HG2 ARG 113 HG2 ARG 113 29.020 -4.835 -11.416 827 HG3 ARG 113 HG3 ARG 113 29.782 -3.828 -12.637 828 HD2 ARG 113 HD2 ARG 113 32.005 -4.669 -11.897 829 HD3 ARG 113 HD3 ARG 113 31.170 -5.816 -10.818 830 HE ARG 113 HE ARG 113 30.052 -6.692 -12.951 831 HH11 ARG 113 HH21 ARG 113 33.396 -5.556 -12.924 832 HH12 ARG 113 HH22 ARG 113 33.854 -6.646 -14.200 833 HH21 ARG 113 HH11 ARG 113 30.743 -8.098 -14.461 834 HH22 ARG 113 HH12 ARG 113 32.386 -8.042 -15.064 835 H THR 114 H THR 114 30.827 -0.210 -10.204 836 HA THR 114 HA THR 114 30.512 0.152 -7.380 837 HB THR 114 HB THR 114 31.645 2.022 -9.510 838 HG1 THR 114 HG1 THR 114 32.824 0.177 -9.355 839 HG21 THR 114 HG21 THR 114 31.888 2.168 -6.485 840 HG22 THR 114 HG22 THR 114 32.928 3.050 -7.633 841 HG23 THR 114 HG23 THR 114 31.194 3.398 -7.573 842 H VAL 115 H VAL 115 28.998 1.948 -10.085 843 HA VAL 115 HA VAL 115 27.356 3.601 -8.341 844 HB VAL 115 HB VAL 115 27.201 2.801 -11.257 845 HG11 VAL 115 HG11 VAL 115 24.838 3.131 -10.583 846 HG12 VAL 115 HG12 VAL 115 25.282 4.686 -9.815 847 HG13 VAL 115 HG13 VAL 115 25.427 4.462 -11.579 848 HG21 VAL 115 HG21 VAL 115 27.764 5.381 -9.724 849 HG22 VAL 115 HG22 VAL 115 28.923 4.399 -10.658 850 HG23 VAL 115 HG23 VAL 115 27.631 5.285 -11.481 851 H ARG 116 H ARG 116 26.673 0.462 -9.953 852 HA ARG 116 HA ARG 116 24.016 0.206 -9.144 853 HB2 ARG 116 HB2 ARG 116 24.146 -1.691 -10.290 854 HB3 ARG 116 HB3 ARG 116 25.851 -1.361 -10.528 855 HG2 ARG 116 HG2 ARG 116 26.458 -2.801 -8.660 856 HG3 ARG 116 HG3 ARG 116 24.765 -3.096 -8.255 857 HD2 ARG 116 HD2 ARG 116 24.389 -4.345 -10.245 858 HD3 ARG 116 HD3 ARG 116 25.883 -3.739 -10.988 859 HE ARG 116 HE ARG 116 26.251 -5.276 -8.487 860 HH11 ARG 116 HH11 ARG 116 25.882 -5.806 -11.915 861 HH12 ARG 116 HH12 ARG 116 27.367 -6.750 -12.032 862 HH21 ARG 116 HH21 ARG 116 27.871 -6.860 -8.634 863 HH22 ARG 116 HH22 ARG 116 28.219 -7.563 -10.185 864 H GLY 117 H GLY 117 26.838 -0.820 -7.216 865 HA2 GLY 117 HA2 GLY 117 25.401 -2.016 -5.068 866 HA3 GLY 117 HA3 GLY 117 26.999 -1.264 -4.935 867 H GLN 118 H GLN 118 26.229 1.421 -5.608 868 HA GLN 118 HA GLN 118 25.169 2.255 -3.007 869 HB2 GLN 118 HB2 GLN 118 26.112 3.858 -5.418 870 HB3 GLN 118 HB3 GLN 118 25.643 4.543 -3.854 871 HG2 GLN 118 HG2 GLN 118 27.463 3.415 -2.716 872 HG3 GLN 118 HG3 GLN 118 27.873 2.478 -4.153 873 HE21 GLN 118 HE22 GLN 118 28.912 3.531 -5.975 874 HE22 GLN 118 HE21 GLN 118 29.647 5.123 -5.769 875 H VAL 119 H VAL 119 24.023 2.649 -6.427 876 HA VAL 119 HA VAL 119 21.490 3.787 -5.802 877 HB VAL 119 HB VAL 119 22.101 1.828 -8.064 878 HG11 VAL 119 HG11 VAL 119 19.877 3.876 -7.693 879 HG12 VAL 119 HG12 VAL 119 20.219 2.996 -9.206 880 HG13 VAL 119 HG13 VAL 119 19.684 2.111 -7.770 881 HG21 VAL 119 HG21 VAL 119 23.569 3.851 -8.130 882 HG22 VAL 119 HG22 VAL 119 22.412 3.825 -9.456 883 HG23 VAL 119 HG23 VAL 119 22.120 4.881 -8.053 884 H LYS 120 H LYS 120 22.400 0.305 -5.896 885 HA LYS 120 HA LYS 120 19.887 -0.799 -5.132 886 HB2 LYS 120 HB2 LYS 120 21.794 -2.118 -5.977 887 HB3 LYS 120 HB3 LYS 120 22.725 -1.769 -4.526 888 HG2 LYS 120 HG2 LYS 120 21.053 -2.924 -3.137 889 HG3 LYS 120 HG3 LYS 120 20.045 -3.208 -4.568 890 HD2 LYS 120 HD2 LYS 120 21.867 -4.599 -5.541 891 HD3 LYS 120 HD3 LYS 120 22.866 -4.323 -4.116 892 HE2 LYS 120 HE2 LYS 120 20.035 -5.333 -3.767 893 HE3 LYS 120 HE3 LYS 120 21.247 -6.473 -4.390 894 HZ1 LYS 120 HZ1 LYS 120 21.365 -5.028 -1.770 895 HZ2 LYS 120 HZ2 LYS 120 21.151 -6.629 -1.981 896 HZ3 LYS 120 HZ3 LYS 120 22.594 -5.968 -2.354 897 H GLU 121 H GLU 121 22.673 0.087 -2.958 898 HA GLU 121 HA GLU 121 21.163 -0.610 -0.631 899 HB2 GLU 121 HB2 GLU 121 22.958 -0.047 0.626 900 HB3 GLU 121 HB3 GLU 121 23.745 -0.340 -0.916 901 HG2 GLU 121 HG2 GLU 121 23.768 2.137 -1.313 902 HG3 GLU 121 HG3 GLU 121 23.058 2.379 0.277 903 H ARG 122 H ARG 122 21.370 2.563 -2.265 904 HA ARG 122 HA ARG 122 19.812 3.866 -0.190 905 HB2 ARG 122 HB2 ARG 122 20.029 4.526 -3.165 906 HB3 ARG 122 HB3 ARG 122 19.294 5.533 -1.924 907 HG2 ARG 122 HG2 ARG 122 22.227 4.823 -2.122 908 HG3 ARG 122 HG3 ARG 122 21.500 6.378 -2.496 909 HD2 ARG 122 HD2 ARG 122 21.742 5.045 0.218 910 HD3 ARG 122 HD3 ARG 122 22.640 6.445 -0.372 911 HE ARG 122 HE ARG 122 19.961 7.231 -0.542 912 HH11 ARG 122 HH11 ARG 122 22.141 6.341 2.060 913 HH12 ARG 122 HH12 ARG 122 21.235 7.223 3.251 914 HH21 ARG 122 HH21 ARG 122 18.796 8.334 1.076 915 HH22 ARG 122 HH22 ARG 122 19.433 8.334 2.690 916 H VAL 123 H VAL 123 18.752 2.168 -3.209 917 HA VAL 123 HA VAL 123 15.978 2.450 -2.605 918 HB VAL 123 HB VAL 123 17.535 0.450 -4.286 919 HG11 VAL 123 HG11 VAL 123 14.529 0.445 -3.872 920 HG12 VAL 123 HG12 VAL 123 15.451 -0.447 -5.123 921 HG13 VAL 123 HG13 VAL 123 15.665 -0.863 -3.431 922 HG21 VAL 123 HG21 VAL 123 16.346 1.547 -6.109 923 HG22 VAL 123 HG22 VAL 123 15.492 2.595 -4.951 924 HG23 VAL 123 HG23 VAL 123 17.267 2.710 -5.145 925 H GLU 124 H GLU 124 18.102 -0.355 -1.641 926 HA GLU 124 HA GLU 124 16.000 -1.681 -0.215 927 HB2 GLU 124 HB2 GLU 124 18.979 -1.677 0.375 928 HB3 GLU 124 HB3 GLU 124 17.774 -2.795 1.051 929 HG2 GLU 124 HG2 GLU 124 17.199 -3.577 -1.180 930 HG3 GLU 124 HG3 GLU 124 18.458 -2.561 -1.883 931 H ASN 125 H ASN 125 18.113 0.937 0.888 932 HA ASN 125 HA ASN 125 17.032 0.757 3.532 933 HB2 ASN 125 HB2 ASN 125 18.816 2.002 4.008 934 HB3 ASN 125 HB3 ASN 125 19.177 2.122 2.295 935 HD21 ASN 125 HD22 ASN 125 18.063 3.911 1.075 936 HD22 ASN 125 HD21 ASN 125 17.908 5.436 1.946 937 H LEU 126 H LEU 126 15.932 2.401 0.677 938 HA LEU 126 HA LEU 126 14.023 4.120 2.078 939 HB2 LEU 126 HB2 LEU 126 15.057 4.887 0.030 940 HB3 LEU 126 HB3 LEU 126 14.574 3.431 -0.838 941 HG LEU 126 HG LEU 126 12.215 4.085 -0.725 942 HD11 LEU 126 HD11 LEU 126 12.211 5.399 1.397 943 HD12 LEU 126 HD12 LEU 126 13.204 6.644 0.607 944 HD13 LEU 126 HD13 LEU 126 11.550 6.317 0.056 945 HD21 LEU 126 HD21 LEU 126 12.378 6.006 -2.244 946 HD22 LEU 126 HD22 LEU 126 14.064 6.269 -1.729 947 HD23 LEU 126 HD23 LEU 126 13.621 4.790 -2.611 948 H ILE 127 H ILE 127 13.731 1.104 0.063 949 HA ILE 127 HA ILE 127 10.869 1.106 0.306 950 HB ILE 127 HB ILE 127 10.935 -1.233 -0.412 951 HG12 ILE 127 HG12 ILE 127 13.942 -0.994 -0.099 952 HG13 ILE 127 HG13 ILE 127 12.853 -2.153 0.649 953 HG21 ILE 127 HG21 ILE 127 12.806 0.568 -2.041 954 HG22 ILE 127 HG22 ILE 127 11.736 -0.705 -2.666 955 HG23 ILE 127 HG23 ILE 127 11.041 0.761 -1.970 956 HD11 ILE 127 HD11 ILE 127 14.082 -3.253 -1.083 957 HD12 ILE 127 HD12 ILE 127 12.397 -3.099 -1.632 958 HD13 ILE 127 HD13 ILE 127 13.663 -2.008 -2.273 959 H ALA 128 H ALA 128 13.312 -0.161 2.524 960 HA ALA 128 HA ALA 128 11.429 -1.607 4.115 961 HB1 ALA 128 HB1 ALA 128 13.271 -1.612 5.781 962 HB2 ALA 128 HB2 ALA 128 13.870 -1.997 4.157 963 HB3 ALA 128 HB3 ALA 128 14.136 -0.377 4.842 964 H LYS 129 H LYS 129 12.020 1.823 3.834 965 HA LYS 129 HA LYS 129 10.698 2.527 6.399 966 HB2 LYS 129 HB2 LYS 129 11.756 4.254 4.118 967 HB3 LYS 129 HB3 LYS 129 11.046 4.863 5.611 968 HG2 LYS 129 HG2 LYS 129 12.843 3.881 6.948 969 HG3 LYS 129 HG3 LYS 129 13.545 3.131 5.507 970 HD2 LYS 129 HD2 LYS 129 13.811 5.418 4.495 971 HD3 LYS 129 HD3 LYS 129 13.254 6.133 6.010 972 HE2 LYS 129 HE2 LYS 129 15.724 4.361 5.664 973 HE3 LYS 129 HE3 LYS 129 15.735 6.128 5.676 974 HZ1 LYS 129 HZ1 LYS 129 14.867 6.054 7.976 975 HZ2 LYS 129 HZ2 LYS 129 14.905 4.415 7.975 976 HZ3 LYS 129 HZ3 LYS 129 16.290 5.264 7.868 977 H ILE 130 H ILE 130 10.015 2.743 2.886 978 HA ILE 130 HA ILE 130 7.369 3.877 3.555 979 HB ILE 130 HB ILE 130 7.219 4.702 1.299 980 HG12 ILE 130 HG12 ILE 130 9.160 4.883 -0.155 981 HG13 ILE 130 HG13 ILE 130 10.091 3.804 0.864 982 HG21 ILE 130 HG21 ILE 130 8.188 5.976 3.220 983 HG22 ILE 130 HG22 ILE 130 9.814 5.510 2.669 984 HG23 ILE 130 HG23 ILE 130 8.762 6.504 1.645 985 HD11 ILE 130 HD11 ILE 130 9.237 2.721 -1.187 986 HD12 ILE 130 HD12 ILE 130 8.623 1.931 0.267 987 HD13 ILE 130 HD13 ILE 130 7.570 3.038 -0.663 988 H SER 131 H SER 131 8.235 0.710 2.921 989 HA SER 131 HA SER 131 6.176 -0.110 1.153 990 HB2 SER 131 HB2 SER 131 6.410 -2.327 2.189 991 HB3 SER 131 HB3 SER 131 7.961 -1.600 1.714 992 HG SER 131 HG SER 131 6.914 -1.327 4.343 Start of MODEL 14 1 H MET 1 H1 MET 1 2.569 0.218 1.958 2 HA MET 1 HA MET 1 3.307 -0.303 -0.164 3 HB2 MET 1 HB2 MET 1 1.441 -1.804 -0.771 4 HB3 MET 1 HB3 MET 1 0.382 -0.415 -1.038 5 HG2 MET 1 HG2 MET 1 1.826 0.345 -2.893 6 HG3 MET 1 HG3 MET 1 2.976 -0.945 -2.535 7 HE1 MET 1 HE1 MET 1 1.953 -2.664 -5.709 8 HE2 MET 1 HE2 MET 1 2.676 -1.099 -5.276 9 HE3 MET 1 HE3 MET 1 3.189 -2.581 -4.435 10 H LYS 2 H LYS 2 4.293 1.483 -0.836 11 HA LYS 2 HA LYS 2 2.669 3.842 -1.741 12 HB2 LYS 2 HB2 LYS 2 5.269 3.958 -0.139 13 HB3 LYS 2 HB3 LYS 2 4.476 5.333 -0.900 14 HG2 LYS 2 HG2 LYS 2 2.429 4.922 0.453 15 HG3 LYS 2 HG3 LYS 2 3.266 3.609 1.297 16 HD2 LYS 2 HD2 LYS 2 4.954 5.229 2.144 17 HD3 LYS 2 HD3 LYS 2 4.072 6.545 1.336 18 HE2 LYS 2 HE2 LYS 2 2.037 6.007 2.636 19 HE3 LYS 2 HE3 LYS 2 2.863 4.650 3.418 20 HZ1 LYS 2 HZ1 LYS 2 4.392 6.247 4.437 21 HZ2 LYS 2 HZ2 LYS 2 3.676 7.505 3.681 22 HZ3 LYS 2 HZ3 LYS 2 2.845 6.655 4.816 23 H LYS 3 H LYS 3 3.890 5.213 -3.291 24 HA LYS 3 HA LYS 3 5.437 3.458 -5.159 25 HB2 LYS 3 HB2 LYS 3 3.756 5.892 -5.853 26 HB3 LYS 3 HB3 LYS 3 4.638 4.885 -6.977 27 HG2 LYS 3 HG2 LYS 3 2.586 3.941 -7.242 28 HG3 LYS 3 HG3 LYS 3 3.250 2.901 -5.992 29 HD2 LYS 3 HD2 LYS 3 0.921 3.410 -5.493 30 HD3 LYS 3 HD3 LYS 3 1.946 4.149 -4.267 31 HE2 LYS 3 HE2 LYS 3 1.866 6.227 -5.940 32 HE3 LYS 3 HE3 LYS 3 0.397 5.451 -6.522 33 HZ1 LYS 3 HZ1 LYS 3 0.993 6.307 -3.730 34 HZ2 LYS 3 HZ2 LYS 3 -0.045 7.049 -4.753 35 HZ3 LYS 3 HZ3 LYS 3 -0.422 5.555 -4.172 36 H VAL 4 H VAL 4 7.250 4.093 -6.149 37 HA VAL 4 HA VAL 4 8.545 6.645 -5.242 38 HB VAL 4 HB VAL 4 10.084 4.075 -5.606 39 HG11 VAL 4 HG11 VAL 4 11.419 6.097 -5.974 40 HG12 VAL 4 HG12 VAL 4 10.860 6.759 -4.415 41 HG13 VAL 4 HG13 VAL 4 11.880 5.298 -4.483 42 HG21 VAL 4 HG21 VAL 4 8.701 3.732 -3.652 43 HG22 VAL 4 HG22 VAL 4 10.362 4.055 -3.154 44 HG23 VAL 4 HG23 VAL 4 9.137 5.333 -3.011 45 H MET 5 H MET 5 9.658 7.806 -6.762 46 HA MET 5 HA MET 5 9.817 6.689 -9.523 47 HB2 MET 5 HB2 MET 5 7.859 7.961 -9.641 48 HB3 MET 5 HB3 MET 5 8.530 9.276 -8.675 49 HG2 MET 5 HG2 MET 5 8.318 9.876 -11.035 50 HG3 MET 5 HG3 MET 5 9.980 9.973 -10.481 51 HE1 MET 5 HE1 MET 5 8.334 9.784 -13.453 52 HE2 MET 5 HE2 MET 5 8.614 8.244 -14.292 53 HE3 MET 5 HE3 MET 5 7.439 8.319 -12.974 54 H PHE 6 H PHE 6 11.612 7.035 -10.528 55 HA PHE 6 HA PHE 6 13.770 8.590 -9.149 56 HB2 PHE 6 HB2 PHE 6 14.049 6.399 -11.234 57 HB3 PHE 6 HB3 PHE 6 15.316 7.093 -10.228 58 HD1 PHE 6 HD1 PHE 6 15.168 6.748 -7.658 59 HD2 PHE 6 HD2 PHE 6 12.828 4.532 -10.505 60 HE1 PHE 6 HE1 PHE 6 14.552 5.141 -5.871 61 HE2 PHE 6 HE2 PHE 6 12.183 2.937 -8.708 62 HZ PHE 6 HZ PHE 6 12.986 3.286 -6.376 63 H VAL 7 H VAL 7 14.619 10.344 -10.030 64 HA VAL 7 HA VAL 7 14.253 10.960 -12.930 65 HB VAL 7 HB VAL 7 14.153 12.733 -10.492 66 HG11 VAL 7 HG11 VAL 7 15.037 13.670 -13.259 67 HG12 VAL 7 HG12 VAL 7 14.461 14.713 -11.950 68 HG13 VAL 7 HG13 VAL 7 15.957 13.819 -11.737 69 HG21 VAL 7 HG21 VAL 7 12.727 12.881 -13.184 70 HG22 VAL 7 HG22 VAL 7 12.096 11.939 -11.793 71 HG23 VAL 7 HG23 VAL 7 12.296 13.687 -11.655 72 H CYS 8 H CYS 8 16.034 11.152 -14.141 73 HA CYS 8 HA CYS 8 18.653 11.769 -12.846 74 HB2 CYS 8 HB2 CYS 8 18.462 9.340 -13.120 75 HB3 CYS 8 HB3 CYS 8 18.080 9.514 -14.837 76 HG CYS 8 HG CYS 8 20.866 10.162 -13.104 77 H LYS 9 H LYS 9 20.305 12.397 -14.675 78 HA LYS 9 HA LYS 9 19.138 14.746 -15.880 79 HB2 LYS 9 HB2 LYS 9 21.649 14.017 -14.991 80 HB3 LYS 9 HB3 LYS 9 21.913 13.999 -16.722 81 HG2 LYS 9 HG2 LYS 9 20.830 16.294 -15.028 82 HG3 LYS 9 HG3 LYS 9 22.468 16.145 -15.630 83 HD2 LYS 9 HD2 LYS 9 19.980 16.661 -17.316 84 HD3 LYS 9 HD3 LYS 9 21.240 17.803 -16.878 85 HE2 LYS 9 HE2 LYS 9 22.913 16.314 -18.106 86 HE3 LYS 9 HE3 LYS 9 21.539 15.386 -18.724 87 HZ1 LYS 9 HZ1 LYS 9 22.184 17.137 -20.292 88 HZ2 LYS 9 HZ2 LYS 9 20.685 17.473 -19.728 89 HZ3 LYS 9 HZ3 LYS 9 21.987 18.300 -19.170 90 H ARG 10 H ARG 10 19.923 11.629 -17.300 91 HA ARG 10 HA ARG 10 18.261 12.476 -19.625 92 HB2 ARG 10 HB2 ARG 10 19.683 11.863 -21.338 93 HB3 ARG 10 HB3 ARG 10 20.598 12.911 -20.299 94 HG2 ARG 10 HG2 ARG 10 20.892 9.869 -20.411 95 HG3 ARG 10 HG3 ARG 10 21.897 11.048 -21.235 96 HD2 ARG 10 HD2 ARG 10 22.370 12.043 -18.854 97 HD3 ARG 10 HD3 ARG 10 21.696 10.512 -18.267 98 HE ARG 10 HE ARG 10 23.735 9.609 -18.564 99 HH11 ARG 10 HH21 ARG 10 23.656 12.266 -20.906 100 HH12 ARG 10 HH22 ARG 10 25.293 11.955 -21.399 101 HH21 ARG 10 HH11 ARG 10 25.767 9.295 -19.268 102 HH22 ARG 10 HH12 ARG 10 26.446 10.309 -20.526 103 H ASN 11 H ASN 11 18.329 10.366 -17.314 104 HA ASN 11 HA ASN 11 17.577 8.257 -16.887 105 HB2 ASN 11 HB2 ASN 11 15.658 9.724 -17.443 106 HB3 ASN 11 HB3 ASN 11 15.641 9.103 -19.085 107 HD21 ASN 11 HD22 ASN 11 15.823 7.465 -15.770 108 HD22 ASN 11 HD21 ASN 11 14.422 6.511 -16.117 109 H SER 12 H SER 12 19.793 8.102 -18.699 110 HA SER 12 HA SER 12 19.229 5.766 -20.398 111 HB2 SER 12 HB2 SER 12 21.703 6.029 -20.887 112 HB3 SER 12 HB3 SER 12 20.715 7.463 -21.246 113 HG SER 12 HG SER 12 22.688 7.861 -19.955 114 H CYS 13 H CYS 13 21.062 6.549 -17.486 115 HA CYS 13 HA CYS 13 21.084 3.676 -16.616 116 HB2 CYS 13 HB2 CYS 13 23.250 4.551 -17.652 117 HB3 CYS 13 HB3 CYS 13 23.371 5.701 -16.325 118 HG CYS 13 HG CYS 13 23.230 2.354 -16.229 119 H ARG 14 H ARG 14 22.390 4.344 -14.095 120 HA ARG 14 HA ARG 14 21.740 4.654 -11.912 121 HB2 ARG 14 HB2 ARG 14 21.266 7.428 -13.094 122 HB3 ARG 14 HB3 ARG 14 21.280 7.096 -11.348 123 HG2 ARG 14 HG2 ARG 14 23.566 6.296 -11.467 124 HG3 ARG 14 HG3 ARG 14 23.617 6.486 -13.221 125 HD2 ARG 14 HD2 ARG 14 23.096 8.817 -11.327 126 HD3 ARG 14 HD3 ARG 14 24.719 8.301 -11.793 127 HE ARG 14 HE ARG 14 23.234 8.675 -14.199 128 HH11 ARG 14 HH21 ARG 14 24.744 10.676 -11.713 129 HH12 ARG 14 HH22 ARG 14 24.580 12.111 -12.696 130 HH21 ARG 14 HH11 ARG 14 23.574 10.456 -15.477 131 HH22 ARG 14 HH12 ARG 14 23.901 12.000 -14.735 132 H SER 15 H SER 15 19.179 6.816 -12.806 133 HA SER 15 HA SER 15 17.040 5.831 -11.345 134 HB2 SER 15 HB2 SER 15 15.609 6.875 -13.141 135 HB3 SER 15 HB3 SER 15 16.940 7.893 -12.631 136 HG SER 15 HG SER 15 18.142 6.948 -14.569 137 H GLN 16 H GLN 16 17.936 4.599 -14.602 138 HA GLN 16 HA GLN 16 15.730 2.749 -14.781 139 HB2 GLN 16 HB2 GLN 16 18.486 2.643 -16.105 140 HB3 GLN 16 HB3 GLN 16 17.095 1.695 -16.607 141 HG2 GLN 16 HG2 GLN 16 17.189 4.761 -16.692 142 HG3 GLN 16 HG3 GLN 16 17.564 3.697 -18.033 143 HE21 GLN 16 HE22 GLN 16 15.776 5.220 -18.873 144 HE22 GLN 16 HE21 GLN 16 14.144 4.554 -18.775 145 H MET 17 H MET 17 18.968 2.323 -13.335 146 HA MET 17 HA MET 17 18.615 -0.524 -12.711 147 HB2 MET 17 HB2 MET 17 20.461 1.612 -11.544 148 HB3 MET 17 HB3 MET 17 20.520 -0.090 -11.124 149 HG2 MET 17 HG2 MET 17 21.129 -0.686 -13.421 150 HG3 MET 17 HG3 MET 17 21.044 1.010 -13.912 151 HE1 MET 17 HE1 MET 17 23.451 -1.319 -13.927 152 HE2 MET 17 HE2 MET 17 23.657 0.225 -14.803 153 HE3 MET 17 HE3 MET 17 24.889 -0.311 -13.636 154 H ALA 18 H ALA 18 17.815 2.552 -11.085 155 HA ALA 18 HA ALA 18 17.309 1.452 -8.494 156 HB1 ALA 18 HB1 ALA 18 16.305 3.597 -8.026 157 HB2 ALA 18 HB2 ALA 18 17.698 3.881 -9.083 158 HB3 ALA 18 HB3 ALA 18 16.059 3.931 -9.752 159 H GLU 19 H GLU 19 15.078 1.972 -11.272 160 HA GLU 19 HA GLU 19 12.770 0.800 -10.005 161 HB2 GLU 19 HB2 GLU 19 12.787 2.146 -12.115 162 HB3 GLU 19 HB3 GLU 19 13.526 0.774 -12.956 163 HG2 GLU 19 HG2 GLU 19 11.528 -0.623 -12.286 164 HG3 GLU 19 HG3 GLU 19 10.809 0.813 -11.560 165 H GLY 20 H GLY 20 15.468 -0.694 -11.850 166 HA2 GLY 20 HA2 GLY 20 14.581 -3.384 -11.865 167 HA3 GLY 20 HA3 GLY 20 16.270 -2.858 -11.845 168 H PHE 21 H PHE 21 16.672 -1.798 -9.343 169 HA PHE 21 HA PHE 21 16.601 -4.166 -7.657 170 HB2 PHE 21 HB2 PHE 21 17.370 -1.265 -7.132 171 HB3 PHE 21 HB3 PHE 21 17.468 -2.520 -5.898 172 HD1 PHE 21 HD2 PHE 21 18.635 -4.796 -6.715 173 HD2 PHE 21 HD1 PHE 21 19.362 -0.878 -8.370 174 HE1 PHE 21 HE2 PHE 21 20.805 -5.580 -7.592 175 HE2 PHE 21 HE1 PHE 21 21.546 -1.653 -9.222 176 HZ PHE 21 HZ PHE 21 22.272 -4.032 -8.837 177 H ALA 22 H ALA 22 14.700 -1.105 -7.542 178 HA ALA 22 HA ALA 22 13.275 -1.874 -5.185 179 HB1 ALA 22 HB1 ALA 22 13.463 0.445 -6.056 180 HB2 ALA 22 HB2 ALA 22 12.490 -0.005 -7.454 181 HB3 ALA 22 HB3 ALA 22 11.773 -0.024 -5.805 182 H LYS 23 H LYS 23 12.385 -2.489 -8.651 183 HA LYS 23 HA LYS 23 9.794 -3.571 -7.974 184 HB2 LYS 23 HB2 LYS 23 9.597 -4.144 -10.222 185 HB3 LYS 23 HB3 LYS 23 10.633 -2.715 -10.225 186 HG2 LYS 23 HG2 LYS 23 12.616 -4.316 -10.416 187 HG3 LYS 23 HG3 LYS 23 11.443 -5.620 -10.647 188 HD2 LYS 23 HD2 LYS 23 10.503 -4.237 -12.611 189 HD3 LYS 23 HD3 LYS 23 11.890 -3.162 -12.390 190 HE2 LYS 23 HE2 LYS 23 12.516 -4.656 -14.130 191 HE3 LYS 23 HE3 LYS 23 13.423 -5.166 -12.712 192 HZ1 LYS 23 HZ1 LYS 23 11.763 -6.971 -12.402 193 HZ2 LYS 23 HZ2 LYS 23 10.953 -6.485 -13.745 194 HZ3 LYS 23 HZ3 LYS 23 12.469 -7.073 -13.870 195 H THR 24 H THR 24 12.917 -4.969 -7.965 196 HA THR 24 HA THR 24 12.013 -7.760 -7.646 197 HB THR 24 HB THR 24 14.814 -6.653 -7.332 198 HG1 THR 24 HG1 THR 24 14.406 -6.172 -9.379 199 HG21 THR 24 HG21 THR 24 14.549 -8.983 -6.516 200 HG22 THR 24 HG22 THR 24 13.785 -9.436 -8.057 201 HG23 THR 24 HG23 THR 24 15.488 -8.936 -8.003 202 H LEU 25 H LEU 25 13.699 -5.355 -5.548 203 HA LEU 25 HA LEU 25 13.682 -7.184 -3.248 204 HB2 LEU 25 HB2 LEU 25 14.606 -4.282 -3.486 205 HB3 LEU 25 HB3 LEU 25 14.984 -5.361 -2.156 206 HG LEU 25 HG LEU 25 15.886 -5.796 -5.053 207 HD11 LEU 25 HD11 LEU 25 17.547 -5.026 -2.671 208 HD12 LEU 25 HD12 LEU 25 18.020 -5.054 -4.382 209 HD13 LEU 25 HD13 LEU 25 16.880 -3.817 -3.795 210 HD21 LEU 25 HD21 LEU 25 16.609 -7.274 -2.494 211 HD22 LEU 25 HD22 LEU 25 15.721 -7.937 -3.883 212 HD23 LEU 25 HD23 LEU 25 17.414 -7.473 -4.066 213 H GLY 26 H GLY 26 11.839 -4.361 -4.272 214 HA2 GLY 26 HA2 GLY 26 10.129 -4.401 -1.849 215 HA3 GLY 26 HA3 GLY 26 10.207 -3.168 -3.110 216 H ALA 27 H ALA 27 10.137 -6.365 -4.362 217 HA ALA 27 HA ALA 27 8.002 -6.056 -6.031 218 HB1 ALA 27 HB1 ALA 27 9.621 -7.922 -6.111 219 HB2 ALA 27 HB2 ALA 27 8.889 -8.642 -4.664 220 HB3 ALA 27 HB3 ALA 27 7.959 -8.531 -6.173 221 H GLY 28 H GLY 28 5.996 -5.333 -5.546 222 HA2 GLY 28 HA2 GLY 28 3.747 -5.720 -5.114 223 HA3 GLY 28 HA3 GLY 28 4.153 -7.142 -4.146 224 H LYS 29 H LYS 29 6.126 -5.289 -2.596 225 HA LYS 29 HA LYS 29 4.149 -4.054 -0.753 226 HB2 LYS 29 HB2 LYS 29 6.114 -3.521 0.644 227 HB3 LYS 29 HB3 LYS 29 5.711 -5.246 0.476 228 HG2 LYS 29 HG2 LYS 29 7.541 -5.391 -1.270 229 HG3 LYS 29 HG3 LYS 29 8.019 -3.749 -0.808 230 HD2 LYS 29 HD2 LYS 29 7.940 -6.225 0.983 231 HD3 LYS 29 HD3 LYS 29 9.389 -5.568 0.224 232 HE2 LYS 29 HE2 LYS 29 9.161 -3.469 1.518 233 HE3 LYS 29 HE3 LYS 29 7.658 -4.070 2.238 234 HZ1 LYS 29 HZ1 LYS 29 9.533 -4.443 3.742 235 HZ2 LYS 29 HZ2 LYS 29 8.930 -5.879 3.277 236 HZ3 LYS 29 HZ3 LYS 29 10.332 -5.337 2.631 237 H ILE 30 H ILE 30 6.411 -3.079 -3.210 238 HA ILE 30 HA ILE 30 5.131 -0.432 -2.999 239 HB ILE 30 HB ILE 30 7.227 0.757 -3.596 240 HG12 ILE 30 HG12 ILE 30 9.396 -0.170 -3.197 241 HG13 ILE 30 HG13 ILE 30 8.719 -1.750 -2.794 242 HG21 ILE 30 HG21 ILE 30 7.427 -0.844 -1.011 243 HG22 ILE 30 HG22 ILE 30 8.222 0.695 -1.365 244 HG23 ILE 30 HG23 ILE 30 6.452 0.631 -1.243 245 HD11 ILE 30 HD11 ILE 30 9.836 -1.470 -5.066 246 HD12 ILE 30 HD12 ILE 30 8.236 -2.210 -5.083 247 HD13 ILE 30 HD13 ILE 30 8.447 -0.499 -5.559 248 H ALA 31 H ALA 31 5.500 0.891 -5.082 249 HA ALA 31 HA ALA 31 5.918 -0.812 -7.478 250 HB1 ALA 31 HB1 ALA 31 3.512 -0.689 -7.350 251 HB2 ALA 31 HB2 ALA 31 3.554 1.071 -7.115 252 HB3 ALA 31 HB3 ALA 31 4.056 0.364 -8.665 253 H VAL 32 H VAL 32 6.924 0.310 -9.265 254 HA VAL 32 HA VAL 32 8.024 2.974 -8.602 255 HB VAL 32 HB VAL 32 10.201 1.814 -9.518 256 HG11 VAL 32 HG11 VAL 32 10.925 1.577 -7.190 257 HG12 VAL 32 HG12 VAL 32 9.924 2.993 -7.420 258 HG13 VAL 32 HG13 VAL 32 9.227 1.551 -6.648 259 HG21 VAL 32 HG21 VAL 32 9.198 -0.442 -9.839 260 HG22 VAL 32 HG22 VAL 32 10.629 -0.408 -8.809 261 HG23 VAL 32 HG23 VAL 32 9.026 -0.570 -8.065 262 H THR 33 H THR 33 8.907 4.187 -10.127 263 HA THR 33 HA THR 33 8.769 3.365 -12.986 264 HB THR 33 HB THR 33 7.747 6.047 -11.989 265 HG1 THR 33 HG1 THR 33 5.666 5.187 -12.462 266 HG21 THR 33 HG21 THR 33 6.674 6.157 -14.214 267 HG22 THR 33 HG22 THR 33 8.417 5.982 -14.395 268 HG23 THR 33 HG23 THR 33 7.359 4.577 -14.640 269 H SER 34 H SER 34 10.382 4.338 -14.275 270 HA SER 34 HA SER 34 12.293 6.229 -12.980 271 HB2 SER 34 HB2 SER 34 13.185 3.991 -13.420 272 HB3 SER 34 HB3 SER 34 12.706 4.123 -15.130 273 HG SER 34 HG SER 34 14.924 4.714 -14.701 274 H CYS 35 H CYS 35 12.885 8.072 -14.021 275 HA CYS 35 HA CYS 35 12.273 8.595 -16.831 276 HB2 CYS 35 HB2 CYS 35 10.786 10.420 -16.492 277 HB3 CYS 35 HB3 CYS 35 10.153 9.058 -15.555 278 HG CYS 35 HG CYS 35 11.350 9.820 -13.277 279 H GLY 36 H GLY 36 12.863 11.092 -17.233 280 HA2 GLY 36 HA2 GLY 36 14.912 12.097 -15.324 281 HA3 GLY 36 HA3 GLY 36 15.403 11.902 -17.015 282 H LEU 37 H LEU 37 15.542 14.393 -15.816 283 HA LEU 37 HA LEU 37 13.153 15.924 -16.452 284 HB2 LEU 37 HB2 LEU 37 14.521 17.939 -16.234 285 HB3 LEU 37 HB3 LEU 37 14.404 16.932 -14.817 286 HG LEU 37 HG LEU 37 16.806 16.508 -16.614 287 HD11 LEU 37 HD11 LEU 37 16.524 18.838 -14.658 288 HD12 LEU 37 HD12 LEU 37 18.027 18.338 -15.465 289 HD13 LEU 37 HD13 LEU 37 16.686 18.973 -16.424 290 HD21 LEU 37 HD21 LEU 37 17.900 16.201 -14.377 291 HD22 LEU 37 HD22 LEU 37 16.336 16.561 -13.603 292 HD23 LEU 37 HD23 LEU 37 16.522 15.113 -14.594 293 H GLU 38 H GLU 38 15.313 14.433 -18.352 294 HA GLU 38 HA GLU 38 14.077 15.293 -20.781 295 HB2 GLU 38 HB2 GLU 38 16.052 15.931 -22.055 296 HB3 GLU 38 HB3 GLU 38 15.750 17.075 -20.755 297 HG2 GLU 38 HG2 GLU 38 17.501 16.033 -19.387 298 HG3 GLU 38 HG3 GLU 38 17.824 14.845 -20.659 299 H SER 39 H SER 39 15.061 13.899 -22.656 300 HA SER 39 HA SER 39 15.489 11.153 -21.525 301 HB2 SER 39 HB2 SER 39 13.194 11.701 -22.384 302 HB3 SER 39 HB3 SER 39 13.918 11.906 -23.996 303 HG SER 39 HG SER 39 13.206 9.773 -23.764 304 H SER 40 H SER 40 16.762 9.732 -22.563 305 HA SER 40 HA SER 40 18.244 10.479 -25.049 306 HB2 SER 40 HB2 SER 40 19.762 10.868 -23.235 307 HB3 SER 40 HB3 SER 40 19.402 9.299 -22.503 308 HG SER 40 HG SER 40 20.827 9.869 -24.907 309 H ARG 41 H ARG 41 19.244 7.560 -23.839 310 HA ARG 41 HA ARG 41 17.031 5.860 -24.777 311 HB2 ARG 41 HB2 ARG 41 18.300 4.579 -26.309 312 HB3 ARG 41 HB3 ARG 41 18.565 6.250 -26.768 313 HG2 ARG 41 HG2 ARG 41 20.516 4.409 -25.318 314 HG3 ARG 41 HG3 ARG 41 20.607 4.955 -26.986 315 HD2 ARG 41 HD2 ARG 41 20.998 7.283 -26.221 316 HD3 ARG 41 HD3 ARG 41 20.883 6.730 -24.536 317 HE ARG 41 HE ARG 41 22.920 5.400 -26.197 318 HH11 ARG 41 HH11 ARG 41 22.419 8.055 -23.891 319 HH12 ARG 41 HH12 ARG 41 24.083 7.861 -23.294 320 HH21 ARG 41 HH21 ARG 41 25.040 5.419 -25.359 321 HH22 ARG 41 HH22 ARG 41 25.403 6.549 -24.053 322 H VAL 42 H VAL 42 17.078 3.736 -23.780 323 HA VAL 42 HA VAL 42 18.475 3.585 -21.263 324 HB VAL 42 HB VAL 42 16.550 1.889 -22.643 325 HG11 VAL 42 HG11 VAL 42 18.801 0.341 -21.393 326 HG12 VAL 42 HG12 VAL 42 17.183 -0.281 -21.832 327 HG13 VAL 42 HG13 VAL 42 18.274 0.270 -23.097 328 HG21 VAL 42 HG21 VAL 42 17.622 1.907 -19.804 329 HG22 VAL 42 HG22 VAL 42 16.342 3.001 -20.430 330 HG23 VAL 42 HG23 VAL 42 16.065 1.245 -20.337 331 H HIS 43 H HIS 43 20.447 2.911 -20.672 332 HA HIS 43 HA HIS 43 22.383 2.557 -22.822 333 HB2 HIS 43 HB2 HIS 43 22.693 3.832 -20.603 334 HB3 HIS 43 HB3 HIS 43 22.974 2.250 -19.861 335 HD2 HIS 43 HD2 HIS 43 24.538 4.918 -21.983 336 HE1 HIS 43 HE1 HIS 43 27.375 1.754 -22.000 337 HE2 HIS 43 HE2 HIS 43 26.957 4.193 -22.653 338 HA PRO 44 HA PRO 44 21.668 -1.762 -22.808 339 HB2 PRO 44 HB2 PRO 44 23.478 -2.680 -24.662 340 HB3 PRO 44 HB3 PRO 44 22.089 -1.626 -25.092 341 HG2 PRO 44 HG2 PRO 44 24.955 -0.778 -24.553 342 HG3 PRO 44 HG3 PRO 44 23.923 -0.357 -25.959 343 HD2 PRO 44 HD2 PRO 44 24.186 1.290 -23.797 344 HD3 PRO 44 HD3 PRO 44 22.631 1.142 -24.681 345 H THR 45 H THR 45 24.845 -0.490 -21.890 346 HA THR 45 HA THR 45 25.770 -3.040 -20.762 347 HB THR 45 HB THR 45 26.792 -0.219 -20.303 348 HG1 THR 45 HG1 THR 45 27.071 -1.008 -22.440 349 HG21 THR 45 HG21 THR 45 28.875 -1.433 -19.572 350 HG22 THR 45 HG22 THR 45 27.524 -1.603 -18.450 351 HG23 THR 45 HG23 THR 45 27.929 -2.948 -19.545 352 H ALA 46 H ALA 46 23.770 -0.335 -19.570 353 HA ALA 46 HA ALA 46 23.846 -1.072 -16.805 354 HB1 ALA 46 HB1 ALA 46 21.746 0.181 -16.642 355 HB2 ALA 46 HB2 ALA 46 22.826 1.030 -17.776 356 HB3 ALA 46 HB3 ALA 46 21.483 0.044 -18.390 357 H ILE 47 H ILE 47 21.795 -2.256 -19.492 358 HA ILE 47 HA ILE 47 20.218 -4.128 -17.985 359 HB ILE 47 HB ILE 47 21.033 -3.957 -20.907 360 HG12 ILE 47 HG12 ILE 47 18.673 -3.580 -21.334 361 HG13 ILE 47 HG13 ILE 47 18.261 -3.888 -19.651 362 HG21 ILE 47 HG21 ILE 47 19.369 -6.167 -19.641 363 HG22 ILE 47 HG22 ILE 47 19.441 -5.824 -21.382 364 HG23 ILE 47 HG23 ILE 47 20.894 -6.349 -20.536 365 HD11 ILE 47 HD11 ILE 47 19.855 -1.548 -20.747 366 HD12 ILE 47 HD12 ILE 47 18.160 -1.531 -20.171 367 HD13 ILE 47 HD13 ILE 47 19.464 -1.772 -19.026 368 H ALA 48 H ALA 48 23.411 -4.514 -19.583 369 HA ALA 48 HA ALA 48 23.732 -7.284 -18.904 370 HB1 ALA 48 HB1 ALA 48 25.052 -6.136 -20.639 371 HB2 ALA 48 HB2 ALA 48 25.872 -5.177 -19.382 372 HB3 ALA 48 HB3 ALA 48 26.081 -6.939 -19.434 373 H MET 49 H MET 49 24.766 -4.334 -17.176 374 HA MET 49 HA MET 49 26.052 -5.718 -14.998 375 HB2 MET 49 HB2 MET 49 24.936 -2.892 -15.099 376 HB3 MET 49 HB3 MET 49 26.117 -3.504 -13.920 377 HG2 MET 49 HG2 MET 49 26.801 -3.689 -16.848 378 HG3 MET 49 HG3 MET 49 26.817 -2.132 -16.059 379 HE1 MET 49 HE1 MET 49 28.878 -4.875 -17.206 380 HE2 MET 49 HE2 MET 49 29.940 -5.387 -15.879 381 HE3 MET 49 HE3 MET 49 28.224 -5.859 -15.871 382 H MET 50 H MET 50 22.664 -4.901 -15.541 383 HA MET 50 HA MET 50 21.893 -5.683 -12.801 384 HB2 MET 50 HB2 MET 50 20.261 -5.125 -15.309 385 HB3 MET 50 HB3 MET 50 19.579 -5.521 -13.733 386 HG2 MET 50 HG2 MET 50 21.224 -3.069 -14.428 387 HG3 MET 50 HG3 MET 50 19.509 -3.138 -14.069 388 HE1 MET 50 HE1 MET 50 19.982 -5.257 -11.248 389 HE2 MET 50 HE2 MET 50 19.429 -3.882 -10.263 390 HE3 MET 50 HE3 MET 50 18.669 -4.193 -11.835 391 H GLU 51 H GLU 51 22.025 -7.285 -16.037 392 HA GLU 51 HA GLU 51 20.856 -9.759 -15.114 393 HB2 GLU 51 HB2 GLU 51 22.762 -9.111 -17.393 394 HB3 GLU 51 HB3 GLU 51 22.180 -10.741 -17.061 395 HG2 GLU 51 HG2 GLU 51 19.831 -9.962 -17.271 396 HG3 GLU 51 HG3 GLU 51 20.399 -8.360 -17.726 397 H GLU 52 H GLU 52 24.098 -8.409 -14.753 398 HA GLU 52 HA GLU 52 25.457 -10.773 -13.835 399 HB2 GLU 52 HB2 GLU 52 25.816 -7.806 -13.325 400 HB3 GLU 52 HB3 GLU 52 26.889 -8.991 -12.601 401 HG2 GLU 52 HG2 GLU 52 26.439 -8.933 -15.606 402 HG3 GLU 52 HG3 GLU 52 27.579 -7.851 -14.817 403 H VAL 53 H VAL 53 22.969 -8.928 -12.272 404 HA VAL 53 HA VAL 53 23.348 -10.528 -9.773 405 HB VAL 53 HB VAL 53 22.111 -8.764 -8.540 406 HG11 VAL 53 HG11 VAL 53 24.012 -7.237 -8.331 407 HG12 VAL 53 HG12 VAL 53 24.545 -8.927 -8.426 408 HG13 VAL 53 HG13 VAL 53 24.705 -7.876 -9.840 409 HG21 VAL 53 HG21 VAL 53 22.613 -7.013 -10.991 410 HG22 VAL 53 HG22 VAL 53 21.016 -7.605 -10.463 411 HG23 VAL 53 HG23 VAL 53 21.942 -6.500 -9.437 412 H GLY 54 H GLY 54 21.832 -10.927 -12.445 413 HA2 GLY 54 HA2 GLY 54 20.039 -12.190 -13.045 414 HA3 GLY 54 HA3 GLY 54 19.747 -12.524 -11.338 415 H ILE 55 H ILE 55 19.656 -9.205 -12.536 416 HA ILE 55 HA ILE 55 16.672 -9.123 -12.220 417 HB ILE 55 HB ILE 55 18.777 -7.044 -11.577 418 HG12 ILE 55 HG12 ILE 55 16.733 -8.535 -9.877 419 HG13 ILE 55 HG13 ILE 55 18.481 -8.753 -9.842 420 HG21 ILE 55 HG21 ILE 55 16.935 -5.540 -10.936 421 HG22 ILE 55 HG22 ILE 55 16.824 -5.919 -12.642 422 HG23 ILE 55 HG23 ILE 55 15.740 -6.731 -11.482 423 HD11 ILE 55 HD11 ILE 55 17.905 -7.474 -7.915 424 HD12 ILE 55 HD12 ILE 55 18.705 -6.365 -9.045 425 HD13 ILE 55 HD13 ILE 55 16.931 -6.329 -8.849 426 H ASP 56 H ASP 56 15.475 -8.272 -13.838 427 HA ASP 56 HA ASP 56 16.871 -7.564 -16.356 428 HB2 ASP 56 HB2 ASP 56 14.937 -8.214 -17.496 429 HB3 ASP 56 HB3 ASP 56 15.235 -9.459 -16.291 430 H ILE 57 H ILE 57 16.805 -5.559 -17.200 431 HA ILE 57 HA ILE 57 14.553 -3.754 -16.465 432 HB ILE 57 HB ILE 57 15.973 -1.780 -16.423 433 HG12 ILE 57 HG12 ILE 57 18.406 -3.599 -16.225 434 HG13 ILE 57 HG13 ILE 57 17.895 -2.824 -17.722 435 HG21 ILE 57 HG21 ILE 57 16.775 -2.051 -14.156 436 HG22 ILE 57 HG22 ILE 57 15.298 -2.994 -14.343 437 HG23 ILE 57 HG23 ILE 57 16.871 -3.817 -14.337 438 HD11 ILE 57 HD11 ILE 57 19.656 -1.516 -16.613 439 HD12 ILE 57 HD12 ILE 57 18.144 -0.594 -16.735 440 HD13 ILE 57 HD13 ILE 57 18.642 -1.307 -15.185 441 H SER 58 H SER 58 15.432 -5.555 -18.809 442 HA SER 58 HA SER 58 16.117 -3.919 -21.015 443 HB2 SER 58 HB2 SER 58 14.716 -6.608 -21.117 444 HB3 SER 58 HB3 SER 58 15.816 -5.902 -22.321 445 HG SER 58 HG SER 58 16.868 -7.451 -20.959 446 H GLY 59 H GLY 59 12.968 -4.639 -19.653 447 HA2 GLY 59 HA2 GLY 59 11.394 -3.792 -21.962 448 HA3 GLY 59 HA3 GLY 59 10.814 -4.137 -20.333 449 H GLN 60 H GLN 60 13.345 -1.880 -20.082 450 HA GLN 60 HA GLN 60 11.451 0.409 -19.843 451 HB2 GLN 60 HB2 GLN 60 14.168 -0.145 -18.579 452 HB3 GLN 60 HB3 GLN 60 13.330 1.391 -18.471 453 HG2 GLN 60 HG2 GLN 60 11.637 0.570 -17.088 454 HG3 GLN 60 HG3 GLN 60 11.897 -1.110 -17.567 455 HE21 GLN 60 HE22 GLN 60 14.107 1.459 -16.189 456 HE22 GLN 60 HE21 GLN 60 14.719 0.362 -14.938 457 H THR 61 H THR 61 12.297 2.510 -20.538 458 HA THR 61 HA THR 61 14.631 2.700 -22.146 459 HB THR 61 HB THR 61 13.100 1.933 -23.888 460 HG1 THR 61 HG1 THR 61 13.576 3.609 -25.278 461 HG21 THR 61 HG21 THR 61 11.478 4.448 -23.311 462 HG22 THR 61 HG22 THR 61 11.238 3.326 -24.667 463 HG23 THR 61 HG23 THR 61 10.939 2.781 -23.007 464 H SER 62 H SER 62 14.484 5.147 -22.954 465 HA SER 62 HA SER 62 14.378 6.592 -20.406 466 HB2 SER 62 HB2 SER 62 15.076 7.478 -23.173 467 HB3 SER 62 HB3 SER 62 15.309 8.431 -21.664 468 HG SER 62 HG SER 62 16.737 6.722 -20.965 469 H ASP 63 H ASP 63 12.853 7.959 -19.725 470 HA ASP 63 HA ASP 63 10.899 9.128 -21.650 471 HB2 ASP 63 HB2 ASP 63 10.214 7.567 -19.152 472 HB3 ASP 63 HB3 ASP 63 9.117 8.754 -19.857 473 HA PRO 64 HA PRO 64 11.729 12.763 -19.299 474 HB2 PRO 64 HB2 PRO 64 10.073 14.567 -20.442 475 HB3 PRO 64 HB3 PRO 64 11.360 13.745 -21.370 476 HG2 PRO 64 HG2 PRO 64 8.418 12.997 -21.212 477 HG3 PRO 64 HG3 PRO 64 9.426 13.206 -22.679 478 HD2 PRO 64 HD2 PRO 64 8.961 10.759 -21.498 479 HD3 PRO 64 HD3 PRO 64 10.485 11.146 -22.358 480 H ILE 65 H ILE 65 11.167 13.850 -17.509 481 HA ILE 65 HA ILE 65 9.165 13.048 -15.705 482 HB ILE 65 HB ILE 65 11.353 14.284 -15.309 483 HG12 ILE 65 HG12 ILE 65 8.884 15.265 -13.897 484 HG13 ILE 65 HG13 ILE 65 9.793 13.791 -13.527 485 HG21 ILE 65 HG21 ILE 65 11.403 16.719 -15.263 486 HG22 ILE 65 HG22 ILE 65 10.934 16.226 -16.892 487 HG23 ILE 65 HG23 ILE 65 9.714 16.825 -15.738 488 HD11 ILE 65 HD11 ILE 65 10.527 15.331 -11.905 489 HD12 ILE 65 HD12 ILE 65 11.811 15.400 -13.123 490 HD13 ILE 65 HD13 ILE 65 10.578 16.680 -13.047 491 H GLU 66 H GLU 66 9.081 15.677 -18.075 492 HA GLU 66 HA GLU 66 6.761 17.030 -17.260 493 HB2 GLU 66 HB2 GLU 66 7.946 16.600 -20.031 494 HB3 GLU 66 HB3 GLU 66 6.633 17.731 -19.717 495 HG2 GLU 66 HG2 GLU 66 9.360 17.898 -18.359 496 HG3 GLU 66 HG3 GLU 66 8.916 18.766 -19.819 497 H ASN 67 H ASN 67 6.836 13.916 -18.921 498 HA ASN 67 HA ASN 67 3.985 14.129 -19.654 499 HB2 ASN 67 HB2 ASN 67 4.344 12.477 -21.094 500 HB3 ASN 67 HB3 ASN 67 6.048 12.820 -20.868 501 HD21 ASN 67 HD22 ASN 67 7.006 11.516 -18.792 502 HD22 ASN 67 HD21 ASN 67 6.361 9.907 -18.594 503 H PHE 68 H PHE 68 5.629 13.278 -16.775 504 HA PHE 68 HA PHE 68 3.620 11.245 -15.957 505 HB2 PHE 68 HB2 PHE 68 6.397 11.950 -14.957 506 HB3 PHE 68 HB3 PHE 68 5.338 10.788 -14.173 507 HD1 PHE 68 HD1 PHE 68 4.226 9.045 -16.093 508 HD2 PHE 68 HD2 PHE 68 8.145 10.863 -16.077 509 HE1 PHE 68 HE1 PHE 68 5.104 7.175 -17.458 510 HE2 PHE 68 HE2 PHE 68 9.001 8.978 -17.458 511 HZ PHE 68 HZ PHE 68 7.494 7.133 -18.138 512 H ASN 69 H ASN 69 3.421 11.217 -13.463 513 HA ASN 69 HA ASN 69 2.217 13.836 -12.655 514 HB2 ASN 69 HB2 ASN 69 0.526 12.259 -11.495 515 HB3 ASN 69 HB3 ASN 69 0.450 12.469 -13.241 516 HD21 ASN 69 HD22 ASN 69 2.230 10.254 -10.986 517 HD22 ASN 69 HD21 ASN 69 1.786 8.806 -11.887 518 H ALA 70 H ALA 70 3.792 14.677 -11.279 519 HA ALA 70 HA ALA 70 5.226 13.294 -9.316 520 HB1 ALA 70 HB1 ALA 70 5.362 15.782 -10.122 521 HB2 ALA 70 HB2 ALA 70 4.182 16.089 -8.835 522 HB3 ALA 70 HB3 ALA 70 5.756 15.394 -8.438 523 H ASP 71 H ASP 71 1.903 14.429 -9.235 524 HA ASP 71 HA ASP 71 1.318 14.503 -6.497 525 HB2 ASP 71 HB2 ASP 71 -0.047 15.412 -8.372 526 HB3 ASP 71 HB3 ASP 71 -0.449 13.762 -8.863 527 H ASP 72 H ASP 72 1.296 11.687 -8.668 528 HA ASP 72 HA ASP 72 -0.089 10.016 -6.659 529 HB2 ASP 72 HB2 ASP 72 -0.590 9.849 -9.113 530 HB3 ASP 72 HB3 ASP 72 1.050 9.217 -9.341 531 H TYR 73 H TYR 73 3.238 10.446 -7.847 532 HA TYR 73 HA TYR 73 4.242 8.041 -6.561 533 HB2 TYR 73 HB2 TYR 73 5.756 10.491 -7.517 534 HB3 TYR 73 HB3 TYR 73 6.428 8.904 -7.169 535 HD1 TYR 73 HD1 TYR 73 4.576 7.033 -8.537 536 HD2 TYR 73 HD2 TYR 73 6.077 10.880 -9.780 537 HE1 TYR 73 HE1 TYR 73 4.250 6.396 -10.910 538 HE2 TYR 73 HE2 TYR 73 5.930 10.176 -12.157 539 HH TYR 73 HH TYR 73 5.107 8.521 -13.646 540 H ASP 74 H ASP 74 3.905 7.925 -4.409 541 HA ASP 74 HA ASP 74 3.727 9.988 -2.536 542 HB2 ASP 74 HB2 ASP 74 4.839 7.174 -2.165 543 HB3 ASP 74 HB3 ASP 74 4.245 8.213 -0.871 544 H VAL 75 H VAL 75 6.620 8.489 -3.866 545 HA VAL 75 HA VAL 75 8.347 10.447 -2.394 546 HB VAL 75 HB VAL 75 8.975 7.538 -2.963 547 HG11 VAL 75 HG11 VAL 75 10.645 9.663 -1.560 548 HG12 VAL 75 HG12 VAL 75 11.017 7.938 -1.632 549 HG13 VAL 75 HG13 VAL 75 11.010 8.890 -3.112 550 HG21 VAL 75 HG21 VAL 75 7.470 7.594 -1.096 551 HG22 VAL 75 HG22 VAL 75 9.099 7.405 -0.438 552 HG23 VAL 75 HG23 VAL 75 8.296 8.989 -0.377 553 H VAL 76 H VAL 76 9.956 11.404 -3.670 554 HA VAL 76 HA VAL 76 10.400 10.366 -6.451 555 HB VAL 76 HB VAL 76 9.883 13.230 -5.642 556 HG11 VAL 76 HG11 VAL 76 11.882 13.263 -7.117 557 HG12 VAL 76 HG12 VAL 76 11.032 12.238 -8.303 558 HG13 VAL 76 HG13 VAL 76 10.478 13.897 -7.941 559 HG21 VAL 76 HG21 VAL 76 8.743 11.576 -7.942 560 HG22 VAL 76 HG22 VAL 76 7.940 11.729 -6.369 561 HG23 VAL 76 HG23 VAL 76 8.196 13.176 -7.361 562 H ILE 77 H ILE 77 12.494 10.278 -7.093 563 HA ILE 77 HA ILE 77 14.582 11.197 -5.143 564 HB ILE 77 HB ILE 77 14.604 8.684 -6.833 565 HG12 ILE 77 HG12 ILE 77 12.816 8.422 -5.153 566 HG13 ILE 77 HG13 ILE 77 14.156 7.340 -4.878 567 HG21 ILE 77 HG21 ILE 77 16.426 9.652 -4.597 568 HG22 ILE 77 HG22 ILE 77 16.463 8.009 -5.308 569 HG23 ILE 77 HG23 ILE 77 16.845 9.418 -6.302 570 HD11 ILE 77 HD11 ILE 77 14.954 8.626 -3.000 571 HD12 ILE 77 HD12 ILE 77 13.817 9.951 -3.332 572 HD13 ILE 77 HD13 ILE 77 13.223 8.387 -2.793 573 H SER 78 H SER 78 16.267 12.333 -5.981 574 HA SER 78 HA SER 78 16.600 12.456 -8.965 575 HB2 SER 78 HB2 SER 78 16.354 14.632 -7.921 576 HB3 SER 78 HB3 SER 78 17.717 14.283 -6.832 577 HG SER 78 HG SER 78 18.376 15.456 -8.731 578 H LEU 79 H LEU 79 18.291 11.625 -9.926 579 HA LEU 79 HA LEU 79 20.749 10.854 -8.397 580 HB2 LEU 79 HB2 LEU 79 19.529 9.143 -10.604 581 HB3 LEU 79 HB3 LEU 79 20.918 8.800 -9.584 582 HG LEU 79 HG LEU 79 19.063 8.917 -7.627 583 HD11 LEU 79 HD11 LEU 79 16.973 7.866 -8.400 584 HD12 LEU 79 HD12 LEU 79 17.153 9.464 -9.128 585 HD13 LEU 79 HD13 LEU 79 17.507 8.020 -10.091 586 HD21 LEU 79 HD21 LEU 79 19.419 6.530 -9.499 587 HD22 LEU 79 HD22 LEU 79 20.488 6.969 -8.139 588 HD23 LEU 79 HD23 LEU 79 18.820 6.475 -7.826 589 H CYS 80 H CYS 80 20.482 13.288 -9.662 590 HA CYS 80 HA CYS 80 21.286 13.044 -12.477 591 HB2 CYS 80 HB2 CYS 80 20.784 15.479 -10.707 592 HB3 CYS 80 HB3 CYS 80 21.081 15.517 -12.458 593 HG CYS 80 HG CYS 80 18.588 14.227 -10.707 594 H GLY 81 H GLY 81 23.081 13.766 -9.504 595 HA2 GLY 81 HA2 GLY 81 25.433 13.831 -9.301 596 HA3 GLY 81 HA3 GLY 81 25.623 13.937 -11.054 597 H CYS 82 H CYS 82 23.816 15.831 -8.631 598 HA CYS 82 HA CYS 82 23.555 18.032 -8.177 599 HB2 CYS 82 HB2 CYS 82 26.458 18.267 -9.075 600 HB3 CYS 82 HB3 CYS 82 25.575 19.462 -8.121 601 HG CYS 82 HG CYS 82 27.218 18.127 -6.564 602 H GLY 83 H GLY 83 23.913 20.419 -9.115 603 HA2 GLY 83 HA2 GLY 83 23.370 21.949 -10.747 604 HA3 GLY 83 HA3 GLY 83 23.666 20.724 -11.978 605 H VAL 84 H VAL 84 21.368 19.683 -9.677 606 HA VAL 84 HA VAL 84 18.978 20.592 -11.216 607 HB VAL 84 HB VAL 84 19.636 17.678 -10.591 608 HG11 VAL 84 HG11 VAL 84 17.209 18.869 -12.010 609 HG12 VAL 84 HG12 VAL 84 17.575 17.139 -11.802 610 HG13 VAL 84 HG13 VAL 84 17.205 18.107 -10.394 611 HG21 VAL 84 HG21 VAL 84 19.556 17.369 -13.066 612 HG22 VAL 84 HG22 VAL 84 19.471 19.132 -13.263 613 HG23 VAL 84 HG23 VAL 84 20.907 18.363 -12.544 614 H ASN 85 H ASN 85 17.301 21.100 -9.854 615 HA ASN 85 HA ASN 85 17.222 19.814 -7.159 616 HB2 ASN 85 HB2 ASN 85 18.347 22.248 -7.461 617 HB3 ASN 85 HB3 ASN 85 16.672 22.772 -7.370 618 HD21 ASN 85 HD22 ASN 85 19.068 20.628 -5.718 619 HD22 ASN 85 HD21 ASN 85 18.489 20.998 -4.102 620 H LEU 86 H LEU 86 15.442 20.031 -9.836 621 HA LEU 86 HA LEU 86 13.210 20.150 -10.406 622 HB2 LEU 86 HB2 LEU 86 13.158 18.332 -7.972 623 HB3 LEU 86 HB3 LEU 86 11.877 18.451 -9.179 624 HG LEU 86 HG LEU 86 14.647 17.339 -9.614 625 HD11 LEU 86 HD11 LEU 86 12.003 15.943 -9.961 626 HD12 LEU 86 HD12 LEU 86 13.607 15.251 -9.666 627 HD13 LEU 86 HD13 LEU 86 12.733 16.072 -8.353 628 HD21 LEU 86 HD21 LEU 86 13.958 18.473 -11.681 629 HD22 LEU 86 HD22 LEU 86 13.707 16.743 -11.898 630 HD23 LEU 86 HD23 LEU 86 12.319 17.793 -11.543 631 HA PRO 87 HA PRO 87 11.951 23.560 -7.504 632 HB2 PRO 87 HB2 PRO 87 11.233 24.655 -10.230 633 HB3 PRO 87 HB3 PRO 87 11.785 25.533 -8.772 634 HG2 PRO 87 HG2 PRO 87 13.556 24.970 -10.725 635 HG3 PRO 87 HG3 PRO 87 14.011 24.688 -9.013 636 HD2 PRO 87 HD2 PRO 87 13.054 22.667 -11.061 637 HD3 PRO 87 HD3 PRO 87 14.410 22.557 -9.901 638 HA PRO 88 HA PRO 88 7.476 23.102 -9.151 639 HB2 PRO 88 HB2 PRO 88 7.418 20.527 -10.670 640 HB3 PRO 88 HB3 PRO 88 6.680 22.102 -11.079 641 HG2 PRO 88 HG2 PRO 88 8.870 21.131 -12.366 642 HG3 PRO 88 HG3 PRO 88 8.709 22.893 -11.997 643 HD2 PRO 88 HD2 PRO 88 10.241 20.775 -10.458 644 HD3 PRO 88 HD3 PRO 88 10.753 22.413 -10.974 645 H GLU 89 H GLU 89 5.680 20.989 -9.163 646 HA GLU 89 HA GLU 89 5.497 20.042 -6.498 647 HB2 GLU 89 HB2 GLU 89 3.685 18.597 -7.414 648 HB3 GLU 89 HB3 GLU 89 3.547 20.299 -7.820 649 HG2 GLU 89 HG2 GLU 89 4.393 19.874 -10.093 650 HG3 GLU 89 HG3 GLU 89 4.664 18.182 -9.709 651 H TRP 90 H TRP 90 7.763 18.934 -8.683 652 HA TRP 90 HA TRP 90 7.866 16.134 -7.888 653 HB2 TRP 90 HB2 TRP 90 9.743 17.930 -9.444 654 HB3 TRP 90 HB3 TRP 90 9.998 16.206 -9.133 655 HD1 TRP 90 HD1 TRP 90 8.047 18.535 -11.412 656 HE1 TRP 90 HE1 TRP 90 6.608 17.154 -13.044 657 HE3 TRP 90 HE3 TRP 90 8.862 13.889 -9.479 658 HZ2 TRP 90 HZ2 TRP 90 6.090 14.365 -13.597 659 HZ3 TRP 90 HZ3 TRP 90 7.963 11.890 -10.603 660 HH2 TRP 90 HH2 TRP 90 6.592 12.120 -12.668 661 H VAL 91 H VAL 91 8.341 18.647 -5.983 662 HA VAL 91 HA VAL 91 10.130 17.057 -4.242 663 HB VAL 91 HB VAL 91 11.283 18.997 -3.344 664 HG11 VAL 91 HG11 VAL 91 12.815 19.428 -5.187 665 HG12 VAL 91 HG12 VAL 91 12.405 17.713 -5.010 666 HG13 VAL 91 HG13 VAL 91 11.672 18.658 -6.306 667 HG21 VAL 91 HG21 VAL 91 11.257 21.180 -4.449 668 HG22 VAL 91 HG22 VAL 91 10.073 20.608 -5.627 669 HG23 VAL 91 HG23 VAL 91 9.615 20.779 -3.922 670 H THR 92 H THR 92 7.104 17.851 -4.516 671 HA THR 92 HA THR 92 6.680 18.881 -1.736 672 HB THR 92 HB THR 92 4.421 19.464 -2.385 673 HG1 THR 92 HG1 THR 92 3.696 19.162 -4.417 674 HG21 THR 92 HG21 THR 92 4.906 21.322 -3.892 675 HG22 THR 92 HG22 THR 92 6.232 21.145 -2.724 676 HG23 THR 92 HG23 THR 92 6.438 20.570 -4.395 677 H GLN 93 H GLN 93 7.156 16.083 -3.029 678 HA GLN 93 HA GLN 93 5.144 14.258 -2.423 679 HB2 GLN 93 HB2 GLN 93 8.192 14.190 -2.561 680 HB3 GLN 93 HB3 GLN 93 7.302 12.740 -2.156 681 HG2 GLN 93 HG2 GLN 93 7.700 12.724 -4.488 682 HG3 GLN 93 HG3 GLN 93 5.966 12.922 -4.205 683 HE21 GLN 93 HE22 GLN 93 5.308 14.053 -6.079 684 HE22 GLN 93 HE21 GLN 93 5.952 15.683 -6.345 685 H GLU 94 H GLU 94 5.667 12.372 -0.832 686 HA GLU 94 HA GLU 94 5.492 13.331 1.948 687 HB2 GLU 94 HB2 GLU 94 4.344 11.260 1.189 688 HB3 GLU 94 HB3 GLU 94 5.918 10.509 0.866 689 HG2 GLU 94 HG2 GLU 94 6.551 10.731 3.215 690 HG3 GLU 94 HG3 GLU 94 5.013 11.513 3.582 691 H ILE 95 H ILE 95 7.954 11.776 -0.108 692 HA ILE 95 HA ILE 95 10.114 12.948 1.559 693 HB ILE 95 HB ILE 95 10.085 10.047 0.622 694 HG12 ILE 95 HG12 ILE 95 9.911 11.243 3.413 695 HG13 ILE 95 HG13 ILE 95 8.720 10.242 2.568 696 HG21 ILE 95 HG21 ILE 95 12.287 11.574 2.081 697 HG22 ILE 95 HG22 ILE 95 12.309 9.844 1.696 698 HG23 ILE 95 HG23 ILE 95 12.343 10.997 0.393 699 HD11 ILE 95 HD11 ILE 95 10.440 8.362 2.594 700 HD12 ILE 95 HD12 ILE 95 11.360 9.350 3.748 701 HD13 ILE 95 HD13 ILE 95 9.723 8.821 4.155 702 H PHE 96 H PHE 96 11.798 13.727 0.400 703 HA PHE 96 HA PHE 96 12.129 12.913 -2.406 704 HB2 PHE 96 HB2 PHE 96 11.044 15.023 -2.699 705 HB3 PHE 96 HB3 PHE 96 12.074 15.788 -1.487 706 HD1 PHE 96 HD1 PHE 96 14.398 16.371 -1.963 707 HD2 PHE 96 HD2 PHE 96 11.921 14.584 -5.029 708 HE1 PHE 96 HE1 PHE 96 16.129 16.864 -3.662 709 HE2 PHE 96 HE2 PHE 96 13.703 14.986 -6.682 710 HZ PHE 96 HZ PHE 96 15.792 16.165 -6.023 711 H GLU 97 H GLU 97 14.216 12.437 -2.920 712 HA GLU 97 HA GLU 97 16.415 13.226 -1.077 713 HB2 GLU 97 HB2 GLU 97 15.869 10.375 -1.928 714 HB3 GLU 97 HB3 GLU 97 17.367 10.928 -1.204 715 HG2 GLU 97 HG2 GLU 97 14.631 10.985 0.117 716 HG3 GLU 97 HG3 GLU 97 15.894 9.803 0.411 717 H ASP 98 H ASP 98 18.482 13.197 -1.992 718 HA ASP 98 HA ASP 98 18.574 13.000 -4.949 719 HB2 ASP 98 HB2 ASP 98 19.478 15.103 -5.250 720 HB3 ASP 98 HB3 ASP 98 18.081 15.331 -4.233 721 H TRP 99 H TRP 99 19.501 10.865 -4.172 722 HA TRP 99 HA TRP 99 22.165 10.889 -3.044 723 HB2 TRP 99 HB2 TRP 99 21.204 8.515 -4.582 724 HB3 TRP 99 HB3 TRP 99 22.121 8.614 -3.099 725 HD1 TRP 99 HD1 TRP 99 18.692 8.418 -4.542 726 HE1 TRP 99 HE1 TRP 99 16.921 7.960 -2.718 727 HE3 TRP 99 HE3 TRP 99 21.573 9.119 -0.365 728 HZ2 TRP 99 HZ2 TRP 99 16.897 7.434 0.086 729 HZ3 TRP 99 HZ3 TRP 99 20.637 8.654 1.886 730 HH2 TRP 99 HH2 TRP 99 18.309 7.829 2.141 731 H GLN 100 H GLN 100 23.659 12.022 -4.172 732 HA GLN 100 HA GLN 100 23.698 12.074 -7.071 733 HB2 GLN 100 HB2 GLN 100 25.745 13.178 -5.113 734 HB3 GLN 100 HB3 GLN 100 25.561 13.624 -6.812 735 HG2 GLN 100 HG2 GLN 100 23.615 14.212 -4.539 736 HG3 GLN 100 HG3 GLN 100 24.650 15.353 -5.351 737 HE21 GLN 100 HE22 GLN 100 21.806 15.781 -5.173 738 HE22 GLN 100 HE21 GLN 100 21.240 15.708 -6.839 739 H LEU 101 H LEU 101 24.771 10.771 -8.463 740 HA LEU 101 HA LEU 101 27.152 9.216 -7.637 741 HB2 LEU 101 HB2 LEU 101 24.613 8.021 -8.860 742 HB3 LEU 101 HB3 LEU 101 26.147 7.170 -8.720 743 HG LEU 101 HG LEU 101 24.469 8.114 -6.352 744 HD11 LEU 101 HD11 LEU 101 23.387 6.324 -7.631 745 HD12 LEU 101 HD12 LEU 101 24.861 5.324 -7.461 746 HD13 LEU 101 HD13 LEU 101 23.903 5.792 -6.026 747 HD21 LEU 101 HD21 LEU 101 25.936 6.703 -5.006 748 HD22 LEU 101 HD22 LEU 101 26.903 6.270 -6.439 749 HD23 LEU 101 HD23 LEU 101 26.905 7.930 -5.808 750 H GLU 102 H GLU 102 28.430 8.552 -9.537 751 HA GLU 102 HA GLU 102 28.275 10.531 -11.643 752 HB2 GLU 102 HB2 GLU 102 30.290 9.547 -12.480 753 HB3 GLU 102 HB3 GLU 102 30.428 9.824 -10.740 754 HG2 GLU 102 HG2 GLU 102 29.914 7.358 -10.398 755 HG3 GLU 102 HG3 GLU 102 29.988 7.155 -12.152 756 H ASP 103 H ASP 103 28.407 9.961 -13.896 757 HA ASP 103 HA ASP 103 26.248 8.062 -14.536 758 HB2 ASP 103 HB2 ASP 103 26.157 10.434 -15.221 759 HB3 ASP 103 HB3 ASP 103 27.459 10.124 -16.368 760 HA PRO 104 HA PRO 104 29.569 5.280 -15.791 761 HB2 PRO 104 HB2 PRO 104 27.286 3.485 -16.396 762 HB3 PRO 104 HB3 PRO 104 28.795 3.149 -15.481 763 HG2 PRO 104 HG2 PRO 104 26.493 3.544 -14.151 764 HG3 PRO 104 HG3 PRO 104 27.960 4.441 -13.609 765 HD2 PRO 104 HD2 PRO 104 25.787 5.420 -15.514 766 HD3 PRO 104 HD3 PRO 104 26.355 6.154 -13.994 767 H ASP 105 H ASP 105 27.286 6.544 -18.066 768 HA ASP 105 HA ASP 105 27.625 4.845 -20.293 769 HB2 ASP 105 HB2 ASP 105 25.912 6.610 -20.046 770 HB3 ASP 105 HB3 ASP 105 27.174 7.842 -20.205 771 H GLY 106 H GLY 106 29.522 4.222 -21.144 772 HA2 GLY 106 HA2 GLY 106 31.477 4.366 -22.374 773 HA3 GLY 106 HA3 GLY 106 31.350 6.126 -22.376 774 H GLN 107 H GLN 107 31.259 4.650 -19.223 775 HA GLN 107 HA GLN 107 33.952 5.726 -18.599 776 HB2 GLN 107 HB2 GLN 107 31.909 4.487 -16.732 777 HB3 GLN 107 HB3 GLN 107 33.397 5.318 -16.269 778 HG2 GLN 107 HG2 GLN 107 30.991 6.564 -17.656 779 HG3 GLN 107 HG3 GLN 107 31.332 6.596 -15.931 780 HE21 GLN 107 HE22 GLN 107 30.850 8.922 -16.775 781 HE22 GLN 107 HE21 GLN 107 32.300 9.892 -17.071 782 H SER 108 H SER 108 32.799 2.890 -16.916 783 HA SER 108 HA SER 108 34.191 0.884 -18.442 784 HB2 SER 108 HB2 SER 108 35.865 0.232 -16.871 785 HB3 SER 108 HB3 SER 108 36.094 1.974 -17.093 786 HG SER 108 HG SER 108 36.136 1.489 -14.894 787 H LEU 109 H LEU 109 33.836 -1.286 -17.459 788 HA LEU 109 HA LEU 109 31.169 -1.403 -16.320 789 HB2 LEU 109 HB2 LEU 109 33.242 -3.484 -17.036 790 HB3 LEU 109 HB3 LEU 109 31.767 -3.904 -16.157 791 HG LEU 109 HG LEU 109 30.345 -3.080 -17.927 792 HD11 LEU 109 HD11 LEU 109 31.243 -2.482 -20.162 793 HD12 LEU 109 HD12 LEU 109 31.573 -1.265 -18.932 794 HD13 LEU 109 HD13 LEU 109 32.873 -2.373 -19.454 795 HD21 LEU 109 HD21 LEU 109 31.200 -5.428 -18.015 796 HD22 LEU 109 HD22 LEU 109 30.858 -4.775 -19.622 797 HD23 LEU 109 HD23 LEU 109 32.534 -4.884 -19.042 798 H GLU 110 H GLU 110 34.365 -1.354 -14.859 799 HA GLU 110 HA GLU 110 33.503 -2.141 -12.210 800 HB2 GLU 110 HB2 GLU 110 35.858 -2.098 -12.975 801 HB3 GLU 110 HB3 GLU 110 35.799 -0.333 -13.073 802 HG2 GLU 110 HG2 GLU 110 35.384 -0.194 -10.643 803 HG3 GLU 110 HG3 GLU 110 35.311 -1.956 -10.536 804 H VAL 111 H VAL 111 33.594 1.044 -13.913 805 HA VAL 111 HA VAL 111 32.508 2.522 -11.661 806 HB VAL 111 HB VAL 111 32.575 3.097 -14.626 807 HG11 VAL 111 HG11 VAL 111 31.568 4.862 -12.361 808 HG12 VAL 111 HG12 VAL 111 32.007 5.467 -13.969 809 HG13 VAL 111 HG13 VAL 111 30.662 4.336 -13.799 810 HG21 VAL 111 HG21 VAL 111 34.073 4.325 -12.260 811 HG22 VAL 111 HG22 VAL 111 34.761 3.148 -13.399 812 HG23 VAL 111 HG23 VAL 111 34.291 4.754 -13.971 813 H PHE 112 H PHE 112 30.918 0.797 -14.453 814 HA PHE 112 HA PHE 112 28.243 1.522 -13.673 815 HB2 PHE 112 HB2 PHE 112 29.452 -0.802 -15.166 816 HB3 PHE 112 HB3 PHE 112 27.802 -0.890 -14.608 817 HD1 PHE 112 HD1 PHE 112 26.049 0.592 -15.413 818 HD2 PHE 112 HD2 PHE 112 30.014 0.715 -17.072 819 HE1 PHE 112 HE1 PHE 112 25.151 1.628 -17.507 820 HE2 PHE 112 HE2 PHE 112 29.140 1.805 -19.112 821 HZ PHE 112 HZ PHE 112 26.712 2.282 -19.313 822 H ARG 113 H ARG 113 30.202 -1.348 -12.691 823 HA ARG 113 HA ARG 113 28.287 -2.440 -10.853 824 HB2 ARG 113 HB2 ARG 113 31.330 -2.550 -10.918 825 HB3 ARG 113 HB3 ARG 113 30.355 -3.515 -9.816 826 HG2 ARG 113 HG2 ARG 113 29.329 -4.753 -11.614 827 HG3 ARG 113 HG3 ARG 113 29.954 -3.645 -12.827 828 HD2 ARG 113 HD2 ARG 113 32.286 -4.258 -12.108 829 HD3 ARG 113 HD3 ARG 113 31.598 -5.555 -11.126 830 HE ARG 113 HE ARG 113 31.993 -5.448 -14.012 831 HH11 ARG 113 HH22 ARG 113 30.145 -7.235 -11.571 832 HH12 ARG 113 HH21 ARG 113 29.794 -8.498 -12.764 833 HH21 ARG 113 HH11 ARG 113 31.597 -7.301 -15.279 834 HH22 ARG 113 HH12 ARG 113 30.498 -8.509 -14.611 835 H THR 114 H THR 114 30.823 0.009 -10.321 836 HA THR 114 HA THR 114 30.463 0.297 -7.483 837 HB THR 114 HB THR 114 31.437 2.325 -9.536 838 HG1 THR 114 HG1 THR 114 32.755 0.551 -9.492 839 HG21 THR 114 HG21 THR 114 31.729 2.286 -6.510 840 HG22 THR 114 HG22 THR 114 32.654 3.335 -7.613 841 HG23 THR 114 HG23 THR 114 30.901 3.521 -7.490 842 H VAL 115 H VAL 115 28.996 2.124 -10.216 843 HA VAL 115 HA VAL 115 27.316 3.770 -8.519 844 HB VAL 115 HB VAL 115 27.281 3.121 -11.494 845 HG11 VAL 115 HG11 VAL 115 25.521 5.101 -9.960 846 HG12 VAL 115 HG12 VAL 115 25.757 5.099 -11.720 847 HG13 VAL 115 HG13 VAL 115 24.974 3.719 -10.949 848 HG21 VAL 115 HG21 VAL 115 28.110 5.477 -11.619 849 HG22 VAL 115 HG22 VAL 115 28.038 5.606 -9.863 850 HG23 VAL 115 HG23 VAL 115 29.188 4.493 -10.633 851 H ARG 116 H ARG 116 26.618 0.790 -10.380 852 HA ARG 116 HA ARG 116 23.918 0.382 -9.711 853 HB2 ARG 116 HB2 ARG 116 25.330 -0.924 -11.334 854 HB3 ARG 116 HB3 ARG 116 26.174 -1.669 -9.982 855 HG2 ARG 116 HG2 ARG 116 23.781 -2.473 -9.246 856 HG3 ARG 116 HG3 ARG 116 23.300 -2.031 -10.888 857 HD2 ARG 116 HD2 ARG 116 23.817 -4.370 -10.878 858 HD3 ARG 116 HD3 ARG 116 25.149 -3.554 -11.720 859 HE ARG 116 HE ARG 116 25.670 -3.846 -8.861 860 HH11 ARG 116 HH11 ARG 116 25.637 -5.857 -11.728 861 HH12 ARG 116 HH12 ARG 116 26.945 -6.861 -11.132 862 HH21 ARG 116 HH21 ARG 116 27.280 -5.179 -8.146 863 HH22 ARG 116 HH22 ARG 116 27.773 -6.535 -9.096 864 H GLY 117 H GLY 117 26.773 -0.720 -7.817 865 HA2 GLY 117 HA2 GLY 117 25.409 -2.013 -5.703 866 HA3 GLY 117 HA3 GLY 117 27.006 -1.262 -5.590 867 H GLN 118 H GLN 118 26.268 1.482 -6.011 868 HA GLN 118 HA GLN 118 25.053 2.091 -3.428 869 HB2 GLN 118 HB2 GLN 118 26.022 3.899 -5.664 870 HB3 GLN 118 HB3 GLN 118 25.267 4.465 -4.166 871 HG2 GLN 118 HG2 GLN 118 27.065 3.029 -2.932 872 HG3 GLN 118 HG3 GLN 118 27.905 2.993 -4.484 873 HE21 GLN 118 HE22 GLN 118 29.361 4.736 -4.785 874 HE22 GLN 118 HE21 GLN 118 29.239 6.248 -3.898 875 H VAL 119 H VAL 119 23.884 2.570 -6.835 876 HA VAL 119 HA VAL 119 21.351 3.641 -6.167 877 HB VAL 119 HB VAL 119 21.979 1.703 -8.440 878 HG11 VAL 119 HG11 VAL 119 19.607 3.524 -7.936 879 HG12 VAL 119 HG12 VAL 119 19.990 2.809 -9.522 880 HG13 VAL 119 HG13 VAL 119 19.577 1.758 -8.161 881 HG21 VAL 119 HG21 VAL 119 23.284 3.869 -8.498 882 HG22 VAL 119 HG22 VAL 119 22.144 3.693 -9.829 883 HG23 VAL 119 HG23 VAL 119 21.738 4.746 -8.450 884 H LYS 120 H LYS 120 22.307 0.178 -6.207 885 HA LYS 120 HA LYS 120 19.823 -0.932 -5.352 886 HB2 LYS 120 HB2 LYS 120 21.763 -2.270 -6.143 887 HB3 LYS 120 HB3 LYS 120 22.684 -1.828 -4.709 888 HG2 LYS 120 HG2 LYS 120 21.006 -2.919 -3.263 889 HG3 LYS 120 HG3 LYS 120 20.032 -3.320 -4.681 890 HD2 LYS 120 HD2 LYS 120 21.923 -4.725 -5.530 891 HD3 LYS 120 HD3 LYS 120 22.856 -4.351 -4.080 892 HE2 LYS 120 HE2 LYS 120 20.028 -5.352 -3.736 893 HE3 LYS 120 HE3 LYS 120 21.223 -6.523 -4.319 894 HZ1 LYS 120 HZ1 LYS 120 22.581 -5.970 -2.310 895 HZ2 LYS 120 HZ2 LYS 120 21.375 -4.975 -1.764 896 HZ3 LYS 120 HZ3 LYS 120 21.122 -6.582 -1.903 897 H GLU 121 H GLU 121 22.618 0.055 -3.246 898 HA GLU 121 HA GLU 121 21.114 -0.567 -0.879 899 HB2 GLU 121 HB2 GLU 121 22.938 -0.044 0.341 900 HB3 GLU 121 HB3 GLU 121 23.689 -0.411 -1.209 901 HG2 GLU 121 HG2 GLU 121 23.825 2.063 -1.657 902 HG3 GLU 121 HG3 GLU 121 23.132 2.368 -0.074 903 H ARG 122 H ARG 122 21.369 2.543 -2.606 904 HA ARG 122 HA ARG 122 19.995 3.978 -0.472 905 HB2 ARG 122 HB2 ARG 122 19.984 4.662 -3.452 906 HB3 ARG 122 HB3 ARG 122 19.584 5.737 -2.120 907 HG2 ARG 122 HG2 ARG 122 22.308 4.648 -2.859 908 HG3 ARG 122 HG3 ARG 122 21.765 6.298 -2.949 909 HD2 ARG 122 HD2 ARG 122 21.760 6.439 -0.502 910 HD3 ARG 122 HD3 ARG 122 22.177 4.715 -0.382 911 HE ARG 122 HE ARG 122 24.151 5.901 -2.008 912 HH11 ARG 122 HH11 ARG 122 23.167 6.274 1.334 913 HH12 ARG 122 HH12 ARG 122 24.793 6.606 1.871 914 HH21 ARG 122 HH21 ARG 122 26.237 6.236 -1.242 915 HH22 ARG 122 HH22 ARG 122 26.461 6.628 0.437 916 H VAL 123 H VAL 123 18.730 2.261 -3.395 917 HA VAL 123 HA VAL 123 16.002 2.651 -2.640 918 HB VAL 123 HB VAL 123 17.458 0.637 -4.405 919 HG11 VAL 123 HG11 VAL 123 14.474 0.581 -3.864 920 HG12 VAL 123 HG12 VAL 123 15.374 -0.302 -5.142 921 HG13 VAL 123 HG13 VAL 123 15.640 -0.700 -3.454 922 HG21 VAL 123 HG21 VAL 123 17.094 2.932 -5.220 923 HG22 VAL 123 HG22 VAL 123 16.178 1.742 -6.165 924 HG23 VAL 123 HG23 VAL 123 15.342 2.748 -4.962 925 H GLU 124 H GLU 124 18.103 -0.251 -1.793 926 HA GLU 124 HA GLU 124 16.074 -1.482 -0.230 927 HB2 GLU 124 HB2 GLU 124 19.070 -1.464 0.264 928 HB3 GLU 124 HB3 GLU 124 17.888 -2.557 1.026 929 HG2 GLU 124 HG2 GLU 124 17.244 -3.435 -1.145 930 HG3 GLU 124 HG3 GLU 124 18.480 -2.456 -1.940 931 H ASN 125 H ASN 125 18.243 1.147 0.742 932 HA ASN 125 HA ASN 125 17.271 1.024 3.421 933 HB2 ASN 125 HB2 ASN 125 19.098 2.226 3.814 934 HB3 ASN 125 HB3 ASN 125 19.402 2.312 2.090 935 HD21 ASN 125 HD22 ASN 125 18.284 4.109 0.869 936 HD22 ASN 125 HD21 ASN 125 18.329 5.660 1.705 937 H LEU 126 H LEU 126 16.061 2.583 0.596 938 HA LEU 126 HA LEU 126 14.246 4.400 2.021 939 HB2 LEU 126 HB2 LEU 126 15.263 5.064 -0.091 940 HB3 LEU 126 HB3 LEU 126 14.661 3.616 -0.898 941 HG LEU 126 HG LEU 126 12.343 4.401 -0.649 942 HD11 LEU 126 HD11 LEU 126 11.868 6.714 0.059 943 HD12 LEU 126 HD12 LEU 126 12.560 5.808 1.393 944 HD13 LEU 126 HD13 LEU 126 13.581 6.952 0.481 945 HD21 LEU 126 HD21 LEU 126 14.239 6.405 -1.902 946 HD22 LEU 126 HD22 LEU 126 13.645 4.911 -2.658 947 HD23 LEU 126 HD23 LEU 126 12.505 6.215 -2.284 948 H ILE 127 H ILE 127 13.846 1.318 0.111 949 HA ILE 127 HA ILE 127 10.996 1.364 0.432 950 HB ILE 127 HB ILE 127 11.013 -1.004 -0.196 951 HG12 ILE 127 HG12 ILE 127 14.029 -0.792 0.026 952 HG13 ILE 127 HG13 ILE 127 12.952 -1.896 0.867 953 HG21 ILE 127 HG21 ILE 127 11.769 -0.586 -2.486 954 HG22 ILE 127 HG22 ILE 127 11.126 0.927 -1.841 955 HG23 ILE 127 HG23 ILE 127 12.879 0.693 -1.938 956 HD11 ILE 127 HD11 ILE 127 12.404 -2.939 -1.364 957 HD12 ILE 127 HD12 ILE 127 13.681 -1.908 -2.077 958 HD13 ILE 127 HD13 ILE 127 14.100 -3.111 -0.849 959 H ALA 128 H ALA 128 13.477 0.132 2.640 960 HA ALA 128 HA ALA 128 11.623 -1.224 4.330 961 HB1 ALA 128 HB1 ALA 128 14.330 0.050 4.975 962 HB2 ALA 128 HB2 ALA 128 13.484 -1.151 5.979 963 HB3 ALA 128 HB3 ALA 128 14.071 -1.601 4.363 964 H LYS 129 H LYS 129 12.267 2.196 3.925 965 HA LYS 129 HA LYS 129 10.994 3.027 6.465 966 HB2 LYS 129 HB2 LYS 129 12.005 4.635 4.076 967 HB3 LYS 129 HB3 LYS 129 11.381 5.320 5.576 968 HG2 LYS 129 HG2 LYS 129 13.190 4.370 6.871 969 HG3 LYS 129 HG3 LYS 129 13.808 3.477 5.472 970 HD2 LYS 129 HD2 LYS 129 14.195 5.619 4.269 971 HD3 LYS 129 HD3 LYS 129 13.667 6.523 5.695 972 HE2 LYS 129 HE2 LYS 129 16.046 4.599 5.579 973 HE3 LYS 129 HE3 LYS 129 16.151 6.353 5.402 974 HZ1 LYS 129 HZ1 LYS 129 15.213 4.963 7.866 975 HZ2 LYS 129 HZ2 LYS 129 16.643 5.721 7.678 976 HZ3 LYS 129 HZ3 LYS 129 15.267 6.591 7.669 977 H ILE 130 H ILE 130 10.190 3.061 2.976 978 HA ILE 130 HA ILE 130 7.542 4.193 3.674 979 HB ILE 130 HB ILE 130 7.356 4.991 1.396 980 HG12 ILE 130 HG12 ILE 130 9.299 5.173 -0.061 981 HG13 ILE 130 HG13 ILE 130 10.249 4.141 0.988 982 HG21 ILE 130 HG21 ILE 130 9.925 5.854 2.779 983 HG22 ILE 130 HG22 ILE 130 8.875 6.821 1.726 984 HG23 ILE 130 HG23 ILE 130 8.290 6.305 3.305 985 HD11 ILE 130 HD11 ILE 130 8.812 2.223 0.431 986 HD12 ILE 130 HD12 ILE 130 7.752 3.278 -0.541 987 HD13 ILE 130 HD13 ILE 130 9.430 2.979 -1.039 988 H SER 131 H SER 131 8.441 1.086 3.199 989 HA SER 131 HA SER 131 6.359 -0.049 1.638 990 HB2 SER 131 HB2 SER 131 8.229 -1.291 2.648 991 HB3 SER 131 HB3 SER 131 7.539 -1.045 4.266 992 HG SER 131 HG SER 131 5.743 -2.287 3.648 Start of MODEL 15 1 H MET 1 H1 MET 1 2.833 0.188 2.213 2 HA MET 1 HA MET 1 3.516 -0.415 0.102 3 HB2 MET 1 HB2 MET 1 1.599 -1.878 -0.435 4 HB3 MET 1 HB3 MET 1 0.580 -0.462 -0.742 5 HG2 MET 1 HG2 MET 1 2.036 0.199 -2.624 6 HG3 MET 1 HG3 MET 1 3.159 -1.103 -2.231 7 HE1 MET 1 HE1 MET 1 2.794 -1.300 -5.015 8 HE2 MET 1 HE2 MET 1 3.342 -2.737 -4.122 9 HE3 MET 1 HE3 MET 1 2.078 -2.888 -5.362 10 H LYS 2 H LYS 2 4.495 1.297 -0.742 11 HA LYS 2 HA LYS 2 2.958 3.764 -1.463 12 HB2 LYS 2 HB2 LYS 2 5.528 3.589 0.160 13 HB3 LYS 2 HB3 LYS 2 5.068 5.043 -0.717 14 HG2 LYS 2 HG2 LYS 2 2.858 5.035 0.457 15 HG3 LYS 2 HG3 LYS 2 3.405 3.671 1.436 16 HD2 LYS 2 HD2 LYS 2 5.091 4.970 2.517 17 HD3 LYS 2 HD3 LYS 2 4.884 6.342 1.420 18 HE2 LYS 2 HE2 LYS 2 2.518 5.283 3.010 19 HE3 LYS 2 HE3 LYS 2 3.710 6.312 3.814 20 HZ1 LYS 2 HZ1 LYS 2 2.409 7.203 1.281 21 HZ2 LYS 2 HZ2 LYS 2 1.788 7.537 2.776 22 HZ3 LYS 2 HZ3 LYS 2 3.284 8.066 2.368 23 H LYS 3 H LYS 3 4.128 5.172 -2.975 24 HA LYS 3 HA LYS 3 5.424 3.497 -5.097 25 HB2 LYS 3 HB2 LYS 3 3.840 6.063 -5.476 26 HB3 LYS 3 HB3 LYS 3 4.586 5.112 -6.732 27 HG2 LYS 3 HG2 LYS 3 2.400 4.443 -6.898 28 HG3 LYS 3 HG3 LYS 3 3.142 3.142 -5.987 29 HD2 LYS 3 HD2 LYS 3 0.903 3.658 -5.143 30 HD3 LYS 3 HD3 LYS 3 2.101 3.971 -3.901 31 HE2 LYS 3 HE2 LYS 3 2.080 6.420 -4.779 32 HE3 LYS 3 HE3 LYS 3 0.615 5.969 -5.651 33 HZ1 LYS 3 HZ1 LYS 3 -0.261 5.291 -3.349 34 HZ2 LYS 3 HZ2 LYS 3 1.103 6.007 -2.717 35 HZ3 LYS 3 HZ3 LYS 3 -0.001 6.900 -3.527 36 H VAL 4 H VAL 4 7.272 4.063 -6.015 37 HA VAL 4 HA VAL 4 8.640 6.567 -5.088 38 HB VAL 4 HB VAL 4 10.152 3.980 -5.467 39 HG11 VAL 4 HG11 VAL 4 11.508 5.966 -5.877 40 HG12 VAL 4 HG12 VAL 4 10.986 6.667 -4.326 41 HG13 VAL 4 HG13 VAL 4 11.971 5.189 -4.375 42 HG21 VAL 4 HG21 VAL 4 10.451 3.973 -3.007 43 HG22 VAL 4 HG22 VAL 4 9.237 5.264 -2.869 44 HG23 VAL 4 HG23 VAL 4 8.782 3.669 -3.493 45 H MET 5 H MET 5 9.758 7.723 -6.604 46 HA MET 5 HA MET 5 9.838 6.655 -9.384 47 HB2 MET 5 HB2 MET 5 7.872 7.955 -9.394 48 HB3 MET 5 HB3 MET 5 8.616 9.243 -8.444 49 HG2 MET 5 HG2 MET 5 8.360 9.936 -10.738 50 HG3 MET 5 HG3 MET 5 10.057 9.861 -10.304 51 HE1 MET 5 HE1 MET 5 7.156 8.141 -12.449 52 HE2 MET 5 HE2 MET 5 7.864 9.654 -13.057 53 HE3 MET 5 HE3 MET 5 8.112 8.150 -13.949 54 H PHE 6 H PHE 6 11.625 6.989 -10.420 55 HA PHE 6 HA PHE 6 13.825 8.515 -9.065 56 HB2 PHE 6 HB2 PHE 6 14.051 6.209 -11.032 57 HB3 PHE 6 HB3 PHE 6 15.333 6.900 -10.056 58 HD1 PHE 6 HD2 PHE 6 15.158 6.674 -7.469 59 HD2 PHE 6 HD1 PHE 6 12.792 4.383 -10.248 60 HE1 PHE 6 HE2 PHE 6 14.577 5.086 -5.662 61 HE2 PHE 6 HE1 PHE 6 12.250 2.777 -8.447 62 HZ PHE 6 HZ PHE 6 13.067 3.177 -6.120 63 H VAL 7 H VAL 7 14.418 10.387 -9.986 64 HA VAL 7 HA VAL 7 14.165 10.831 -12.910 65 HB VAL 7 HB VAL 7 14.060 12.609 -10.528 66 HG11 VAL 7 HG11 VAL 7 14.775 14.619 -11.754 67 HG12 VAL 7 HG12 VAL 7 16.123 13.558 -11.425 68 HG13 VAL 7 HG13 VAL 7 15.416 13.628 -13.070 69 HG21 VAL 7 HG21 VAL 7 12.149 12.122 -12.008 70 HG22 VAL 7 HG22 VAL 7 12.543 13.832 -11.961 71 HG23 VAL 7 HG23 VAL 7 13.022 12.875 -13.388 72 H CYS 8 H CYS 8 15.849 11.093 -14.253 73 HA CYS 8 HA CYS 8 18.590 11.584 -13.192 74 HB2 CYS 8 HB2 CYS 8 18.375 9.193 -13.456 75 HB3 CYS 8 HB3 CYS 8 17.802 9.358 -15.125 76 HG CYS 8 HG CYS 8 20.296 8.390 -15.026 77 H LYS 9 H LYS 9 20.031 12.137 -15.336 78 HA LYS 9 HA LYS 9 18.956 14.514 -16.543 79 HB2 LYS 9 HB2 LYS 9 21.291 12.749 -17.362 80 HB3 LYS 9 HB3 LYS 9 20.874 14.261 -18.179 81 HG2 LYS 9 HG2 LYS 9 21.144 15.538 -16.110 82 HG3 LYS 9 HG3 LYS 9 21.513 14.080 -15.200 83 HD2 LYS 9 HD2 LYS 9 23.176 15.115 -17.552 84 HD3 LYS 9 HD3 LYS 9 23.517 15.443 -15.848 85 HE2 LYS 9 HE2 LYS 9 23.703 12.986 -15.421 86 HE3 LYS 9 HE3 LYS 9 23.453 12.666 -17.142 87 HZ1 LYS 9 HZ1 LYS 9 25.725 14.272 -16.048 88 HZ2 LYS 9 HZ2 LYS 9 25.828 12.696 -16.482 89 HZ3 LYS 9 HZ3 LYS 9 25.521 13.851 -17.618 90 H ARG 10 H ARG 10 19.512 11.455 -18.265 91 HA ARG 10 HA ARG 10 17.140 12.090 -20.005 92 HB2 ARG 10 HB2 ARG 10 18.325 11.408 -21.951 93 HB3 ARG 10 HB3 ARG 10 19.276 12.596 -21.067 94 HG2 ARG 10 HG2 ARG 10 20.356 10.351 -19.977 95 HG3 ARG 10 HG3 ARG 10 19.810 9.665 -21.511 96 HD2 ARG 10 HD2 ARG 10 21.633 12.060 -21.099 97 HD3 ARG 10 HD3 ARG 10 22.128 10.414 -21.592 98 HE ARG 10 HE ARG 10 20.165 11.362 -23.451 99 HH11 ARG 10 HH21 ARG 10 23.512 12.114 -22.687 100 HH12 ARG 10 HH22 ARG 10 23.832 12.666 -24.309 101 HH21 ARG 10 HH11 ARG 10 20.617 12.037 -25.423 102 HH22 ARG 10 HH12 ARG 10 22.201 12.663 -25.837 103 H ASN 11 H ASN 11 17.401 10.292 -17.671 104 HA ASN 11 HA ASN 11 16.926 8.191 -16.897 105 HB2 ASN 11 HB2 ASN 11 14.829 9.253 -17.541 106 HB3 ASN 11 HB3 ASN 11 14.859 8.486 -19.095 107 HD21 ASN 11 HD22 ASN 11 15.456 6.906 -15.778 108 HD22 ASN 11 HD21 ASN 11 14.096 5.823 -16.069 109 H SER 12 H SER 12 19.146 8.113 -18.556 110 HA SER 12 HA SER 12 19.022 5.663 -20.168 111 HB2 SER 12 HB2 SER 12 21.447 6.294 -20.577 112 HB3 SER 12 HB3 SER 12 20.233 7.473 -21.108 113 HG SER 12 HG SER 12 22.076 8.302 -19.740 114 H CYS 13 H CYS 13 20.838 6.868 -17.345 115 HA CYS 13 HA CYS 13 21.243 4.067 -16.360 116 HB2 CYS 13 HB2 CYS 13 23.214 5.135 -17.593 117 HB3 CYS 13 HB3 CYS 13 23.325 6.313 -16.287 118 HG CYS 13 HG CYS 13 25.181 4.396 -16.075 119 H ARG 14 H ARG 14 22.280 4.371 -13.984 120 HA ARG 14 HA ARG 14 21.613 4.427 -11.810 121 HB2 ARG 14 HB2 ARG 14 20.985 7.372 -12.267 122 HB3 ARG 14 HB3 ARG 14 21.399 6.560 -10.743 123 HG2 ARG 14 HG2 ARG 14 23.662 6.002 -11.845 124 HG3 ARG 14 HG3 ARG 14 23.194 7.135 -13.123 125 HD2 ARG 14 HD2 ARG 14 22.700 8.762 -11.058 126 HD3 ARG 14 HD3 ARG 14 23.774 7.675 -10.199 127 HE ARG 14 HE ARG 14 25.609 8.433 -11.491 128 HH11 ARG 14 HH21 ARG 14 22.691 10.069 -12.707 129 HH12 ARG 14 HH22 ARG 14 23.626 10.881 -13.932 130 HH21 ARG 14 HH11 ARG 14 26.641 9.868 -12.669 131 HH22 ARG 14 HH12 ARG 14 25.843 10.774 -13.954 132 H SER 15 H SER 15 19.124 6.631 -13.020 133 HA SER 15 HA SER 15 16.992 5.814 -11.366 134 HB2 SER 15 HB2 SER 15 15.536 6.869 -13.077 135 HB3 SER 15 HB3 SER 15 16.956 7.832 -12.749 136 HG SER 15 HG SER 15 17.932 6.922 -14.727 137 H GLN 16 H GLN 16 17.876 4.435 -14.525 138 HA GLN 16 HA GLN 16 15.674 2.544 -14.629 139 HB2 GLN 16 HB2 GLN 16 18.401 2.571 -16.014 140 HB3 GLN 16 HB3 GLN 16 17.105 1.462 -16.428 141 HG2 GLN 16 HG2 GLN 16 16.753 4.497 -16.552 142 HG3 GLN 16 HG3 GLN 16 17.376 3.550 -17.882 143 HE21 GLN 16 HE22 GLN 16 15.350 4.840 -18.675 144 HE22 GLN 16 HE21 GLN 16 13.855 3.892 -18.698 145 H MET 17 H MET 17 18.995 2.315 -13.300 146 HA MET 17 HA MET 17 18.809 -0.499 -12.520 147 HB2 MET 17 HB2 MET 17 20.572 1.747 -11.415 148 HB3 MET 17 HB3 MET 17 20.716 0.035 -11.046 149 HG2 MET 17 HG2 MET 17 21.276 -0.451 -13.404 150 HG3 MET 17 HG3 MET 17 21.241 1.283 -13.758 151 HE1 MET 17 HE1 MET 17 23.606 -0.993 -14.034 152 HE2 MET 17 HE2 MET 17 23.879 0.656 -14.661 153 HE3 MET 17 HE3 MET 17 25.061 -0.087 -13.550 154 H ALA 18 H ALA 18 18.121 2.623 -10.872 155 HA ALA 18 HA ALA 18 17.464 1.594 -8.325 156 HB1 ALA 18 HB1 ALA 18 16.223 3.999 -9.713 157 HB2 ALA 18 HB2 ALA 18 16.347 3.705 -7.967 158 HB3 ALA 18 HB3 ALA 18 17.811 4.006 -8.911 159 H GLU 19 H GLU 19 15.307 2.080 -11.155 160 HA GLU 19 HA GLU 19 12.978 0.833 -10.035 161 HB2 GLU 19 HB2 GLU 19 13.164 2.241 -12.113 162 HB3 GLU 19 HB3 GLU 19 13.909 0.868 -12.940 163 HG2 GLU 19 HG2 GLU 19 11.839 -0.472 -12.467 164 HG3 GLU 19 HG3 GLU 19 11.120 0.961 -11.719 165 H GLY 20 H GLY 20 15.787 -0.573 -11.749 166 HA2 GLY 20 HA2 GLY 20 15.055 -3.292 -11.857 167 HA3 GLY 20 HA3 GLY 20 16.693 -2.660 -11.721 168 H PHE 21 H PHE 21 16.974 -1.726 -9.159 169 HA PHE 21 HA PHE 21 16.898 -4.167 -7.579 170 HB2 PHE 21 HB2 PHE 21 17.132 -1.410 -6.358 171 HB3 PHE 21 HB3 PHE 21 17.798 -2.923 -5.779 172 HD1 PHE 21 HD1 PHE 21 19.553 -4.077 -7.524 173 HD2 PHE 21 HD2 PHE 21 18.517 0.101 -7.319 174 HE1 PHE 21 HE1 PHE 21 21.657 -3.482 -8.715 175 HE2 PHE 21 HE2 PHE 21 20.567 0.671 -8.589 176 HZ PHE 21 HZ PHE 21 22.124 -1.082 -9.255 177 H ALA 22 H ALA 22 14.889 -1.197 -7.511 178 HA ALA 22 HA ALA 22 13.355 -2.003 -5.259 179 HB1 ALA 22 HB1 ALA 22 13.615 0.330 -6.123 180 HB2 ALA 22 HB2 ALA 22 12.605 -0.092 -7.505 181 HB3 ALA 22 HB3 ALA 22 11.933 -0.133 -5.837 182 H LYS 23 H LYS 23 12.580 -2.499 -8.765 183 HA LYS 23 HA LYS 23 9.983 -3.627 -8.316 184 HB2 LYS 23 HB2 LYS 23 10.054 -4.335 -10.587 185 HB3 LYS 23 HB3 LYS 23 10.937 -2.805 -10.504 186 HG2 LYS 23 HG2 LYS 23 13.048 -4.255 -10.317 187 HG3 LYS 23 HG3 LYS 23 12.069 -5.621 -10.805 188 HD2 LYS 23 HD2 LYS 23 12.549 -3.076 -12.430 189 HD3 LYS 23 HD3 LYS 23 13.401 -4.617 -12.618 190 HE2 LYS 23 HE2 LYS 23 11.138 -5.706 -13.078 191 HE3 LYS 23 HE3 LYS 23 10.463 -4.068 -13.190 192 HZ1 LYS 23 HZ1 LYS 23 12.132 -3.627 -14.991 193 HZ2 LYS 23 HZ2 LYS 23 12.663 -5.184 -14.899 194 HZ3 LYS 23 HZ3 LYS 23 11.130 -4.870 -15.387 195 H THR 24 H THR 24 13.109 -5.018 -8.043 196 HA THR 24 HA THR 24 12.208 -7.820 -7.797 197 HB THR 24 HB THR 24 14.969 -6.681 -7.291 198 HG1 THR 24 HG1 THR 24 14.722 -6.152 -9.348 199 HG21 THR 24 HG21 THR 24 15.724 -8.932 -7.974 200 HG22 THR 24 HG22 THR 24 14.672 -9.039 -6.562 201 HG23 THR 24 HG23 THR 24 14.036 -9.448 -8.179 202 H LEU 25 H LEU 25 13.836 -5.467 -5.612 203 HA LEU 25 HA LEU 25 13.712 -7.315 -3.339 204 HB2 LEU 25 HB2 LEU 25 14.716 -4.433 -3.517 205 HB3 LEU 25 HB3 LEU 25 15.042 -5.543 -2.199 206 HG LEU 25 HG LEU 25 16.010 -5.904 -5.079 207 HD11 LEU 25 HD11 LEU 25 17.032 -4.030 -3.687 208 HD12 LEU 25 HD12 LEU 25 17.617 -5.314 -2.605 209 HD13 LEU 25 HD13 LEU 25 18.156 -5.270 -4.293 210 HD21 LEU 25 HD21 LEU 25 17.452 -7.684 -4.130 211 HD22 LEU 25 HD22 LEU 25 16.606 -7.526 -2.575 212 HD23 LEU 25 HD23 LEU 25 15.737 -8.101 -4.019 213 H GLY 26 H GLY 26 11.932 -4.472 -4.385 214 HA2 GLY 26 HA2 GLY 26 10.277 -4.393 -1.925 215 HA3 GLY 26 HA3 GLY 26 10.342 -3.217 -3.240 216 H ALA 27 H ALA 27 10.164 -6.420 -4.450 217 HA ALA 27 HA ALA 27 7.926 -5.984 -5.978 218 HB1 ALA 27 HB1 ALA 27 7.876 -8.446 -6.294 219 HB2 ALA 27 HB2 ALA 27 9.539 -7.840 -6.292 220 HB3 ALA 27 HB3 ALA 27 8.901 -8.660 -4.857 221 H GLY 28 H GLY 28 5.930 -5.358 -5.356 222 HA2 GLY 28 HA2 GLY 28 3.730 -5.806 -4.749 223 HA3 GLY 28 HA3 GLY 28 4.244 -7.219 -3.823 224 H LYS 29 H LYS 29 6.282 -5.320 -2.435 225 HA LYS 29 HA LYS 29 4.416 -4.082 -0.468 226 HB2 LYS 29 HB2 LYS 29 6.461 -3.574 0.825 227 HB3 LYS 29 HB3 LYS 29 6.030 -5.291 0.669 228 HG2 LYS 29 HG2 LYS 29 7.761 -5.432 -1.199 229 HG3 LYS 29 HG3 LYS 29 8.288 -3.807 -0.720 230 HD2 LYS 29 HD2 LYS 29 8.262 -6.338 0.998 231 HD3 LYS 29 HD3 LYS 29 9.681 -5.667 0.190 232 HE2 LYS 29 HE2 LYS 29 9.549 -3.619 1.553 233 HE3 LYS 29 HE3 LYS 29 8.071 -4.195 2.325 234 HZ1 LYS 29 HZ1 LYS 29 10.006 -4.650 3.730 235 HZ2 LYS 29 HZ2 LYS 29 9.356 -6.069 3.263 236 HZ3 LYS 29 HZ3 LYS 29 10.730 -5.536 2.560 237 H ILE 30 H ILE 30 6.566 -3.116 -3.044 238 HA ILE 30 HA ILE 30 5.317 -0.467 -2.759 239 HB ILE 30 HB ILE 30 7.378 0.722 -3.437 240 HG12 ILE 30 HG12 ILE 30 9.566 -0.190 -3.168 241 HG13 ILE 30 HG13 ILE 30 8.934 -1.771 -2.709 242 HG21 ILE 30 HG21 ILE 30 7.702 -0.898 -0.875 243 HG22 ILE 30 HG22 ILE 30 8.478 0.643 -1.259 244 HG23 ILE 30 HG23 ILE 30 6.717 0.580 -1.058 245 HD11 ILE 30 HD11 ILE 30 8.522 -0.542 -5.464 246 HD12 ILE 30 HD12 ILE 30 9.926 -1.528 -5.034 247 HD13 ILE 30 HD13 ILE 30 8.317 -2.252 -4.979 248 H ALA 31 H ALA 31 5.593 0.880 -4.831 249 HA ALA 31 HA ALA 31 5.860 -0.809 -7.267 250 HB1 ALA 31 HB1 ALA 31 3.623 1.180 -6.746 251 HB2 ALA 31 HB2 ALA 31 4.007 0.500 -8.339 252 HB3 ALA 31 HB3 ALA 31 3.471 -0.565 -7.034 253 H VAL 32 H VAL 32 6.916 0.227 -9.042 254 HA VAL 32 HA VAL 32 8.101 2.876 -8.453 255 HB VAL 32 HB VAL 32 10.230 1.636 -9.370 256 HG11 VAL 32 HG11 VAL 32 9.997 2.855 -7.275 257 HG12 VAL 32 HG12 VAL 32 9.269 1.437 -6.489 258 HG13 VAL 32 HG13 VAL 32 10.960 1.419 -7.037 259 HG21 VAL 32 HG21 VAL 32 9.165 -0.593 -9.665 260 HG22 VAL 32 HG22 VAL 32 10.602 -0.591 -8.638 261 HG23 VAL 32 HG23 VAL 32 8.994 -0.702 -7.895 262 H THR 33 H THR 33 8.984 4.022 -9.980 263 HA THR 33 HA THR 33 8.829 3.213 -12.844 264 HB THR 33 HB THR 33 7.716 5.849 -11.799 265 HG1 THR 33 HG1 THR 33 6.216 3.560 -12.588 266 HG21 THR 33 HG21 THR 33 7.355 4.462 -14.495 267 HG22 THR 33 HG22 THR 33 6.584 5.984 -13.980 268 HG23 THR 33 HG23 THR 33 8.335 5.910 -14.190 269 H SER 34 H SER 34 10.425 4.344 -14.139 270 HA SER 34 HA SER 34 11.966 6.475 -12.734 271 HB2 SER 34 HB2 SER 34 13.959 5.814 -13.840 272 HB3 SER 34 HB3 SER 34 13.333 4.444 -12.917 273 HG SER 34 HG SER 34 12.615 3.514 -14.793 274 H CYS 35 H CYS 35 12.748 8.177 -13.934 275 HA CYS 35 HA CYS 35 11.967 8.579 -16.706 276 HB2 CYS 35 HB2 CYS 35 10.489 10.406 -16.362 277 HB3 CYS 35 HB3 CYS 35 9.901 9.074 -15.353 278 HG CYS 35 HG CYS 35 10.948 9.903 -13.121 279 H GLY 36 H GLY 36 12.510 11.139 -17.162 280 HA2 GLY 36 HA2 GLY 36 14.612 12.158 -15.377 281 HA3 GLY 36 HA3 GLY 36 15.151 11.740 -17.018 282 H LEU 37 H LEU 37 15.486 14.330 -16.217 283 HA LEU 37 HA LEU 37 13.173 15.930 -16.987 284 HB2 LEU 37 HB2 LEU 37 14.722 17.841 -17.096 285 HB3 LEU 37 HB3 LEU 37 14.509 17.083 -15.543 286 HG LEU 37 HG LEU 37 16.859 16.136 -17.192 287 HD11 LEU 37 HD11 LEU 37 16.986 18.581 -17.459 288 HD12 LEU 37 HD12 LEU 37 16.822 18.797 -15.702 289 HD13 LEU 37 HD13 LEU 37 18.259 17.995 -16.378 290 HD21 LEU 37 HD21 LEU 37 16.345 15.209 -14.900 291 HD22 LEU 37 HD22 LEU 37 17.916 16.018 -14.962 292 HD23 LEU 37 HD23 LEU 37 16.508 16.834 -14.239 293 H GLU 38 H GLU 38 15.342 14.126 -18.732 294 HA GLU 38 HA GLU 38 14.110 14.966 -21.287 295 HB2 GLU 38 HB2 GLU 38 17.108 14.447 -20.951 296 HB3 GLU 38 HB3 GLU 38 16.261 14.701 -22.474 297 HG2 GLU 38 HG2 GLU 38 15.610 16.991 -21.714 298 HG3 GLU 38 HG3 GLU 38 16.601 16.765 -20.265 299 H SER 39 H SER 39 14.697 13.146 -22.979 300 HA SER 39 HA SER 39 15.140 10.467 -21.761 301 HB2 SER 39 HB2 SER 39 13.393 9.511 -23.224 302 HB3 SER 39 HB3 SER 39 12.749 10.581 -21.962 303 HG SER 39 HG SER 39 11.862 10.895 -24.156 304 H SER 40 H SER 40 16.317 9.058 -23.021 305 HA SER 40 HA SER 40 16.754 9.736 -25.895 306 HB2 SER 40 HB2 SER 40 19.066 9.120 -24.028 307 HB3 SER 40 HB3 SER 40 19.154 9.317 -25.790 308 HG SER 40 HG SER 40 18.117 11.494 -25.246 309 H ARG 41 H ARG 41 18.168 7.259 -23.734 310 HA ARG 41 HA ARG 41 16.373 5.182 -24.402 311 HB2 ARG 41 HB2 ARG 41 17.751 3.640 -25.644 312 HB3 ARG 41 HB3 ARG 41 17.541 5.090 -26.583 313 HG2 ARG 41 HG2 ARG 41 20.058 4.315 -25.035 314 HG3 ARG 41 HG3 ARG 41 19.793 4.098 -26.753 315 HD2 ARG 41 HD2 ARG 41 20.062 6.756 -25.308 316 HD3 ARG 41 HD3 ARG 41 21.245 5.966 -26.350 317 HE ARG 41 HE ARG 41 18.688 6.396 -27.692 318 HH11 ARG 41 HH11 ARG 41 21.766 7.956 -27.040 319 HH12 ARG 41 HH12 ARG 41 21.607 9.028 -28.402 320 HH21 ARG 41 HH21 ARG 41 18.565 7.781 -29.413 321 HH22 ARG 41 HH22 ARG 41 19.833 8.926 -29.709 322 H VAL 42 H VAL 42 17.018 3.113 -23.237 323 HA VAL 42 HA VAL 42 18.471 3.620 -20.752 324 HB VAL 42 HB VAL 42 17.936 0.856 -21.938 325 HG11 VAL 42 HG11 VAL 42 18.051 0.182 -19.529 326 HG12 VAL 42 HG12 VAL 42 19.586 0.832 -20.085 327 HG13 VAL 42 HG13 VAL 42 18.510 1.839 -19.087 328 HG21 VAL 42 HG21 VAL 42 15.821 1.920 -21.724 329 HG22 VAL 42 HG22 VAL 42 16.044 0.813 -20.359 330 HG23 VAL 42 HG23 VAL 42 16.235 2.573 -20.120 331 H HIS 43 H HIS 43 20.660 3.267 -20.261 332 HA HIS 43 HA HIS 43 22.534 3.121 -22.479 333 HB2 HIS 43 HB2 HIS 43 22.883 4.288 -20.226 334 HB3 HIS 43 HB3 HIS 43 23.152 2.692 -19.529 335 HD2 HIS 43 HD2 HIS 43 24.814 5.445 -21.429 336 HE1 HIS 43 HE1 HIS 43 27.563 2.202 -21.715 337 HE2 HIS 43 HE2 HIS 43 27.219 4.703 -22.149 338 HA PRO 44 HA PRO 44 21.848 -1.150 -22.801 339 HB2 PRO 44 HB2 PRO 44 23.752 -1.985 -24.617 340 HB3 PRO 44 HB3 PRO 44 22.376 -0.913 -25.039 341 HG2 PRO 44 HG2 PRO 44 25.210 -0.072 -24.341 342 HG3 PRO 44 HG3 PRO 44 24.239 0.409 -25.767 343 HD2 PRO 44 HD2 PRO 44 24.368 1.959 -23.542 344 HD3 PRO 44 HD3 PRO 44 22.838 1.798 -24.461 345 H THR 45 H THR 45 25.091 -0.037 -21.812 346 HA THR 45 HA THR 45 25.963 -2.580 -20.713 347 HB THR 45 HB THR 45 26.893 0.205 -19.935 348 HG1 THR 45 HG1 THR 45 27.899 -1.514 -21.977 349 HG21 THR 45 HG21 THR 45 29.060 -1.022 -19.546 350 HG22 THR 45 HG22 THR 45 27.770 -1.470 -18.423 351 HG23 THR 45 HG23 THR 45 28.173 -2.559 -19.765 352 H ALA 46 H ALA 46 23.919 0.065 -19.439 353 HA ALA 46 HA ALA 46 24.011 -0.701 -16.686 354 HB1 ALA 46 HB1 ALA 46 21.659 0.441 -18.273 355 HB2 ALA 46 HB2 ALA 46 21.881 0.516 -16.512 356 HB3 ALA 46 HB3 ALA 46 22.984 1.409 -17.574 357 H ILE 47 H ILE 47 21.901 -1.825 -19.346 358 HA ILE 47 HA ILE 47 20.376 -3.752 -17.856 359 HB ILE 47 HB ILE 47 21.204 -3.597 -20.777 360 HG12 ILE 47 HG12 ILE 47 18.350 -3.232 -20.026 361 HG13 ILE 47 HG13 ILE 47 19.396 -2.004 -19.333 362 HG21 ILE 47 HG21 ILE 47 19.326 -5.186 -21.236 363 HG22 ILE 47 HG22 ILE 47 20.679 -5.928 -20.380 364 HG23 ILE 47 HG23 ILE 47 19.200 -5.494 -19.488 365 HD11 ILE 47 HD11 ILE 47 18.422 -1.433 -21.569 366 HD12 ILE 47 HD12 ILE 47 20.182 -1.282 -21.435 367 HD13 ILE 47 HD13 ILE 47 19.453 -2.684 -22.288 368 H ALA 48 H ALA 48 23.520 -4.095 -19.559 369 HA ALA 48 HA ALA 48 23.854 -6.888 -18.998 370 HB1 ALA 48 HB1 ALA 48 26.171 -6.520 -19.599 371 HB2 ALA 48 HB2 ALA 48 25.103 -5.650 -20.722 372 HB3 ALA 48 HB3 ALA 48 25.972 -4.760 -19.446 373 H MET 49 H MET 49 24.753 -4.004 -17.161 374 HA MET 49 HA MET 49 26.142 -5.391 -15.030 375 HB2 MET 49 HB2 MET 49 24.994 -2.592 -15.239 376 HB3 MET 49 HB3 MET 49 26.044 -3.139 -13.924 377 HG2 MET 49 HG2 MET 49 26.973 -3.405 -16.795 378 HG3 MET 49 HG3 MET 49 27.001 -1.854 -15.982 379 HE1 MET 49 HE1 MET 49 28.885 -5.035 -16.760 380 HE2 MET 49 HE2 MET 49 29.913 -5.343 -15.337 381 HE3 MET 49 HE3 MET 49 28.181 -5.692 -15.263 382 H MET 50 H MET 50 22.747 -4.452 -15.467 383 HA MET 50 HA MET 50 21.989 -5.355 -12.776 384 HB2 MET 50 HB2 MET 50 20.365 -4.825 -15.298 385 HB3 MET 50 HB3 MET 50 19.676 -5.247 -13.732 386 HG2 MET 50 HG2 MET 50 21.285 -2.754 -14.389 387 HG3 MET 50 HG3 MET 50 19.564 -2.845 -14.055 388 HE1 MET 50 HE1 MET 50 19.906 -4.957 -11.237 389 HE2 MET 50 HE2 MET 50 19.367 -3.551 -10.290 390 HE3 MET 50 HE3 MET 50 18.664 -3.859 -11.890 391 H GLU 51 H GLU 51 22.239 -6.897 -16.009 392 HA GLU 51 HA GLU 51 21.073 -9.375 -15.171 393 HB2 GLU 51 HB2 GLU 51 22.851 -8.521 -17.459 394 HB3 GLU 51 HB3 GLU 51 22.507 -10.224 -17.211 395 HG2 GLU 51 HG2 GLU 51 20.237 -8.206 -17.362 396 HG3 GLU 51 HG3 GLU 51 20.997 -8.860 -18.809 397 H GLU 52 H GLU 52 24.363 -8.121 -14.623 398 HA GLU 52 HA GLU 52 25.609 -10.590 -13.887 399 HB2 GLU 52 HB2 GLU 52 25.939 -7.859 -12.600 400 HB3 GLU 52 HB3 GLU 52 26.984 -9.248 -12.338 401 HG2 GLU 52 HG2 GLU 52 27.388 -9.181 -14.904 402 HG3 GLU 52 HG3 GLU 52 26.753 -7.528 -14.803 403 H VAL 53 H VAL 53 23.269 -8.604 -12.129 404 HA VAL 53 HA VAL 53 23.390 -10.426 -9.769 405 HB VAL 53 HB VAL 53 22.122 -8.749 -8.537 406 HG11 VAL 53 HG11 VAL 53 24.660 -7.635 -9.810 407 HG12 VAL 53 HG12 VAL 53 23.947 -7.138 -8.264 408 HG13 VAL 53 HG13 VAL 53 24.587 -8.778 -8.451 409 HG21 VAL 53 HG21 VAL 53 22.560 -6.868 -10.896 410 HG22 VAL 53 HG22 VAL 53 20.989 -7.596 -10.458 411 HG23 VAL 53 HG23 VAL 53 21.805 -6.489 -9.338 412 H GLY 54 H GLY 54 22.004 -10.701 -12.567 413 HA2 GLY 54 HA2 GLY 54 20.281 -11.998 -13.309 414 HA3 GLY 54 HA3 GLY 54 19.921 -12.427 -11.634 415 H ILE 55 H ILE 55 19.814 -9.030 -12.553 416 HA ILE 55 HA ILE 55 16.840 -9.039 -12.237 417 HB ILE 55 HB ILE 55 18.915 -6.895 -11.742 418 HG12 ILE 55 HG12 ILE 55 16.961 -8.368 -9.916 419 HG13 ILE 55 HG13 ILE 55 18.705 -8.597 -9.962 420 HG21 ILE 55 HG21 ILE 55 15.869 -6.665 -11.578 421 HG22 ILE 55 HG22 ILE 55 17.047 -5.432 -11.078 422 HG23 ILE 55 HG23 ILE 55 16.910 -5.850 -12.769 423 HD11 ILE 55 HD11 ILE 55 18.208 -7.288 -8.033 424 HD12 ILE 55 HD12 ILE 55 18.997 -6.213 -9.205 425 HD13 ILE 55 HD13 ILE 55 17.233 -6.140 -8.951 426 H ASP 56 H ASP 56 15.574 -8.525 -13.893 427 HA ASP 56 HA ASP 56 16.865 -7.768 -16.439 428 HB2 ASP 56 HB2 ASP 56 15.499 -9.769 -16.421 429 HB3 ASP 56 HB3 ASP 56 14.096 -8.838 -15.884 430 H ILE 57 H ILE 57 16.964 -5.773 -17.044 431 HA ILE 57 HA ILE 57 14.538 -4.048 -16.844 432 HB ILE 57 HB ILE 57 15.858 -2.054 -16.722 433 HG12 ILE 57 HG12 ILE 57 18.390 -3.595 -16.118 434 HG13 ILE 57 HG13 ILE 57 17.973 -3.196 -17.775 435 HG21 ILE 57 HG21 ILE 57 16.524 -2.167 -14.383 436 HG22 ILE 57 HG22 ILE 57 15.103 -3.184 -14.604 437 HG23 ILE 57 HG23 ILE 57 16.702 -3.936 -14.466 438 HD11 ILE 57 HD11 ILE 57 17.870 -0.795 -17.244 439 HD12 ILE 57 HD12 ILE 57 18.270 -1.140 -15.545 440 HD13 ILE 57 HD13 ILE 57 19.452 -1.480 -16.818 441 H SER 58 H SER 58 15.743 -5.993 -18.942 442 HA SER 58 HA SER 58 16.743 -4.457 -21.133 443 HB2 SER 58 HB2 SER 58 15.257 -7.079 -21.441 444 HB3 SER 58 HB3 SER 58 16.582 -6.436 -22.421 445 HG SER 58 HG SER 58 16.569 -7.530 -19.819 446 H GLY 59 H GLY 59 13.441 -5.295 -20.213 447 HA2 GLY 59 HA2 GLY 59 12.202 -4.299 -22.670 448 HA3 GLY 59 HA3 GLY 59 11.392 -4.855 -21.212 449 H GLN 60 H GLN 60 13.702 -2.455 -20.335 450 HA GLN 60 HA GLN 60 11.520 -0.462 -20.041 451 HB2 GLN 60 HB2 GLN 60 14.233 -0.788 -18.730 452 HB3 GLN 60 HB3 GLN 60 13.344 0.730 -18.673 453 HG2 GLN 60 HG2 GLN 60 11.572 -0.130 -17.419 454 HG3 GLN 60 HG3 GLN 60 11.902 -1.799 -17.886 455 HE21 GLN 60 HE22 GLN 60 14.011 0.746 -16.302 456 HE22 GLN 60 HE21 GLN 60 14.434 -0.342 -14.978 457 H THR 61 H THR 61 11.989 1.748 -20.500 458 HA THR 61 HA THR 61 13.827 2.416 -22.703 459 HB THR 61 HB THR 61 11.921 3.605 -23.854 460 HG1 THR 61 HG1 THR 61 9.829 2.859 -23.423 461 HG21 THR 61 HG21 THR 61 11.100 1.674 -25.075 462 HG22 THR 61 HG22 THR 61 12.820 1.455 -24.725 463 HG23 THR 61 HG23 THR 61 11.605 0.574 -23.771 464 H SER 62 H SER 62 13.936 4.846 -22.912 465 HA SER 62 HA SER 62 13.688 6.026 -20.229 466 HB2 SER 62 HB2 SER 62 14.981 7.881 -21.169 467 HB3 SER 62 HB3 SER 62 15.762 6.284 -21.293 468 HG SER 62 HG SER 62 14.189 7.248 -23.463 469 H ASP 63 H ASP 63 12.346 7.598 -19.597 470 HA ASP 63 HA ASP 63 10.547 8.903 -21.602 471 HB2 ASP 63 HB2 ASP 63 9.720 7.376 -19.131 472 HB3 ASP 63 HB3 ASP 63 8.690 8.604 -19.873 473 HA PRO 64 HA PRO 64 11.508 12.512 -19.344 474 HB2 PRO 64 HB2 PRO 64 9.970 14.381 -20.539 475 HB3 PRO 64 HB3 PRO 64 11.184 13.426 -21.447 476 HG2 PRO 64 HG2 PRO 64 8.197 12.901 -21.224 477 HG3 PRO 64 HG3 PRO 64 9.192 12.968 -22.712 478 HD2 PRO 64 HD2 PRO 64 8.577 10.610 -21.424 479 HD3 PRO 64 HD3 PRO 64 10.106 10.868 -22.320 480 H ILE 65 H ILE 65 11.024 13.764 -17.615 481 HA ILE 65 HA ILE 65 9.067 13.155 -15.714 482 HB ILE 65 HB ILE 65 11.309 14.316 -15.489 483 HG12 ILE 65 HG12 ILE 65 8.944 15.495 -14.035 484 HG13 ILE 65 HG13 ILE 65 9.842 14.011 -13.632 485 HG21 ILE 65 HG21 ILE 65 10.908 16.171 -17.181 486 HG22 ILE 65 HG22 ILE 65 9.787 16.909 -16.008 487 HG23 ILE 65 HG23 ILE 65 11.493 16.729 -15.613 488 HD11 ILE 65 HD11 ILE 65 10.760 16.884 -13.398 489 HD12 ILE 65 HD12 ILE 65 10.663 15.644 -12.138 490 HD13 ILE 65 HD13 ILE 65 11.910 15.524 -13.392 491 H GLU 66 H GLU 66 8.983 15.626 -18.244 492 HA GLU 66 HA GLU 66 6.728 17.095 -17.472 493 HB2 GLU 66 HB2 GLU 66 7.625 16.425 -20.304 494 HB3 GLU 66 HB3 GLU 66 6.547 17.745 -19.840 495 HG2 GLU 66 HG2 GLU 66 8.416 18.667 -18.394 496 HG3 GLU 66 HG3 GLU 66 9.487 17.455 -19.101 497 H ASN 67 H ASN 67 6.694 13.847 -18.851 498 HA ASN 67 HA ASN 67 3.799 14.031 -19.469 499 HB2 ASN 67 HB2 ASN 67 4.126 12.406 -20.936 500 HB3 ASN 67 HB3 ASN 67 5.843 12.712 -20.755 501 HD21 ASN 67 HD22 ASN 67 6.872 11.365 -18.786 502 HD22 ASN 67 HD21 ASN 67 6.213 9.758 -18.575 503 H PHE 68 H PHE 68 5.614 13.295 -16.677 504 HA PHE 68 HA PHE 68 3.804 11.139 -15.752 505 HB2 PHE 68 HB2 PHE 68 6.557 12.098 -14.977 506 HB3 PHE 68 HB3 PHE 68 5.648 11.033 -13.928 507 HD1 PHE 68 HD2 PHE 68 4.455 8.956 -15.377 508 HD2 PHE 68 HD1 PHE 68 8.153 10.983 -16.262 509 HE1 PHE 68 HE2 PHE 68 5.241 6.970 -16.628 510 HE2 PHE 68 HE1 PHE 68 8.930 8.988 -17.529 511 HZ PHE 68 HZ PHE 68 7.482 6.977 -17.704 512 H ASN 69 H ASN 69 3.533 11.093 -13.305 513 HA ASN 69 HA ASN 69 2.137 13.629 -12.533 514 HB2 ASN 69 HB2 ASN 69 0.363 12.041 -11.622 515 HB3 ASN 69 HB3 ASN 69 0.474 12.245 -13.362 516 HD21 ASN 69 HD22 ASN 69 1.871 10.020 -10.863 517 HD22 ASN 69 HD21 ASN 69 1.543 8.575 -11.813 518 H ALA 70 H ALA 70 3.852 14.309 -11.165 519 HA ALA 70 HA ALA 70 5.173 12.895 -9.212 520 HB1 ALA 70 HB1 ALA 70 5.648 15.237 -9.815 521 HB2 ALA 70 HB2 ALA 70 4.154 15.753 -9.012 522 HB3 ALA 70 HB3 ALA 70 5.472 15.054 -8.057 523 H ASP 71 H ASP 71 1.891 14.173 -8.992 524 HA ASP 71 HA ASP 71 1.403 14.079 -6.218 525 HB2 ASP 71 HB2 ASP 71 0.009 15.163 -8.000 526 HB3 ASP 71 HB3 ASP 71 -0.501 13.557 -8.537 527 H ASP 72 H ASP 72 1.529 11.397 -8.488 528 HA ASP 72 HA ASP 72 0.203 9.557 -6.570 529 HB2 ASP 72 HB2 ASP 72 -0.322 9.632 -9.105 530 HB3 ASP 72 HB3 ASP 72 1.253 8.841 -9.284 531 H TYR 73 H TYR 73 3.300 10.714 -6.846 532 HA TYR 73 HA TYR 73 4.560 8.091 -6.161 533 HB2 TYR 73 HB2 TYR 73 6.009 10.612 -6.940 534 HB3 TYR 73 HB3 TYR 73 6.636 8.967 -6.846 535 HD1 TYR 73 HD1 TYR 73 4.458 7.495 -8.416 536 HD2 TYR 73 HD2 TYR 73 6.526 11.215 -9.141 537 HE1 TYR 73 HE1 TYR 73 3.934 7.324 -10.829 538 HE2 TYR 73 HE2 TYR 73 5.960 11.053 -11.568 539 HH TYR 73 HH TYR 73 4.069 8.315 -12.897 540 H ASP 74 H ASP 74 4.247 7.846 -3.987 541 HA ASP 74 HA ASP 74 4.120 9.803 -1.963 542 HB2 ASP 74 HB2 ASP 74 5.313 6.990 -1.871 543 HB3 ASP 74 HB3 ASP 74 4.978 7.976 -0.459 544 H VAL 75 H VAL 75 6.942 8.266 -3.466 545 HA VAL 75 HA VAL 75 8.707 10.307 -2.175 546 HB VAL 75 HB VAL 75 9.467 7.447 -2.798 547 HG11 VAL 75 HG11 VAL 75 11.375 8.907 -2.952 548 HG12 VAL 75 HG12 VAL 75 10.959 9.724 -1.443 549 HG13 VAL 75 HG13 VAL 75 11.489 8.033 -1.420 550 HG21 VAL 75 HG21 VAL 75 8.652 8.725 -0.170 551 HG22 VAL 75 HG22 VAL 75 7.998 7.270 -0.949 552 HG23 VAL 75 HG23 VAL 75 9.631 7.246 -0.270 553 H VAL 76 H VAL 76 10.048 11.395 -3.529 554 HA VAL 76 HA VAL 76 10.484 10.330 -6.301 555 HB VAL 76 HB VAL 76 9.951 13.174 -5.449 556 HG11 VAL 76 HG11 VAL 76 11.934 13.223 -6.973 557 HG12 VAL 76 HG12 VAL 76 11.041 12.237 -8.157 558 HG13 VAL 76 HG13 VAL 76 10.513 13.888 -7.731 559 HG21 VAL 76 HG21 VAL 76 7.981 11.823 -6.053 560 HG22 VAL 76 HG22 VAL 76 8.286 13.069 -7.277 561 HG23 VAL 76 HG23 VAL 76 8.754 11.386 -7.606 562 H ILE 77 H ILE 77 12.527 10.209 -6.950 563 HA ILE 77 HA ILE 77 14.677 11.210 -5.113 564 HB ILE 77 HB ILE 77 14.659 8.744 -6.853 565 HG12 ILE 77 HG12 ILE 77 13.025 8.304 -5.122 566 HG13 ILE 77 HG13 ILE 77 14.463 7.337 -4.893 567 HG21 ILE 77 HG21 ILE 77 16.608 9.640 -4.691 568 HG22 ILE 77 HG22 ILE 77 16.645 8.093 -5.574 569 HG23 ILE 77 HG23 ILE 77 16.921 9.600 -6.433 570 HD11 ILE 77 HD11 ILE 77 13.573 8.172 -2.775 571 HD12 ILE 77 HD12 ILE 77 15.213 8.759 -3.051 572 HD13 ILE 77 HD13 ILE 77 13.829 9.846 -3.287 573 H SER 78 H SER 78 16.333 12.358 -6.070 574 HA SER 78 HA SER 78 16.446 12.442 -9.081 575 HB2 SER 78 HB2 SER 78 16.136 14.651 -8.072 576 HB3 SER 78 HB3 SER 78 17.627 14.424 -7.120 577 HG SER 78 HG SER 78 18.066 15.528 -9.091 578 H LEU 79 H LEU 79 18.173 11.639 -10.111 579 HA LEU 79 HA LEU 79 20.615 10.847 -8.555 580 HB2 LEU 79 HB2 LEU 79 19.310 9.205 -10.769 581 HB3 LEU 79 HB3 LEU 79 20.718 8.806 -9.798 582 HG LEU 79 HG LEU 79 19.026 8.935 -7.757 583 HD11 LEU 79 HD11 LEU 79 17.213 8.289 -10.134 584 HD12 LEU 79 HD12 LEU 79 16.800 8.010 -8.421 585 HD13 LEU 79 HD13 LEU 79 17.013 9.650 -9.026 586 HD21 LEU 79 HD21 LEU 79 19.043 6.635 -9.760 587 HD22 LEU 79 HD22 LEU 79 20.238 6.907 -8.457 588 HD23 LEU 79 HD23 LEU 79 18.549 6.524 -8.060 589 H CYS 80 H CYS 80 20.415 13.287 -9.794 590 HA CYS 80 HA CYS 80 21.674 13.022 -12.510 591 HB2 CYS 80 HB2 CYS 80 20.400 15.477 -11.228 592 HB3 CYS 80 HB3 CYS 80 20.772 15.208 -12.936 593 HG CYS 80 HG CYS 80 18.404 14.054 -10.970 594 H GLY 81 H GLY 81 22.469 14.166 -9.300 595 HA2 GLY 81 HA2 GLY 81 24.631 15.016 -8.638 596 HA3 GLY 81 HA3 GLY 81 24.929 15.562 -10.276 597 H CYS 82 H CYS 82 25.471 17.560 -9.010 598 HA CYS 82 HA CYS 82 23.563 18.994 -7.473 599 HB2 CYS 82 HB2 CYS 82 26.135 19.053 -7.539 600 HB3 CYS 82 HB3 CYS 82 25.960 20.129 -8.949 601 HG CYS 82 HG CYS 82 26.550 21.530 -6.769 602 H GLY 83 H GLY 83 23.966 18.987 -10.929 603 HA2 GLY 83 HA2 GLY 83 23.122 21.627 -11.554 604 HA3 GLY 83 HA3 GLY 83 23.136 20.239 -12.651 605 H VAL 84 H VAL 84 21.101 19.427 -10.117 606 HA VAL 84 HA VAL 84 18.642 20.303 -11.577 607 HB VAL 84 HB VAL 84 19.272 17.458 -10.694 608 HG11 VAL 84 HG11 VAL 84 17.279 16.842 -11.984 609 HG12 VAL 84 HG12 VAL 84 16.847 17.953 -10.690 610 HG13 VAL 84 HG13 VAL 84 16.971 18.558 -12.368 611 HG21 VAL 84 HG21 VAL 84 19.316 17.008 -13.196 612 HG22 VAL 84 HG22 VAL 84 19.391 18.756 -13.441 613 HG23 VAL 84 HG23 VAL 84 20.701 17.918 -12.565 614 H ASN 85 H ASN 85 17.001 20.930 -10.300 615 HA ASN 85 HA ASN 85 16.994 20.081 -7.425 616 HB2 ASN 85 HB2 ASN 85 17.989 22.421 -8.106 617 HB3 ASN 85 HB3 ASN 85 16.304 22.896 -8.314 618 HD21 ASN 85 HD22 ASN 85 18.567 21.345 -5.978 619 HD22 ASN 85 HD21 ASN 85 17.794 22.034 -4.556 620 H LEU 86 H LEU 86 15.068 20.087 -10.188 621 HA LEU 86 HA LEU 86 12.800 20.014 -10.634 622 HB2 LEU 86 HB2 LEU 86 12.891 18.293 -8.136 623 HB3 LEU 86 HB3 LEU 86 11.653 18.271 -9.402 624 HG LEU 86 HG LEU 86 14.508 17.323 -9.655 625 HD11 LEU 86 HD11 LEU 86 13.520 15.160 -9.747 626 HD12 LEU 86 HD12 LEU 86 12.678 15.973 -8.405 627 HD13 LEU 86 HD13 LEU 86 11.891 15.821 -9.992 628 HD21 LEU 86 HD21 LEU 86 12.222 17.596 -11.651 629 HD22 LEU 86 HD22 LEU 86 13.851 18.296 -11.802 630 HD23 LEU 86 HD23 LEU 86 13.636 16.548 -11.932 631 HA PRO 87 HA PRO 87 11.581 23.435 -7.696 632 HB2 PRO 87 HB2 PRO 87 10.725 24.492 -10.393 633 HB3 PRO 87 HB3 PRO 87 11.312 25.396 -8.959 634 HG2 PRO 87 HG2 PRO 87 13.013 24.879 -10.982 635 HG3 PRO 87 HG3 PRO 87 13.550 24.614 -9.291 636 HD2 PRO 87 HD2 PRO 87 12.577 22.560 -11.291 637 HD3 PRO 87 HD3 PRO 87 13.974 22.499 -10.181 638 HA PRO 88 HA PRO 88 7.058 22.850 -9.155 639 HB2 PRO 88 HB2 PRO 88 6.936 20.286 -10.634 640 HB3 PRO 88 HB3 PRO 88 6.246 21.874 -11.057 641 HG2 PRO 88 HG2 PRO 88 8.382 20.780 -12.358 642 HG3 PRO 88 HG3 PRO 88 8.229 22.558 -12.090 643 HD2 PRO 88 HD2 PRO 88 9.825 20.531 -10.501 644 HD3 PRO 88 HD3 PRO 88 10.294 22.157 -11.093 645 H GLU 89 H GLU 89 5.309 20.635 -9.020 646 HA GLU 89 HA GLU 89 5.378 19.876 -6.290 647 HB2 GLU 89 HB2 GLU 89 3.589 18.257 -6.909 648 HB3 GLU 89 HB3 GLU 89 3.280 19.921 -7.372 649 HG2 GLU 89 HG2 GLU 89 4.548 18.151 -9.452 650 HG3 GLU 89 HG3 GLU 89 2.888 17.794 -8.990 651 H TRP 90 H TRP 90 7.351 18.606 -8.683 652 HA TRP 90 HA TRP 90 7.756 15.889 -7.904 653 HB2 TRP 90 HB2 TRP 90 9.477 17.971 -9.229 654 HB3 TRP 90 HB3 TRP 90 10.001 16.307 -8.932 655 HD1 TRP 90 HD1 TRP 90 7.561 18.314 -11.097 656 HE1 TRP 90 HE1 TRP 90 6.422 16.778 -12.805 657 HE3 TRP 90 HE3 TRP 90 9.723 13.905 -9.753 658 HZ2 TRP 90 HZ2 TRP 90 6.413 13.964 -13.465 659 HZ3 TRP 90 HZ3 TRP 90 9.328 11.869 -11.083 660 HH2 TRP 90 HH2 TRP 90 7.671 11.869 -12.925 661 H VAL 91 H VAL 91 8.573 18.792 -6.174 662 HA VAL 91 HA VAL 91 10.111 17.117 -4.205 663 HB VAL 91 HB VAL 91 11.313 19.067 -3.467 664 HG11 VAL 91 HG11 VAL 91 12.758 19.386 -5.411 665 HG12 VAL 91 HG12 VAL 91 12.342 17.690 -5.135 666 HG13 VAL 91 HG13 VAL 91 11.540 18.590 -6.428 667 HG21 VAL 91 HG21 VAL 91 9.979 20.602 -5.738 668 HG22 VAL 91 HG22 VAL 91 9.685 20.857 -4.008 669 HG23 VAL 91 HG23 VAL 91 11.283 21.189 -4.691 670 H THR 92 H THR 92 7.078 18.343 -4.583 671 HA THR 92 HA THR 92 6.757 19.149 -1.736 672 HB THR 92 HB THR 92 4.551 19.864 -2.293 673 HG1 THR 92 HG1 THR 92 3.616 19.458 -4.204 674 HG21 THR 92 HG21 THR 92 6.430 20.783 -4.520 675 HG22 THR 92 HG22 THR 92 4.986 21.627 -3.929 676 HG23 THR 92 HG23 THR 92 6.395 21.441 -2.872 677 H GLN 93 H GLN 93 6.938 16.269 -3.259 678 HA GLN 93 HA GLN 93 4.662 14.883 -2.105 679 HB2 GLN 93 HB2 GLN 93 7.252 13.753 -3.236 680 HB3 GLN 93 HB3 GLN 93 5.767 12.868 -2.895 681 HG2 GLN 93 HG2 GLN 93 6.275 14.876 -5.088 682 HG3 GLN 93 HG3 GLN 93 5.744 13.212 -5.225 683 HE21 GLN 93 HE22 GLN 93 4.658 16.334 -5.552 684 HE22 GLN 93 HE21 GLN 93 2.959 16.081 -5.164 685 H GLU 94 H GLU 94 5.354 12.769 -0.797 686 HA GLU 94 HA GLU 94 5.708 13.875 1.827 687 HB2 GLU 94 HB2 GLU 94 4.215 12.020 1.380 688 HB3 GLU 94 HB3 GLU 94 5.571 10.979 0.930 689 HG2 GLU 94 HG2 GLU 94 6.453 10.993 3.151 690 HG3 GLU 94 HG3 GLU 94 5.316 12.251 3.667 691 H ILE 95 H ILE 95 7.982 12.040 -0.209 692 HA ILE 95 HA ILE 95 10.167 13.143 1.480 693 HB ILE 95 HB ILE 95 10.148 10.259 0.544 694 HG12 ILE 95 HG12 ILE 95 9.877 11.361 3.365 695 HG13 ILE 95 HG13 ILE 95 8.656 10.477 2.436 696 HG21 ILE 95 HG21 ILE 95 12.306 10.062 1.747 697 HG22 ILE 95 HG22 ILE 95 12.414 11.246 0.476 698 HG23 ILE 95 HG23 ILE 95 12.236 11.792 2.161 699 HD11 ILE 95 HD11 ILE 95 9.524 8.896 3.925 700 HD12 ILE 95 HD12 ILE 95 10.289 8.515 2.365 701 HD13 ILE 95 HD13 ILE 95 11.205 9.373 3.629 702 H PHE 96 H PHE 96 11.822 13.955 0.352 703 HA PHE 96 HA PHE 96 12.247 13.103 -2.440 704 HB2 PHE 96 HB2 PHE 96 11.187 15.253 -2.687 705 HB3 PHE 96 HB3 PHE 96 12.282 15.978 -1.512 706 HD1 PHE 96 HD2 PHE 96 12.038 14.607 -4.992 707 HD2 PHE 96 HD1 PHE 96 14.577 16.560 -2.089 708 HE1 PHE 96 HE2 PHE 96 13.773 14.966 -6.721 709 HE2 PHE 96 HE1 PHE 96 16.256 16.993 -3.851 710 HZ PHE 96 HZ PHE 96 15.863 16.199 -6.167 711 H GLU 97 H GLU 97 14.311 12.573 -2.907 712 HA GLU 97 HA GLU 97 16.512 13.465 -1.115 713 HB2 GLU 97 HB2 GLU 97 16.121 10.567 -1.941 714 HB3 GLU 97 HB3 GLU 97 17.532 11.251 -1.131 715 HG2 GLU 97 HG2 GLU 97 16.067 11.846 0.825 716 HG3 GLU 97 HG3 GLU 97 14.735 11.001 0.024 717 H ASP 98 H ASP 98 18.546 13.610 -2.141 718 HA ASP 98 HA ASP 98 18.593 13.019 -5.055 719 HB2 ASP 98 HB2 ASP 98 19.850 14.906 -5.544 720 HB3 ASP 98 HB3 ASP 98 18.422 15.423 -4.655 721 H TRP 99 H TRP 99 19.792 11.388 -5.500 722 HA TRP 99 HA TRP 99 22.039 10.546 -3.729 723 HB2 TRP 99 HB2 TRP 99 20.561 9.007 -5.879 724 HB3 TRP 99 HB3 TRP 99 21.732 8.363 -4.743 725 HD1 TRP 99 HD1 TRP 99 19.918 10.163 -2.351 726 HE1 TRP 99 HE1 TRP 99 17.866 8.925 -1.402 727 HE3 TRP 99 HE3 TRP 99 19.487 6.506 -5.893 728 HZ2 TRP 99 HZ2 TRP 99 16.273 6.656 -2.098 729 HZ3 TRP 99 HZ3 TRP 99 17.675 4.816 -5.744 730 HH2 TRP 99 HH2 TRP 99 16.074 4.860 -3.829 731 H GLN 100 H GLN 100 23.423 12.198 -4.540 732 HA GLN 100 HA GLN 100 24.136 12.275 -7.350 733 HB2 GLN 100 HB2 GLN 100 25.575 13.468 -4.943 734 HB3 GLN 100 HB3 GLN 100 25.843 13.861 -6.651 735 HG2 GLN 100 HG2 GLN 100 23.334 14.560 -6.695 736 HG3 GLN 100 HG3 GLN 100 23.383 14.428 -4.943 737 HE21 GLN 100 HE22 GLN 100 22.848 16.694 -4.779 738 HE22 GLN 100 HE21 GLN 100 24.078 17.923 -5.135 739 H LEU 101 H LEU 101 25.402 10.858 -8.379 740 HA LEU 101 HA LEU 101 27.743 9.560 -7.075 741 HB2 LEU 101 HB2 LEU 101 25.562 8.162 -8.682 742 HB3 LEU 101 HB3 LEU 101 27.116 7.440 -8.317 743 HG LEU 101 HG LEU 101 24.977 8.131 -6.257 744 HD11 LEU 101 HD11 LEU 101 24.731 5.754 -6.045 745 HD12 LEU 101 HD12 LEU 101 24.478 6.244 -7.730 746 HD13 LEU 101 HD13 LEU 101 26.010 5.468 -7.254 747 HD21 LEU 101 HD21 LEU 101 27.247 8.323 -5.241 748 HD22 LEU 101 HD22 LEU 101 26.403 6.888 -4.666 749 HD23 LEU 101 HD23 LEU 101 27.672 6.734 -5.909 750 H GLU 102 H GLU 102 29.138 8.482 -8.892 751 HA GLU 102 HA GLU 102 29.722 10.488 -10.888 752 HB2 GLU 102 HB2 GLU 102 31.528 9.055 -11.545 753 HB3 GLU 102 HB3 GLU 102 31.480 9.232 -9.788 754 HG2 GLU 102 HG2 GLU 102 30.312 6.977 -9.693 755 HG3 GLU 102 HG3 GLU 102 30.647 6.800 -11.418 756 H ASP 103 H ASP 103 30.305 9.479 -13.182 757 HA ASP 103 HA ASP 103 27.651 8.651 -14.270 758 HB2 ASP 103 HB2 ASP 103 28.546 11.084 -14.396 759 HB3 ASP 103 HB3 ASP 103 29.507 10.499 -15.745 760 HA PRO 104 HA PRO 104 30.413 5.303 -15.494 761 HB2 PRO 104 HB2 PRO 104 27.807 3.959 -16.071 762 HB3 PRO 104 HB3 PRO 104 29.254 3.328 -15.217 763 HG2 PRO 104 HG2 PRO 104 27.111 4.129 -13.795 764 HG3 PRO 104 HG3 PRO 104 28.755 4.668 -13.285 765 HD2 PRO 104 HD2 PRO 104 26.734 6.170 -14.992 766 HD3 PRO 104 HD3 PRO 104 27.596 6.707 -13.525 767 H ASP 105 H ASP 105 28.196 6.848 -17.695 768 HA ASP 105 HA ASP 105 28.354 5.152 -19.952 769 HB2 ASP 105 HB2 ASP 105 26.739 6.918 -19.873 770 HB3 ASP 105 HB3 ASP 105 27.995 8.149 -19.695 771 H GLY 106 H GLY 106 30.130 4.401 -20.905 772 HA2 GLY 106 HA2 GLY 106 32.008 4.437 -22.259 773 HA3 GLY 106 HA3 GLY 106 32.072 6.201 -22.142 774 H GLN 107 H GLN 107 31.920 4.553 -19.104 775 HA GLN 107 HA GLN 107 34.760 5.205 -18.531 776 HB2 GLN 107 HB2 GLN 107 32.608 4.255 -16.623 777 HB3 GLN 107 HB3 GLN 107 34.213 4.855 -16.200 778 HG2 GLN 107 HG2 GLN 107 31.972 6.461 -17.494 779 HG3 GLN 107 HG3 GLN 107 32.353 6.403 -15.780 780 HE21 GLN 107 HE22 GLN 107 32.190 8.786 -16.601 781 HE22 GLN 107 HE21 GLN 107 33.760 9.551 -16.902 782 H SER 108 H SER 108 33.354 2.617 -16.772 783 HA SER 108 HA SER 108 34.677 0.398 -18.167 784 HB2 SER 108 HB2 SER 108 35.620 1.333 -15.407 785 HB3 SER 108 HB3 SER 108 36.050 -0.208 -16.166 786 HG SER 108 HG SER 108 37.687 1.377 -16.463 787 H LEU 109 H LEU 109 34.032 -1.665 -17.207 788 HA LEU 109 HA LEU 109 31.375 -1.685 -16.129 789 HB2 LEU 109 HB2 LEU 109 33.470 -3.895 -16.032 790 HB3 LEU 109 HB3 LEU 109 31.735 -4.089 -15.820 791 HG LEU 109 HG LEU 109 33.172 -3.278 -18.378 792 HD11 LEU 109 HD11 LEU 109 31.548 -5.734 -17.624 793 HD12 LEU 109 HD12 LEU 109 32.345 -5.434 -19.185 794 HD13 LEU 109 HD13 LEU 109 33.321 -5.636 -17.715 795 HD21 LEU 109 HD21 LEU 109 30.924 -3.441 -19.461 796 HD22 LEU 109 HD22 LEU 109 30.181 -3.539 -17.847 797 HD23 LEU 109 HD23 LEU 109 31.051 -2.075 -18.343 798 H GLU 110 H GLU 110 34.495 -1.970 -14.491 799 HA GLU 110 HA GLU 110 33.589 -2.350 -11.826 800 HB2 GLU 110 HB2 GLU 110 35.893 -0.529 -12.691 801 HB3 GLU 110 HB3 GLU 110 35.660 -1.274 -11.098 802 HG2 GLU 110 HG2 GLU 110 35.727 -3.506 -12.233 803 HG3 GLU 110 HG3 GLU 110 36.149 -2.669 -13.734 804 H VAL 111 H VAL 111 33.675 0.644 -13.734 805 HA VAL 111 HA VAL 111 32.955 2.280 -11.455 806 HB VAL 111 HB VAL 111 33.073 2.854 -14.426 807 HG11 VAL 111 HG11 VAL 111 31.363 4.353 -13.621 808 HG12 VAL 111 HG12 VAL 111 32.333 4.772 -12.192 809 HG13 VAL 111 HG13 VAL 111 32.858 5.269 -13.812 810 HG21 VAL 111 HG21 VAL 111 35.007 4.247 -13.757 811 HG22 VAL 111 HG22 VAL 111 34.730 3.812 -12.054 812 HG23 VAL 111 HG23 VAL 111 35.241 2.576 -13.223 813 H PHE 112 H PHE 112 31.187 0.744 -14.172 814 HA PHE 112 HA PHE 112 28.556 1.727 -13.437 815 HB2 PHE 112 HB2 PHE 112 29.598 -0.670 -14.951 816 HB3 PHE 112 HB3 PHE 112 27.930 -0.639 -14.401 817 HD1 PHE 112 HD1 PHE 112 26.301 0.947 -15.246 818 HD2 PHE 112 HD2 PHE 112 30.315 0.801 -16.803 819 HE1 PHE 112 HE1 PHE 112 25.548 2.160 -17.287 820 HE2 PHE 112 HE2 PHE 112 29.574 2.052 -18.813 821 HZ PHE 112 HZ PHE 112 27.203 2.763 -19.032 822 H ARG 113 H ARG 113 30.320 -1.249 -12.442 823 HA ARG 113 HA ARG 113 28.396 -2.243 -10.576 824 HB2 ARG 113 HB2 ARG 113 31.429 -2.493 -10.749 825 HB3 ARG 113 HB3 ARG 113 30.462 -3.396 -9.579 826 HG2 ARG 113 HG2 ARG 113 29.306 -4.609 -11.272 827 HG3 ARG 113 HG3 ARG 113 29.813 -3.520 -12.542 828 HD2 ARG 113 HD2 ARG 113 31.006 -5.620 -12.725 829 HD3 ARG 113 HD3 ARG 113 32.114 -4.302 -12.385 830 HE ARG 113 HE ARG 113 32.531 -5.134 -10.221 831 HH11 ARG 113 HH21 ARG 113 30.169 -7.260 -11.785 832 HH12 ARG 113 HH22 ARG 113 30.588 -8.580 -10.721 833 HH21 ARG 113 HH11 ARG 113 32.896 -6.844 -8.877 834 HH22 ARG 113 HH12 ARG 113 32.029 -8.330 -9.088 835 H THR 114 H THR 114 31.051 0.060 -10.064 836 HA THR 114 HA THR 114 30.710 0.437 -7.242 837 HB THR 114 HB THR 114 31.818 2.310 -9.374 838 HG1 THR 114 HG1 THR 114 33.024 0.464 -9.190 839 HG21 THR 114 HG21 THR 114 32.009 2.441 -6.341 840 HG22 THR 114 HG22 THR 114 33.062 3.342 -7.460 841 HG23 THR 114 HG23 THR 114 31.326 3.673 -7.445 842 H VAL 115 H VAL 115 29.176 2.158 -10.000 843 HA VAL 115 HA VAL 115 27.537 3.833 -8.251 844 HB VAL 115 HB VAL 115 27.467 3.216 -11.214 845 HG11 VAL 115 HG11 VAL 115 25.646 5.147 -9.699 846 HG12 VAL 115 HG12 VAL 115 25.833 5.058 -11.461 847 HG13 VAL 115 HG13 VAL 115 25.118 3.695 -10.592 848 HG21 VAL 115 HG21 VAL 115 29.297 4.645 -10.471 849 HG22 VAL 115 HG22 VAL 115 28.105 5.664 -11.295 850 HG23 VAL 115 HG23 VAL 115 28.177 5.657 -9.530 851 H ARG 116 H ARG 116 26.783 0.885 -10.136 852 HA ARG 116 HA ARG 116 24.131 0.446 -9.520 853 HB2 ARG 116 HB2 ARG 116 25.623 -0.915 -11.030 854 HB3 ARG 116 HB3 ARG 116 26.353 -1.662 -9.612 855 HG2 ARG 116 HG2 ARG 116 23.977 -2.511 -9.027 856 HG3 ARG 116 HG3 ARG 116 23.517 -1.934 -10.648 857 HD2 ARG 116 HD2 ARG 116 23.939 -4.281 -10.776 858 HD3 ARG 116 HD3 ARG 116 25.232 -3.422 -11.628 859 HE ARG 116 HE ARG 116 25.779 -4.102 -8.787 860 HH11 ARG 116 HH11 ARG 116 25.906 -5.492 -11.982 861 HH12 ARG 116 HH12 ARG 116 27.467 -6.243 -11.735 862 HH21 ARG 116 HH21 ARG 116 27.614 -5.349 -8.383 863 HH22 ARG 116 HH22 ARG 116 28.199 -6.409 -9.630 864 H GLY 117 H GLY 117 26.833 -0.730 -7.469 865 HA2 GLY 117 HA2 GLY 117 25.291 -1.891 -5.407 866 HA3 GLY 117 HA3 GLY 117 26.923 -1.249 -5.214 867 H GLN 118 H GLN 118 26.429 1.536 -5.639 868 HA GLN 118 HA GLN 118 25.361 2.221 -3.011 869 HB2 GLN 118 HB2 GLN 118 26.367 3.916 -5.323 870 HB3 GLN 118 HB3 GLN 118 25.839 4.577 -3.763 871 HG2 GLN 118 HG2 GLN 118 27.564 3.320 -2.572 872 HG3 GLN 118 HG3 GLN 118 28.047 2.478 -4.044 873 HE21 GLN 118 HE22 GLN 118 29.218 3.645 -5.706 874 HE22 GLN 118 HE21 GLN 118 30.030 5.156 -5.289 875 H VAL 119 H VAL 119 24.113 2.539 -6.307 876 HA VAL 119 HA VAL 119 21.632 3.880 -5.550 877 HB VAL 119 HB VAL 119 22.115 2.135 -7.990 878 HG11 VAL 119 HG11 VAL 119 19.673 2.573 -7.542 879 HG12 VAL 119 HG12 VAL 119 20.022 4.306 -7.462 880 HG13 VAL 119 HG13 VAL 119 20.241 3.418 -8.988 881 HG21 VAL 119 HG21 VAL 119 23.676 4.018 -7.990 882 HG22 VAL 119 HG22 VAL 119 22.433 4.265 -9.205 883 HG23 VAL 119 HG23 VAL 119 22.341 5.151 -7.660 884 H LYS 120 H LYS 120 22.455 0.397 -5.964 885 HA LYS 120 HA LYS 120 19.961 -0.749 -5.156 886 HB2 LYS 120 HB2 LYS 120 21.947 -1.965 -6.106 887 HB3 LYS 120 HB3 LYS 120 22.790 -1.737 -4.577 888 HG2 LYS 120 HG2 LYS 120 21.005 -2.979 -3.396 889 HG3 LYS 120 HG3 LYS 120 20.174 -3.252 -4.938 890 HD2 LYS 120 HD2 LYS 120 22.168 -4.507 -5.771 891 HD3 LYS 120 HD3 LYS 120 22.996 -4.185 -4.226 892 HE2 LYS 120 HE2 LYS 120 21.048 -5.305 -3.048 893 HE3 LYS 120 HE3 LYS 120 20.418 -5.775 -4.630 894 HZ1 LYS 120 HZ1 LYS 120 23.068 -6.602 -3.518 895 HZ2 LYS 120 HZ2 LYS 120 21.759 -7.560 -3.629 896 HZ3 LYS 120 HZ3 LYS 120 22.503 -7.047 -4.991 897 H GLU 121 H GLU 121 22.756 0.208 -3.090 898 HA GLU 121 HA GLU 121 21.540 -0.299 -0.585 899 HB2 GLU 121 HB2 GLU 121 23.563 1.834 -1.429 900 HB3 GLU 121 HB3 GLU 121 22.960 1.718 0.227 901 HG2 GLU 121 HG2 GLU 121 23.585 -0.603 0.316 902 HG3 GLU 121 HG3 GLU 121 24.289 -0.477 -1.334 903 H ARG 122 H ARG 122 21.447 2.830 -2.426 904 HA ARG 122 HA ARG 122 19.840 4.049 -0.402 905 HB2 ARG 122 HB2 ARG 122 20.004 4.741 -3.360 906 HB3 ARG 122 HB3 ARG 122 19.256 5.716 -2.092 907 HG2 ARG 122 HG2 ARG 122 22.200 5.092 -2.319 908 HG3 ARG 122 HG3 ARG 122 21.430 6.619 -2.695 909 HD2 ARG 122 HD2 ARG 122 21.744 5.326 0.028 910 HD3 ARG 122 HD3 ARG 122 22.622 6.716 -0.618 911 HE ARG 122 HE ARG 122 19.852 7.378 -0.689 912 HH11 ARG 122 HH22 ARG 122 22.413 6.974 1.672 913 HH12 ARG 122 HH21 ARG 122 21.625 7.992 2.843 914 HH21 ARG 122 HH11 ARG 122 18.820 8.605 0.934 915 HH22 ARG 122 HH12 ARG 122 19.694 8.912 2.409 916 H VAL 123 H VAL 123 18.771 2.192 -3.277 917 HA VAL 123 HA VAL 123 16.008 2.456 -2.561 918 HB VAL 123 HB VAL 123 17.508 0.391 -4.221 919 HG11 VAL 123 HG11 VAL 123 15.537 -0.780 -3.326 920 HG12 VAL 123 HG12 VAL 123 14.497 0.572 -3.849 921 HG13 VAL 123 HG13 VAL 123 15.377 -0.440 -5.032 922 HG21 VAL 123 HG21 VAL 123 16.329 1.479 -6.101 923 HG22 VAL 123 HG22 VAL 123 15.584 2.627 -4.968 924 HG23 VAL 123 HG23 VAL 123 17.354 2.607 -5.214 925 H GLU 124 H GLU 124 18.220 -0.310 -1.693 926 HA GLU 124 HA GLU 124 16.160 -1.685 -0.243 927 HB2 GLU 124 HB2 GLU 124 19.162 -1.679 0.221 928 HB3 GLU 124 HB3 GLU 124 17.988 -2.767 0.999 929 HG2 GLU 124 HG2 GLU 124 17.291 -3.611 -1.181 930 HG3 GLU 124 HG3 GLU 124 18.576 -2.680 -1.964 931 H ASN 125 H ASN 125 18.323 0.889 0.776 932 HA ASN 125 HA ASN 125 17.364 0.715 3.471 933 HB2 ASN 125 HB2 ASN 125 19.298 1.697 3.893 934 HB3 ASN 125 HB3 ASN 125 19.597 1.830 2.177 935 HD21 ASN 125 HD22 ASN 125 19.212 3.684 1.109 936 HD22 ASN 125 HD21 ASN 125 19.005 5.245 1.931 937 H LEU 126 H LEU 126 16.319 2.553 0.678 938 HA LEU 126 HA LEU 126 14.433 4.221 2.140 939 HB2 LEU 126 HB2 LEU 126 15.275 4.954 -0.013 940 HB3 LEU 126 HB3 LEU 126 14.750 3.457 -0.784 941 HG LEU 126 HG LEU 126 12.382 4.073 -0.459 942 HD11 LEU 126 HD11 LEU 126 12.525 5.489 1.547 943 HD12 LEU 126 HD12 LEU 126 13.512 6.683 0.647 944 HD13 LEU 126 HD13 LEU 126 11.810 6.394 0.221 945 HD21 LEU 126 HD21 LEU 126 12.341 5.894 -2.091 946 HD22 LEU 126 HD22 LEU 126 14.062 6.220 -1.777 947 HD23 LEU 126 HD23 LEU 126 13.572 4.684 -2.520 948 H ILE 127 H ILE 127 13.996 1.151 0.223 949 HA ILE 127 HA ILE 127 11.168 1.190 0.664 950 HB ILE 127 HB ILE 127 11.148 -1.174 0.032 951 HG12 ILE 127 HG12 ILE 127 14.170 -0.980 0.092 952 HG13 ILE 127 HG13 ILE 127 13.147 -2.091 0.985 953 HG21 ILE 127 HG21 ILE 127 11.190 0.767 -1.606 954 HG22 ILE 127 HG22 ILE 127 12.940 0.520 -1.793 955 HG23 ILE 127 HG23 ILE 127 11.794 -0.745 -2.287 956 HD11 ILE 127 HD11 ILE 127 14.183 -3.289 -0.796 957 HD12 ILE 127 HD12 ILE 127 12.472 -3.102 -1.235 958 HD13 ILE 127 HD13 ILE 127 13.721 -2.064 -1.990 959 H ALA 128 H ALA 128 13.730 -0.039 2.747 960 HA ALA 128 HA ALA 128 12.021 -1.448 4.504 961 HB1 ALA 128 HB1 ALA 128 14.682 -0.025 5.039 962 HB2 ALA 128 HB2 ALA 128 13.963 -1.283 6.063 963 HB3 ALA 128 HB3 ALA 128 14.491 -1.682 4.420 964 H LYS 129 H LYS 129 12.501 2.038 4.185 965 HA LYS 129 HA LYS 129 11.059 2.516 6.754 966 HB2 LYS 129 HB2 LYS 129 11.587 4.862 6.476 967 HB3 LYS 129 HB3 LYS 129 12.994 3.812 6.634 968 HG2 LYS 129 HG2 LYS 129 13.509 4.061 4.274 969 HG3 LYS 129 HG3 LYS 129 12.023 4.996 4.011 970 HD2 LYS 129 HD2 LYS 129 12.889 6.745 5.585 971 HD3 LYS 129 HD3 LYS 129 14.383 5.806 5.777 972 HE2 LYS 129 HE2 LYS 129 14.835 6.014 3.341 973 HE3 LYS 129 HE3 LYS 129 13.339 6.945 3.141 974 HZ1 LYS 129 HZ1 LYS 129 14.319 8.659 4.619 975 HZ2 LYS 129 HZ2 LYS 129 15.710 7.801 4.731 976 HZ3 LYS 129 HZ3 LYS 129 15.246 8.427 3.286 977 H ILE 130 H ILE 130 10.493 2.922 3.291 978 HA ILE 130 HA ILE 130 7.831 4.085 3.963 979 HB ILE 130 HB ILE 130 7.601 4.800 1.660 980 HG12 ILE 130 HG12 ILE 130 9.593 4.986 0.214 981 HG13 ILE 130 HG13 ILE 130 10.468 3.879 1.254 982 HG21 ILE 130 HG21 ILE 130 8.541 6.184 3.522 983 HG22 ILE 130 HG22 ILE 130 10.170 5.786 2.939 984 HG23 ILE 130 HG23 ILE 130 9.027 6.669 1.904 985 HD11 ILE 130 HD11 ILE 130 9.600 2.830 -0.810 986 HD12 ILE 130 HD12 ILE 130 8.951 2.054 0.642 987 HD13 ILE 130 HD13 ILE 130 7.939 3.185 -0.291 988 H SER 131 H SER 131 8.741 0.910 3.325 989 HA SER 131 HA SER 131 6.568 0.066 1.646 990 HB2 SER 131 HB2 SER 131 8.118 -1.410 3.787 991 HB3 SER 131 HB3 SER 131 6.864 -2.154 2.762 992 HG SER 131 HG SER 131 9.291 -0.917 1.985 Start of MODEL 16 1 H MET 1 H1 MET 1 2.624 0.261 1.872 2 HA MET 1 HA MET 1 3.293 -0.320 -0.230 3 HB2 MET 1 HB2 MET 1 1.356 -1.807 -0.743 4 HB3 MET 1 HB3 MET 1 0.375 -0.384 -1.125 5 HG2 MET 1 HG2 MET 1 1.972 0.214 -2.945 6 HG3 MET 1 HG3 MET 1 2.988 -1.153 -2.483 7 HE1 MET 1 HE1 MET 1 1.883 -2.697 -5.769 8 HE2 MET 1 HE2 MET 1 2.622 -1.140 -5.328 9 HE3 MET 1 HE3 MET 1 3.164 -2.647 -4.544 10 H LYS 2 H LYS 2 4.262 1.389 -1.073 11 HA LYS 2 HA LYS 2 2.680 3.833 -1.814 12 HB2 LYS 2 HB2 LYS 2 5.269 3.673 -0.207 13 HB3 LYS 2 HB3 LYS 2 4.789 5.136 -1.067 14 HG2 LYS 2 HG2 LYS 2 2.582 5.082 0.123 15 HG3 LYS 2 HG3 LYS 2 3.157 3.727 1.086 16 HD2 LYS 2 HD2 LYS 2 4.831 5.046 2.165 17 HD3 LYS 2 HD3 LYS 2 4.610 6.412 1.064 18 HE2 LYS 2 HE2 LYS 2 2.274 5.340 2.693 19 HE3 LYS 2 HE3 LYS 2 3.456 6.414 3.451 20 HZ1 LYS 2 HZ1 LYS 2 2.111 7.230 0.912 21 HZ2 LYS 2 HZ2 LYS 2 1.467 7.549 2.404 22 HZ3 LYS 2 HZ3 LYS 2 2.939 8.139 2.002 23 H LYS 3 H LYS 3 3.793 5.251 -3.361 24 HA LYS 3 HA LYS 3 5.164 3.585 -5.436 25 HB2 LYS 3 HB2 LYS 3 3.582 6.138 -5.894 26 HB3 LYS 3 HB3 LYS 3 4.375 5.176 -7.112 27 HG2 LYS 3 HG2 LYS 3 2.243 4.402 -7.362 28 HG3 LYS 3 HG3 LYS 3 2.933 3.187 -6.300 29 HD2 LYS 3 HD2 LYS 3 0.665 3.723 -5.592 30 HD3 LYS 3 HD3 LYS 3 1.793 4.252 -4.348 31 HE2 LYS 3 HE2 LYS 3 1.732 6.521 -5.753 32 HE3 LYS 3 HE3 LYS 3 0.192 5.892 -6.328 33 HZ1 LYS 3 HZ1 LYS 3 -0.477 5.747 -3.924 34 HZ2 LYS 3 HZ2 LYS 3 0.985 6.411 -3.497 35 HZ3 LYS 3 HZ3 LYS 3 -0.094 7.279 -4.361 36 H VAL 4 H VAL 4 7.007 4.159 -6.354 37 HA VAL 4 HA VAL 4 8.408 6.622 -5.377 38 HB VAL 4 HB VAL 4 9.860 4.001 -5.688 39 HG11 VAL 4 HG11 VAL 4 10.684 6.675 -4.502 40 HG12 VAL 4 HG12 VAL 4 11.644 5.177 -4.459 41 HG13 VAL 4 HG13 VAL 4 11.296 5.945 -6.008 42 HG21 VAL 4 HG21 VAL 4 8.405 3.694 -3.789 43 HG22 VAL 4 HG22 VAL 4 10.046 3.985 -3.215 44 HG23 VAL 4 HG23 VAL 4 8.836 5.286 -3.135 45 H MET 5 H MET 5 9.566 7.763 -6.873 46 HA MET 5 HA MET 5 9.664 6.687 -9.659 47 HB2 MET 5 HB2 MET 5 7.713 8.030 -9.652 48 HB3 MET 5 HB3 MET 5 8.489 9.299 -8.699 49 HG2 MET 5 HG2 MET 5 8.253 10.004 -10.999 50 HG3 MET 5 HG3 MET 5 9.950 9.878 -10.570 51 HE1 MET 5 HE1 MET 5 7.996 8.260 -14.222 52 HE2 MET 5 HE2 MET 5 7.007 8.410 -12.750 53 HE3 MET 5 HE3 MET 5 7.902 9.811 -13.387 54 H PHE 6 H PHE 6 11.505 7.022 -10.695 55 HA PHE 6 HA PHE 6 13.647 8.504 -9.232 56 HB2 PHE 6 HB2 PHE 6 13.958 6.351 -11.340 57 HB3 PHE 6 HB3 PHE 6 15.235 7.072 -10.357 58 HD1 PHE 6 HD1 PHE 6 15.334 6.611 -7.874 59 HD2 PHE 6 HD2 PHE 6 12.563 4.593 -10.475 60 HE1 PHE 6 HE1 PHE 6 14.754 5.041 -6.030 61 HE2 PHE 6 HE2 PHE 6 11.968 3.056 -8.637 62 HZ PHE 6 HZ PHE 6 12.991 3.321 -6.388 63 H VAL 7 H VAL 7 14.844 10.087 -10.128 64 HA VAL 7 HA VAL 7 14.389 10.879 -12.969 65 HB VAL 7 HB VAL 7 14.223 12.572 -10.498 66 HG11 VAL 7 HG11 VAL 7 14.757 14.613 -11.829 67 HG12 VAL 7 HG12 VAL 7 16.173 13.646 -11.472 68 HG13 VAL 7 HG13 VAL 7 15.443 13.603 -13.106 69 HG21 VAL 7 HG21 VAL 7 13.042 12.795 -13.308 70 HG22 VAL 7 HG22 VAL 7 12.268 11.982 -11.912 71 HG23 VAL 7 HG23 VAL 7 12.565 13.716 -11.859 72 H CYS 8 H CYS 8 16.083 10.850 -14.188 73 HA CYS 8 HA CYS 8 18.804 11.457 -13.079 74 HB2 CYS 8 HB2 CYS 8 18.687 9.097 -13.409 75 HB3 CYS 8 HB3 CYS 8 17.958 9.264 -15.023 76 HG CYS 8 HG CYS 8 20.442 8.324 -15.198 77 H LYS 9 H LYS 9 20.270 12.196 -15.043 78 HA LYS 9 HA LYS 9 19.025 14.559 -16.040 79 HB2 LYS 9 HB2 LYS 9 21.618 13.816 -15.700 80 HB3 LYS 9 HB3 LYS 9 21.503 13.587 -17.445 81 HG2 LYS 9 HG2 LYS 9 20.452 16.009 -17.443 82 HG3 LYS 9 HG3 LYS 9 21.012 16.070 -15.764 83 HD2 LYS 9 HD2 LYS 9 22.715 17.135 -17.022 84 HD3 LYS 9 HD3 LYS 9 23.344 15.550 -16.601 85 HE2 LYS 9 HE2 LYS 9 23.990 15.874 -18.837 86 HE3 LYS 9 HE3 LYS 9 22.638 14.757 -18.952 87 HZ1 LYS 9 HZ1 LYS 9 22.414 17.713 -19.373 88 HZ2 LYS 9 HZ2 LYS 9 22.567 16.626 -20.579 89 HZ3 LYS 9 HZ3 LYS 9 21.214 16.620 -19.678 90 H ARG 10 H ARG 10 19.952 11.662 -17.897 91 HA ARG 10 HA ARG 10 17.740 12.294 -19.812 92 HB2 ARG 10 HB2 ARG 10 18.878 11.797 -21.724 93 HB3 ARG 10 HB3 ARG 10 19.910 12.860 -20.801 94 HG2 ARG 10 HG2 ARG 10 20.305 9.856 -21.213 95 HG3 ARG 10 HG3 ARG 10 21.178 11.179 -21.985 96 HD2 ARG 10 HD2 ARG 10 21.841 11.896 -19.573 97 HD3 ARG 10 HD3 ARG 10 21.342 10.255 -19.118 98 HE ARG 10 HE ARG 10 23.335 10.654 -21.315 99 HH11 ARG 10 HH11 ARG 10 22.787 9.265 -18.152 100 HH12 ARG 10 HH12 ARG 10 24.503 9.146 -17.806 101 HH21 ARG 10 HH21 ARG 10 25.517 10.249 -20.873 102 HH22 ARG 10 HH22 ARG 10 25.960 9.656 -19.284 103 H ASN 11 H ASN 11 17.981 10.303 -17.503 104 HA ASN 11 HA ASN 11 17.253 8.202 -16.975 105 HB2 ASN 11 HB2 ASN 11 15.270 9.548 -17.555 106 HB3 ASN 11 HB3 ASN 11 15.253 8.870 -19.167 107 HD21 ASN 11 HD22 ASN 11 15.655 7.242 -15.865 108 HD22 ASN 11 HD21 ASN 11 14.293 6.209 -16.145 109 H SER 12 H SER 12 19.384 8.128 -18.984 110 HA SER 12 HA SER 12 18.975 5.624 -20.434 111 HB2 SER 12 HB2 SER 12 21.409 6.059 -20.992 112 HB3 SER 12 HB3 SER 12 20.288 7.367 -21.434 113 HG SER 12 HG SER 12 22.242 8.016 -20.256 114 H CYS 13 H CYS 13 20.691 6.772 -17.526 115 HA CYS 13 HA CYS 13 21.134 3.968 -16.577 116 HB2 CYS 13 HB2 CYS 13 23.094 4.932 -17.889 117 HB3 CYS 13 HB3 CYS 13 23.285 6.160 -16.632 118 HG CYS 13 HG CYS 13 25.077 4.146 -16.482 119 H ARG 14 H ARG 14 22.290 4.345 -14.203 120 HA ARG 14 HA ARG 14 21.739 4.627 -11.985 121 HB2 ARG 14 HB2 ARG 14 21.374 7.479 -13.004 122 HB3 ARG 14 HB3 ARG 14 21.264 7.065 -11.287 123 HG2 ARG 14 HG2 ARG 14 23.510 6.232 -11.252 124 HG3 ARG 14 HG3 ARG 14 23.692 6.378 -12.999 125 HD2 ARG 14 HD2 ARG 14 23.094 8.785 -11.244 126 HD3 ARG 14 HD3 ARG 14 24.742 8.199 -11.477 127 HE ARG 14 HE ARG 14 23.913 8.438 -14.069 128 HH11 ARG 14 HH11 ARG 14 23.702 10.804 -11.488 129 HH12 ARG 14 HH12 ARG 14 24.306 12.093 -12.493 130 HH21 ARG 14 HH21 ARG 14 24.600 10.150 -15.316 131 HH22 ARG 14 HH22 ARG 14 24.597 11.762 -14.638 132 H SER 15 H SER 15 19.214 6.781 -13.055 133 HA SER 15 HA SER 15 17.087 5.960 -11.456 134 HB2 SER 15 HB2 SER 15 15.618 6.896 -13.292 135 HB3 SER 15 HB3 SER 15 16.966 7.935 -12.877 136 HG SER 15 HG SER 15 18.120 6.877 -14.785 137 H GLN 16 H GLN 16 17.871 4.502 -14.623 138 HA GLN 16 HA GLN 16 15.588 2.705 -14.592 139 HB2 GLN 16 HB2 GLN 16 18.238 2.579 -16.109 140 HB3 GLN 16 HB3 GLN 16 16.855 1.552 -16.458 141 HG2 GLN 16 HG2 GLN 16 16.627 4.605 -16.545 142 HG3 GLN 16 HG3 GLN 16 17.240 3.670 -17.894 143 HE21 GLN 16 HE22 GLN 16 15.294 4.977 -18.743 144 HE22 GLN 16 HE21 GLN 16 13.784 4.042 -18.815 145 H MET 17 H MET 17 18.974 2.312 -13.417 146 HA MET 17 HA MET 17 18.547 -0.490 -12.632 147 HB2 MET 17 HB2 MET 17 20.766 1.487 -11.898 148 HB3 MET 17 HB3 MET 17 20.716 -0.214 -11.421 149 HG2 MET 17 HG2 MET 17 20.501 -0.709 -13.971 150 HG3 MET 17 HG3 MET 17 21.103 0.925 -14.198 151 HE1 MET 17 HE1 MET 17 23.656 1.624 -13.819 152 HE2 MET 17 HE2 MET 17 23.351 1.397 -12.075 153 HE3 MET 17 HE3 MET 17 24.779 0.664 -12.832 154 H ALA 18 H ALA 18 18.173 2.665 -11.022 155 HA ALA 18 HA ALA 18 17.608 1.679 -8.376 156 HB1 ALA 18 HB1 ALA 18 16.706 3.863 -7.990 157 HB2 ALA 18 HB2 ALA 18 18.055 4.092 -9.115 158 HB3 ALA 18 HB3 ALA 18 16.386 4.129 -9.715 159 H GLU 19 H GLU 19 15.400 2.288 -11.142 160 HA GLU 19 HA GLU 19 13.106 1.109 -9.893 161 HB2 GLU 19 HB2 GLU 19 13.304 2.514 -12.069 162 HB3 GLU 19 HB3 GLU 19 13.674 0.976 -12.859 163 HG2 GLU 19 HG2 GLU 19 11.420 0.271 -11.454 164 HG3 GLU 19 HG3 GLU 19 11.124 2.002 -11.635 165 H GLY 20 H GLY 20 15.678 -0.418 -11.874 166 HA2 GLY 20 HA2 GLY 20 14.832 -3.079 -11.903 167 HA3 GLY 20 HA3 GLY 20 16.517 -2.558 -11.819 168 H PHE 21 H PHE 21 16.840 -1.582 -9.244 169 HA PHE 21 HA PHE 21 16.653 -4.011 -7.649 170 HB2 PHE 21 HB2 PHE 21 17.483 -1.159 -7.004 171 HB3 PHE 21 HB3 PHE 21 17.453 -2.435 -5.790 172 HD1 PHE 21 HD2 PHE 21 18.571 -4.734 -6.534 173 HD2 PHE 21 HD1 PHE 21 19.534 -0.857 -8.152 174 HE1 PHE 21 HE2 PHE 21 20.779 -5.590 -7.254 175 HE2 PHE 21 HE1 PHE 21 21.725 -1.704 -8.883 176 HZ PHE 21 HZ PHE 21 22.359 -4.103 -8.438 177 H ALA 22 H ALA 22 14.827 -0.922 -7.521 178 HA ALA 22 HA ALA 22 13.296 -1.712 -5.244 179 HB1 ALA 22 HB1 ALA 22 11.919 0.209 -5.806 180 HB2 ALA 22 HB2 ALA 22 13.610 0.622 -6.091 181 HB3 ALA 22 HB3 ALA 22 12.590 0.232 -7.476 182 H LYS 23 H LYS 23 12.549 -2.260 -8.739 183 HA LYS 23 HA LYS 23 9.911 -3.327 -8.188 184 HB2 LYS 23 HB2 LYS 23 9.815 -3.916 -10.456 185 HB3 LYS 23 HB3 LYS 23 10.731 -2.404 -10.352 186 HG2 LYS 23 HG2 LYS 23 12.821 -3.945 -10.452 187 HG3 LYS 23 HG3 LYS 23 11.725 -5.181 -11.055 188 HD2 LYS 23 HD2 LYS 23 12.186 -2.425 -12.286 189 HD3 LYS 23 HD3 LYS 23 12.903 -3.930 -12.864 190 HE2 LYS 23 HE2 LYS 23 10.791 -4.813 -13.565 191 HE3 LYS 23 HE3 LYS 23 9.891 -3.535 -12.733 192 HZ1 LYS 23 HZ1 LYS 23 10.915 -1.898 -14.273 193 HZ2 LYS 23 HZ2 LYS 23 11.685 -3.077 -15.082 194 HZ3 LYS 23 HZ3 LYS 23 10.047 -3.027 -15.103 195 H THR 24 H THR 24 13.031 -4.760 -8.129 196 HA THR 24 HA THR 24 12.083 -7.526 -7.787 197 HB THR 24 HB THR 24 14.866 -6.438 -7.312 198 HG1 THR 24 HG1 THR 24 14.538 -6.003 -9.396 199 HG21 THR 24 HG21 THR 24 13.865 -9.230 -8.031 200 HG22 THR 24 HG22 THR 24 15.562 -8.745 -7.854 201 HG23 THR 24 HG23 THR 24 14.496 -8.743 -6.445 202 H LEU 25 H LEU 25 13.802 -5.216 -5.607 203 HA LEU 25 HA LEU 25 13.522 -7.006 -3.300 204 HB2 LEU 25 HB2 LEU 25 14.623 -4.159 -3.493 205 HB3 LEU 25 HB3 LEU 25 14.890 -5.266 -2.159 206 HG LEU 25 HG LEU 25 15.916 -5.662 -5.017 207 HD11 LEU 25 HD11 LEU 25 17.420 -5.070 -2.470 208 HD12 LEU 25 HD12 LEU 25 18.071 -5.124 -4.121 209 HD13 LEU 25 HD13 LEU 25 16.961 -3.818 -3.645 210 HD21 LEU 25 HD21 LEU 25 16.410 -7.305 -2.505 211 HD22 LEU 25 HD22 LEU 25 15.547 -7.847 -3.965 212 HD23 LEU 25 HD23 LEU 25 17.278 -7.485 -4.041 213 H GLY 26 H GLY 26 11.769 -4.271 -4.542 214 HA2 GLY 26 HA2 GLY 26 10.102 -3.972 -2.108 215 HA3 GLY 26 HA3 GLY 26 10.199 -2.908 -3.512 216 H ALA 27 H ALA 27 10.009 -6.122 -4.621 217 HA ALA 27 HA ALA 27 7.602 -5.839 -5.964 218 HB1 ALA 27 HB1 ALA 27 9.269 -7.614 -6.397 219 HB2 ALA 27 HB2 ALA 27 8.838 -8.408 -4.873 220 HB3 ALA 27 HB3 ALA 27 7.650 -8.307 -6.193 221 H GLY 28 H GLY 28 5.628 -5.347 -5.181 222 HA2 GLY 28 HA2 GLY 28 3.553 -5.840 -4.199 223 HA3 GLY 28 HA3 GLY 28 4.292 -7.081 -3.197 224 H LYS 29 H LYS 29 6.431 -5.061 -2.363 225 HA LYS 29 HA LYS 29 5.058 -3.710 -0.121 226 HB2 LYS 29 HB2 LYS 29 7.932 -3.693 -1.149 227 HB3 LYS 29 HB3 LYS 29 7.384 -2.767 0.230 228 HG2 LYS 29 HG2 LYS 29 7.221 -4.570 1.615 229 HG3 LYS 29 HG3 LYS 29 6.694 -5.657 0.332 230 HD2 LYS 29 HD2 LYS 29 8.794 -6.452 1.020 231 HD3 LYS 29 HD3 LYS 29 9.053 -5.685 -0.550 232 HE2 LYS 29 HE2 LYS 29 9.962 -3.659 0.601 233 HE3 LYS 29 HE3 LYS 29 9.640 -4.409 2.164 234 HZ1 LYS 29 HZ1 LYS 29 11.531 -5.525 0.118 235 HZ2 LYS 29 HZ2 LYS 29 11.968 -4.770 1.517 236 HZ3 LYS 29 HZ3 LYS 29 11.205 -6.203 1.577 237 H ILE 30 H ILE 30 6.471 -2.817 -3.248 238 HA ILE 30 HA ILE 30 5.084 -0.196 -3.147 239 HB ILE 30 HB ILE 30 7.124 1.001 -3.872 240 HG12 ILE 30 HG12 ILE 30 9.354 0.158 -3.527 241 HG13 ILE 30 HG13 ILE 30 8.752 -1.432 -3.082 242 HG21 ILE 30 HG21 ILE 30 8.242 1.134 -1.743 243 HG22 ILE 30 HG22 ILE 30 6.508 0.948 -1.457 244 HG23 ILE 30 HG23 ILE 30 7.617 -0.433 -1.225 245 HD11 ILE 30 HD11 ILE 30 8.239 -0.261 -5.834 246 HD12 ILE 30 HD12 ILE 30 9.761 -1.061 -5.433 247 HD13 ILE 30 HD13 ILE 30 8.254 -1.973 -5.339 248 H ALA 31 H ALA 31 5.299 1.006 -5.215 249 HA ALA 31 HA ALA 31 5.675 -0.741 -7.608 250 HB1 ALA 31 HB1 ALA 31 3.419 1.257 -7.194 251 HB2 ALA 31 HB2 ALA 31 3.836 0.500 -8.744 252 HB3 ALA 31 HB3 ALA 31 3.281 -0.502 -7.398 253 H VAL 32 H VAL 32 6.853 0.264 -9.324 254 HA VAL 32 HA VAL 32 7.955 2.945 -8.710 255 HB VAL 32 HB VAL 32 10.121 1.790 -9.581 256 HG11 VAL 32 HG11 VAL 32 9.078 1.648 -6.734 257 HG12 VAL 32 HG12 VAL 32 10.787 1.525 -7.211 258 HG13 VAL 32 HG13 VAL 32 9.902 2.996 -7.547 259 HG21 VAL 32 HG21 VAL 32 8.953 -0.594 -8.136 260 HG22 VAL 32 HG22 VAL 32 9.189 -0.479 -9.901 261 HG23 VAL 32 HG23 VAL 32 10.582 -0.397 -8.815 262 H THR 33 H THR 33 8.771 4.164 -10.222 263 HA THR 33 HA THR 33 8.567 3.349 -13.089 264 HB THR 33 HB THR 33 7.595 6.015 -12.004 265 HG1 THR 33 HG1 THR 33 5.507 5.196 -12.322 266 HG21 THR 33 HG21 THR 33 6.460 6.204 -14.177 267 HG22 THR 33 HG22 THR 33 8.191 6.008 -14.433 268 HG23 THR 33 HG23 THR 33 7.103 4.627 -14.684 269 H SER 34 H SER 34 10.190 4.252 -14.415 270 HA SER 34 HA SER 34 12.198 6.026 -13.111 271 HB2 SER 34 HB2 SER 34 12.762 3.661 -13.906 272 HB3 SER 34 HB3 SER 34 12.608 4.298 -15.557 273 HG SER 34 HG SER 34 14.470 4.854 -13.538 274 H CYS 35 H CYS 35 12.690 7.983 -13.980 275 HA CYS 35 HA CYS 35 12.069 8.611 -16.775 276 HB2 CYS 35 HB2 CYS 35 10.606 10.399 -16.364 277 HB3 CYS 35 HB3 CYS 35 10.006 9.058 -15.371 278 HG CYS 35 HG CYS 35 11.354 9.871 -13.188 279 H GLY 36 H GLY 36 12.651 11.124 -17.097 280 HA2 GLY 36 HA2 GLY 36 14.732 12.107 -15.283 281 HA3 GLY 36 HA3 GLY 36 15.318 11.712 -16.903 282 H LEU 37 H LEU 37 15.565 14.294 -16.015 283 HA LEU 37 HA LEU 37 13.304 15.885 -16.944 284 HB2 LEU 37 HB2 LEU 37 14.775 17.824 -16.844 285 HB3 LEU 37 HB3 LEU 37 14.527 16.981 -15.335 286 HG LEU 37 HG LEU 37 16.975 16.219 -16.937 287 HD11 LEU 37 HD11 LEU 37 16.981 18.690 -17.055 288 HD12 LEU 37 HD12 LEU 37 16.795 18.779 -15.290 289 HD13 LEU 37 HD13 LEU 37 18.268 18.080 -16.007 290 HD21 LEU 37 HD21 LEU 37 17.943 16.086 -14.640 291 HD22 LEU 37 HD22 LEU 37 16.405 16.690 -13.973 292 HD23 LEU 37 HD23 LEU 37 16.473 15.114 -14.761 293 H GLU 38 H GLU 38 15.611 14.134 -18.512 294 HA GLU 38 HA GLU 38 14.666 15.045 -21.159 295 HB2 GLU 38 HB2 GLU 38 17.593 14.340 -20.692 296 HB3 GLU 38 HB3 GLU 38 16.845 14.872 -22.179 297 HG2 GLU 38 HG2 GLU 38 16.490 17.118 -21.243 298 HG3 GLU 38 HG3 GLU 38 17.150 16.605 -19.686 299 H SER 39 H SER 39 15.057 13.176 -22.785 300 HA SER 39 HA SER 39 15.276 10.518 -21.437 301 HB2 SER 39 HB2 SER 39 13.360 9.720 -22.831 302 HB3 SER 39 HB3 SER 39 12.978 10.829 -21.512 303 HG SER 39 HG SER 39 13.160 11.525 -24.282 304 H SER 40 H SER 40 16.831 9.423 -22.251 305 HA SER 40 HA SER 40 16.951 8.944 -25.150 306 HB2 SER 40 HB2 SER 40 18.717 10.695 -24.582 307 HB3 SER 40 HB3 SER 40 19.492 9.466 -23.572 308 HG SER 40 HG SER 40 19.099 9.499 -26.389 309 H ARG 41 H ARG 41 17.603 6.903 -25.633 310 HA ARG 41 HA ARG 41 16.720 4.752 -24.503 311 HB2 ARG 41 HB2 ARG 41 18.110 3.435 -25.898 312 HB3 ARG 41 HB3 ARG 41 17.846 4.951 -26.727 313 HG2 ARG 41 HG2 ARG 41 20.399 4.018 -25.343 314 HG3 ARG 41 HG3 ARG 41 20.106 4.200 -27.065 315 HD2 ARG 41 HD2 ARG 41 19.892 6.675 -26.740 316 HD3 ARG 41 HD3 ARG 41 20.307 6.460 -25.025 317 HE ARG 41 HE ARG 41 22.302 5.207 -26.648 318 HH11 ARG 41 HH11 ARG 41 21.245 8.458 -25.827 319 HH12 ARG 41 HH12 ARG 41 22.847 9.119 -26.040 320 HH21 ARG 41 HH21 ARG 41 24.306 6.128 -26.920 321 HH22 ARG 41 HH22 ARG 41 24.528 7.829 -26.652 322 H VAL 42 H VAL 42 17.081 3.137 -23.099 323 HA VAL 42 HA VAL 42 18.763 3.486 -20.825 324 HB VAL 42 HB VAL 42 18.005 0.692 -21.768 325 HG11 VAL 42 HG11 VAL 42 18.465 1.993 -19.034 326 HG12 VAL 42 HG12 VAL 42 17.973 0.312 -19.316 327 HG13 VAL 42 HG13 VAL 42 19.568 0.857 -19.840 328 HG21 VAL 42 HG21 VAL 42 16.310 2.739 -20.316 329 HG22 VAL 42 HG22 VAL 42 15.966 1.871 -21.836 330 HG23 VAL 42 HG23 VAL 42 16.031 0.962 -20.312 331 H HIS 43 H HIS 43 20.869 3.108 -20.413 332 HA HIS 43 HA HIS 43 22.683 2.660 -22.612 333 HB2 HIS 43 HB2 HIS 43 23.052 4.007 -20.442 334 HB3 HIS 43 HB3 HIS 43 23.343 2.462 -19.641 335 HD2 HIS 43 HD2 HIS 43 24.991 5.115 -21.678 336 HE1 HIS 43 HE1 HIS 43 27.771 1.895 -21.662 337 HE2 HIS 43 HE2 HIS 43 27.419 4.358 -22.267 338 HA PRO 44 HA PRO 44 21.795 -1.584 -22.491 339 HB2 PRO 44 HB2 PRO 44 23.614 -2.682 -24.273 340 HB3 PRO 44 HB3 PRO 44 22.269 -1.598 -24.764 341 HG2 PRO 44 HG2 PRO 44 25.156 -0.828 -24.227 342 HG3 PRO 44 HG3 PRO 44 24.156 -0.432 -25.665 343 HD2 PRO 44 HD2 PRO 44 24.450 1.306 -23.585 344 HD3 PRO 44 HD3 PRO 44 22.886 1.148 -24.454 345 H THR 45 H THR 45 25.099 -0.512 -21.671 346 HA THR 45 HA THR 45 25.942 -2.948 -20.374 347 HB THR 45 HB THR 45 26.830 -0.097 -19.844 348 HG1 THR 45 HG1 THR 45 28.499 -0.705 -21.306 349 HG21 THR 45 HG21 THR 45 27.608 -1.550 -18.051 350 HG22 THR 45 HG22 THR 45 28.100 -2.801 -19.208 351 HG23 THR 45 HG23 THR 45 28.961 -1.242 -19.135 352 H ALA 46 H ALA 46 23.764 -0.323 -19.310 353 HA ALA 46 HA ALA 46 23.808 -1.019 -16.510 354 HB1 ALA 46 HB1 ALA 46 21.724 0.232 -16.409 355 HB2 ALA 46 HB2 ALA 46 22.848 1.096 -17.481 356 HB3 ALA 46 HB3 ALA 46 21.512 0.129 -18.161 357 H ILE 47 H ILE 47 21.840 -2.236 -19.270 358 HA ILE 47 HA ILE 47 20.247 -4.142 -17.803 359 HB ILE 47 HB ILE 47 21.314 -4.193 -20.665 360 HG12 ILE 47 HG12 ILE 47 19.020 -3.851 -21.368 361 HG13 ILE 47 HG13 ILE 47 18.462 -3.863 -19.701 362 HG21 ILE 47 HG21 ILE 47 19.392 -6.160 -19.352 363 HG22 ILE 47 HG22 ILE 47 19.715 -6.049 -21.098 364 HG23 ILE 47 HG23 ILE 47 20.999 -6.529 -20.012 365 HD11 ILE 47 HD11 ILE 47 19.506 -1.697 -19.297 366 HD12 ILE 47 HD12 ILE 47 20.281 -1.740 -20.899 367 HD13 ILE 47 HD13 ILE 47 18.520 -1.623 -20.762 368 H ALA 48 H ALA 48 23.485 -4.431 -19.331 369 HA ALA 48 HA ALA 48 23.897 -7.155 -18.623 370 HB1 ALA 48 HB1 ALA 48 25.979 -4.987 -19.079 371 HB2 ALA 48 HB2 ALA 48 26.226 -6.742 -19.179 372 HB3 ALA 48 HB3 ALA 48 25.169 -5.935 -20.356 373 H MET 49 H MET 49 24.667 -4.183 -16.792 374 HA MET 49 HA MET 49 26.052 -5.587 -14.665 375 HB2 MET 49 HB2 MET 49 24.927 -2.772 -14.770 376 HB3 MET 49 HB3 MET 49 26.056 -3.400 -13.550 377 HG2 MET 49 HG2 MET 49 26.852 -3.611 -16.445 378 HG3 MET 49 HG3 MET 49 26.852 -2.044 -15.674 379 HE1 MET 49 HE1 MET 49 29.878 -5.429 -15.153 380 HE2 MET 49 HE2 MET 49 28.154 -5.827 -15.026 381 HE3 MET 49 HE3 MET 49 28.790 -5.108 -16.526 382 H MET 50 H MET 50 22.640 -4.640 -15.170 383 HA MET 50 HA MET 50 21.864 -5.559 -12.501 384 HB2 MET 50 HB2 MET 50 20.241 -5.066 -15.029 385 HB3 MET 50 HB3 MET 50 19.557 -5.482 -13.461 386 HG2 MET 50 HG2 MET 50 21.123 -2.983 -14.167 387 HG3 MET 50 HG3 MET 50 19.417 -3.086 -13.782 388 HE1 MET 50 HE1 MET 50 19.431 -3.806 -9.948 389 HE2 MET 50 HE2 MET 50 18.575 -3.991 -11.490 390 HE3 MET 50 HE3 MET 50 19.839 -5.165 -11.016 391 H GLU 51 H GLU 51 22.225 -7.151 -15.705 392 HA GLU 51 HA GLU 51 21.029 -9.614 -14.855 393 HB2 GLU 51 HB2 GLU 51 23.051 -8.966 -17.029 394 HB3 GLU 51 HB3 GLU 51 22.497 -10.611 -16.709 395 HG2 GLU 51 HG2 GLU 51 20.142 -9.890 -17.042 396 HG3 GLU 51 HG3 GLU 51 20.699 -8.286 -17.502 397 H GLU 52 H GLU 52 24.288 -8.334 -14.168 398 HA GLU 52 HA GLU 52 25.465 -10.803 -13.313 399 HB2 GLU 52 HB2 GLU 52 25.905 -8.067 -12.075 400 HB3 GLU 52 HB3 GLU 52 26.951 -9.471 -11.927 401 HG2 GLU 52 HG2 GLU 52 27.138 -9.345 -14.528 402 HG3 GLU 52 HG3 GLU 52 26.529 -7.697 -14.326 403 H VAL 53 H VAL 53 23.083 -8.762 -11.758 404 HA VAL 53 HA VAL 53 23.140 -10.412 -9.268 405 HB VAL 53 HB VAL 53 21.845 -8.618 -8.205 406 HG11 VAL 53 HG11 VAL 53 24.310 -8.682 -8.016 407 HG12 VAL 53 HG12 VAL 53 24.446 -7.633 -9.446 408 HG13 VAL 53 HG13 VAL 53 23.678 -7.029 -7.967 409 HG21 VAL 53 HG21 VAL 53 20.819 -7.610 -10.251 410 HG22 VAL 53 HG22 VAL 53 21.625 -6.417 -9.224 411 HG23 VAL 53 HG23 VAL 53 22.421 -6.965 -10.700 412 H GLY 54 H GLY 54 21.816 -10.818 -12.094 413 HA2 GLY 54 HA2 GLY 54 20.098 -12.116 -12.814 414 HA3 GLY 54 HA3 GLY 54 19.670 -12.447 -11.132 415 H ILE 55 H ILE 55 19.662 -9.135 -12.372 416 HA ILE 55 HA ILE 55 16.674 -9.048 -12.174 417 HB ILE 55 HB ILE 55 18.787 -6.975 -11.560 418 HG12 ILE 55 HG12 ILE 55 16.686 -8.362 -9.842 419 HG13 ILE 55 HG13 ILE 55 18.415 -8.674 -9.797 420 HG21 ILE 55 HG21 ILE 55 15.751 -6.643 -11.584 421 HG22 ILE 55 HG22 ILE 55 16.907 -5.463 -10.957 422 HG23 ILE 55 HG23 ILE 55 16.912 -5.829 -12.666 423 HD11 ILE 55 HD11 ILE 55 17.889 -7.337 -7.895 424 HD12 ILE 55 HD12 ILE 55 18.798 -6.313 -9.024 425 HD13 ILE 55 HD13 ILE 55 17.032 -6.135 -8.858 426 H ASP 56 H ASP 56 15.505 -8.064 -13.783 427 HA ASP 56 HA ASP 56 16.969 -7.606 -16.346 428 HB2 ASP 56 HB2 ASP 56 15.594 -9.577 -16.388 429 HB3 ASP 56 HB3 ASP 56 14.197 -8.673 -15.797 430 H ILE 57 H ILE 57 17.071 -5.636 -17.066 431 HA ILE 57 HA ILE 57 14.659 -3.911 -16.983 432 HB ILE 57 HB ILE 57 15.947 -1.891 -16.820 433 HG12 ILE 57 HG12 ILE 57 18.432 -3.377 -15.941 434 HG13 ILE 57 HG13 ILE 57 18.160 -3.070 -17.643 435 HG21 ILE 57 HG21 ILE 57 16.431 -1.922 -14.439 436 HG22 ILE 57 HG22 ILE 57 14.995 -2.893 -14.761 437 HG23 ILE 57 HG23 ILE 57 16.551 -3.699 -14.447 438 HD11 ILE 57 HD11 ILE 57 17.927 -0.660 -17.249 439 HD12 ILE 57 HD12 ILE 57 18.263 -0.907 -15.512 440 HD13 ILE 57 HD13 ILE 57 19.510 -1.288 -16.720 441 H SER 58 H SER 58 15.751 -5.860 -18.982 442 HA SER 58 HA SER 58 16.639 -4.212 -21.249 443 HB2 SER 58 HB2 SER 58 16.645 -6.280 -22.499 444 HB3 SER 58 HB3 SER 58 17.428 -6.537 -20.932 445 HG SER 58 HG SER 58 15.569 -7.532 -20.171 446 H GLY 59 H GLY 59 13.562 -5.356 -20.047 447 HA2 GLY 59 HA2 GLY 59 12.072 -4.848 -22.498 448 HA3 GLY 59 HA3 GLY 59 11.432 -5.328 -20.931 449 H GLN 60 H GLN 60 13.460 -2.458 -20.833 450 HA GLN 60 HA GLN 60 11.053 -0.706 -20.911 451 HB2 GLN 60 HB2 GLN 60 11.751 0.431 -18.862 452 HB3 GLN 60 HB3 GLN 60 11.308 -1.254 -18.618 453 HG2 GLN 60 HG2 GLN 60 13.816 -1.784 -18.674 454 HG3 GLN 60 HG3 GLN 60 14.104 -0.041 -18.551 455 HE21 GLN 60 HE22 GLN 60 13.673 0.947 -16.421 456 HE22 GLN 60 HE21 GLN 60 12.954 -0.024 -15.120 457 H THR 61 H THR 61 11.634 1.633 -20.876 458 HA THR 61 HA THR 61 13.901 2.274 -22.661 459 HB THR 61 HB THR 61 12.272 3.520 -24.108 460 HG1 THR 61 HG1 THR 61 10.084 2.933 -23.956 461 HG21 THR 61 HG21 THR 61 11.518 1.631 -25.413 462 HG22 THR 61 HG22 THR 61 13.124 1.265 -24.780 463 HG23 THR 61 HG23 THR 61 11.688 0.528 -24.029 464 H SER 62 H SER 62 13.908 4.769 -22.942 465 HA SER 62 HA SER 62 13.558 5.915 -20.270 466 HB2 SER 62 HB2 SER 62 14.960 7.613 -20.924 467 HB3 SER 62 HB3 SER 62 15.587 6.140 -21.686 468 HG SER 62 HG SER 62 14.430 6.875 -23.656 469 H ASP 63 H ASP 63 12.361 7.666 -19.676 470 HA ASP 63 HA ASP 63 10.520 8.900 -21.657 471 HB2 ASP 63 HB2 ASP 63 9.645 7.432 -19.169 472 HB3 ASP 63 HB3 ASP 63 8.672 8.719 -19.878 473 HA PRO 64 HA PRO 64 11.663 12.486 -19.409 474 HB2 PRO 64 HB2 PRO 64 10.201 14.414 -20.617 475 HB3 PRO 64 HB3 PRO 64 11.397 13.427 -21.519 476 HG2 PRO 64 HG2 PRO 64 8.397 13.011 -21.350 477 HG3 PRO 64 HG3 PRO 64 9.430 13.040 -22.816 478 HD2 PRO 64 HD2 PRO 64 8.697 10.704 -21.552 479 HD3 PRO 64 HD3 PRO 64 10.255 10.900 -22.406 480 H ILE 65 H ILE 65 11.204 13.763 -17.694 481 HA ILE 65 HA ILE 65 9.206 13.232 -15.821 482 HB ILE 65 HB ILE 65 11.478 14.382 -15.610 483 HG12 ILE 65 HG12 ILE 65 9.155 15.601 -14.137 484 HG13 ILE 65 HG13 ILE 65 9.965 14.064 -13.762 485 HG21 ILE 65 HG21 ILE 65 9.937 16.964 -16.141 486 HG22 ILE 65 HG22 ILE 65 11.641 16.806 -15.731 487 HG23 ILE 65 HG23 ILE 65 11.078 16.230 -17.298 488 HD11 ILE 65 HD11 ILE 65 11.076 16.876 -13.508 489 HD12 ILE 65 HD12 ILE 65 10.877 15.655 -12.251 490 HD13 ILE 65 HD13 ILE 65 12.125 15.433 -13.487 491 H GLU 66 H GLU 66 9.195 15.622 -18.414 492 HA GLU 66 HA GLU 66 6.960 17.184 -17.766 493 HB2 GLU 66 HB2 GLU 66 8.007 16.287 -20.485 494 HB3 GLU 66 HB3 GLU 66 6.834 17.581 -20.266 495 HG2 GLU 66 HG2 GLU 66 9.657 17.615 -19.106 496 HG3 GLU 66 HG3 GLU 66 9.179 18.362 -20.619 497 H ASN 67 H ASN 67 6.889 13.876 -19.039 498 HA ASN 67 HA ASN 67 4.012 14.106 -19.705 499 HB2 ASN 67 HB2 ASN 67 4.314 12.424 -21.110 500 HB3 ASN 67 HB3 ASN 67 6.032 12.717 -20.931 501 HD21 ASN 67 HD22 ASN 67 7.028 11.433 -18.908 502 HD22 ASN 67 HD21 ASN 67 6.350 9.843 -18.642 503 H PHE 68 H PHE 68 5.752 13.435 -16.871 504 HA PHE 68 HA PHE 68 3.888 11.347 -15.898 505 HB2 PHE 68 HB2 PHE 68 6.668 12.247 -15.131 506 HB3 PHE 68 HB3 PHE 68 5.722 11.210 -14.091 507 HD1 PHE 68 HD1 PHE 68 4.473 9.182 -15.611 508 HD2 PHE 68 HD2 PHE 68 8.294 11.056 -16.303 509 HE1 PHE 68 HE1 PHE 68 5.232 7.171 -16.837 510 HE2 PHE 68 HE2 PHE 68 9.051 9.027 -17.521 511 HZ PHE 68 HZ PHE 68 7.526 7.087 -17.792 512 H ASN 69 H ASN 69 3.570 11.364 -13.476 513 HA ASN 69 HA ASN 69 2.330 13.992 -12.738 514 HB2 ASN 69 HB2 ASN 69 0.439 12.534 -11.852 515 HB3 ASN 69 HB3 ASN 69 0.584 12.721 -13.591 516 HD21 ASN 69 HD22 ASN 69 1.789 10.432 -11.059 517 HD22 ASN 69 HD21 ASN 69 1.382 8.997 -11.996 518 H ALA 70 H ALA 70 4.080 14.551 -11.348 519 HA ALA 70 HA ALA 70 5.233 12.994 -9.379 520 HB1 ALA 70 HB1 ALA 70 4.524 15.915 -9.033 521 HB2 ALA 70 HB2 ALA 70 5.819 15.028 -8.236 522 HB3 ALA 70 HB3 ALA 70 5.901 15.328 -9.989 523 H ASP 71 H ASP 71 2.124 14.662 -9.249 524 HA ASP 71 HA ASP 71 1.486 14.649 -6.528 525 HB2 ASP 71 HB2 ASP 71 0.282 15.801 -8.393 526 HB3 ASP 71 HB3 ASP 71 -0.341 14.233 -8.924 527 H ASP 72 H ASP 72 1.461 11.879 -8.709 528 HA ASP 72 HA ASP 72 -0.147 10.231 -6.856 529 HB2 ASP 72 HB2 ASP 72 -0.303 9.995 -9.369 530 HB3 ASP 72 HB3 ASP 72 1.360 9.393 -9.339 531 H TYR 73 H TYR 73 3.257 10.828 -7.558 532 HA TYR 73 HA TYR 73 4.143 8.288 -6.444 533 HB2 TYR 73 HB2 TYR 73 5.834 10.678 -7.152 534 HB3 TYR 73 HB3 TYR 73 6.332 8.992 -7.051 535 HD1 TYR 73 HD1 TYR 73 4.090 7.708 -8.713 536 HD2 TYR 73 HD2 TYR 73 6.487 11.246 -9.327 537 HE1 TYR 73 HE1 TYR 73 3.600 7.622 -11.139 538 HE2 TYR 73 HE2 TYR 73 5.959 11.171 -11.761 539 HH TYR 73 HH TYR 73 3.867 8.626 -13.182 540 H ASP 74 H ASP 74 3.878 8.031 -4.290 541 HA ASP 74 HA ASP 74 3.842 9.918 -2.220 542 HB2 ASP 74 HB2 ASP 74 5.017 7.099 -2.217 543 HB3 ASP 74 HB3 ASP 74 4.646 8.036 -0.775 544 H VAL 75 H VAL 75 6.632 8.448 -3.844 545 HA VAL 75 HA VAL 75 8.447 10.363 -2.447 546 HB VAL 75 HB VAL 75 9.089 7.470 -3.029 547 HG11 VAL 75 HG11 VAL 75 10.643 9.640 -1.569 548 HG12 VAL 75 HG12 VAL 75 11.081 7.922 -1.624 549 HG13 VAL 75 HG13 VAL 75 11.064 8.875 -3.109 550 HG21 VAL 75 HG21 VAL 75 9.160 7.270 -0.495 551 HG22 VAL 75 HG22 VAL 75 8.287 8.816 -0.427 552 HG23 VAL 75 HG23 VAL 75 7.545 7.406 -1.202 553 H VAL 76 H VAL 76 9.965 11.336 -3.721 554 HA VAL 76 HA VAL 76 10.407 10.313 -6.506 555 HB VAL 76 HB VAL 76 9.990 13.155 -5.605 556 HG11 VAL 76 HG11 VAL 76 11.033 12.243 -8.333 557 HG12 VAL 76 HG12 VAL 76 10.602 13.904 -7.844 558 HG13 VAL 76 HG13 VAL 76 11.993 13.128 -7.120 559 HG21 VAL 76 HG21 VAL 76 8.354 13.152 -7.471 560 HG22 VAL 76 HG22 VAL 76 8.744 11.448 -7.804 561 HG23 VAL 76 HG23 VAL 76 7.967 11.916 -6.261 562 H ILE 77 H ILE 77 12.454 10.115 -7.156 563 HA ILE 77 HA ILE 77 14.629 10.879 -5.232 564 HB ILE 77 HB ILE 77 14.402 8.347 -6.887 565 HG12 ILE 77 HG12 ILE 77 12.643 8.257 -5.162 566 HG13 ILE 77 HG13 ILE 77 13.909 7.079 -4.891 567 HG21 ILE 77 HG21 ILE 77 16.240 7.567 -5.353 568 HG22 ILE 77 HG22 ILE 77 16.686 8.855 -6.477 569 HG23 ILE 77 HG23 ILE 77 16.367 9.263 -4.782 570 HD11 ILE 77 HD11 ILE 77 13.727 9.731 -3.404 571 HD12 ILE 77 HD12 ILE 77 13.161 8.175 -2.809 572 HD13 ILE 77 HD13 ILE 77 14.877 8.403 -3.096 573 H SER 78 H SER 78 15.911 12.374 -6.216 574 HA SER 78 HA SER 78 16.490 12.118 -9.124 575 HB2 SER 78 HB2 SER 78 16.156 14.384 -8.207 576 HB3 SER 78 HB3 SER 78 17.575 14.145 -7.156 577 HG SER 78 HG SER 78 18.174 15.151 -9.131 578 H LEU 79 H LEU 79 18.438 11.456 -9.899 579 HA LEU 79 HA LEU 79 20.654 10.867 -7.979 580 HB2 LEU 79 HB2 LEU 79 20.113 9.065 -10.360 581 HB3 LEU 79 HB3 LEU 79 21.215 8.830 -9.019 582 HG LEU 79 HG LEU 79 18.892 8.767 -7.597 583 HD11 LEU 79 HD11 LEU 79 17.212 7.491 -8.892 584 HD12 LEU 79 HD12 LEU 79 17.393 9.138 -9.510 585 HD13 LEU 79 HD13 LEU 79 18.141 7.785 -10.382 586 HD21 LEU 79 HD21 LEU 79 19.960 6.437 -9.241 587 HD22 LEU 79 HD22 LEU 79 20.589 6.987 -7.663 588 HD23 LEU 79 HD23 LEU 79 18.949 6.339 -7.775 589 H CYS 80 H CYS 80 20.020 13.165 -9.784 590 HA CYS 80 HA CYS 80 21.487 12.932 -12.271 591 HB2 CYS 80 HB2 CYS 80 20.392 15.372 -10.800 592 HB3 CYS 80 HB3 CYS 80 21.001 15.346 -12.465 593 HG CYS 80 HG CYS 80 18.371 13.891 -11.084 594 H GLY 81 H GLY 81 22.386 14.514 -9.162 595 HA2 GLY 81 HA2 GLY 81 24.681 14.934 -8.482 596 HA3 GLY 81 HA3 GLY 81 25.193 14.839 -10.156 597 H CYS 82 H CYS 82 26.187 16.869 -10.054 598 HA CYS 82 HA CYS 82 24.930 19.298 -9.176 599 HB2 CYS 82 HB2 CYS 82 27.412 18.783 -9.404 600 HB3 CYS 82 HB3 CYS 82 27.221 18.980 -11.160 601 HG CYS 82 HG CYS 82 28.339 21.132 -10.094 602 H GLY 83 H GLY 83 24.248 21.126 -10.422 603 HA2 GLY 83 HA2 GLY 83 23.469 22.301 -12.259 604 HA3 GLY 83 HA3 GLY 83 23.751 20.896 -13.290 605 H VAL 84 H VAL 84 21.821 19.846 -10.726 606 HA VAL 84 HA VAL 84 19.277 20.436 -12.187 607 HB VAL 84 HB VAL 84 20.274 17.696 -11.354 608 HG11 VAL 84 HG11 VAL 84 17.873 17.786 -10.808 609 HG12 VAL 84 HG12 VAL 84 17.518 18.522 -12.395 610 HG13 VAL 84 HG13 VAL 84 18.107 16.851 -12.264 611 HG21 VAL 84 HG21 VAL 84 21.099 18.451 -13.550 612 HG22 VAL 84 HG22 VAL 84 19.885 17.189 -13.761 613 HG23 VAL 84 HG23 VAL 84 19.433 18.886 -14.026 614 H ASN 85 H ASN 85 17.633 20.913 -11.085 615 HA ASN 85 HA ASN 85 17.062 19.885 -8.397 616 HB2 ASN 85 HB2 ASN 85 17.271 22.857 -9.078 617 HB3 ASN 85 HB3 ASN 85 16.233 22.267 -7.784 618 HD21 ASN 85 HD22 ASN 85 19.587 22.884 -8.678 619 HD22 ASN 85 HD21 ASN 85 20.248 22.387 -7.129 620 H LEU 86 H LEU 86 14.718 20.015 -7.996 621 HA LEU 86 HA LEU 86 13.084 20.109 -10.533 622 HB2 LEU 86 HB2 LEU 86 12.900 18.226 -8.161 623 HB3 LEU 86 HB3 LEU 86 11.776 18.291 -9.522 624 HG LEU 86 HG LEU 86 14.651 17.374 -9.640 625 HD11 LEU 86 HD11 LEU 86 13.683 15.205 -9.805 626 HD12 LEU 86 HD12 LEU 86 12.770 15.992 -8.491 627 HD13 LEU 86 HD13 LEU 86 12.058 15.861 -10.108 628 HD21 LEU 86 HD21 LEU 86 12.443 17.658 -11.733 629 HD22 LEU 86 HD22 LEU 86 14.046 18.429 -11.774 630 HD23 LEU 86 HD23 LEU 86 13.904 16.679 -11.981 631 HA PRO 87 HA PRO 87 11.554 23.110 -7.295 632 HB2 PRO 87 HB2 PRO 87 10.935 25.243 -8.969 633 HB3 PRO 87 HB3 PRO 87 12.505 24.945 -8.170 634 HG2 PRO 87 HG2 PRO 87 11.675 24.213 -10.989 635 HG3 PRO 87 HG3 PRO 87 13.182 25.010 -10.449 636 HD2 PRO 87 HD2 PRO 87 13.119 22.353 -10.939 637 HD3 PRO 87 HD3 PRO 87 14.038 22.991 -9.543 638 HA PRO 88 HA PRO 88 7.192 22.961 -9.250 639 HB2 PRO 88 HB2 PRO 88 7.221 20.395 -10.767 640 HB3 PRO 88 HB3 PRO 88 6.477 21.954 -11.209 641 HG2 PRO 88 HG2 PRO 88 8.704 21.008 -12.428 642 HG3 PRO 88 HG3 PRO 88 8.531 22.768 -12.057 643 HD2 PRO 88 HD2 PRO 88 9.990 20.631 -10.474 644 HD3 PRO 88 HD3 PRO 88 10.548 22.257 -10.981 645 H GLU 89 H GLU 89 5.437 20.806 -9.265 646 HA GLU 89 HA GLU 89 5.194 19.853 -6.649 647 HB2 GLU 89 HB2 GLU 89 3.601 18.187 -7.658 648 HB3 GLU 89 HB3 GLU 89 3.312 19.873 -8.062 649 HG2 GLU 89 HG2 GLU 89 4.286 19.577 -10.286 650 HG3 GLU 89 HG3 GLU 89 4.780 17.939 -9.906 651 H TRP 90 H TRP 90 7.453 18.700 -8.924 652 HA TRP 90 HA TRP 90 7.869 15.993 -8.135 653 HB2 TRP 90 HB2 TRP 90 9.602 18.111 -9.380 654 HB3 TRP 90 HB3 TRP 90 10.144 16.446 -9.080 655 HD1 TRP 90 HD1 TRP 90 7.853 18.459 -11.361 656 HE1 TRP 90 HE1 TRP 90 6.618 16.913 -13.001 657 HE3 TRP 90 HE3 TRP 90 9.810 14.014 -9.861 658 HZ2 TRP 90 HZ2 TRP 90 6.540 14.091 -13.609 659 HZ3 TRP 90 HZ3 TRP 90 9.345 11.950 -11.133 660 HH2 TRP 90 HH2 TRP 90 7.713 11.964 -12.997 661 H VAL 91 H VAL 91 8.600 18.881 -6.333 662 HA VAL 91 HA VAL 91 10.024 17.158 -4.325 663 HB VAL 91 HB VAL 91 11.256 19.062 -3.539 664 HG11 VAL 91 HG11 VAL 91 12.370 17.710 -5.103 665 HG12 VAL 91 HG12 VAL 91 11.574 18.497 -6.463 666 HG13 VAL 91 HG13 VAL 91 12.756 19.392 -5.479 667 HG21 VAL 91 HG21 VAL 91 10.011 20.652 -5.826 668 HG22 VAL 91 HG22 VAL 91 9.714 20.912 -4.097 669 HG23 VAL 91 HG23 VAL 91 11.323 21.196 -4.774 670 H THR 92 H THR 92 7.040 18.448 -4.802 671 HA THR 92 HA THR 92 6.623 19.296 -1.986 672 HB THR 92 HB THR 92 4.400 19.914 -2.624 673 HG1 THR 92 HG1 THR 92 3.559 19.459 -4.577 674 HG21 THR 92 HG21 THR 92 6.220 21.531 -3.190 675 HG22 THR 92 HG22 THR 92 6.300 20.843 -4.829 676 HG23 THR 92 HG23 THR 92 4.820 21.651 -4.272 677 H GLN 93 H GLN 93 6.913 16.358 -3.405 678 HA GLN 93 HA GLN 93 4.588 15.007 -2.305 679 HB2 GLN 93 HB2 GLN 93 7.163 13.818 -3.409 680 HB3 GLN 93 HB3 GLN 93 5.649 12.975 -3.087 681 HG2 GLN 93 HG2 GLN 93 6.231 14.985 -5.268 682 HG3 GLN 93 HG3 GLN 93 5.659 13.331 -5.420 683 HE21 GLN 93 HE22 GLN 93 4.658 16.482 -5.742 684 HE22 GLN 93 HE21 GLN 93 2.964 16.297 -5.321 685 H GLU 94 H GLU 94 5.259 12.843 -1.028 686 HA GLU 94 HA GLU 94 5.558 13.949 1.624 687 HB2 GLU 94 HB2 GLU 94 4.006 12.171 1.181 688 HB3 GLU 94 HB3 GLU 94 5.302 11.075 0.692 689 HG2 GLU 94 HG2 GLU 94 6.196 10.968 2.895 690 HG3 GLU 94 HG3 GLU 94 5.177 12.314 3.450 691 H ILE 95 H ILE 95 7.786 12.031 -0.388 692 HA ILE 95 HA ILE 95 9.989 13.091 1.291 693 HB ILE 95 HB ILE 95 9.869 10.177 0.445 694 HG12 ILE 95 HG12 ILE 95 9.700 11.435 3.210 695 HG13 ILE 95 HG13 ILE 95 8.445 10.520 2.365 696 HG21 ILE 95 HG21 ILE 95 12.047 9.943 1.590 697 HG22 ILE 95 HG22 ILE 95 12.166 11.082 0.276 698 HG23 ILE 95 HG23 ILE 95 12.052 11.683 1.949 699 HD11 ILE 95 HD11 ILE 95 9.302 9.008 3.927 700 HD12 ILE 95 HD12 ILE 95 10.062 8.533 2.395 701 HD13 ILE 95 HD13 ILE 95 10.986 9.455 3.598 702 H PHE 96 H PHE 96 11.643 13.881 0.143 703 HA PHE 96 HA PHE 96 11.979 13.045 -2.679 704 HB2 PHE 96 HB2 PHE 96 11.043 15.237 -2.858 705 HB3 PHE 96 HB3 PHE 96 12.141 15.871 -1.631 706 HD1 PHE 96 HD1 PHE 96 11.976 14.540 -5.148 707 HD2 PHE 96 HD2 PHE 96 14.389 16.533 -2.168 708 HE1 PHE 96 HE1 PHE 96 13.764 14.898 -6.818 709 HE2 PHE 96 HE2 PHE 96 16.127 16.972 -3.879 710 HZ PHE 96 HZ PHE 96 15.831 16.147 -6.200 711 H GLU 97 H GLU 97 14.026 12.456 -3.222 712 HA GLU 97 HA GLU 97 16.264 13.077 -1.344 713 HB2 GLU 97 HB2 GLU 97 15.806 10.378 -2.591 714 HB3 GLU 97 HB3 GLU 97 17.206 10.845 -1.658 715 HG2 GLU 97 HG2 GLU 97 14.366 10.740 -0.560 716 HG3 GLU 97 HG3 GLU 97 15.557 9.471 -0.390 717 H ASP 98 H ASP 98 18.363 13.013 -2.261 718 HA ASP 98 HA ASP 98 18.554 13.082 -5.218 719 HB2 ASP 98 HB2 ASP 98 18.179 15.390 -4.605 720 HB3 ASP 98 HB3 ASP 98 19.435 15.312 -3.368 721 H TRP 99 H TRP 99 19.503 11.010 -4.922 722 HA TRP 99 HA TRP 99 21.957 10.771 -3.302 723 HB2 TRP 99 HB2 TRP 99 20.826 8.630 -5.077 724 HB3 TRP 99 HB3 TRP 99 21.909 8.475 -3.708 725 HD1 TRP 99 HD1 TRP 99 18.530 8.107 -4.759 726 HE1 TRP 99 HE1 TRP 99 16.855 7.747 -2.808 727 HE3 TRP 99 HE3 TRP 99 21.428 9.663 -0.849 728 HZ2 TRP 99 HZ2 TRP 99 16.971 7.564 0.026 729 HZ3 TRP 99 HZ3 TRP 99 20.583 9.452 1.484 730 HH2 TRP 99 HH2 TRP 99 18.392 8.375 1.943 731 H GLN 100 H GLN 100 23.153 12.387 -4.449 732 HA GLN 100 HA GLN 100 23.688 12.279 -7.229 733 HB2 GLN 100 HB2 GLN 100 25.377 13.504 -5.000 734 HB3 GLN 100 HB3 GLN 100 25.565 13.813 -6.727 735 HG2 GLN 100 HG2 GLN 100 23.132 14.645 -6.728 736 HG3 GLN 100 HG3 GLN 100 23.167 14.527 -4.972 737 HE21 GLN 100 HE22 GLN 100 22.537 16.889 -5.450 738 HE22 GLN 100 HE21 GLN 100 23.894 18.030 -5.498 739 H LEU 101 H LEU 101 25.041 11.088 -8.469 740 HA LEU 101 HA LEU 101 27.354 9.612 -7.355 741 HB2 LEU 101 HB2 LEU 101 25.010 8.377 -8.874 742 HB3 LEU 101 HB3 LEU 101 26.574 7.591 -8.699 743 HG LEU 101 HG LEU 101 24.698 8.257 -6.385 744 HD11 LEU 101 HD11 LEU 101 23.902 6.473 -7.888 745 HD12 LEU 101 HD12 LEU 101 25.427 5.585 -7.617 746 HD13 LEU 101 HD13 LEU 101 24.306 5.894 -6.266 747 HD21 LEU 101 HD21 LEU 101 26.202 6.824 -5.056 748 HD22 LEU 101 HD22 LEU 101 27.313 6.705 -6.444 749 HD23 LEU 101 HD23 LEU 101 27.048 8.258 -5.624 750 H GLU 102 H GLU 102 28.658 8.635 -9.206 751 HA GLU 102 HA GLU 102 29.064 10.629 -11.299 752 HB2 GLU 102 HB2 GLU 102 30.913 9.215 -11.976 753 HB3 GLU 102 HB3 GLU 102 31.015 9.633 -10.271 754 HG2 GLU 102 HG2 GLU 102 29.832 6.972 -11.118 755 HG3 GLU 102 HG3 GLU 102 31.564 7.218 -11.127 756 H ASP 103 H ASP 103 29.393 9.834 -13.545 757 HA ASP 103 HA ASP 103 26.956 8.345 -14.390 758 HB2 ASP 103 HB2 ASP 103 27.153 10.711 -14.986 759 HB3 ASP 103 HB3 ASP 103 28.577 10.344 -15.968 760 HA PRO 104 HA PRO 104 30.073 5.265 -15.438 761 HB2 PRO 104 HB2 PRO 104 27.665 3.633 -16.129 762 HB3 PRO 104 HB3 PRO 104 29.105 3.191 -15.151 763 HG2 PRO 104 HG2 PRO 104 26.805 3.803 -13.905 764 HG3 PRO 104 HG3 PRO 104 28.343 4.546 -13.328 765 HD2 PRO 104 HD2 PRO 104 26.299 5.743 -15.251 766 HD3 PRO 104 HD3 PRO 104 26.957 6.426 -13.733 767 H ASP 105 H ASP 105 27.949 6.590 -17.815 768 HA ASP 105 HA ASP 105 28.375 4.893 -20.031 769 HB2 ASP 105 HB2 ASP 105 26.678 6.603 -20.067 770 HB3 ASP 105 HB3 ASP 105 27.881 7.877 -19.854 771 H GLY 106 H GLY 106 30.211 4.250 -20.921 772 HA2 GLY 106 HA2 GLY 106 32.221 4.337 -22.049 773 HA3 GLY 106 HA3 GLY 106 32.197 6.103 -21.939 774 H GLN 107 H GLN 107 31.878 4.498 -18.894 775 HA GLN 107 HA GLN 107 34.618 5.362 -18.138 776 HB2 GLN 107 HB2 GLN 107 32.408 4.297 -16.354 777 HB3 GLN 107 HB3 GLN 107 33.930 5.027 -15.837 778 HG2 GLN 107 HG2 GLN 107 31.693 6.434 -17.340 779 HG3 GLN 107 HG3 GLN 107 31.937 6.442 -15.602 780 HE21 GLN 107 HE22 GLN 107 31.685 8.795 -16.455 781 HE22 GLN 107 HE21 GLN 107 33.219 9.652 -16.677 782 H SER 108 H SER 108 33.143 2.630 -16.531 783 HA SER 108 HA SER 108 34.503 0.527 -17.955 784 HB2 SER 108 HB2 SER 108 36.031 -0.194 -16.246 785 HB3 SER 108 HB3 SER 108 36.392 1.510 -16.563 786 HG SER 108 HG SER 108 36.304 1.182 -14.346 787 H LEU 109 H LEU 109 34.007 -1.617 -16.922 788 HA LEU 109 HA LEU 109 31.315 -1.735 -15.881 789 HB2 LEU 109 HB2 LEU 109 33.486 -3.863 -15.725 790 HB3 LEU 109 HB3 LEU 109 31.746 -4.101 -15.537 791 HG LEU 109 HG LEU 109 33.197 -3.289 -18.094 792 HD11 LEU 109 HD11 LEU 109 33.482 -5.617 -17.373 793 HD12 LEU 109 HD12 LEU 109 31.714 -5.819 -17.286 794 HD13 LEU 109 HD13 LEU 109 32.506 -5.517 -18.853 795 HD21 LEU 109 HD21 LEU 109 30.222 -3.729 -17.603 796 HD22 LEU 109 HD22 LEU 109 31.008 -2.217 -18.101 797 HD23 LEU 109 HD23 LEU 109 30.986 -3.603 -19.202 798 H GLU 110 H GLU 110 34.474 -1.795 -14.279 799 HA GLU 110 HA GLU 110 33.540 -2.218 -11.609 800 HB2 GLU 110 HB2 GLU 110 35.911 -2.301 -12.344 801 HB3 GLU 110 HB3 GLU 110 35.905 -0.539 -12.537 802 HG2 GLU 110 HG2 GLU 110 35.449 -0.264 -10.128 803 HG3 GLU 110 HG3 GLU 110 35.335 -2.010 -9.925 804 H VAL 111 H VAL 111 33.731 0.846 -13.491 805 HA VAL 111 HA VAL 111 32.694 2.455 -11.294 806 HB VAL 111 HB VAL 111 32.931 2.979 -14.254 807 HG11 VAL 111 HG11 VAL 111 31.954 4.849 -12.052 808 HG12 VAL 111 HG12 VAL 111 32.513 5.391 -13.644 809 HG13 VAL 111 HG13 VAL 111 31.078 4.365 -13.526 810 HG21 VAL 111 HG21 VAL 111 35.050 2.890 -12.902 811 HG22 VAL 111 HG22 VAL 111 34.729 4.503 -13.542 812 HG23 VAL 111 HG23 VAL 111 34.393 4.144 -11.835 813 H PHE 112 H PHE 112 31.082 0.719 -14.035 814 HA PHE 112 HA PHE 112 28.413 1.640 -13.375 815 HB2 PHE 112 HB2 PHE 112 29.562 -0.743 -14.815 816 HB3 PHE 112 HB3 PHE 112 27.901 -0.799 -14.244 817 HD1 PHE 112 HD1 PHE 112 26.138 0.581 -15.151 818 HD2 PHE 112 HD2 PHE 112 30.160 0.763 -16.686 819 HE1 PHE 112 HE1 PHE 112 25.303 1.683 -17.223 820 HE2 PHE 112 HE2 PHE 112 29.334 1.900 -18.726 821 HZ PHE 112 HZ PHE 112 26.919 2.384 -18.980 822 H ARG 113 H ARG 113 30.247 -1.233 -12.251 823 HA ARG 113 HA ARG 113 28.273 -2.203 -10.407 824 HB2 ARG 113 HB2 ARG 113 31.310 -2.442 -10.444 825 HB3 ARG 113 HB3 ARG 113 30.272 -3.355 -9.344 826 HG2 ARG 113 HG2 ARG 113 29.177 -4.505 -11.200 827 HG3 ARG 113 HG3 ARG 113 29.999 -3.505 -12.384 828 HD2 ARG 113 HD2 ARG 113 32.181 -4.343 -11.551 829 HD3 ARG 113 HD3 ARG 113 31.307 -5.466 -10.484 830 HE ARG 113 HE ARG 113 30.248 -6.372 -12.639 831 HH11 ARG 113 HH11 ARG 113 33.601 -5.253 -12.532 832 HH12 ARG 113 HH12 ARG 113 34.079 -6.334 -13.804 833 HH21 ARG 113 HH21 ARG 113 30.961 -7.755 -14.140 834 HH22 ARG 113 HH22 ARG 113 32.609 -7.709 -14.726 835 H THR 114 H THR 114 30.915 0.133 -9.924 836 HA THR 114 HA THR 114 30.534 0.622 -7.125 837 HB THR 114 HB THR 114 31.579 2.452 -9.331 838 HG1 THR 114 HG1 THR 114 32.850 0.666 -9.060 839 HG21 THR 114 HG21 THR 114 32.764 3.622 -7.460 840 HG22 THR 114 HG22 THR 114 31.018 3.888 -7.482 841 HG23 THR 114 HG23 THR 114 31.732 2.744 -6.311 842 H VAL 115 H VAL 115 28.954 2.165 -9.966 843 HA VAL 115 HA VAL 115 27.241 3.855 -8.306 844 HB VAL 115 HB VAL 115 27.266 3.094 -11.237 845 HG11 VAL 115 HG11 VAL 115 24.877 3.449 -10.721 846 HG12 VAL 115 HG12 VAL 115 25.281 4.971 -9.882 847 HG13 VAL 115 HG13 VAL 115 25.533 4.804 -11.637 848 HG21 VAL 115 HG21 VAL 115 27.763 5.564 -11.414 849 HG22 VAL 115 HG22 VAL 115 27.765 5.657 -9.655 850 HG23 VAL 115 HG23 VAL 115 28.986 4.673 -10.492 851 H ARG 116 H ARG 116 26.672 0.775 -10.035 852 HA ARG 116 HA ARG 116 23.991 0.314 -9.388 853 HB2 ARG 116 HB2 ARG 116 25.464 -1.021 -10.944 854 HB3 ARG 116 HB3 ARG 116 26.251 -1.738 -9.535 855 HG2 ARG 116 HG2 ARG 116 23.933 -2.592 -8.845 856 HG3 ARG 116 HG3 ARG 116 23.369 -2.053 -10.438 857 HD2 ARG 116 HD2 ARG 116 23.837 -4.406 -10.566 858 HD3 ARG 116 HD3 ARG 116 25.096 -3.546 -11.466 859 HE ARG 116 HE ARG 116 25.724 -4.163 -8.625 860 HH11 ARG 116 HH11 ARG 116 25.837 -5.618 -11.786 861 HH12 ARG 116 HH12 ARG 116 27.449 -6.274 -11.570 862 HH21 ARG 116 HH21 ARG 116 27.610 -5.348 -8.240 863 HH22 ARG 116 HH22 ARG 116 28.237 -6.364 -9.502 864 H GLY 117 H GLY 117 26.800 -0.692 -7.364 865 HA2 GLY 117 HA2 GLY 117 25.301 -1.918 -5.283 866 HA3 GLY 117 HA3 GLY 117 26.922 -1.229 -5.118 867 H GLN 118 H GLN 118 26.266 1.524 -5.673 868 HA GLN 118 HA GLN 118 25.150 2.283 -3.082 869 HB2 GLN 118 HB2 GLN 118 26.084 3.949 -5.454 870 HB3 GLN 118 HB3 GLN 118 25.509 4.625 -3.913 871 HG2 GLN 118 HG2 GLN 118 27.299 3.529 -2.680 872 HG3 GLN 118 HG3 GLN 118 27.847 2.669 -4.124 873 HE21 GLN 118 HE22 GLN 118 28.883 3.875 -5.851 874 HE22 GLN 118 HE21 GLN 118 29.565 5.470 -5.510 875 H VAL 119 H VAL 119 23.994 2.691 -6.484 876 HA VAL 119 HA VAL 119 21.436 3.772 -5.899 877 HB VAL 119 HB VAL 119 22.249 1.853 -8.127 878 HG11 VAL 119 HG11 VAL 119 19.745 3.524 -7.764 879 HG12 VAL 119 HG12 VAL 119 20.264 2.826 -9.324 880 HG13 VAL 119 HG13 VAL 119 19.851 1.758 -7.979 881 HG21 VAL 119 HG21 VAL 119 21.885 4.886 -8.074 882 HG22 VAL 119 HG22 VAL 119 23.444 4.044 -8.155 883 HG23 VAL 119 HG23 VAL 119 22.313 3.907 -9.499 884 H LYS 120 H LYS 120 22.392 0.303 -5.915 885 HA LYS 120 HA LYS 120 19.884 -0.801 -5.147 886 HB2 LYS 120 HB2 LYS 120 21.891 -2.097 -5.910 887 HB3 LYS 120 HB3 LYS 120 22.700 -1.734 -4.395 888 HG2 LYS 120 HG2 LYS 120 20.848 -2.886 -3.154 889 HG3 LYS 120 HG3 LYS 120 20.105 -3.291 -4.699 890 HD2 LYS 120 HD2 LYS 120 22.273 -4.532 -5.286 891 HD3 LYS 120 HD3 LYS 120 22.817 -4.194 -3.630 892 HE2 LYS 120 HE2 LYS 120 20.617 -5.264 -2.833 893 HE3 LYS 120 HE3 LYS 120 20.363 -5.797 -4.502 894 HZ1 LYS 120 HZ1 LYS 120 22.698 -6.550 -2.786 895 HZ2 LYS 120 HZ2 LYS 120 21.457 -7.536 -3.167 896 HZ3 LYS 120 HZ3 LYS 120 22.495 -7.048 -4.332 897 H GLU 121 H GLU 121 22.643 0.101 -2.963 898 HA GLU 121 HA GLU 121 21.131 -0.520 -0.612 899 HB2 GLU 121 HB2 GLU 121 22.921 0.133 0.632 900 HB3 GLU 121 HB3 GLU 121 23.718 -0.248 -0.898 901 HG2 GLU 121 HG2 GLU 121 23.911 2.119 -1.427 902 HG3 GLU 121 HG3 GLU 121 22.937 2.567 -0.045 903 H ARG 122 H ARG 122 21.376 2.592 -2.336 904 HA ARG 122 HA ARG 122 19.968 4.052 -0.260 905 HB2 ARG 122 HB2 ARG 122 20.160 4.539 -3.284 906 HB3 ARG 122 HB3 ARG 122 19.498 5.695 -2.137 907 HG2 ARG 122 HG2 ARG 122 22.398 4.748 -2.195 908 HG3 ARG 122 HG3 ARG 122 21.765 6.256 -2.815 909 HD2 ARG 122 HD2 ARG 122 22.591 6.968 -0.841 910 HD3 ARG 122 HD3 ARG 122 20.924 6.604 -0.346 911 HE ARG 122 HE ARG 122 23.052 4.530 -0.001 912 HH11 ARG 122 HH11 ARG 122 21.124 6.937 1.642 913 HH12 ARG 122 HH12 ARG 122 21.533 6.327 3.218 914 HH21 ARG 122 HH21 ARG 122 23.632 3.848 2.036 915 HH22 ARG 122 HH22 ARG 122 22.892 4.595 3.424 916 H VAL 123 H VAL 123 18.749 2.318 -3.171 917 HA VAL 123 HA VAL 123 15.998 2.725 -2.476 918 HB VAL 123 HB VAL 123 17.487 0.768 -4.263 919 HG11 VAL 123 HG11 VAL 123 15.676 -0.610 -3.363 920 HG12 VAL 123 HG12 VAL 123 14.495 0.663 -3.772 921 HG13 VAL 123 HG13 VAL 123 15.425 -0.189 -5.044 922 HG21 VAL 123 HG21 VAL 123 16.218 1.918 -6.007 923 HG22 VAL 123 HG22 VAL 123 15.358 2.875 -4.777 924 HG23 VAL 123 HG23 VAL 123 17.115 3.080 -5.012 925 H GLU 124 H GLU 124 18.110 -0.111 -1.573 926 HA GLU 124 HA GLU 124 16.003 -1.406 -0.108 927 HB2 GLU 124 HB2 GLU 124 18.984 -1.462 0.443 928 HB3 GLU 124 HB3 GLU 124 17.754 -2.546 1.136 929 HG2 GLU 124 HG2 GLU 124 17.165 -3.336 -1.090 930 HG3 GLU 124 HG3 GLU 124 18.484 -2.395 -1.791 931 H ASN 125 H ASN 125 18.207 1.154 0.935 932 HA ASN 125 HA ASN 125 17.209 1.013 3.604 933 HB2 ASN 125 HB2 ASN 125 19.033 2.216 4.028 934 HB3 ASN 125 HB3 ASN 125 19.351 2.305 2.305 935 HD21 ASN 125 HD22 ASN 125 18.252 4.138 1.094 936 HD22 ASN 125 HD21 ASN 125 18.204 5.673 1.960 937 H LEU 126 H LEU 126 16.012 2.580 0.812 938 HA LEU 126 HA LEU 126 14.192 4.403 2.243 939 HB2 LEU 126 HB2 LEU 126 15.277 5.130 0.173 940 HB3 LEU 126 HB3 LEU 126 14.719 3.684 -0.672 941 HG LEU 126 HG LEU 126 12.370 4.472 -0.420 942 HD11 LEU 126 HD11 LEU 126 11.940 6.821 0.154 943 HD12 LEU 126 HD12 LEU 126 12.635 5.981 1.530 944 HD13 LEU 126 HD13 LEU 126 13.659 7.059 0.546 945 HD21 LEU 126 HD21 LEU 126 12.525 6.122 -2.186 946 HD22 LEU 126 HD22 LEU 126 14.266 6.351 -1.826 947 HD23 LEU 126 HD23 LEU 126 13.663 4.800 -2.462 948 H ILE 127 H ILE 127 13.812 1.429 0.181 949 HA ILE 127 HA ILE 127 10.965 1.449 0.526 950 HB ILE 127 HB ILE 127 10.919 -0.855 -0.193 951 HG12 ILE 127 HG12 ILE 127 13.910 -0.825 0.180 952 HG13 ILE 127 HG13 ILE 127 12.713 -1.983 0.762 953 HG21 ILE 127 HG21 ILE 127 11.089 1.104 -1.763 954 HG22 ILE 127 HG22 ILE 127 12.837 0.818 -1.885 955 HG23 ILE 127 HG23 ILE 127 11.679 -0.405 -2.460 956 HD11 ILE 127 HD11 ILE 127 13.713 -1.652 -2.088 957 HD12 ILE 127 HD12 ILE 127 14.005 -3.004 -0.985 958 HD13 ILE 127 HD13 ILE 127 12.367 -2.720 -1.612 959 H ALA 128 H ALA 128 13.478 0.094 2.643 960 HA ALA 128 HA ALA 128 11.696 -1.368 4.270 961 HB1 ALA 128 HB1 ALA 128 14.152 -1.660 4.246 962 HB2 ALA 128 HB2 ALA 128 14.366 -0.048 4.968 963 HB3 ALA 128 HB3 ALA 128 13.581 -1.342 5.896 964 H LYS 129 H LYS 129 12.145 2.110 4.113 965 HA LYS 129 HA LYS 129 10.608 2.460 6.659 966 HB2 LYS 129 HB2 LYS 129 11.142 4.838 6.493 967 HB3 LYS 129 HB3 LYS 129 12.516 3.756 6.730 968 HG2 LYS 129 HG2 LYS 129 13.204 4.042 4.412 969 HG3 LYS 129 HG3 LYS 129 11.754 4.986 4.055 970 HD2 LYS 129 HD2 LYS 129 13.657 6.486 4.304 971 HD3 LYS 129 HD3 LYS 129 12.480 6.755 5.579 972 HE2 LYS 129 HE2 LYS 129 14.591 6.889 6.627 973 HE3 LYS 129 HE3 LYS 129 13.907 5.351 7.135 974 HZ1 LYS 129 HZ1 LYS 129 15.361 4.277 5.373 975 HZ2 LYS 129 HZ2 LYS 129 16.018 5.751 5.058 976 HZ3 LYS 129 HZ3 LYS 129 16.220 5.067 6.519 977 H ILE 130 H ILE 130 10.202 3.079 3.201 978 HA ILE 130 HA ILE 130 7.494 4.169 3.792 979 HB ILE 130 HB ILE 130 7.362 4.923 1.497 980 HG12 ILE 130 HG12 ILE 130 9.480 5.150 0.175 981 HG13 ILE 130 HG13 ILE 130 10.229 3.953 1.210 982 HG21 ILE 130 HG21 ILE 130 8.206 6.298 3.400 983 HG22 ILE 130 HG22 ILE 130 9.868 5.893 2.913 984 HG23 ILE 130 HG23 ILE 130 8.799 6.787 1.814 985 HD11 ILE 130 HD11 ILE 130 9.438 3.060 -0.960 986 HD12 ILE 130 HD12 ILE 130 8.663 2.244 0.406 987 HD13 ILE 130 HD13 ILE 130 7.768 3.476 -0.523 988 H SER 131 H SER 131 8.496 1.055 3.238 989 HA SER 131 HA SER 131 6.513 -0.027 1.502 990 HB2 SER 131 HB2 SER 131 7.847 -1.169 3.978 991 HB3 SER 131 HB3 SER 131 6.734 -2.092 2.936 992 HG SER 131 HG SER 131 9.176 -0.842 2.198 Start of MODEL 17 1 H MET 1 H1 MET 1 2.222 0.380 1.662 2 HA MET 1 HA MET 1 3.172 -0.110 -0.399 3 HB2 MET 1 HB2 MET 1 1.498 -1.631 -1.266 4 HB3 MET 1 HB3 MET 1 0.311 -0.339 -1.448 5 HG2 MET 1 HG2 MET 1 1.616 0.724 -3.186 6 HG3 MET 1 HG3 MET 1 2.967 -0.370 -2.929 7 HE1 MET 1 HE1 MET 1 2.019 -3.266 -2.913 8 HE2 MET 1 HE2 MET 1 1.891 -3.663 -4.639 9 HE3 MET 1 HE3 MET 1 3.257 -2.690 -4.054 10 H LYS 2 H LYS 2 4.180 1.701 -0.976 11 HA LYS 2 HA LYS 2 2.619 4.044 -1.999 12 HB2 LYS 2 HB2 LYS 2 5.108 4.151 -0.243 13 HB3 LYS 2 HB3 LYS 2 4.425 5.524 -1.092 14 HG2 LYS 2 HG2 LYS 2 2.284 5.258 0.123 15 HG3 LYS 2 HG3 LYS 2 2.976 3.911 1.044 16 HD2 LYS 2 HD2 LYS 2 4.667 5.412 2.018 17 HD3 LYS 2 HD3 LYS 2 4.038 6.769 1.059 18 HE2 LYS 2 HE2 LYS 2 1.837 6.560 2.156 19 HE3 LYS 2 HE3 LYS 2 2.399 5.165 3.084 20 HZ1 LYS 2 HZ1 LYS 2 2.500 7.299 4.337 21 HZ2 LYS 2 HZ2 LYS 2 3.978 6.604 4.226 22 HZ3 LYS 2 HZ3 LYS 2 3.604 7.886 3.273 23 H LYS 3 H LYS 3 3.938 5.390 -3.490 24 HA LYS 3 HA LYS 3 5.484 3.553 -5.281 25 HB2 LYS 3 HB2 LYS 3 3.837 5.987 -6.085 26 HB3 LYS 3 HB3 LYS 3 4.748 4.955 -7.157 27 HG2 LYS 3 HG2 LYS 3 2.683 4.030 -7.445 28 HG3 LYS 3 HG3 LYS 3 3.352 2.984 -6.202 29 HD2 LYS 3 HD2 LYS 3 1.019 3.465 -5.703 30 HD3 LYS 3 HD3 LYS 3 2.032 4.202 -4.466 31 HE2 LYS 3 HE2 LYS 3 1.944 6.279 -6.138 32 HE3 LYS 3 HE3 LYS 3 0.476 5.491 -6.718 33 HZ1 LYS 3 HZ1 LYS 3 -0.335 5.607 -4.368 34 HZ2 LYS 3 HZ2 LYS 3 1.063 6.400 -3.942 35 HZ3 LYS 3 HZ3 LYS 3 0.004 7.093 -4.978 36 H VAL 4 H VAL 4 7.329 4.137 -6.249 37 HA VAL 4 HA VAL 4 8.567 6.744 -5.448 38 HB VAL 4 HB VAL 4 10.280 4.282 -5.748 39 HG11 VAL 4 HG11 VAL 4 10.832 7.019 -4.589 40 HG12 VAL 4 HG12 VAL 4 11.952 5.638 -4.650 41 HG13 VAL 4 HG13 VAL 4 11.433 6.386 -6.139 42 HG21 VAL 4 HG21 VAL 4 8.889 3.836 -3.814 43 HG22 VAL 4 HG22 VAL 4 10.513 4.298 -3.289 44 HG23 VAL 4 HG23 VAL 4 9.179 5.470 -3.178 45 H MET 5 H MET 5 9.549 7.889 -6.984 46 HA MET 5 HA MET 5 9.826 6.698 -9.709 47 HB2 MET 5 HB2 MET 5 7.872 7.976 -9.856 48 HB3 MET 5 HB3 MET 5 8.563 9.323 -8.948 49 HG2 MET 5 HG2 MET 5 8.377 9.810 -11.343 50 HG3 MET 5 HG3 MET 5 10.034 9.911 -10.766 51 HE1 MET 5 HE1 MET 5 8.528 7.841 -14.412 52 HE2 MET 5 HE2 MET 5 7.440 7.958 -13.020 53 HE3 MET 5 HE3 MET 5 8.198 9.424 -13.685 54 H PHE 6 H PHE 6 11.661 6.937 -10.607 55 HA PHE 6 HA PHE 6 13.805 8.527 -9.250 56 HB2 PHE 6 HB2 PHE 6 14.123 6.214 -11.189 57 HB3 PHE 6 HB3 PHE 6 15.366 6.958 -10.194 58 HD1 PHE 6 HD2 PHE 6 15.221 6.713 -7.637 59 HD2 PHE 6 HD1 PHE 6 12.819 4.451 -10.392 60 HE1 PHE 6 HE2 PHE 6 14.560 5.203 -5.782 61 HE2 PHE 6 HE1 PHE 6 12.097 2.968 -8.519 62 HZ PHE 6 HZ PHE 6 12.872 3.414 -6.205 63 H VAL 7 H VAL 7 14.551 10.297 -10.197 64 HA VAL 7 HA VAL 7 14.249 10.716 -13.130 65 HB VAL 7 HB VAL 7 14.124 12.595 -10.801 66 HG11 VAL 7 HG11 VAL 7 16.018 13.609 -11.941 67 HG12 VAL 7 HG12 VAL 7 15.222 13.417 -13.526 68 HG13 VAL 7 HG13 VAL 7 14.565 14.524 -12.308 69 HG21 VAL 7 HG21 VAL 7 12.866 12.626 -13.578 70 HG22 VAL 7 HG22 VAL 7 12.148 11.799 -12.150 71 HG23 VAL 7 HG23 VAL 7 12.364 13.541 -12.132 72 H CYS 8 H CYS 8 16.010 10.718 -14.405 73 HA CYS 8 HA CYS 8 18.646 11.464 -13.200 74 HB2 CYS 8 HB2 CYS 8 18.501 9.003 -13.377 75 HB3 CYS 8 HB3 CYS 8 18.211 9.124 -15.112 76 HG CYS 8 HG CYS 8 20.875 10.001 -13.272 77 H LYS 9 H LYS 9 20.233 12.088 -15.104 78 HA LYS 9 HA LYS 9 18.985 14.380 -16.217 79 HB2 LYS 9 HB2 LYS 9 21.511 13.866 -15.597 80 HB3 LYS 9 HB3 LYS 9 21.643 13.401 -17.296 81 HG2 LYS 9 HG2 LYS 9 20.605 15.721 -17.829 82 HG3 LYS 9 HG3 LYS 9 20.763 16.069 -16.104 83 HD2 LYS 9 HD2 LYS 9 22.624 17.073 -17.164 84 HD3 LYS 9 HD3 LYS 9 23.253 15.659 -16.308 85 HE2 LYS 9 HE2 LYS 9 23.312 14.382 -18.446 86 HE3 LYS 9 HE3 LYS 9 22.560 15.739 -19.291 87 HZ1 LYS 9 HZ1 LYS 9 24.979 15.734 -19.591 88 HZ2 LYS 9 HZ2 LYS 9 24.536 17.085 -18.792 89 HZ3 LYS 9 HZ3 LYS 9 25.241 15.845 -17.984 90 H ARG 10 H ARG 10 20.002 11.454 -17.950 91 HA ARG 10 HA ARG 10 17.994 12.097 -20.075 92 HB2 ARG 10 HB2 ARG 10 19.274 11.604 -21.884 93 HB3 ARG 10 HB3 ARG 10 20.277 12.613 -20.870 94 HG2 ARG 10 HG2 ARG 10 20.589 9.635 -21.405 95 HG3 ARG 10 HG3 ARG 10 21.640 10.962 -21.902 96 HD2 ARG 10 HD2 ARG 10 21.997 11.441 -19.412 97 HD3 ARG 10 HD3 ARG 10 21.250 9.843 -19.131 98 HE ARG 10 HE ARG 10 23.501 9.807 -21.017 99 HH11 ARG 10 HH21 ARG 10 22.623 9.380 -17.653 100 HH12 ARG 10 HH22 ARG 10 24.274 9.199 -17.123 101 HH21 ARG 10 HH12 ARG 10 25.585 9.085 -20.290 102 HH22 ARG 10 HH11 ARG 10 25.826 8.976 -18.547 103 H ASN 11 H ASN 11 17.776 10.421 -17.751 104 HA ASN 11 HA ASN 11 17.199 8.346 -16.995 105 HB2 ASN 11 HB2 ASN 11 15.219 9.542 -17.971 106 HB3 ASN 11 HB3 ASN 11 15.366 8.562 -19.409 107 HD21 ASN 11 HD22 ASN 11 15.375 7.871 -15.783 108 HD22 ASN 11 HD21 ASN 11 14.336 6.494 -15.982 109 H SER 12 H SER 12 19.561 7.858 -18.162 110 HA SER 12 HA SER 12 19.294 5.620 -20.059 111 HB2 SER 12 HB2 SER 12 21.786 6.030 -20.210 112 HB3 SER 12 HB3 SER 12 20.790 7.466 -20.541 113 HG SER 12 HG SER 12 22.628 7.265 -18.678 114 H CYS 13 H CYS 13 20.940 6.183 -16.920 115 HA CYS 13 HA CYS 13 21.127 3.194 -16.543 116 HB2 CYS 13 HB2 CYS 13 23.499 3.619 -15.770 117 HB3 CYS 13 HB3 CYS 13 23.195 3.973 -17.477 118 HG CYS 13 HG CYS 13 24.847 5.764 -16.650 119 H ARG 14 H ARG 14 21.925 6.060 -14.514 120 HA ARG 14 HA ARG 14 21.816 4.639 -12.079 121 HB2 ARG 14 HB2 ARG 14 21.435 7.602 -12.706 122 HB3 ARG 14 HB3 ARG 14 21.499 6.989 -11.051 123 HG2 ARG 14 HG2 ARG 14 23.708 6.063 -11.380 124 HG3 ARG 14 HG3 ARG 14 23.742 6.534 -13.075 125 HD2 ARG 14 HD2 ARG 14 23.404 8.588 -10.857 126 HD3 ARG 14 HD3 ARG 14 24.994 7.984 -11.323 127 HE ARG 14 HE ARG 14 23.960 8.785 -13.753 128 HH11 ARG 14 HH11 ARG 14 24.976 10.505 -10.858 129 HH12 ARG 14 HH12 ARG 14 24.786 12.035 -11.649 130 HH21 ARG 14 HH21 ARG 14 24.130 10.705 -14.676 131 HH22 ARG 14 HH22 ARG 14 24.245 12.188 -13.723 132 H SER 15 H SER 15 19.087 6.548 -13.419 133 HA SER 15 HA SER 15 17.227 5.817 -11.302 134 HB2 SER 15 HB2 SER 15 15.539 6.715 -13.040 135 HB3 SER 15 HB3 SER 15 16.821 7.814 -12.527 136 HG SER 15 HG SER 15 16.684 6.331 -14.972 137 H GLN 16 H GLN 16 18.154 4.300 -14.346 138 HA GLN 16 HA GLN 16 15.832 2.490 -14.466 139 HB2 GLN 16 HB2 GLN 16 18.550 2.326 -15.861 140 HB3 GLN 16 HB3 GLN 16 17.133 1.367 -16.266 141 HG2 GLN 16 HG2 GLN 16 17.253 4.421 -16.512 142 HG3 GLN 16 HG3 GLN 16 17.621 3.301 -17.805 143 HE21 GLN 16 HE22 GLN 16 15.817 4.826 -18.709 144 HE22 GLN 16 HE21 GLN 16 14.195 4.171 -18.561 145 H MET 17 H MET 17 19.199 2.210 -13.264 146 HA MET 17 HA MET 17 18.978 -0.484 -12.232 147 HB2 MET 17 HB2 MET 17 20.664 1.903 -11.324 148 HB3 MET 17 HB3 MET 17 20.816 0.266 -10.677 149 HG2 MET 17 HG2 MET 17 21.351 -0.552 -12.994 150 HG3 MET 17 HG3 MET 17 21.406 1.126 -13.540 151 HE1 MET 17 HE1 MET 17 23.579 -1.501 -13.247 152 HE2 MET 17 HE2 MET 17 23.922 -0.095 -14.286 153 HE3 MET 17 HE3 MET 17 25.102 -0.599 -13.046 154 H ALA 18 H ALA 18 18.071 2.693 -10.812 155 HA ALA 18 HA ALA 18 17.487 1.659 -8.198 156 HB1 ALA 18 HB1 ALA 18 16.467 3.818 -7.823 157 HB2 ALA 18 HB2 ALA 18 17.911 4.075 -8.819 158 HB3 ALA 18 HB3 ALA 18 16.306 4.120 -9.568 159 H GLU 19 H GLU 19 15.305 2.236 -11.018 160 HA GLU 19 HA GLU 19 13.033 0.969 -9.803 161 HB2 GLU 19 HB2 GLU 19 13.158 2.319 -11.997 162 HB3 GLU 19 HB3 GLU 19 13.693 0.817 -12.757 163 HG2 GLU 19 HG2 GLU 19 11.549 -0.209 -11.567 164 HG3 GLU 19 HG3 GLU 19 11.050 1.463 -11.405 165 H GLY 20 H GLY 20 15.726 -0.458 -11.717 166 HA2 GLY 20 HA2 GLY 20 14.961 -3.135 -11.794 167 HA3 GLY 20 HA3 GLY 20 16.624 -2.565 -11.671 168 H PHE 21 H PHE 21 16.734 -1.552 -9.033 169 HA PHE 21 HA PHE 21 16.694 -4.103 -7.563 170 HB2 PHE 21 HB2 PHE 21 17.636 -1.299 -6.962 171 HB3 PHE 21 HB3 PHE 21 17.604 -2.558 -5.713 172 HD1 PHE 21 HD1 PHE 21 18.678 -4.890 -6.496 173 HD2 PHE 21 HD2 PHE 21 19.654 -0.984 -8.045 174 HE1 PHE 21 HE1 PHE 21 20.925 -5.712 -7.153 175 HE2 PHE 21 HE2 PHE 21 21.865 -1.792 -8.709 176 HZ PHE 21 HZ PHE 21 22.523 -4.191 -8.261 177 H ALA 22 H ALA 22 14.855 -0.995 -7.339 178 HA ALA 22 HA ALA 22 13.398 -1.851 -5.005 179 HB1 ALA 22 HB1 ALA 22 11.935 0.050 -5.565 180 HB2 ALA 22 HB2 ALA 22 13.642 0.501 -5.722 181 HB3 ALA 22 HB3 ALA 22 12.695 0.174 -7.182 182 H LYS 23 H LYS 23 12.653 -2.318 -8.492 183 HA LYS 23 HA LYS 23 10.008 -3.403 -7.998 184 HB2 LYS 23 HB2 LYS 23 9.943 -3.941 -10.283 185 HB3 LYS 23 HB3 LYS 23 10.885 -2.454 -10.154 186 HG2 LYS 23 HG2 LYS 23 12.949 -4.008 -10.240 187 HG3 LYS 23 HG3 LYS 23 11.859 -5.261 -10.809 188 HD2 LYS 23 HD2 LYS 23 12.285 -2.529 -12.119 189 HD3 LYS 23 HD3 LYS 23 13.067 -4.027 -12.633 190 HE2 LYS 23 HE2 LYS 23 11.027 -5.003 -13.351 191 HE3 LYS 23 HE3 LYS 23 10.040 -3.757 -12.572 192 HZ1 LYS 23 HZ1 LYS 23 10.887 -2.115 -14.142 193 HZ2 LYS 23 HZ2 LYS 23 11.925 -3.167 -14.819 194 HZ3 LYS 23 HZ3 LYS 23 10.302 -3.389 -15.003 195 H THR 24 H THR 24 13.106 -4.803 -7.863 196 HA THR 24 HA THR 24 12.183 -7.602 -7.648 197 HB THR 24 HB THR 24 14.955 -6.482 -7.167 198 HG1 THR 24 HG1 THR 24 14.663 -6.036 -9.254 199 HG21 THR 24 HG21 THR 24 14.003 -9.277 -7.941 200 HG22 THR 24 HG22 THR 24 15.694 -8.755 -7.772 201 HG23 THR 24 HG23 THR 24 14.652 -8.814 -6.350 202 H LEU 25 H LEU 25 13.779 -5.253 -5.427 203 HA LEU 25 HA LEU 25 13.654 -7.130 -3.181 204 HB2 LEU 25 HB2 LEU 25 14.583 -4.228 -3.318 205 HB3 LEU 25 HB3 LEU 25 14.897 -5.319 -1.983 206 HG LEU 25 HG LEU 25 15.941 -5.721 -4.835 207 HD11 LEU 25 HD11 LEU 25 16.867 -3.755 -3.515 208 HD12 LEU 25 HD12 LEU 25 17.484 -4.968 -2.364 209 HD13 LEU 25 HD13 LEU 25 18.043 -4.979 -4.049 210 HD21 LEU 25 HD21 LEU 25 15.726 -7.880 -3.703 211 HD22 LEU 25 HD22 LEU 25 17.428 -7.408 -3.803 212 HD23 LEU 25 HD23 LEU 25 16.547 -7.234 -2.265 213 H GLY 26 H GLY 26 11.808 -4.319 -4.215 214 HA2 GLY 26 HA2 GLY 26 10.064 -4.352 -1.811 215 HA3 GLY 26 HA3 GLY 26 10.142 -3.150 -3.103 216 H ALA 27 H ALA 27 10.153 -6.326 -4.336 217 HA ALA 27 HA ALA 27 7.939 -5.998 -5.956 218 HB1 ALA 27 HB1 ALA 27 9.072 -8.611 -4.862 219 HB2 ALA 27 HB2 ALA 27 8.066 -8.442 -6.319 220 HB3 ALA 27 HB3 ALA 27 9.685 -7.726 -6.267 221 H GLY 28 H GLY 28 5.865 -5.560 -5.408 222 HA2 GLY 28 HA2 GLY 28 3.699 -6.273 -4.906 223 HA3 GLY 28 HA3 GLY 28 4.325 -7.608 -3.931 224 H LYS 29 H LYS 29 6.059 -5.195 -2.713 225 HA LYS 29 HA LYS 29 3.967 -4.144 -0.837 226 HB2 LYS 29 HB2 LYS 29 5.864 -3.512 0.631 227 HB3 LYS 29 HB3 LYS 29 5.548 -5.250 0.471 228 HG2 LYS 29 HG2 LYS 29 7.426 -5.334 -1.232 229 HG3 LYS 29 HG3 LYS 29 7.828 -3.665 -0.779 230 HD2 LYS 29 HD2 LYS 29 7.824 -6.148 1.004 231 HD3 LYS 29 HD3 LYS 29 9.249 -5.419 0.268 232 HE2 LYS 29 HE2 LYS 29 8.903 -3.345 1.579 233 HE3 LYS 29 HE3 LYS 29 7.422 -4.016 2.288 234 HZ1 LYS 29 HZ1 LYS 29 9.314 -4.301 3.795 235 HZ2 LYS 29 HZ2 LYS 29 8.772 -5.765 3.330 236 HZ3 LYS 29 HZ3 LYS 29 10.149 -5.163 2.685 237 H ILE 30 H ILE 30 6.355 -3.146 -3.211 238 HA ILE 30 HA ILE 30 5.013 -0.518 -3.098 239 HB ILE 30 HB ILE 30 7.083 0.684 -3.654 240 HG12 ILE 30 HG12 ILE 30 9.256 -0.202 -3.300 241 HG13 ILE 30 HG13 ILE 30 8.629 -1.772 -2.810 242 HG21 ILE 30 HG21 ILE 30 7.267 -0.928 -1.071 243 HG22 ILE 30 HG22 ILE 30 8.063 0.609 -1.410 244 HG23 ILE 30 HG23 ILE 30 6.290 0.546 -1.315 245 HD11 ILE 30 HD11 ILE 30 8.142 -2.383 -5.062 246 HD12 ILE 30 HD12 ILE 30 8.259 -0.697 -5.624 247 HD13 ILE 30 HD13 ILE 30 9.710 -1.562 -5.113 248 H ALA 31 H ALA 31 5.476 0.814 -5.168 249 HA ALA 31 HA ALA 31 5.857 -0.890 -7.560 250 HB1 ALA 31 HB1 ALA 31 4.003 0.225 -8.735 251 HB2 ALA 31 HB2 ALA 31 3.414 -0.657 -7.310 252 HB3 ALA 31 HB3 ALA 31 3.577 1.105 -7.251 253 H VAL 32 H VAL 32 7.082 0.169 -9.220 254 HA VAL 32 HA VAL 32 8.026 2.908 -8.604 255 HB VAL 32 HB VAL 32 10.286 1.895 -9.196 256 HG11 VAL 32 HG11 VAL 32 9.498 2.793 -6.985 257 HG12 VAL 32 HG12 VAL 32 9.119 1.152 -6.487 258 HG13 VAL 32 HG13 VAL 32 10.802 1.611 -6.854 259 HG21 VAL 32 HG21 VAL 32 10.805 -0.348 -8.610 260 HG22 VAL 32 HG22 VAL 32 9.136 -0.691 -8.122 261 HG23 VAL 32 HG23 VAL 32 9.534 -0.383 -9.835 262 H THR 33 H THR 33 9.016 4.062 -10.122 263 HA THR 33 HA THR 33 8.906 3.149 -12.960 264 HB THR 33 HB THR 33 7.853 5.847 -12.068 265 HG1 THR 33 HG1 THR 33 5.763 4.938 -12.355 266 HG21 THR 33 HG21 THR 33 8.417 5.595 -14.499 267 HG22 THR 33 HG22 THR 33 7.335 4.191 -14.584 268 HG23 THR 33 HG23 THR 33 6.680 5.807 -14.235 269 H SER 34 H SER 34 10.473 4.098 -14.289 270 HA SER 34 HA SER 34 12.389 6.061 -13.095 271 HB2 SER 34 HB2 SER 34 13.183 3.768 -13.674 272 HB3 SER 34 HB3 SER 34 12.755 4.081 -15.370 273 HG SER 34 HG SER 34 14.979 4.531 -14.792 274 H CYS 35 H CYS 35 12.771 7.974 -14.107 275 HA CYS 35 HA CYS 35 12.107 8.407 -16.918 276 HB2 CYS 35 HB2 CYS 35 10.579 10.201 -16.643 277 HB3 CYS 35 HB3 CYS 35 9.989 8.879 -15.637 278 HG CYS 35 HG CYS 35 11.102 9.794 -13.406 279 H GLY 36 H GLY 36 12.642 10.921 -17.427 280 HA2 GLY 36 HA2 GLY 36 14.664 12.033 -15.565 281 HA3 GLY 36 HA3 GLY 36 15.245 11.627 -17.183 282 H LEU 37 H LEU 37 15.420 14.211 -16.203 283 HA LEU 37 HA LEU 37 13.230 15.822 -17.229 284 HB2 LEU 37 HB2 LEU 37 14.763 17.721 -17.146 285 HB3 LEU 37 HB3 LEU 37 14.464 16.915 -15.623 286 HG LEU 37 HG LEU 37 16.913 16.045 -17.162 287 HD11 LEU 37 HD11 LEU 37 18.250 17.886 -16.201 288 HD12 LEU 37 HD12 LEU 37 17.034 18.505 -17.322 289 HD13 LEU 37 HD13 LEU 37 16.768 18.643 -15.568 290 HD21 LEU 37 HD21 LEU 37 16.323 14.994 -14.991 291 HD22 LEU 37 HD22 LEU 37 17.828 15.904 -14.853 292 HD23 LEU 37 HD23 LEU 37 16.307 16.582 -14.219 293 H GLU 38 H GLU 38 15.629 14.043 -18.694 294 HA GLU 38 HA GLU 38 14.662 14.785 -21.367 295 HB2 GLU 38 HB2 GLU 38 17.673 14.542 -20.876 296 HB3 GLU 38 HB3 GLU 38 16.857 14.778 -22.412 297 HG2 GLU 38 HG2 GLU 38 16.020 17.001 -21.597 298 HG3 GLU 38 HG3 GLU 38 16.976 16.778 -20.122 299 H SER 39 H SER 39 15.389 12.955 -22.939 300 HA SER 39 HA SER 39 15.937 10.341 -21.644 301 HB2 SER 39 HB2 SER 39 13.235 11.180 -22.641 302 HB3 SER 39 HB3 SER 39 13.770 9.496 -22.855 303 HG SER 39 HG SER 39 14.000 10.918 -20.390 304 H SER 40 H SER 40 16.948 8.943 -22.995 305 HA SER 40 HA SER 40 16.692 9.344 -25.947 306 HB2 SER 40 HB2 SER 40 18.707 10.499 -25.214 307 HB3 SER 40 HB3 SER 40 19.354 8.994 -24.535 308 HG SER 40 HG SER 40 19.884 9.696 -26.840 309 H ARG 41 H ARG 41 18.564 7.015 -23.910 310 HA ARG 41 HA ARG 41 16.683 4.890 -24.404 311 HB2 ARG 41 HB2 ARG 41 17.928 3.394 -25.726 312 HB3 ARG 41 HB3 ARG 41 17.956 4.910 -26.592 313 HG2 ARG 41 HG2 ARG 41 20.251 3.706 -24.971 314 HG3 ARG 41 HG3 ARG 41 20.083 3.694 -26.710 315 HD2 ARG 41 HD2 ARG 41 20.533 6.148 -24.967 316 HD3 ARG 41 HD3 ARG 41 21.727 5.362 -25.979 317 HE ARG 41 HE ARG 41 19.690 7.251 -26.800 318 HH11 ARG 41 HH11 ARG 41 21.700 4.688 -28.134 319 HH12 ARG 41 HH12 ARG 41 21.505 5.297 -29.755 320 HH21 ARG 41 HH21 ARG 41 19.492 7.936 -28.834 321 HH22 ARG 41 HH22 ARG 41 20.275 7.095 -30.144 322 H VAL 42 H VAL 42 17.169 2.916 -23.188 323 HA VAL 42 HA VAL 42 18.650 3.344 -20.719 324 HB VAL 42 HB VAL 42 17.959 0.606 -21.888 325 HG11 VAL 42 HG11 VAL 42 18.084 -0.085 -19.500 326 HG12 VAL 42 HG12 VAL 42 19.641 0.526 -20.050 327 HG13 VAL 42 HG13 VAL 42 18.602 1.549 -19.042 328 HG21 VAL 42 HG21 VAL 42 16.374 2.380 -20.019 329 HG22 VAL 42 HG22 VAL 42 15.912 1.812 -21.647 330 HG23 VAL 42 HG23 VAL 42 16.092 0.637 -20.328 331 H HIS 43 H HIS 43 20.773 3.020 -20.254 332 HA HIS 43 HA HIS 43 22.671 2.751 -22.435 333 HB2 HIS 43 HB2 HIS 43 22.954 4.029 -20.216 334 HB3 HIS 43 HB3 HIS 43 23.241 2.463 -19.458 335 HD2 HIS 43 HD2 HIS 43 24.886 5.207 -21.385 336 HE1 HIS 43 HE1 HIS 43 27.768 2.071 -21.297 337 HE2 HIS 43 HE2 HIS 43 27.366 4.549 -21.862 338 HA PRO 44 HA PRO 44 21.957 -1.527 -22.494 339 HB2 PRO 44 HB2 PRO 44 23.862 -2.489 -24.253 340 HB3 PRO 44 HB3 PRO 44 22.490 -1.444 -24.748 341 HG2 PRO 44 HG2 PRO 44 25.328 -0.573 -24.121 342 HG3 PRO 44 HG3 PRO 44 24.336 -0.172 -25.560 343 HD2 PRO 44 HD2 PRO 44 24.508 1.505 -23.423 344 HD3 PRO 44 HD3 PRO 44 22.972 1.311 -24.328 345 H THR 45 H THR 45 25.215 -0.373 -21.601 346 HA THR 45 HA THR 45 26.078 -2.818 -20.328 347 HB THR 45 HB THR 45 26.999 0.015 -19.754 348 HG1 THR 45 HG1 THR 45 28.614 -0.538 -21.301 349 HG21 THR 45 HG21 THR 45 27.816 -1.531 -18.058 350 HG22 THR 45 HG22 THR 45 28.264 -2.724 -19.291 351 HG23 THR 45 HG23 THR 45 29.137 -1.173 -19.168 352 H ALA 46 H ALA 46 23.961 -0.159 -19.241 353 HA ALA 46 HA ALA 46 24.017 -0.803 -16.447 354 HB1 ALA 46 HB1 ALA 46 21.884 0.396 -16.350 355 HB2 ALA 46 HB2 ALA 46 22.976 1.254 -17.455 356 HB3 ALA 46 HB3 ALA 46 21.661 0.233 -18.101 357 H ILE 47 H ILE 47 21.971 -2.023 -19.118 358 HA ILE 47 HA ILE 47 20.449 -3.929 -17.600 359 HB ILE 47 HB ILE 47 21.308 -3.836 -20.510 360 HG12 ILE 47 HG12 ILE 47 18.439 -3.527 -19.815 361 HG13 ILE 47 HG13 ILE 47 19.446 -2.250 -19.145 362 HG21 ILE 47 HG21 ILE 47 20.841 -6.170 -20.033 363 HG22 ILE 47 HG22 ILE 47 19.330 -5.740 -19.203 364 HG23 ILE 47 HG23 ILE 47 19.498 -5.491 -20.953 365 HD11 ILE 47 HD11 ILE 47 20.232 -1.564 -21.246 366 HD12 ILE 47 HD12 ILE 47 19.585 -3.015 -22.073 367 HD13 ILE 47 HD13 ILE 47 18.486 -1.779 -21.425 368 H ALA 48 H ALA 48 23.600 -4.290 -19.315 369 HA ALA 48 HA ALA 48 23.971 -7.040 -18.663 370 HB1 ALA 48 HB1 ALA 48 26.089 -4.904 -19.104 371 HB2 ALA 48 HB2 ALA 48 26.301 -6.660 -19.239 372 HB3 ALA 48 HB3 ALA 48 25.248 -5.809 -20.389 373 H MET 49 H MET 49 24.856 -4.120 -16.860 374 HA MET 49 HA MET 49 26.223 -5.471 -14.698 375 HB2 MET 49 HB2 MET 49 25.064 -2.680 -14.983 376 HB3 MET 49 HB3 MET 49 26.056 -3.200 -13.613 377 HG2 MET 49 HG2 MET 49 27.099 -3.516 -16.440 378 HG3 MET 49 HG3 MET 49 27.116 -1.960 -15.628 379 HE1 MET 49 HE1 MET 49 30.017 -5.414 -15.021 380 HE2 MET 49 HE2 MET 49 28.292 -5.790 -15.176 381 HE3 MET 49 HE3 MET 49 29.127 -4.937 -16.489 382 H MET 50 H MET 50 22.806 -4.644 -15.224 383 HA MET 50 HA MET 50 22.053 -5.495 -12.504 384 HB2 MET 50 HB2 MET 50 20.404 -5.006 -15.012 385 HB3 MET 50 HB3 MET 50 19.735 -5.422 -13.441 386 HG2 MET 50 HG2 MET 50 21.269 -2.901 -14.157 387 HG3 MET 50 HG3 MET 50 19.569 -3.042 -13.758 388 HE1 MET 50 HE1 MET 50 18.745 -3.941 -11.437 389 HE2 MET 50 HE2 MET 50 20.018 -5.127 -11.027 390 HE3 MET 50 HE3 MET 50 19.643 -3.794 -9.917 391 H GLU 51 H GLU 51 22.336 -7.080 -15.720 392 HA GLU 51 HA GLU 51 21.191 -9.559 -14.845 393 HB2 GLU 51 HB2 GLU 51 23.132 -8.890 -17.091 394 HB3 GLU 51 HB3 GLU 51 22.566 -10.529 -16.767 395 HG2 GLU 51 HG2 GLU 51 20.215 -9.781 -17.019 396 HG3 GLU 51 HG3 GLU 51 20.767 -8.164 -17.447 397 H GLU 52 H GLU 52 24.458 -8.246 -14.283 398 HA GLU 52 HA GLU 52 25.736 -10.671 -13.454 399 HB2 GLU 52 HB2 GLU 52 26.010 -7.889 -12.261 400 HB3 GLU 52 HB3 GLU 52 27.081 -9.252 -11.942 401 HG2 GLU 52 HG2 GLU 52 27.491 -9.262 -14.515 402 HG3 GLU 52 HG3 GLU 52 26.838 -7.617 -14.464 403 H VAL 53 H VAL 53 23.335 -8.682 -11.791 404 HA VAL 53 HA VAL 53 23.491 -10.395 -9.351 405 HB VAL 53 HB VAL 53 22.166 -8.669 -8.210 406 HG11 VAL 53 HG11 VAL 53 24.626 -8.674 -8.080 407 HG12 VAL 53 HG12 VAL 53 24.712 -7.600 -9.496 408 HG13 VAL 53 HG13 VAL 53 23.962 -7.034 -7.990 409 HG21 VAL 53 HG21 VAL 53 22.621 -6.941 -10.684 410 HG22 VAL 53 HG22 VAL 53 21.057 -7.643 -10.203 411 HG23 VAL 53 HG23 VAL 53 21.856 -6.458 -9.163 412 H GLY 54 H GLY 54 22.104 -10.809 -12.138 413 HA2 GLY 54 HA2 GLY 54 20.399 -12.133 -12.834 414 HA3 GLY 54 HA3 GLY 54 20.030 -12.511 -11.150 415 H ILE 55 H ILE 55 19.915 -9.160 -12.242 416 HA ILE 55 HA ILE 55 16.927 -9.156 -12.020 417 HB ILE 55 HB ILE 55 18.995 -7.026 -11.430 418 HG12 ILE 55 HG12 ILE 55 16.913 -8.446 -9.712 419 HG13 ILE 55 HG13 ILE 55 18.654 -8.700 -9.655 420 HG21 ILE 55 HG21 ILE 55 17.081 -5.938 -12.569 421 HG22 ILE 55 HG22 ILE 55 15.956 -6.726 -11.433 422 HG23 ILE 55 HG23 ILE 55 17.120 -5.514 -10.872 423 HD11 ILE 55 HD11 ILE 55 17.156 -6.208 -8.761 424 HD12 ILE 55 HD12 ILE 55 18.080 -7.347 -7.774 425 HD13 ILE 55 HD13 ILE 55 18.928 -6.298 -8.929 426 H ASP 56 H ASP 56 15.708 -8.288 -13.646 427 HA ASP 56 HA ASP 56 17.164 -7.612 -16.164 428 HB2 ASP 56 HB2 ASP 56 15.886 -9.668 -16.311 429 HB3 ASP 56 HB3 ASP 56 14.423 -8.829 -15.775 430 H ILE 57 H ILE 57 17.074 -5.646 -16.872 431 HA ILE 57 HA ILE 57 14.634 -3.986 -16.446 432 HB ILE 57 HB ILE 57 15.971 -1.953 -16.451 433 HG12 ILE 57 HG12 ILE 57 18.495 -3.542 -15.924 434 HG13 ILE 57 HG13 ILE 57 18.013 -3.157 -17.569 435 HG21 ILE 57 HG21 ILE 57 15.267 -3.009 -14.301 436 HG22 ILE 57 HG22 ILE 57 16.832 -3.833 -14.206 437 HG23 ILE 57 HG23 ILE 57 16.737 -2.055 -14.141 438 HD11 ILE 57 HD11 ILE 57 19.579 -1.471 -16.708 439 HD12 ILE 57 HD12 ILE 57 18.006 -0.751 -17.093 440 HD13 ILE 57 HD13 ILE 57 18.455 -1.072 -15.393 441 H SER 58 H SER 58 15.773 -5.851 -18.713 442 HA SER 58 HA SER 58 16.427 -4.208 -20.947 443 HB2 SER 58 HB2 SER 58 15.025 -6.899 -21.102 444 HB3 SER 58 HB3 SER 58 16.098 -6.157 -22.299 445 HG SER 58 HG SER 58 16.662 -7.261 -19.766 446 H GLY 59 H GLY 59 13.282 -5.065 -19.621 447 HA2 GLY 59 HA2 GLY 59 11.703 -4.194 -21.905 448 HA3 GLY 59 HA3 GLY 59 11.120 -4.601 -20.294 449 H GLN 60 H GLN 60 13.556 -2.234 -19.894 450 HA GLN 60 HA GLN 60 11.510 -0.093 -19.601 451 HB2 GLN 60 HB2 GLN 60 14.292 -0.498 -18.471 452 HB3 GLN 60 HB3 GLN 60 13.493 1.068 -18.449 453 HG2 GLN 60 HG2 GLN 60 11.855 0.430 -16.955 454 HG3 GLN 60 HG3 GLN 60 11.890 -1.264 -17.434 455 HE21 GLN 60 HE22 GLN 60 14.274 1.076 -15.962 456 HE22 GLN 60 HE21 GLN 60 14.791 -0.102 -14.742 457 H THR 61 H THR 61 12.354 2.136 -20.162 458 HA THR 61 HA THR 61 13.760 2.410 -22.691 459 HB THR 61 HB THR 61 11.734 3.795 -23.494 460 HG1 THR 61 HG1 THR 61 10.305 3.806 -21.866 461 HG21 THR 61 HG21 THR 61 12.402 1.669 -24.574 462 HG22 THR 61 HG22 THR 61 11.382 0.772 -23.429 463 HG23 THR 61 HG23 THR 61 10.646 1.905 -24.581 464 H SER 62 H SER 62 14.169 4.751 -22.993 465 HA SER 62 HA SER 62 14.179 6.208 -20.436 466 HB2 SER 62 HB2 SER 62 14.965 7.051 -23.179 467 HB3 SER 62 HB3 SER 62 15.179 7.993 -21.668 468 HG SER 62 HG SER 62 16.566 6.322 -20.920 469 H ASP 63 H ASP 63 12.660 7.621 -19.834 470 HA ASP 63 HA ASP 63 10.720 8.669 -21.823 471 HB2 ASP 63 HB2 ASP 63 9.925 7.084 -19.378 472 HB3 ASP 63 HB3 ASP 63 8.837 8.206 -20.198 473 HA PRO 64 HA PRO 64 11.633 12.291 -19.646 474 HB2 PRO 64 HB2 PRO 64 10.034 14.137 -20.853 475 HB3 PRO 64 HB3 PRO 64 11.347 13.266 -21.710 476 HG2 PRO 64 HG2 PRO 64 8.391 12.583 -21.653 477 HG3 PRO 64 HG3 PRO 64 9.454 12.745 -23.083 478 HD2 PRO 64 HD2 PRO 64 8.926 10.317 -21.950 479 HD3 PRO 64 HD3 PRO 64 10.536 10.705 -22.639 480 H ILE 65 H ILE 65 11.144 13.467 -17.899 481 HA ILE 65 HA ILE 65 9.112 12.872 -16.068 482 HB ILE 65 HB ILE 65 11.350 14.014 -15.724 483 HG12 ILE 65 HG12 ILE 65 8.924 15.208 -14.398 484 HG13 ILE 65 HG13 ILE 65 9.753 13.709 -13.935 485 HG21 ILE 65 HG21 ILE 65 9.859 16.620 -16.292 486 HG22 ILE 65 HG22 ILE 65 11.547 16.426 -15.829 487 HG23 ILE 65 HG23 ILE 65 11.019 15.882 -17.429 488 HD11 ILE 65 HD11 ILE 65 11.847 15.222 -13.608 489 HD12 ILE 65 HD12 ILE 65 10.693 16.573 -13.630 490 HD13 ILE 65 HD13 ILE 65 10.555 15.312 -12.394 491 H GLU 66 H GLU 66 9.165 15.337 -18.589 492 HA GLU 66 HA GLU 66 6.898 16.845 -17.962 493 HB2 GLU 66 HB2 GLU 66 7.894 16.091 -20.741 494 HB3 GLU 66 HB3 GLU 66 6.860 17.467 -20.337 495 HG2 GLU 66 HG2 GLU 66 8.736 18.335 -18.861 496 HG3 GLU 66 HG3 GLU 66 9.766 17.057 -19.514 497 H ASN 67 H ASN 67 6.871 13.553 -19.292 498 HA ASN 67 HA ASN 67 4.020 13.823 -20.053 499 HB2 ASN 67 HB2 ASN 67 4.327 12.115 -21.435 500 HB3 ASN 67 HB3 ASN 67 6.044 12.420 -21.235 501 HD21 ASN 67 HD22 ASN 67 6.976 11.167 -19.129 502 HD22 ASN 67 HD21 ASN 67 6.307 9.571 -18.887 503 H PHE 68 H PHE 68 5.664 13.061 -17.150 504 HA PHE 68 HA PHE 68 3.663 11.049 -16.284 505 HB2 PHE 68 HB2 PHE 68 6.427 11.826 -15.306 506 HB3 PHE 68 HB3 PHE 68 5.377 10.713 -14.448 507 HD1 PHE 68 HD1 PHE 68 4.260 8.841 -16.214 508 HD2 PHE 68 HD2 PHE 68 8.150 10.695 -16.421 509 HE1 PHE 68 HE1 PHE 68 5.117 6.904 -17.489 510 HE2 PHE 68 HE2 PHE 68 8.996 8.745 -17.721 511 HZ PHE 68 HZ PHE 68 7.489 6.846 -18.237 512 H ASN 69 H ASN 69 3.372 11.055 -13.827 513 HA ASN 69 HA ASN 69 2.158 13.674 -13.060 514 HB2 ASN 69 HB2 ASN 69 0.452 12.109 -11.918 515 HB3 ASN 69 HB3 ASN 69 0.407 12.289 -13.663 516 HD21 ASN 69 HD22 ASN 69 2.093 10.099 -11.304 517 HD22 ASN 69 HD21 ASN 69 1.708 8.641 -12.210 518 H ALA 70 H ALA 70 3.834 14.469 -11.725 519 HA ALA 70 HA ALA 70 5.220 13.149 -9.705 520 HB1 ALA 70 HB1 ALA 70 4.035 15.939 -9.520 521 HB2 ALA 70 HB2 ALA 70 5.436 15.325 -8.634 522 HB3 ALA 70 HB3 ALA 70 5.524 15.549 -10.394 523 H ASP 71 H ASP 71 1.904 14.388 -9.630 524 HA ASP 71 HA ASP 71 1.294 14.436 -6.921 525 HB2 ASP 71 HB2 ASP 71 -0.036 15.360 -8.827 526 HB3 ASP 71 HB3 ASP 71 -0.491 13.711 -9.276 527 H ASP 72 H ASP 72 1.384 11.582 -9.009 528 HA ASP 72 HA ASP 72 -0.017 9.910 -7.010 529 HB2 ASP 72 HB2 ASP 72 -0.360 9.606 -9.492 530 HB3 ASP 72 HB3 ASP 72 1.328 9.061 -9.583 531 H TYR 73 H TYR 73 3.300 10.691 -7.894 532 HA TYR 73 HA TYR 73 4.403 8.246 -6.711 533 HB2 TYR 73 HB2 TYR 73 5.797 10.690 -7.821 534 HB3 TYR 73 HB3 TYR 73 6.542 9.144 -7.422 535 HD1 TYR 73 HD1 TYR 73 4.546 7.211 -8.649 536 HD2 TYR 73 HD2 TYR 73 6.213 10.920 -10.104 537 HE1 TYR 73 HE1 TYR 73 4.179 6.467 -10.985 538 HE2 TYR 73 HE2 TYR 73 5.967 10.116 -12.431 539 HH TYR 73 HH TYR 73 5.110 8.402 -13.834 540 H ASP 74 H ASP 74 3.802 8.290 -4.622 541 HA ASP 74 HA ASP 74 3.841 10.239 -2.687 542 HB2 ASP 74 HB2 ASP 74 4.874 7.386 -2.376 543 HB3 ASP 74 HB3 ASP 74 4.260 8.402 -1.074 544 H VAL 75 H VAL 75 6.673 8.547 -4.000 545 HA VAL 75 HA VAL 75 8.420 10.550 -2.646 546 HB VAL 75 HB VAL 75 9.168 7.666 -3.147 547 HG11 VAL 75 HG11 VAL 75 11.166 8.288 -1.732 548 HG12 VAL 75 HG12 VAL 75 11.123 9.083 -3.298 549 HG13 VAL 75 HG13 VAL 75 10.661 9.975 -1.843 550 HG21 VAL 75 HG21 VAL 75 9.264 7.548 -0.627 551 HG22 VAL 75 HG22 VAL 75 8.347 9.076 -0.588 552 HG23 VAL 75 HG23 VAL 75 7.640 7.624 -1.321 553 H VAL 76 H VAL 76 9.883 11.551 -3.946 554 HA VAL 76 HA VAL 76 10.435 10.411 -6.664 555 HB VAL 76 HB VAL 76 9.992 13.314 -5.962 556 HG11 VAL 76 HG11 VAL 76 11.039 12.157 -8.594 557 HG12 VAL 76 HG12 VAL 76 10.588 13.851 -8.285 558 HG13 VAL 76 HG13 VAL 76 11.973 13.164 -7.461 559 HG21 VAL 76 HG21 VAL 76 8.312 13.186 -7.757 560 HG22 VAL 76 HG22 VAL 76 8.706 11.465 -8.020 561 HG23 VAL 76 HG23 VAL 76 7.954 12.005 -6.496 562 H ILE 77 H ILE 77 12.526 10.257 -7.232 563 HA ILE 77 HA ILE 77 14.602 11.306 -5.326 564 HB ILE 77 HB ILE 77 14.649 8.703 -6.857 565 HG12 ILE 77 HG12 ILE 77 12.932 8.474 -5.139 566 HG13 ILE 77 HG13 ILE 77 14.323 7.459 -4.819 567 HG21 ILE 77 HG21 ILE 77 16.582 8.165 -5.397 568 HG22 ILE 77 HG22 ILE 77 16.894 9.563 -6.417 569 HG23 ILE 77 HG23 ILE 77 16.508 9.798 -4.705 570 HD11 ILE 77 HD11 ILE 77 13.850 10.129 -3.422 571 HD12 ILE 77 HD12 ILE 77 13.385 8.546 -2.783 572 HD13 ILE 77 HD13 ILE 77 15.090 8.908 -3.041 573 H SER 78 H SER 78 16.172 12.512 -6.293 574 HA SER 78 HA SER 78 16.456 12.373 -9.287 575 HB2 SER 78 HB2 SER 78 16.163 14.626 -8.409 576 HB3 SER 78 HB3 SER 78 17.594 14.412 -7.364 577 HG SER 78 HG SER 78 18.167 15.420 -9.353 578 H LEU 79 H LEU 79 18.201 11.537 -10.205 579 HA LEU 79 HA LEU 79 20.647 10.912 -8.601 580 HB2 LEU 79 HB2 LEU 79 19.477 9.025 -10.691 581 HB3 LEU 79 HB3 LEU 79 20.875 8.789 -9.647 582 HG LEU 79 HG LEU 79 19.058 9.017 -7.692 583 HD11 LEU 79 HD11 LEU 79 17.114 9.454 -9.211 584 HD12 LEU 79 HD12 LEU 79 17.466 7.941 -10.064 585 HD13 LEU 79 HD13 LEU 79 16.945 7.922 -8.358 586 HD21 LEU 79 HD21 LEU 79 20.457 7.037 -8.069 587 HD22 LEU 79 HD22 LEU 79 18.778 6.554 -7.763 588 HD23 LEU 79 HD23 LEU 79 19.408 6.526 -9.421 589 H CYS 80 H CYS 80 20.326 13.235 -10.026 590 HA CYS 80 HA CYS 80 21.468 12.855 -12.755 591 HB2 CYS 80 HB2 CYS 80 20.516 15.383 -11.322 592 HB3 CYS 80 HB3 CYS 80 20.931 15.218 -13.040 593 HG CYS 80 HG CYS 80 18.423 14.008 -11.260 594 H GLY 81 H GLY 81 22.406 14.416 -9.682 595 HA2 GLY 81 HA2 GLY 81 24.793 14.655 -9.044 596 HA3 GLY 81 HA3 GLY 81 25.175 14.912 -10.744 597 H CYS 82 H CYS 82 26.005 17.010 -10.518 598 HA CYS 82 HA CYS 82 24.522 19.186 -9.258 599 HB2 CYS 82 HB2 CYS 82 26.888 19.120 -11.183 600 HB3 CYS 82 HB3 CYS 82 26.229 20.606 -10.479 601 HG CYS 82 HG CYS 82 27.171 17.936 -8.732 602 H GLY 83 H GLY 83 23.633 21.046 -10.372 603 HA2 GLY 83 HA2 GLY 83 22.794 22.248 -12.179 604 HA3 GLY 83 HA3 GLY 83 23.058 20.873 -13.249 605 H VAL 84 H VAL 84 21.251 19.721 -10.646 606 HA VAL 84 HA VAL 84 18.621 20.318 -11.957 607 HB VAL 84 HB VAL 84 19.599 17.552 -11.177 608 HG11 VAL 84 HG11 VAL 84 17.150 17.795 -10.822 609 HG12 VAL 84 HG12 VAL 84 16.981 18.428 -12.483 610 HG13 VAL 84 HG13 VAL 84 17.503 16.752 -12.189 611 HG21 VAL 84 HG21 VAL 84 19.391 17.059 -13.610 612 HG22 VAL 84 HG22 VAL 84 19.074 18.780 -13.915 613 HG23 VAL 84 HG23 VAL 84 20.648 18.244 -13.277 614 H ASN 85 H ASN 85 17.208 21.065 -10.535 615 HA ASN 85 HA ASN 85 17.154 19.948 -7.749 616 HB2 ASN 85 HB2 ASN 85 17.036 22.857 -8.651 617 HB3 ASN 85 HB3 ASN 85 16.510 22.327 -7.058 618 HD21 ASN 85 HD22 ASN 85 19.338 22.997 -9.025 619 HD22 ASN 85 HD21 ASN 85 20.489 22.641 -7.745 620 H LEU 86 H LEU 86 15.341 19.968 -10.492 621 HA LEU 86 HA LEU 86 13.109 20.014 -11.048 622 HB2 LEU 86 HB2 LEU 86 13.087 18.306 -8.543 623 HB3 LEU 86 HB3 LEU 86 11.805 18.345 -9.755 624 HG LEU 86 HG LEU 86 14.603 17.284 -10.164 625 HD11 LEU 86 HD11 LEU 86 11.926 15.862 -10.331 626 HD12 LEU 86 HD12 LEU 86 13.543 15.153 -10.176 627 HD13 LEU 86 HD13 LEU 86 12.803 16.001 -8.796 628 HD21 LEU 86 HD21 LEU 86 12.218 17.576 -12.048 629 HD22 LEU 86 HD22 LEU 86 13.842 18.276 -12.276 630 HD23 LEU 86 HD23 LEU 86 13.612 16.528 -12.382 631 HA PRO 87 HA PRO 87 11.881 23.531 -8.241 632 HB2 PRO 87 HB2 PRO 87 11.132 24.534 -10.992 633 HB3 PRO 87 HB3 PRO 87 11.698 25.462 -9.567 634 HG2 PRO 87 HG2 PRO 87 13.454 24.836 -11.511 635 HG3 PRO 87 HG3 PRO 87 13.925 24.603 -9.796 636 HD2 PRO 87 HD2 PRO 87 12.957 22.526 -11.774 637 HD3 PRO 87 HD3 PRO 87 14.313 22.457 -10.614 638 HA PRO 88 HA PRO 88 7.383 23.051 -9.840 639 HB2 PRO 88 HB2 PRO 88 7.290 20.429 -11.257 640 HB3 PRO 88 HB3 PRO 88 6.562 21.992 -11.721 641 HG2 PRO 88 HG2 PRO 88 8.739 20.965 -12.988 642 HG3 PRO 88 HG3 PRO 88 8.599 22.735 -12.668 643 HD2 PRO 88 HD2 PRO 88 10.105 20.638 -11.073 644 HD3 PRO 88 HD3 PRO 88 10.647 22.245 -11.649 645 H GLU 89 H GLU 89 5.557 20.961 -9.727 646 HA GLU 89 HA GLU 89 5.412 20.191 -7.019 647 HB2 GLU 89 HB2 GLU 89 3.560 18.709 -7.786 648 HB3 GLU 89 HB3 GLU 89 3.444 20.383 -8.316 649 HG2 GLU 89 HG2 GLU 89 4.269 19.759 -10.568 650 HG3 GLU 89 HG3 GLU 89 4.463 18.094 -10.053 651 H TRP 90 H TRP 90 7.459 18.804 -9.306 652 HA TRP 90 HA TRP 90 7.641 16.086 -8.451 653 HB2 TRP 90 HB2 TRP 90 9.564 17.992 -9.791 654 HB3 TRP 90 HB3 TRP 90 9.922 16.291 -9.458 655 HD1 TRP 90 HD1 TRP 90 7.896 18.456 -11.853 656 HE1 TRP 90 HE1 TRP 90 6.544 16.984 -13.460 657 HE3 TRP 90 HE3 TRP 90 9.018 13.911 -9.870 658 HZ2 TRP 90 HZ2 TRP 90 6.223 14.135 -13.989 659 HZ3 TRP 90 HZ3 TRP 90 8.280 11.837 -10.972 660 HH2 TRP 90 HH2 TRP 90 6.913 11.936 -13.050 661 H VAL 91 H VAL 91 8.597 18.939 -6.747 662 HA VAL 91 HA VAL 91 10.024 17.214 -4.740 663 HB VAL 91 HB VAL 91 11.244 19.133 -3.957 664 HG11 VAL 91 HG11 VAL 91 12.287 17.738 -5.613 665 HG12 VAL 91 HG12 VAL 91 11.545 18.658 -6.926 666 HG13 VAL 91 HG13 VAL 91 12.755 19.417 -5.868 667 HG21 VAL 91 HG21 VAL 91 10.041 20.703 -6.280 668 HG22 VAL 91 HG22 VAL 91 9.663 20.964 -4.564 669 HG23 VAL 91 HG23 VAL 91 11.300 21.256 -5.170 670 H THR 92 H THR 92 7.035 18.524 -5.181 671 HA THR 92 HA THR 92 6.668 19.376 -2.356 672 HB THR 92 HB THR 92 4.511 20.188 -2.988 673 HG1 THR 92 HG1 THR 92 3.648 19.839 -4.950 674 HG21 THR 92 HG21 THR 92 5.091 21.911 -4.609 675 HG22 THR 92 HG22 THR 92 6.458 21.659 -3.512 676 HG23 THR 92 HG23 THR 92 6.509 20.994 -5.160 677 H GLN 93 H GLN 93 6.826 16.463 -3.734 678 HA GLN 93 HA GLN 93 4.416 15.188 -2.704 679 HB2 GLN 93 HB2 GLN 93 6.999 13.924 -3.712 680 HB3 GLN 93 HB3 GLN 93 5.438 13.132 -3.480 681 HG2 GLN 93 HG2 GLN 93 6.172 15.192 -5.579 682 HG3 GLN 93 HG3 GLN 93 5.641 13.541 -5.820 683 HE21 GLN 93 HE21 GLN 93 4.591 16.617 -6.243 684 HE22 GLN 93 HE22 GLN 93 2.872 16.394 -5.932 685 H GLU 94 H GLU 94 5.075 12.979 -1.390 686 HA GLU 94 HA GLU 94 5.299 14.096 1.251 687 HB2 GLU 94 HB2 GLU 94 3.838 12.219 0.778 688 HB3 GLU 94 HB3 GLU 94 5.218 11.185 0.390 689 HG2 GLU 94 HG2 GLU 94 6.057 11.289 2.640 690 HG3 GLU 94 HG3 GLU 94 4.847 12.498 3.095 691 H ILE 95 H ILE 95 7.657 12.242 -0.688 692 HA ILE 95 HA ILE 95 9.769 13.416 1.035 693 HB ILE 95 HB ILE 95 9.919 10.516 0.162 694 HG12 ILE 95 HG12 ILE 95 9.312 11.563 2.951 695 HG13 ILE 95 HG13 ILE 95 8.213 10.664 1.892 696 HG21 ILE 95 HG21 ILE 95 12.123 11.649 0.354 697 HG22 ILE 95 HG22 ILE 95 11.722 12.125 2.021 698 HG23 ILE 95 HG23 ILE 95 11.934 10.422 1.579 699 HD11 ILE 95 HD11 ILE 95 8.974 9.083 3.438 700 HD12 ILE 95 HD12 ILE 95 9.871 8.741 1.945 701 HD13 ILE 95 HD13 ILE 95 10.664 9.591 3.293 702 H PHE 96 H PHE 96 11.468 14.200 -0.069 703 HA PHE 96 HA PHE 96 11.967 13.253 -2.816 704 HB2 PHE 96 HB2 PHE 96 10.910 15.370 -3.218 705 HB3 PHE 96 HB3 PHE 96 11.933 16.162 -2.015 706 HD1 PHE 96 HD2 PHE 96 11.895 14.637 -5.440 707 HD2 PHE 96 HD1 PHE 96 14.256 16.749 -2.498 708 HE1 PHE 96 HE2 PHE 96 13.731 14.898 -7.076 709 HE2 PHE 96 HE1 PHE 96 16.035 17.094 -4.180 710 HZ PHE 96 HZ PHE 96 15.784 16.167 -6.468 711 H GLU 97 H GLU 97 14.068 12.779 -3.237 712 HA GLU 97 HA GLU 97 16.178 13.761 -1.385 713 HB2 GLU 97 HB2 GLU 97 15.941 10.854 -2.243 714 HB3 GLU 97 HB3 GLU 97 17.255 11.593 -1.333 715 HG2 GLU 97 HG2 GLU 97 15.657 12.086 0.526 716 HG3 GLU 97 HG3 GLU 97 14.386 11.247 -0.373 717 H ASP 98 H ASP 98 18.279 13.863 -2.332 718 HA ASP 98 HA ASP 98 18.445 13.218 -5.230 719 HB2 ASP 98 HB2 ASP 98 19.691 15.117 -5.719 720 HB3 ASP 98 HB3 ASP 98 18.213 15.633 -4.918 721 H TRP 99 H TRP 99 19.744 11.651 -5.610 722 HA TRP 99 HA TRP 99 21.973 10.952 -3.745 723 HB2 TRP 99 HB2 TRP 99 20.500 9.239 -5.771 724 HB3 TRP 99 HB3 TRP 99 21.720 8.696 -4.638 725 HD1 TRP 99 HD1 TRP 99 19.869 10.634 -2.343 726 HE1 TRP 99 HE1 TRP 99 17.923 9.368 -1.218 727 HE3 TRP 99 HE3 TRP 99 19.541 6.651 -5.533 728 HZ2 TRP 99 HZ2 TRP 99 16.353 7.028 -1.728 729 HZ3 TRP 99 HZ3 TRP 99 17.774 4.932 -5.221 730 HH2 TRP 99 HH2 TRP 99 16.162 5.120 -3.329 731 H GLN 100 H GLN 100 23.418 12.481 -4.627 732 HA GLN 100 HA GLN 100 24.001 12.520 -7.478 733 HB2 GLN 100 HB2 GLN 100 25.322 13.941 -5.137 734 HB3 GLN 100 HB3 GLN 100 25.664 14.227 -6.846 735 HG2 GLN 100 HG2 GLN 100 23.191 14.835 -7.133 736 HG3 GLN 100 HG3 GLN 100 23.036 14.724 -5.383 737 HE21 GLN 100 HE22 GLN 100 22.607 16.915 -4.929 738 HE22 GLN 100 HE21 GLN 100 23.750 18.201 -5.336 739 H LEU 101 H LEU 101 24.520 10.246 -7.688 740 HA LEU 101 HA LEU 101 27.238 9.371 -6.814 741 HB2 LEU 101 HB2 LEU 101 25.091 7.955 -8.455 742 HB3 LEU 101 HB3 LEU 101 26.610 7.244 -7.920 743 HG LEU 101 HG LEU 101 24.313 8.116 -6.104 744 HD11 LEU 101 HD11 LEU 101 25.371 5.361 -6.832 745 HD12 LEU 101 HD12 LEU 101 24.035 5.737 -5.712 746 HD13 LEU 101 HD13 LEU 101 23.877 6.117 -7.436 747 HD21 LEU 101 HD21 LEU 101 25.593 6.994 -4.308 748 HD22 LEU 101 HD22 LEU 101 26.962 6.769 -5.420 749 HD23 LEU 101 HD23 LEU 101 26.454 8.401 -4.928 750 H GLU 102 H GLU 102 28.715 8.504 -8.600 751 HA GLU 102 HA GLU 102 28.951 10.482 -10.720 752 HB2 GLU 102 HB2 GLU 102 30.906 9.280 -11.398 753 HB3 GLU 102 HB3 GLU 102 30.952 9.584 -9.657 754 HG2 GLU 102 HG2 GLU 102 30.154 7.197 -9.317 755 HG3 GLU 102 HG3 GLU 102 30.372 6.942 -11.052 756 H ASP 103 H ASP 103 29.164 9.827 -12.964 757 HA ASP 103 HA ASP 103 26.862 8.096 -13.656 758 HB2 ASP 103 HB2 ASP 103 26.792 10.469 -14.193 759 HB3 ASP 103 HB3 ASP 103 28.094 10.230 -15.371 760 HA PRO 104 HA PRO 104 30.101 5.289 -14.975 761 HB2 PRO 104 HB2 PRO 104 27.798 3.521 -15.603 762 HB3 PRO 104 HB3 PRO 104 29.302 3.159 -14.690 763 HG2 PRO 104 HG2 PRO 104 27.002 3.583 -13.340 764 HG3 PRO 104 HG3 PRO 104 28.492 4.446 -12.798 765 HD2 PRO 104 HD2 PRO 104 26.314 5.479 -14.663 766 HD3 PRO 104 HD3 PRO 104 26.936 6.187 -13.149 767 H ASP 105 H ASP 105 27.883 6.617 -17.220 768 HA ASP 105 HA ASP 105 28.201 4.990 -19.512 769 HB2 ASP 105 HB2 ASP 105 26.513 6.710 -19.242 770 HB3 ASP 105 HB3 ASP 105 27.753 7.969 -19.179 771 H GLY 106 H GLY 106 30.066 4.381 -20.430 772 HA2 GLY 106 HA2 GLY 106 32.047 4.535 -21.609 773 HA3 GLY 106 HA3 GLY 106 31.974 6.295 -21.488 774 H GLN 107 H GLN 107 31.788 4.647 -18.437 775 HA GLN 107 HA GLN 107 34.533 5.565 -17.747 776 HB2 GLN 107 HB2 GLN 107 32.418 4.418 -15.906 777 HB3 GLN 107 HB3 GLN 107 33.930 5.207 -15.444 778 HG2 GLN 107 HG2 GLN 107 31.576 6.533 -16.849 779 HG3 GLN 107 HG3 GLN 107 31.906 6.563 -15.124 780 HE21 GLN 107 HE22 GLN 107 31.516 8.898 -15.982 781 HE22 GLN 107 HE21 GLN 107 33.007 9.810 -16.259 782 H SER 108 H SER 108 33.156 2.766 -16.159 783 HA SER 108 HA SER 108 34.513 0.734 -17.688 784 HB2 SER 108 HB2 SER 108 36.089 -0.025 -16.059 785 HB3 SER 108 HB3 SER 108 36.405 1.698 -16.281 786 HG SER 108 HG SER 108 36.366 1.256 -14.090 787 H LEU 109 H LEU 109 34.066 -1.456 -16.714 788 HA LEU 109 HA LEU 109 31.377 -1.647 -15.675 789 HB2 LEU 109 HB2 LEU 109 33.556 -3.769 -15.597 790 HB3 LEU 109 HB3 LEU 109 31.812 -4.014 -15.482 791 HG LEU 109 HG LEU 109 33.354 -3.079 -17.942 792 HD11 LEU 109 HD11 LEU 109 31.795 -5.617 -17.335 793 HD12 LEU 109 HD12 LEU 109 32.651 -5.234 -18.848 794 HD13 LEU 109 HD13 LEU 109 33.563 -5.448 -17.337 795 HD21 LEU 109 HD21 LEU 109 30.355 -3.466 -17.566 796 HD22 LEU 109 HD22 LEU 109 31.186 -1.951 -17.961 797 HD23 LEU 109 HD23 LEU 109 31.172 -3.279 -19.130 798 H GLU 110 H GLU 110 34.545 -1.734 -14.111 799 HA GLU 110 HA GLU 110 33.643 -2.270 -11.445 800 HB2 GLU 110 HB2 GLU 110 36.003 -2.347 -12.208 801 HB3 GLU 110 HB3 GLU 110 36.010 -0.583 -12.348 802 HG2 GLU 110 HG2 GLU 110 35.595 -0.357 -9.934 803 HG3 GLU 110 HG3 GLU 110 35.448 -2.110 -9.767 804 H VAL 111 H VAL 111 33.822 0.871 -13.218 805 HA VAL 111 HA VAL 111 32.813 2.391 -10.949 806 HB VAL 111 HB VAL 111 32.965 3.011 -13.902 807 HG11 VAL 111 HG11 VAL 111 32.011 4.781 -11.615 808 HG12 VAL 111 HG12 VAL 111 32.519 5.396 -13.198 809 HG13 VAL 111 HG13 VAL 111 31.109 4.340 -13.078 810 HG21 VAL 111 HG21 VAL 111 34.469 4.122 -11.477 811 HG22 VAL 111 HG22 VAL 111 35.122 2.910 -12.594 812 HG23 VAL 111 HG23 VAL 111 34.760 4.536 -13.181 813 H PHE 112 H PHE 112 31.166 0.767 -13.740 814 HA PHE 112 HA PHE 112 28.503 1.596 -12.975 815 HB2 PHE 112 HB2 PHE 112 29.645 -0.727 -14.511 816 HB3 PHE 112 HB3 PHE 112 28.000 -0.820 -13.920 817 HD1 PHE 112 HD2 PHE 112 26.243 0.701 -14.687 818 HD2 PHE 112 HD1 PHE 112 30.189 0.769 -16.401 819 HE1 PHE 112 HE2 PHE 112 25.333 1.786 -16.743 820 HE2 PHE 112 HE1 PHE 112 29.292 1.877 -18.426 821 HZ PHE 112 HZ PHE 112 26.875 2.382 -18.602 822 H ARG 113 H ARG 113 30.372 -1.309 -11.991 823 HA ARG 113 HA ARG 113 28.468 -2.354 -10.122 824 HB2 ARG 113 HB2 ARG 113 31.505 -2.547 -10.315 825 HB3 ARG 113 HB3 ARG 113 30.555 -3.477 -9.148 826 HG2 ARG 113 HG2 ARG 113 29.414 -4.693 -10.843 827 HG3 ARG 113 HG3 ARG 113 29.900 -3.585 -12.111 828 HD2 ARG 113 HD2 ARG 113 31.139 -5.645 -12.331 829 HD3 ARG 113 HD3 ARG 113 32.224 -4.323 -11.947 830 HE ARG 113 HE ARG 113 32.648 -5.225 -9.819 831 HH11 ARG 113 HH11 ARG 113 30.240 -7.284 -11.417 832 HH12 ARG 113 HH12 ARG 113 30.617 -8.619 -10.354 833 HH21 ARG 113 HH22 ARG 113 32.963 -6.955 -8.482 834 HH22 ARG 113 HH21 ARG 113 32.057 -8.419 -8.714 835 H THR 114 H THR 114 31.064 0.021 -9.621 836 HA THR 114 HA THR 114 30.726 0.399 -6.796 837 HB THR 114 HB THR 114 31.738 2.299 -8.946 838 HG1 THR 114 HG1 THR 114 33.011 0.509 -8.783 839 HG21 THR 114 HG21 THR 114 31.245 3.665 -7.019 840 HG22 THR 114 HG22 THR 114 31.981 2.467 -5.920 841 HG23 THR 114 HG23 THR 114 32.989 3.382 -7.056 842 H VAL 115 H VAL 115 29.085 1.990 -9.549 843 HA VAL 115 HA VAL 115 27.473 3.717 -7.792 844 HB VAL 115 HB VAL 115 27.463 3.138 -10.765 845 HG11 VAL 115 HG11 VAL 115 25.687 5.109 -9.247 846 HG12 VAL 115 HG12 VAL 115 25.935 5.087 -11.008 847 HG13 VAL 115 HG13 VAL 115 25.136 3.720 -10.225 848 HG21 VAL 115 HG21 VAL 115 29.353 4.476 -9.859 849 HG22 VAL 115 HG22 VAL 115 28.287 5.483 -10.834 850 HG23 VAL 115 HG23 VAL 115 28.202 5.577 -9.071 851 H ARG 116 H ARG 116 26.832 0.741 -9.643 852 HA ARG 116 HA ARG 116 24.116 0.353 -9.178 853 HB2 ARG 116 HB2 ARG 116 25.646 -0.995 -10.644 854 HB3 ARG 116 HB3 ARG 116 26.351 -1.735 -9.205 855 HG2 ARG 116 HG2 ARG 116 24.026 -2.611 -8.657 856 HG3 ARG 116 HG3 ARG 116 23.502 -1.998 -10.237 857 HD2 ARG 116 HD2 ARG 116 23.945 -4.336 -10.478 858 HD3 ARG 116 HD3 ARG 116 25.255 -3.454 -11.290 859 HE ARG 116 HE ARG 116 25.764 -4.219 -8.461 860 HH11 ARG 116 HH11 ARG 116 25.980 -5.501 -11.696 861 HH12 ARG 116 HH12 ARG 116 27.550 -6.225 -11.445 862 HH21 ARG 116 HH21 ARG 116 27.594 -5.470 -8.058 863 HH22 ARG 116 HH22 ARG 116 28.235 -6.459 -9.332 864 H GLY 117 H GLY 117 26.749 -0.752 -6.996 865 HA2 GLY 117 HA2 GLY 117 25.092 -1.911 -4.992 866 HA3 GLY 117 HA3 GLY 117 26.734 -1.301 -4.749 867 H GLN 118 H GLN 118 26.204 1.484 -5.364 868 HA GLN 118 HA GLN 118 25.062 2.327 -2.812 869 HB2 GLN 118 HB2 GLN 118 26.171 3.862 -5.188 870 HB3 GLN 118 HB3 GLN 118 25.554 4.631 -3.713 871 HG2 GLN 118 HG2 GLN 118 27.213 3.487 -2.338 872 HG3 GLN 118 HG3 GLN 118 27.801 2.567 -3.716 873 HE21 GLN 118 HE22 GLN 118 29.061 3.655 -5.370 874 HE22 GLN 118 HE21 GLN 118 29.788 5.226 -5.014 875 H VAL 119 H VAL 119 23.940 2.553 -6.238 876 HA VAL 119 HA VAL 119 21.425 3.790 -5.653 877 HB VAL 119 HB VAL 119 22.051 1.750 -7.837 878 HG11 VAL 119 HG11 VAL 119 19.705 3.633 -7.435 879 HG12 VAL 119 HG12 VAL 119 20.081 2.816 -8.969 880 HG13 VAL 119 HG13 VAL 119 19.658 1.851 -7.545 881 HG21 VAL 119 HG21 VAL 119 21.912 4.798 -7.927 882 HG22 VAL 119 HG22 VAL 119 23.406 3.834 -8.034 883 HG23 VAL 119 HG23 VAL 119 22.201 3.723 -9.310 884 H LYS 120 H LYS 120 22.260 0.280 -5.697 885 HA LYS 120 HA LYS 120 19.742 -0.745 -4.801 886 HB2 LYS 120 HB2 LYS 120 21.719 -2.075 -5.684 887 HB3 LYS 120 HB3 LYS 120 22.559 -1.776 -4.170 888 HG2 LYS 120 HG2 LYS 120 20.600 -2.882 -2.967 889 HG3 LYS 120 HG3 LYS 120 19.950 -3.301 -4.549 890 HD2 LYS 120 HD2 LYS 120 22.126 -4.550 -5.012 891 HD3 LYS 120 HD3 LYS 120 22.624 -4.162 -3.350 892 HE2 LYS 120 HE2 LYS 120 20.427 -5.228 -2.570 893 HE3 LYS 120 HE3 LYS 120 20.202 -5.803 -4.233 894 HZ1 LYS 120 HZ1 LYS 120 22.343 -7.028 -4.001 895 HZ2 LYS 120 HZ2 LYS 120 22.512 -6.499 -2.460 896 HZ3 LYS 120 HZ3 LYS 120 21.293 -7.504 -2.841 897 H GLU 121 H GLU 121 22.612 0.089 -2.683 898 HA GLU 121 HA GLU 121 21.071 -0.458 -0.327 899 HB2 GLU 121 HB2 GLU 121 22.853 0.197 0.914 900 HB3 GLU 121 HB3 GLU 121 23.669 -0.170 -0.600 901 HG2 GLU 121 HG2 GLU 121 23.649 2.280 -1.140 902 HG3 GLU 121 HG3 GLU 121 22.901 2.598 0.421 903 H ARG 122 H ARG 122 21.252 2.592 -2.160 904 HA ARG 122 HA ARG 122 19.639 3.890 -0.132 905 HB2 ARG 122 HB2 ARG 122 20.250 4.713 -2.989 906 HB3 ARG 122 HB3 ARG 122 19.287 5.643 -1.830 907 HG2 ARG 122 HG2 ARG 122 21.323 5.338 -0.193 908 HG3 ARG 122 HG3 ARG 122 22.246 4.959 -1.655 909 HD2 ARG 122 HD2 ARG 122 21.539 7.126 -2.624 910 HD3 ARG 122 HD3 ARG 122 20.570 7.428 -1.152 911 HE ARG 122 HE ARG 122 23.544 7.035 -1.020 912 HH11 ARG 122 HH11 ARG 122 20.828 9.148 -0.327 913 HH12 ARG 122 HH12 ARG 122 21.819 10.270 0.563 914 HH21 ARG 122 HH21 ARG 122 24.734 8.491 0.138 915 HH22 ARG 122 HH22 ARG 122 23.981 9.902 0.810 916 H VAL 123 H VAL 123 18.604 2.237 -3.229 917 HA VAL 123 HA VAL 123 15.846 2.716 -2.598 918 HB VAL 123 HB VAL 123 15.357 0.799 -4.094 919 HG11 VAL 123 HG11 VAL 123 17.390 2.651 -5.318 920 HG12 VAL 123 HG12 VAL 123 16.032 1.826 -6.118 921 HG13 VAL 123 HG13 VAL 123 15.709 3.119 -4.957 922 HG21 VAL 123 HG21 VAL 123 16.709 -0.427 -5.257 923 HG22 VAL 123 HG22 VAL 123 18.159 0.433 -4.700 924 HG23 VAL 123 HG23 VAL 123 17.232 -0.645 -3.585 925 H GLU 124 H GLU 124 17.971 -0.009 -1.520 926 HA GLU 124 HA GLU 124 15.851 -1.372 -0.165 927 HB2 GLU 124 HB2 GLU 124 18.813 -1.272 0.510 928 HB3 GLU 124 HB3 GLU 124 17.612 -2.346 1.263 929 HG2 GLU 124 HG2 GLU 124 17.088 -3.327 -0.889 930 HG3 GLU 124 HG3 GLU 124 18.373 -2.388 -1.655 931 H ASN 125 H ASN 125 18.030 1.207 1.002 932 HA ASN 125 HA ASN 125 16.839 1.170 3.552 933 HB2 ASN 125 HB2 ASN 125 18.612 2.517 3.992 934 HB3 ASN 125 HB3 ASN 125 18.975 2.582 2.276 935 HD21 ASN 125 HD22 ASN 125 17.982 4.227 0.957 936 HD22 ASN 125 HD21 ASN 125 17.749 5.808 1.715 937 H LEU 126 H LEU 126 15.840 2.817 0.617 938 HA LEU 126 HA LEU 126 13.882 4.516 1.909 939 HB2 LEU 126 HB2 LEU 126 14.929 5.162 -0.175 940 HB3 LEU 126 HB3 LEU 126 14.395 3.683 -0.975 941 HG LEU 126 HG LEU 126 12.050 4.400 -0.832 942 HD11 LEU 126 HD11 LEU 126 12.128 5.811 1.217 943 HD12 LEU 126 HD12 LEU 126 13.137 6.993 0.354 944 HD13 LEU 126 HD13 LEU 126 11.458 6.683 -0.150 945 HD21 LEU 126 HD21 LEU 126 13.953 6.455 -2.002 946 HD22 LEU 126 HD22 LEU 126 13.380 4.972 -2.791 947 HD23 LEU 126 HD23 LEU 126 12.232 6.277 -2.423 948 H ILE 127 H ILE 127 13.567 1.390 0.051 949 HA ILE 127 HA ILE 127 10.706 1.404 0.309 950 HB ILE 127 HB ILE 127 10.764 -0.981 -0.242 951 HG12 ILE 127 HG12 ILE 127 13.768 -0.732 0.057 952 HG13 ILE 127 HG13 ILE 127 12.681 -1.841 0.876 953 HG21 ILE 127 HG21 ILE 127 12.640 0.667 -2.014 954 HG22 ILE 127 HG22 ILE 127 11.551 -0.636 -2.529 955 HG23 ILE 127 HG23 ILE 127 10.881 0.893 -1.944 956 HD11 ILE 127 HD11 ILE 127 12.236 -2.943 -1.328 957 HD12 ILE 127 HD12 ILE 127 13.493 -1.888 -2.044 958 HD13 ILE 127 HD13 ILE 127 13.925 -3.046 -0.778 959 H ALA 128 H ALA 128 13.165 0.272 2.584 960 HA ALA 128 HA ALA 128 11.300 -1.063 4.290 961 HB1 ALA 128 HB1 ALA 128 13.159 -0.961 5.938 962 HB2 ALA 128 HB2 ALA 128 13.745 -1.450 4.336 963 HB3 ALA 128 HB3 ALA 128 14.009 0.212 4.912 964 H LYS 129 H LYS 129 11.915 2.345 3.802 965 HA LYS 129 HA LYS 129 10.590 3.208 6.314 966 HB2 LYS 129 HB2 LYS 129 11.628 4.792 3.923 967 HB3 LYS 129 HB3 LYS 129 10.887 5.491 5.356 968 HG2 LYS 129 HG2 LYS 129 12.677 4.632 6.781 969 HG3 LYS 129 HG3 LYS 129 13.424 3.809 5.403 970 HD2 LYS 129 HD2 LYS 129 13.649 6.036 4.246 971 HD3 LYS 129 HD3 LYS 129 13.054 6.832 5.708 972 HE2 LYS 129 HE2 LYS 129 15.565 5.091 5.509 973 HE3 LYS 129 HE3 LYS 129 15.548 6.853 5.423 974 HZ1 LYS 129 HZ1 LYS 129 14.722 5.257 7.805 975 HZ2 LYS 129 HZ2 LYS 129 16.081 6.143 7.666 976 HZ3 LYS 129 HZ3 LYS 129 14.634 6.891 7.705 977 H ILE 130 H ILE 130 9.875 3.189 2.800 978 HA ILE 130 HA ILE 130 7.211 4.320 3.435 979 HB ILE 130 HB ILE 130 7.038 5.054 1.144 980 HG12 ILE 130 HG12 ILE 130 8.967 5.222 -0.317 981 HG13 ILE 130 HG13 ILE 130 9.940 4.228 0.751 982 HG21 ILE 130 HG21 ILE 130 9.608 5.983 2.488 983 HG22 ILE 130 HG22 ILE 130 8.527 6.904 1.428 984 HG23 ILE 130 HG23 ILE 130 7.973 6.425 3.024 985 HD11 ILE 130 HD11 ILE 130 7.449 3.291 -0.738 986 HD12 ILE 130 HD12 ILE 130 9.125 3.011 -1.246 987 HD13 ILE 130 HD13 ILE 130 8.535 2.273 0.248 988 H SER 131 H SER 131 8.105 1.166 3.017 989 HA SER 131 HA SER 131 6.053 0.176 1.311 990 HB2 SER 131 HB2 SER 131 6.306 -1.941 2.546 991 HB3 SER 131 HB3 SER 131 7.848 -1.251 1.997 992 HG SER 131 HG SER 131 6.808 -0.743 4.598 Start of MODEL 18 1 H MET 1 H1 MET 1 2.770 0.389 1.964 2 HA MET 1 HA MET 1 3.471 -0.187 -0.156 3 HB2 MET 1 HB2 MET 1 1.571 -1.738 -0.632 4 HB3 MET 1 HB3 MET 1 0.553 -0.348 -1.025 5 HG2 MET 1 HG2 MET 1 2.169 0.281 -2.840 6 HG3 MET 1 HG3 MET 1 3.162 -1.110 -2.401 7 HE1 MET 1 HE1 MET 1 2.666 -0.998 -5.256 8 HE2 MET 1 HE2 MET 1 3.243 -2.525 -4.538 9 HE3 MET 1 HE3 MET 1 1.912 -2.543 -5.715 10 H LYS 2 H LYS 2 4.377 1.580 -0.968 11 HA LYS 2 HA LYS 2 2.691 3.925 -1.772 12 HB2 LYS 2 HB2 LYS 2 5.274 3.982 -0.153 13 HB3 LYS 2 HB3 LYS 2 4.633 5.391 -0.994 14 HG2 LYS 2 HG2 LYS 2 2.492 5.202 0.235 15 HG3 LYS 2 HG3 LYS 2 3.128 3.821 1.142 16 HD2 LYS 2 HD2 LYS 2 4.865 5.232 2.154 17 HD3 LYS 2 HD3 LYS 2 4.284 6.637 1.230 18 HE2 LYS 2 HE2 LYS 2 2.072 6.466 2.310 19 HE3 LYS 2 HE3 LYS 2 2.569 5.001 3.175 20 HZ1 LYS 2 HZ1 LYS 2 2.720 7.045 4.549 21 HZ2 LYS 2 HZ2 LYS 2 4.186 6.330 4.405 22 HZ3 LYS 2 HZ3 LYS 2 3.839 7.675 3.529 23 H LYS 3 H LYS 3 3.863 5.385 -3.299 24 HA LYS 3 HA LYS 3 5.221 3.685 -5.358 25 HB2 LYS 3 HB2 LYS 3 3.634 6.244 -5.785 26 HB3 LYS 3 HB3 LYS 3 4.433 5.318 -7.030 27 HG2 LYS 3 HG2 LYS 3 2.308 4.536 -7.278 28 HG3 LYS 3 HG3 LYS 3 3.025 3.303 -6.252 29 HD2 LYS 3 HD2 LYS 3 0.744 3.782 -5.541 30 HD3 LYS 3 HD3 LYS 3 1.868 4.248 -4.274 31 HE2 LYS 3 HE2 LYS 3 1.785 6.613 -5.361 32 HE3 LYS 3 HE3 LYS 3 0.365 6.028 -6.223 33 HZ1 LYS 3 HZ1 LYS 3 -0.313 7.110 -4.174 34 HZ2 LYS 3 HZ2 LYS 3 -0.560 5.507 -3.917 35 HZ3 LYS 3 HZ3 LYS 3 0.775 6.274 -3.288 36 H VAL 4 H VAL 4 7.042 4.260 -6.342 37 HA VAL 4 HA VAL 4 8.496 6.691 -5.365 38 HB VAL 4 HB VAL 4 9.908 4.057 -5.729 39 HG11 VAL 4 HG11 VAL 4 10.814 6.689 -4.524 40 HG12 VAL 4 HG12 VAL 4 11.758 5.177 -4.634 41 HG13 VAL 4 HG13 VAL 4 11.333 6.028 -6.097 42 HG21 VAL 4 HG21 VAL 4 10.170 4.028 -3.269 43 HG22 VAL 4 HG22 VAL 4 8.998 5.360 -3.142 44 HG23 VAL 4 HG23 VAL 4 8.499 3.779 -3.777 45 H MET 5 H MET 5 9.716 7.793 -6.854 46 HA MET 5 HA MET 5 9.881 6.692 -9.616 47 HB2 MET 5 HB2 MET 5 7.929 8.003 -9.750 48 HB3 MET 5 HB3 MET 5 8.631 9.305 -8.788 49 HG2 MET 5 HG2 MET 5 8.492 9.978 -11.089 50 HG3 MET 5 HG3 MET 5 10.164 9.887 -10.583 51 HE1 MET 5 HE1 MET 5 8.356 8.176 -14.299 52 HE2 MET 5 HE2 MET 5 7.326 8.241 -12.850 53 HE3 MET 5 HE3 MET 5 8.132 9.711 -13.450 54 H PHE 6 H PHE 6 11.718 7.014 -10.574 55 HA PHE 6 HA PHE 6 13.863 8.542 -9.134 56 HB2 PHE 6 HB2 PHE 6 14.180 6.272 -11.125 57 HB3 PHE 6 HB3 PHE 6 15.418 6.962 -10.087 58 HD1 PHE 6 HD2 PHE 6 15.212 6.635 -7.530 59 HD2 PHE 6 HD1 PHE 6 12.825 4.489 -10.406 60 HE1 PHE 6 HE2 PHE 6 14.526 5.037 -5.760 61 HE2 PHE 6 HE1 PHE 6 12.150 2.893 -8.636 62 HZ PHE 6 HZ PHE 6 12.937 3.202 -6.296 63 H VAL 7 H VAL 7 14.515 10.402 -10.005 64 HA VAL 7 HA VAL 7 14.344 10.911 -12.927 65 HB VAL 7 HB VAL 7 14.246 12.665 -10.516 66 HG11 VAL 7 HG11 VAL 7 16.347 13.564 -11.441 67 HG12 VAL 7 HG12 VAL 7 15.602 13.671 -13.065 68 HG13 VAL 7 HG13 VAL 7 15.013 14.666 -11.726 69 HG21 VAL 7 HG21 VAL 7 13.222 12.964 -13.382 70 HG22 VAL 7 HG22 VAL 7 12.321 12.223 -12.018 71 HG23 VAL 7 HG23 VAL 7 12.753 13.927 -11.959 72 H CYS 8 H CYS 8 16.065 11.127 -14.200 73 HA CYS 8 HA CYS 8 18.786 11.567 -13.049 74 HB2 CYS 8 HB2 CYS 8 18.664 9.204 -13.341 75 HB3 CYS 8 HB3 CYS 8 17.904 9.338 -14.934 76 HG CYS 8 HG CYS 8 20.409 8.347 -15.049 77 H LYS 9 H LYS 9 20.283 12.258 -15.048 78 HA LYS 9 HA LYS 9 18.981 14.595 -16.115 79 HB2 LYS 9 HB2 LYS 9 21.576 13.878 -15.583 80 HB3 LYS 9 HB3 LYS 9 21.615 13.821 -17.333 81 HG2 LYS 9 HG2 LYS 9 20.606 16.164 -15.651 82 HG3 LYS 9 HG3 LYS 9 22.265 16.004 -16.188 83 HD2 LYS 9 HD2 LYS 9 19.881 16.282 -18.087 84 HD3 LYS 9 HD3 LYS 9 20.924 17.594 -17.536 85 HE2 LYS 9 HE2 LYS 9 22.921 16.334 -18.469 86 HE3 LYS 9 HE3 LYS 9 21.787 15.199 -19.217 87 HZ1 LYS 9 HZ1 LYS 9 20.812 17.099 -20.444 88 HZ2 LYS 9 HZ2 LYS 9 21.891 18.130 -19.761 89 HZ3 LYS 9 HZ3 LYS 9 22.406 16.958 -20.772 90 H ARG 10 H ARG 10 20.000 11.635 -17.781 91 HA ARG 10 HA ARG 10 18.008 12.254 -19.941 92 HB2 ARG 10 HB2 ARG 10 19.367 11.619 -21.695 93 HB3 ARG 10 HB3 ARG 10 20.270 12.762 -20.728 94 HG2 ARG 10 HG2 ARG 10 20.716 9.741 -20.734 95 HG3 ARG 10 HG3 ARG 10 21.626 10.932 -21.661 96 HD2 ARG 10 HD2 ARG 10 22.205 12.000 -19.392 97 HD3 ARG 10 HD3 ARG 10 21.583 10.476 -18.684 98 HE ARG 10 HE ARG 10 23.512 9.961 -20.769 99 HH11 ARG 10 HH11 ARG 10 23.465 11.158 -17.461 100 HH12 ARG 10 HH12 ARG 10 25.050 10.500 -17.124 101 HH21 ARG 10 HH21 ARG 10 25.511 9.081 -20.189 102 HH22 ARG 10 HH22 ARG 10 26.195 9.562 -18.626 103 H ASN 11 H ASN 11 17.996 10.412 -17.579 104 HA ASN 11 HA ASN 11 17.494 8.266 -16.914 105 HB2 ASN 11 HB2 ASN 11 15.505 9.526 -17.298 106 HB3 ASN 11 HB3 ASN 11 15.373 8.991 -18.950 107 HD21 ASN 11 HD22 ASN 11 15.791 7.119 -15.741 108 HD22 ASN 11 HD21 ASN 11 14.407 6.109 -16.151 109 H SER 12 H SER 12 19.582 8.061 -18.829 110 HA SER 12 HA SER 12 19.136 5.546 -20.260 111 HB2 SER 12 HB2 SER 12 21.612 5.912 -20.731 112 HB3 SER 12 HB3 SER 12 20.552 7.254 -21.208 113 HG SER 12 HG SER 12 22.427 7.930 -19.934 114 H CYS 13 H CYS 13 20.773 6.689 -17.358 115 HA CYS 13 HA CYS 13 21.360 3.927 -16.391 116 HB2 CYS 13 HB2 CYS 13 23.708 4.747 -15.907 117 HB3 CYS 13 HB3 CYS 13 23.306 4.738 -17.623 118 HG CYS 13 HG CYS 13 22.782 7.247 -17.914 119 H ARG 14 H ARG 14 22.371 4.200 -14.039 120 HA ARG 14 HA ARG 14 21.716 4.318 -11.856 121 HB2 ARG 14 HB2 ARG 14 21.364 7.278 -12.560 122 HB3 ARG 14 HB3 ARG 14 21.356 6.622 -10.916 123 HG2 ARG 14 HG2 ARG 14 23.645 5.663 -11.376 124 HG3 ARG 14 HG3 ARG 14 23.672 6.575 -12.890 125 HD2 ARG 14 HD2 ARG 14 23.348 7.743 -10.084 126 HD3 ARG 14 HD3 ARG 14 24.845 7.743 -10.998 127 HE ARG 14 HE ARG 14 22.535 9.531 -11.358 128 HH11 ARG 14 HH11 ARG 14 25.639 8.652 -12.723 129 HH12 ARG 14 HH12 ARG 14 25.400 9.721 -14.112 130 HH21 ARG 14 HH21 ARG 14 22.515 11.082 -12.863 131 HH22 ARG 14 HH22 ARG 14 23.816 11.203 -14.043 132 H SER 15 H SER 15 19.301 6.620 -12.935 133 HA SER 15 HA SER 15 17.142 5.809 -11.362 134 HB2 SER 15 HB2 SER 15 15.734 6.938 -13.101 135 HB3 SER 15 HB3 SER 15 17.162 7.853 -12.692 136 HG SER 15 HG SER 15 18.200 6.922 -14.656 137 H GLN 16 H GLN 16 17.928 4.473 -14.576 138 HA GLN 16 HA GLN 16 15.675 2.656 -14.721 139 HB2 GLN 16 HB2 GLN 16 18.446 2.541 -16.014 140 HB3 GLN 16 HB3 GLN 16 17.109 1.494 -16.467 141 HG2 GLN 16 HG2 GLN 16 16.951 4.546 -16.638 142 HG3 GLN 16 HG3 GLN 16 17.526 3.530 -17.945 143 HE21 GLN 16 HE22 GLN 16 15.479 5.128 -18.508 144 HE22 GLN 16 HE21 GLN 16 13.986 4.195 -18.669 145 H MET 17 H MET 17 18.960 2.259 -13.373 146 HA MET 17 HA MET 17 18.637 -0.565 -12.663 147 HB2 MET 17 HB2 MET 17 20.658 1.547 -11.776 148 HB3 MET 17 HB3 MET 17 20.779 -0.173 -11.424 149 HG2 MET 17 HG2 MET 17 21.578 -0.672 -13.492 150 HG3 MET 17 HG3 MET 17 20.386 0.332 -14.300 151 HE1 MET 17 HE1 MET 17 23.438 1.029 -11.786 152 HE2 MET 17 HE2 MET 17 24.018 -0.035 -13.094 153 HE3 MET 17 HE3 MET 17 24.613 1.637 -12.973 154 H ALA 18 H ALA 18 18.148 2.551 -10.967 155 HA ALA 18 HA ALA 18 17.497 1.471 -8.397 156 HB1 ALA 18 HB1 ALA 18 16.517 3.644 -7.971 157 HB2 ALA 18 HB2 ALA 18 17.966 3.894 -8.969 158 HB3 ALA 18 HB3 ALA 18 16.353 3.983 -9.706 159 H GLU 19 H GLU 19 15.353 2.199 -11.205 160 HA GLU 19 HA GLU 19 12.969 1.046 -10.115 161 HB2 GLU 19 HB2 GLU 19 13.089 2.505 -12.079 162 HB3 GLU 19 HB3 GLU 19 13.921 1.245 -12.999 163 HG2 GLU 19 HG2 GLU 19 11.932 -0.211 -12.813 164 HG3 GLU 19 HG3 GLU 19 11.124 1.016 -11.824 165 H GLY 20 H GLY 20 15.622 -0.528 -11.952 166 HA2 GLY 20 HA2 GLY 20 14.619 -3.166 -12.004 167 HA3 GLY 20 HA3 GLY 20 16.329 -2.721 -11.955 168 H PHE 21 H PHE 21 16.767 -1.743 -9.412 169 HA PHE 21 HA PHE 21 16.569 -4.135 -7.782 170 HB2 PHE 21 HB2 PHE 21 17.397 -1.264 -7.180 171 HB3 PHE 21 HB3 PHE 21 17.407 -2.533 -5.955 172 HD1 PHE 21 HD1 PHE 21 18.521 -4.844 -6.768 173 HD2 PHE 21 HD2 PHE 21 19.487 -0.908 -8.242 174 HE1 PHE 21 HE1 PHE 21 20.727 -5.665 -7.500 175 HE2 PHE 21 HE2 PHE 21 21.694 -1.728 -8.971 176 HZ PHE 21 HZ PHE 21 22.316 -4.136 -8.618 177 H ALA 22 H ALA 22 14.778 -1.030 -7.676 178 HA ALA 22 HA ALA 22 13.288 -1.753 -5.359 179 HB1 ALA 22 HB1 ALA 22 11.957 0.199 -5.893 180 HB2 ALA 22 HB2 ALA 22 13.648 0.557 -6.258 181 HB3 ALA 22 HB3 ALA 22 12.551 0.184 -7.589 182 H LYS 23 H LYS 23 12.407 -2.332 -8.829 183 HA LYS 23 HA LYS 23 9.794 -3.348 -8.102 184 HB2 LYS 23 HB2 LYS 23 9.556 -4.004 -10.337 185 HB3 LYS 23 HB3 LYS 23 10.508 -2.511 -10.350 186 HG2 LYS 23 HG2 LYS 23 12.575 -3.937 -10.655 187 HG3 LYS 23 HG3 LYS 23 11.520 -5.352 -10.809 188 HD2 LYS 23 HD2 LYS 23 10.327 -4.167 -12.707 189 HD3 LYS 23 HD3 LYS 23 11.547 -2.874 -12.596 190 HE2 LYS 23 HE2 LYS 23 13.339 -4.600 -13.011 191 HE3 LYS 23 HE3 LYS 23 12.088 -5.833 -13.155 192 HZ1 LYS 23 HZ1 LYS 23 12.326 -3.451 -14.962 193 HZ2 LYS 23 HZ2 LYS 23 12.790 -4.991 -15.315 194 HZ3 LYS 23 HZ3 LYS 23 11.196 -4.651 -15.092 195 H THR 24 H THR 24 12.889 -4.833 -8.196 196 HA THR 24 HA THR 24 11.948 -7.583 -7.801 197 HB THR 24 HB THR 24 14.743 -6.488 -7.400 198 HG1 THR 24 HG1 THR 24 14.355 -6.037 -9.479 199 HG21 THR 24 HG21 THR 24 15.445 -8.774 -8.004 200 HG22 THR 24 HG22 THR 24 14.434 -8.807 -6.554 201 HG23 THR 24 HG23 THR 24 13.746 -9.279 -8.132 202 H LEU 25 H LEU 25 13.748 -5.292 -5.659 203 HA LEU 25 HA LEU 25 13.510 -7.068 -3.337 204 HB2 LEU 25 HB2 LEU 25 14.572 -4.206 -3.553 205 HB3 LEU 25 HB3 LEU 25 14.871 -5.305 -2.219 206 HG LEU 25 HG LEU 25 15.883 -5.684 -5.078 207 HD11 LEU 25 HD11 LEU 25 16.883 -3.814 -3.666 208 HD12 LEU 25 HD12 LEU 25 17.414 -5.095 -2.551 209 HD13 LEU 25 HD13 LEU 25 18.020 -5.069 -4.219 210 HD21 LEU 25 HD21 LEU 25 16.399 -7.316 -2.567 211 HD22 LEU 25 HD22 LEU 25 15.550 -7.871 -4.028 212 HD23 LEU 25 HD23 LEU 25 17.274 -7.483 -4.105 213 H GLY 26 H GLY 26 11.810 -4.272 -4.551 214 HA2 GLY 26 HA2 GLY 26 10.204 -3.916 -2.086 215 HA3 GLY 26 HA3 GLY 26 10.291 -2.848 -3.487 216 H ALA 27 H ALA 27 9.931 -6.074 -4.580 217 HA ALA 27 HA ALA 27 7.501 -5.714 -5.834 218 HB1 ALA 27 HB1 ALA 27 9.058 -7.595 -6.248 219 HB2 ALA 27 HB2 ALA 27 8.628 -8.315 -4.685 220 HB3 ALA 27 HB3 ALA 27 7.410 -8.183 -5.980 221 H GLY 28 H GLY 28 5.559 -5.139 -5.058 222 HA2 GLY 28 HA2 GLY 28 3.518 -5.360 -3.970 223 HA3 GLY 28 HA3 GLY 28 4.161 -6.680 -2.991 224 H LYS 29 H LYS 29 6.490 -4.811 -2.227 225 HA LYS 29 HA LYS 29 5.300 -3.377 0.067 226 HB2 LYS 29 HB2 LYS 29 8.134 -3.571 -1.043 227 HB3 LYS 29 HB3 LYS 29 7.714 -2.666 0.397 228 HG2 LYS 29 HG2 LYS 29 7.407 -4.533 1.693 229 HG3 LYS 29 HG3 LYS 29 6.745 -5.487 0.377 230 HD2 LYS 29 HD2 LYS 29 8.741 -6.521 1.002 231 HD3 LYS 29 HD3 LYS 29 9.056 -5.757 -0.556 232 HE2 LYS 29 HE2 LYS 29 10.230 -3.887 0.620 233 HE3 LYS 29 HE3 LYS 29 9.849 -4.637 2.179 234 HZ1 LYS 29 HZ1 LYS 29 12.101 -5.256 1.489 235 HZ2 LYS 29 HZ2 LYS 29 11.167 -6.590 1.500 236 HZ3 LYS 29 HZ3 LYS 29 11.571 -5.890 0.068 237 H ILE 30 H ILE 30 6.624 -2.589 -3.130 238 HA ILE 30 HA ILE 30 5.239 0.023 -3.064 239 HB ILE 30 HB ILE 30 7.247 1.197 -3.962 240 HG12 ILE 30 HG12 ILE 30 9.494 0.388 -3.623 241 HG13 ILE 30 HG13 ILE 30 8.918 -1.176 -3.062 242 HG21 ILE 30 HG21 ILE 30 7.801 -0.021 -1.229 243 HG22 ILE 30 HG22 ILE 30 8.398 1.511 -1.893 244 HG23 ILE 30 HG23 ILE 30 6.670 1.312 -1.551 245 HD11 ILE 30 HD11 ILE 30 9.860 -0.951 -5.449 246 HD12 ILE 30 HD12 ILE 30 8.346 -1.846 -5.275 247 HD13 ILE 30 HD13 ILE 30 8.340 -0.160 -5.864 248 H ALA 31 H ALA 31 5.382 1.159 -5.174 249 HA ALA 31 HA ALA 31 5.691 -0.637 -7.535 250 HB1 ALA 31 HB1 ALA 31 3.302 -0.393 -7.307 251 HB2 ALA 31 HB2 ALA 31 3.441 1.362 -7.074 252 HB3 ALA 31 HB3 ALA 31 3.827 0.635 -8.641 253 H VAL 32 H VAL 32 6.823 0.350 -9.312 254 HA VAL 32 HA VAL 32 7.973 3.030 -8.746 255 HB VAL 32 HB VAL 32 10.118 1.801 -9.624 256 HG11 VAL 32 HG11 VAL 32 10.750 1.512 -7.219 257 HG12 VAL 32 HG12 VAL 32 9.981 3.044 -7.612 258 HG13 VAL 32 HG13 VAL 32 9.051 1.775 -6.781 259 HG21 VAL 32 HG21 VAL 32 9.099 -0.436 -9.913 260 HG22 VAL 32 HG22 VAL 32 10.508 -0.397 -8.846 261 HG23 VAL 32 HG23 VAL 32 8.885 -0.529 -8.147 262 H THR 33 H THR 33 8.962 4.128 -10.270 263 HA THR 33 HA THR 33 8.885 3.299 -13.122 264 HB THR 33 HB THR 33 7.799 5.986 -12.195 265 HG1 THR 33 HG1 THR 33 6.270 3.696 -12.918 266 HG21 THR 33 HG21 THR 33 6.732 6.051 -14.412 267 HG22 THR 33 HG22 THR 33 8.481 5.922 -14.572 268 HG23 THR 33 HG23 THR 33 7.471 4.484 -14.836 269 H SER 34 H SER 34 10.484 4.543 -14.405 270 HA SER 34 HA SER 34 12.024 6.579 -12.883 271 HB2 SER 34 HB2 SER 34 14.081 5.956 -13.836 272 HB3 SER 34 HB3 SER 34 13.409 4.540 -13.024 273 HG SER 34 HG SER 34 12.875 3.673 -14.976 274 H CYS 35 H CYS 35 12.907 8.278 -14.031 275 HA CYS 35 HA CYS 35 12.226 8.714 -16.828 276 HB2 CYS 35 HB2 CYS 35 10.790 10.591 -16.493 277 HB3 CYS 35 HB3 CYS 35 10.133 9.247 -15.537 278 HG CYS 35 HG CYS 35 11.181 9.988 -13.256 279 H GLY 36 H GLY 36 12.853 11.223 -17.278 280 HA2 GLY 36 HA2 GLY 36 14.848 12.257 -15.364 281 HA3 GLY 36 HA3 GLY 36 15.476 11.858 -16.979 282 H LEU 37 H LEU 37 15.692 14.457 -16.090 283 HA LEU 37 HA LEU 37 13.427 16.015 -17.060 284 HB2 LEU 37 HB2 LEU 37 14.964 17.941 -17.126 285 HB3 LEU 37 HB3 LEU 37 14.640 17.233 -15.566 286 HG LEU 37 HG LEU 37 17.114 16.258 -16.997 287 HD11 LEU 37 HD11 LEU 37 17.251 18.705 -17.319 288 HD12 LEU 37 HD12 LEU 37 16.929 18.964 -15.591 289 HD13 LEU 37 HD13 LEU 37 18.434 18.170 -16.110 290 HD21 LEU 37 HD21 LEU 37 17.998 16.296 -14.663 291 HD22 LEU 37 HD22 LEU 37 16.454 16.988 -14.109 292 HD23 LEU 37 HD23 LEU 37 16.504 15.348 -14.770 293 H GLU 38 H GLU 38 15.764 14.242 -18.624 294 HA GLU 38 HA GLU 38 14.651 14.982 -21.255 295 HB2 GLU 38 HB2 GLU 38 17.659 14.646 -20.824 296 HB3 GLU 38 HB3 GLU 38 16.834 14.856 -22.362 297 HG2 GLU 38 HG2 GLU 38 16.057 17.116 -21.622 298 HG3 GLU 38 HG3 GLU 38 16.997 16.924 -20.134 299 H SER 39 H SER 39 15.167 13.210 -22.854 300 HA SER 39 HA SER 39 15.733 10.552 -21.624 301 HB2 SER 39 HB2 SER 39 14.248 9.565 -23.349 302 HB3 SER 39 HB3 SER 39 13.397 10.563 -22.157 303 HG SER 39 HG SER 39 12.778 10.952 -24.418 304 H SER 40 H SER 40 16.903 9.105 -22.918 305 HA SER 40 HA SER 40 18.048 10.112 -25.481 306 HB2 SER 40 HB2 SER 40 20.306 9.340 -24.848 307 HB3 SER 40 HB3 SER 40 19.743 10.715 -23.883 308 HG SER 40 HG SER 40 19.185 9.227 -22.207 309 H ARG 41 H ARG 41 18.969 7.292 -23.632 310 HA ARG 41 HA ARG 41 17.264 5.350 -24.970 311 HB2 ARG 41 HB2 ARG 41 18.873 4.144 -26.193 312 HB3 ARG 41 HB3 ARG 41 19.109 5.804 -26.687 313 HG2 ARG 41 HG2 ARG 41 20.892 4.170 -24.832 314 HG3 ARG 41 HG3 ARG 41 21.209 4.626 -26.491 315 HD2 ARG 41 HD2 ARG 41 21.316 7.030 -25.798 316 HD3 ARG 41 HD3 ARG 41 21.100 6.517 -24.115 317 HE ARG 41 HE ARG 41 23.328 5.352 -25.718 318 HH11 ARG 41 HH22 ARG 41 22.581 7.648 -23.144 319 HH12 ARG 41 HH21 ARG 41 24.238 7.545 -22.527 320 HH21 ARG 41 HH11 ARG 41 25.364 5.332 -24.824 321 HH22 ARG 41 HH12 ARG 41 25.703 6.282 -23.398 322 H VAL 42 H VAL 42 17.207 3.380 -23.725 323 HA VAL 42 HA VAL 42 18.435 3.501 -21.118 324 HB VAL 42 HB VAL 42 16.483 1.874 -22.301 325 HG11 VAL 42 HG11 VAL 42 18.699 0.061 -21.351 326 HG12 VAL 42 HG12 VAL 42 17.026 -0.393 -21.737 327 HG13 VAL 42 HG13 VAL 42 18.090 0.195 -23.026 328 HG21 VAL 42 HG21 VAL 42 16.538 2.818 -20.053 329 HG22 VAL 42 HG22 VAL 42 16.251 1.065 -19.980 330 HG23 VAL 42 HG23 VAL 42 17.873 1.685 -19.611 331 H HIS 43 H HIS 43 20.402 2.795 -20.346 332 HA HIS 43 HA HIS 43 22.415 2.589 -22.400 333 HB2 HIS 43 HB2 HIS 43 22.616 3.779 -20.165 334 HB3 HIS 43 HB3 HIS 43 22.841 2.197 -19.418 335 HD2 HIS 43 HD2 HIS 43 24.567 4.876 -21.405 336 HE1 HIS 43 HE1 HIS 43 27.317 1.634 -21.419 337 HE2 HIS 43 HE2 HIS 43 26.971 4.086 -22.056 338 HA PRO 44 HA PRO 44 22.028 -1.735 -22.734 339 HB2 PRO 44 HB2 PRO 44 24.089 -2.428 -24.416 340 HB3 PRO 44 HB3 PRO 44 22.679 -1.452 -24.939 341 HG2 PRO 44 HG2 PRO 44 25.403 -0.442 -24.050 342 HG3 PRO 44 HG3 PRO 44 24.490 -0.010 -25.532 343 HD2 PRO 44 HD2 PRO 44 24.398 1.526 -23.292 344 HD3 PRO 44 HD3 PRO 44 22.942 1.295 -24.312 345 H THR 45 H THR 45 25.121 -0.420 -21.551 346 HA THR 45 HA THR 45 26.030 -2.958 -20.425 347 HB THR 45 HB THR 45 26.992 -0.158 -19.799 348 HG1 THR 45 HG1 THR 45 28.612 -0.741 -21.359 349 HG21 THR 45 HG21 THR 45 27.791 -1.784 -18.150 350 HG22 THR 45 HG22 THR 45 28.256 -2.917 -19.443 351 HG23 THR 45 HG23 THR 45 29.110 -1.363 -19.237 352 H ALA 46 H ALA 46 23.999 -0.271 -19.250 353 HA ALA 46 HA ALA 46 23.919 -1.005 -16.506 354 HB1 ALA 46 HB1 ALA 46 21.698 0.093 -16.512 355 HB2 ALA 46 HB2 ALA 46 22.822 1.032 -17.508 356 HB3 ALA 46 HB3 ALA 46 21.597 -0.037 -18.274 357 H ILE 47 H ILE 47 21.954 -2.246 -19.237 358 HA ILE 47 HA ILE 47 20.411 -4.175 -17.781 359 HB ILE 47 HB ILE 47 21.420 -4.061 -20.637 360 HG12 ILE 47 HG12 ILE 47 18.504 -3.813 -20.026 361 HG13 ILE 47 HG13 ILE 47 19.489 -2.475 -19.436 362 HG21 ILE 47 HG21 ILE 47 19.408 -6.022 -19.479 363 HG22 ILE 47 HG22 ILE 47 19.684 -5.747 -21.210 364 HG23 ILE 47 HG23 ILE 47 20.978 -6.411 -20.220 365 HD11 ILE 47 HD11 ILE 47 18.520 -2.293 -21.794 366 HD12 ILE 47 HD12 ILE 47 20.221 -1.849 -21.504 367 HD13 ILE 47 HD13 ILE 47 19.808 -3.405 -22.286 368 H ALA 48 H ALA 48 23.613 -4.503 -19.394 369 HA ALA 48 HA ALA 48 24.011 -7.255 -18.767 370 HB1 ALA 48 HB1 ALA 48 25.319 -5.942 -20.421 371 HB2 ALA 48 HB2 ALA 48 26.069 -5.031 -19.083 372 HB3 ALA 48 HB3 ALA 48 26.359 -6.777 -19.241 373 H MET 49 H MET 49 24.796 -4.327 -16.888 374 HA MET 49 HA MET 49 26.122 -5.762 -14.753 375 HB2 MET 49 HB2 MET 49 25.123 -2.907 -14.915 376 HB3 MET 49 HB3 MET 49 26.195 -3.546 -13.656 377 HG2 MET 49 HG2 MET 49 27.039 -3.904 -16.530 378 HG3 MET 49 HG3 MET 49 27.100 -2.306 -15.825 379 HE1 MET 49 HE1 MET 49 28.232 -6.099 -14.883 380 HE2 MET 49 HE2 MET 49 28.855 -5.534 -16.452 381 HE3 MET 49 HE3 MET 49 29.965 -5.773 -15.084 382 H MET 50 H MET 50 22.760 -4.774 -15.291 383 HA MET 50 HA MET 50 21.917 -5.600 -12.596 384 HB2 MET 50 HB2 MET 50 20.363 -5.042 -15.151 385 HB3 MET 50 HB3 MET 50 19.629 -5.422 -13.597 386 HG2 MET 50 HG2 MET 50 21.333 -2.990 -14.243 387 HG3 MET 50 HG3 MET 50 19.603 -3.021 -13.958 388 HE1 MET 50 HE1 MET 50 19.799 -5.122 -11.165 389 HE2 MET 50 HE2 MET 50 19.369 -3.745 -10.132 390 HE3 MET 50 HE3 MET 50 18.603 -3.917 -11.722 391 H GLU 51 H GLU 51 22.264 -7.205 -15.789 392 HA GLU 51 HA GLU 51 20.920 -9.609 -14.980 393 HB2 GLU 51 HB2 GLU 51 22.963 -9.006 -17.144 394 HB3 GLU 51 HB3 GLU 51 22.380 -10.643 -16.848 395 HG2 GLU 51 HG2 GLU 51 20.037 -9.890 -17.174 396 HG3 GLU 51 HG3 GLU 51 20.607 -8.282 -17.594 397 H GLU 52 H GLU 52 24.223 -8.493 -14.219 398 HA GLU 52 HA GLU 52 25.314 -11.021 -13.435 399 HB2 GLU 52 HB2 GLU 52 25.771 -8.389 -11.982 400 HB3 GLU 52 HB3 GLU 52 26.800 -9.815 -11.971 401 HG2 GLU 52 HG2 GLU 52 26.940 -9.415 -14.570 402 HG3 GLU 52 HG3 GLU 52 26.415 -7.776 -14.137 403 H VAL 53 H VAL 53 22.963 -8.990 -11.862 404 HA VAL 53 HA VAL 53 22.875 -10.710 -9.432 405 HB VAL 53 HB VAL 53 23.447 -8.455 -8.979 406 HG11 VAL 53 HG11 VAL 53 22.520 -7.229 -10.835 407 HG12 VAL 53 HG12 VAL 53 20.854 -7.591 -10.299 408 HG13 VAL 53 HG13 VAL 53 21.925 -6.547 -9.327 409 HG21 VAL 53 HG21 VAL 53 21.970 -7.896 -7.242 410 HG22 VAL 53 HG22 VAL 53 20.605 -8.735 -7.997 411 HG23 VAL 53 HG23 VAL 53 21.980 -9.663 -7.343 412 H GLY 54 H GLY 54 21.621 -10.936 -12.298 413 HA2 GLY 54 HA2 GLY 54 19.876 -12.153 -13.103 414 HA3 GLY 54 HA3 GLY 54 19.379 -12.496 -11.445 415 H ILE 55 H ILE 55 19.536 -9.136 -12.460 416 HA ILE 55 HA ILE 55 16.544 -8.965 -12.373 417 HB ILE 55 HB ILE 55 18.691 -6.929 -11.728 418 HG12 ILE 55 HG12 ILE 55 16.606 -8.353 -10.016 419 HG13 ILE 55 HG13 ILE 55 18.343 -8.652 -9.991 420 HG21 ILE 55 HG21 ILE 55 16.754 -5.805 -12.826 421 HG22 ILE 55 HG22 ILE 55 15.654 -6.594 -11.665 422 HG23 ILE 55 HG23 ILE 55 16.854 -5.406 -11.119 423 HD11 ILE 55 HD11 ILE 55 17.831 -7.345 -8.076 424 HD12 ILE 55 HD12 ILE 55 18.703 -6.291 -9.209 425 HD13 ILE 55 HD13 ILE 55 16.934 -6.149 -9.016 426 H ASP 56 H ASP 56 15.433 -8.304 -14.089 427 HA ASP 56 HA ASP 56 16.918 -7.641 -16.576 428 HB2 ASP 56 HB2 ASP 56 15.377 -9.566 -16.514 429 HB3 ASP 56 HB3 ASP 56 14.031 -8.479 -16.157 430 H ILE 57 H ILE 57 17.028 -5.618 -17.284 431 HA ILE 57 HA ILE 57 14.681 -3.830 -16.904 432 HB ILE 57 HB ILE 57 16.080 -1.857 -16.756 433 HG12 ILE 57 HG12 ILE 57 18.510 -3.518 -16.051 434 HG13 ILE 57 HG13 ILE 57 18.163 -3.158 -17.736 435 HG21 ILE 57 HG21 ILE 57 16.678 -2.028 -14.406 436 HG22 ILE 57 HG22 ILE 57 15.176 -2.899 -14.689 437 HG23 ILE 57 HG23 ILE 57 16.690 -3.807 -14.494 438 HD11 ILE 57 HD11 ILE 57 19.675 -1.470 -16.817 439 HD12 ILE 57 HD12 ILE 57 18.123 -0.749 -17.295 440 HD13 ILE 57 HD13 ILE 57 18.480 -1.043 -15.572 441 H SER 58 H SER 58 15.452 -5.685 -19.066 442 HA SER 58 HA SER 58 16.247 -4.035 -21.355 443 HB2 SER 58 HB2 SER 58 15.051 -6.833 -21.254 444 HB3 SER 58 HB3 SER 58 15.830 -6.064 -22.649 445 HG SER 58 HG SER 58 17.251 -7.469 -21.463 446 H GLY 59 H GLY 59 13.223 -5.145 -19.898 447 HA2 GLY 59 HA2 GLY 59 11.483 -4.366 -22.090 448 HA3 GLY 59 HA3 GLY 59 11.003 -4.883 -20.473 449 H GLN 60 H GLN 60 13.210 -2.206 -20.456 450 HA GLN 60 HA GLN 60 11.071 -0.159 -20.343 451 HB2 GLN 60 HB2 GLN 60 12.088 0.748 -18.239 452 HB3 GLN 60 HB3 GLN 60 11.258 -0.796 -18.046 453 HG2 GLN 60 HG2 GLN 60 13.447 -1.986 -18.111 454 HG3 GLN 60 HG3 GLN 60 14.281 -0.427 -18.227 455 HE21 GLN 60 HE22 GLN 60 14.180 0.993 -16.308 456 HE22 GLN 60 HE21 GLN 60 13.961 0.222 -14.741 457 H THR 61 H THR 61 11.936 2.061 -20.619 458 HA THR 61 HA THR 61 14.658 2.341 -21.493 459 HB THR 61 HB THR 61 13.573 1.439 -23.541 460 HG1 THR 61 HG1 THR 61 14.557 2.994 -24.833 461 HG21 THR 61 HG21 THR 61 12.146 2.868 -24.896 462 HG22 THR 61 HG22 THR 61 11.347 2.569 -23.346 463 HG23 THR 61 HG23 THR 61 12.140 4.133 -23.652 464 H SER 62 H SER 62 14.583 4.757 -22.667 465 HA SER 62 HA SER 62 14.151 6.214 -20.178 466 HB2 SER 62 HB2 SER 62 15.682 7.784 -20.838 467 HB3 SER 62 HB3 SER 62 16.292 6.191 -21.342 468 HG SER 62 HG SER 62 15.324 6.822 -23.502 469 H ASP 63 H ASP 63 12.805 7.720 -19.696 470 HA ASP 63 HA ASP 63 11.164 9.057 -21.812 471 HB2 ASP 63 HB2 ASP 63 10.139 7.493 -19.440 472 HB3 ASP 63 HB3 ASP 63 9.168 8.728 -20.241 473 HA PRO 64 HA PRO 64 11.951 12.635 -19.476 474 HB2 PRO 64 HB2 PRO 64 10.491 14.515 -20.748 475 HB3 PRO 64 HB3 PRO 64 11.759 13.566 -21.583 476 HG2 PRO 64 HG2 PRO 64 8.765 13.030 -21.545 477 HG3 PRO 64 HG3 PRO 64 9.851 13.128 -22.967 478 HD2 PRO 64 HD2 PRO 64 9.188 10.746 -21.775 479 HD3 PRO 64 HD3 PRO 64 10.790 11.033 -22.523 480 H ILE 65 H ILE 65 11.389 13.922 -17.792 481 HA ILE 65 HA ILE 65 9.417 13.227 -15.957 482 HB ILE 65 HB ILE 65 11.621 14.446 -15.664 483 HG12 ILE 65 HG12 ILE 65 9.213 15.562 -14.228 484 HG13 ILE 65 HG13 ILE 65 10.104 14.068 -13.843 485 HG21 ILE 65 HG21 ILE 65 11.185 16.329 -17.326 486 HG22 ILE 65 HG22 ILE 65 10.040 17.015 -16.139 487 HG23 ILE 65 HG23 ILE 65 11.747 16.862 -15.737 488 HD11 ILE 65 HD11 ILE 65 10.901 15.680 -12.301 489 HD12 ILE 65 HD12 ILE 65 12.169 15.577 -13.538 490 HD13 ILE 65 HD13 ILE 65 11.021 16.938 -13.532 491 H GLU 66 H GLU 66 9.294 15.732 -18.431 492 HA GLU 66 HA GLU 66 6.894 17.011 -17.534 493 HB2 GLU 66 HB2 GLU 66 6.925 18.067 -19.818 494 HB3 GLU 66 HB3 GLU 66 8.363 18.281 -18.829 495 HG2 GLU 66 HG2 GLU 66 9.630 16.705 -20.100 496 HG3 GLU 66 HG3 GLU 66 8.193 16.114 -20.947 497 H ASN 67 H ASN 67 7.120 13.953 -19.077 498 HA ASN 67 HA ASN 67 4.271 14.101 -19.945 499 HB2 ASN 67 HB2 ASN 67 4.724 12.526 -21.427 500 HB3 ASN 67 HB3 ASN 67 6.423 12.837 -21.125 501 HD21 ASN 67 HD22 ASN 67 7.308 11.475 -19.104 502 HD22 ASN 67 HD21 ASN 67 6.655 9.861 -18.957 503 H PHE 68 H PHE 68 5.928 13.421 -17.069 504 HA PHE 68 HA PHE 68 4.110 11.229 -16.227 505 HB2 PHE 68 HB2 PHE 68 6.836 12.172 -15.331 506 HB3 PHE 68 HB3 PHE 68 5.891 11.084 -14.354 507 HD1 PHE 68 HD2 PHE 68 4.762 9.040 -15.890 508 HD2 PHE 68 HD1 PHE 68 8.490 11.085 -16.572 509 HE1 PHE 68 HE2 PHE 68 5.613 7.071 -17.129 510 HE2 PHE 68 HE1 PHE 68 9.335 9.109 -17.825 511 HZ PHE 68 HZ PHE 68 7.903 7.096 -18.091 512 H ASN 69 H ASN 69 3.804 11.191 -13.745 513 HA ASN 69 HA ASN 69 2.420 13.742 -12.997 514 HB2 ASN 69 HB2 ASN 69 0.577 12.184 -12.178 515 HB3 ASN 69 HB3 ASN 69 0.761 12.402 -13.909 516 HD21 ASN 69 HD22 ASN 69 2.005 10.123 -11.374 517 HD22 ASN 69 HD21 ASN 69 1.670 8.691 -12.337 518 H ALA 70 H ALA 70 4.103 14.364 -11.549 519 HA ALA 70 HA ALA 70 5.273 12.843 -9.562 520 HB1 ALA 70 HB1 ALA 70 4.424 15.736 -9.282 521 HB2 ALA 70 HB2 ALA 70 5.702 14.920 -8.376 522 HB3 ALA 70 HB3 ALA 70 5.885 15.185 -10.129 523 H ASP 71 H ASP 71 2.059 14.307 -9.485 524 HA ASP 71 HA ASP 71 1.404 14.199 -6.761 525 HB2 ASP 71 HB2 ASP 71 0.122 15.311 -8.599 526 HB3 ASP 71 HB3 ASP 71 -0.382 13.724 -9.180 527 H ASP 72 H ASP 72 1.580 11.502 -9.021 528 HA ASP 72 HA ASP 72 0.212 9.694 -7.095 529 HB2 ASP 72 HB2 ASP 72 -0.385 9.754 -9.602 530 HB3 ASP 72 HB3 ASP 72 1.163 8.924 -9.832 531 H TYR 73 H TYR 73 3.290 10.798 -7.376 532 HA TYR 73 HA TYR 73 4.509 8.166 -6.636 533 HB2 TYR 73 HB2 TYR 73 6.050 10.619 -7.433 534 HB3 TYR 73 HB3 TYR 73 6.606 8.955 -7.308 535 HD1 TYR 73 HD2 TYR 73 4.438 7.540 -8.934 536 HD2 TYR 73 HD1 TYR 73 6.635 11.194 -9.605 537 HE1 TYR 73 HE2 TYR 73 3.977 7.374 -11.364 538 HE2 TYR 73 HE1 TYR 73 6.129 11.045 -12.034 539 HH TYR 73 HH TYR 73 4.214 8.362 -13.430 540 H ASP 74 H ASP 74 3.993 8.060 -4.488 541 HA ASP 74 HA ASP 74 3.841 10.122 -2.585 542 HB2 ASP 74 HB2 ASP 74 4.844 7.267 -2.218 543 HB3 ASP 74 HB3 ASP 74 4.320 8.326 -0.912 544 H VAL 75 H VAL 75 6.706 8.394 -3.767 545 HA VAL 75 HA VAL 75 8.424 10.445 -2.438 546 HB VAL 75 HB VAL 75 9.164 7.559 -2.959 547 HG11 VAL 75 HG11 VAL 75 11.106 8.959 -3.149 548 HG12 VAL 75 HG12 VAL 75 10.698 9.847 -1.674 549 HG13 VAL 75 HG13 VAL 75 11.183 8.152 -1.587 550 HG21 VAL 75 HG21 VAL 75 7.695 7.439 -1.128 551 HG22 VAL 75 HG22 VAL 75 9.289 7.569 -0.364 552 HG23 VAL 75 HG23 VAL 75 8.231 8.989 -0.455 553 H VAL 76 H VAL 76 9.881 11.462 -3.729 554 HA VAL 76 HA VAL 76 10.414 10.370 -6.474 555 HB VAL 76 HB VAL 76 9.909 13.226 -5.666 556 HG11 VAL 76 HG11 VAL 76 11.973 13.235 -7.080 557 HG12 VAL 76 HG12 VAL 76 11.122 12.265 -8.311 558 HG13 VAL 76 HG13 VAL 76 10.601 13.924 -7.916 559 HG21 VAL 76 HG21 VAL 76 8.337 13.144 -7.576 560 HG22 VAL 76 HG22 VAL 76 8.794 11.447 -7.875 561 HG23 VAL 76 HG23 VAL 76 7.948 11.905 -6.371 562 H ILE 77 H ILE 77 12.488 10.188 -7.028 563 HA ILE 77 HA ILE 77 14.575 11.155 -5.103 564 HB ILE 77 HB ILE 77 14.643 8.675 -6.836 565 HG12 ILE 77 HG12 ILE 77 12.894 8.264 -5.194 566 HG13 ILE 77 HG13 ILE 77 14.301 7.271 -4.898 567 HG21 ILE 77 HG21 ILE 77 16.449 9.616 -4.577 568 HG22 ILE 77 HG22 ILE 77 16.538 8.043 -5.400 569 HG23 ILE 77 HG23 ILE 77 16.855 9.523 -6.295 570 HD11 ILE 77 HD11 ILE 77 13.696 9.821 -3.338 571 HD12 ILE 77 HD12 ILE 77 13.263 8.181 -2.836 572 HD13 ILE 77 HD13 ILE 77 14.966 8.624 -2.992 573 H SER 78 H SER 78 16.152 12.405 -5.986 574 HA SER 78 HA SER 78 16.435 12.498 -8.968 575 HB2 SER 78 HB2 SER 78 17.251 14.417 -6.790 576 HB3 SER 78 HB3 SER 78 18.027 14.430 -8.393 577 HG SER 78 HG SER 78 16.214 15.816 -8.378 578 H LEU 79 H LEU 79 18.204 11.732 -9.936 579 HA LEU 79 HA LEU 79 20.601 10.936 -8.330 580 HB2 LEU 79 HB2 LEU 79 19.424 9.343 -10.657 581 HB3 LEU 79 HB3 LEU 79 20.832 8.948 -9.684 582 HG LEU 79 HG LEU 79 19.081 8.915 -7.666 583 HD11 LEU 79 HD11 LEU 79 17.351 8.282 -10.101 584 HD12 LEU 79 HD12 LEU 79 16.926 7.933 -8.401 585 HD13 LEU 79 HD13 LEU 79 17.073 9.597 -8.952 586 HD21 LEU 79 HD21 LEU 79 18.747 6.501 -8.080 587 HD22 LEU 79 HD22 LEU 79 19.240 6.707 -9.768 588 HD23 LEU 79 HD23 LEU 79 20.413 6.979 -8.449 589 H CYS 80 H CYS 80 20.421 13.337 -9.203 590 HA CYS 80 HA CYS 80 22.125 13.565 -11.653 591 HB2 CYS 80 HB2 CYS 80 20.085 15.493 -10.467 592 HB3 CYS 80 HB3 CYS 80 21.089 15.793 -11.909 593 HG CYS 80 HG CYS 80 18.566 15.255 -12.588 594 H GLY 81 H GLY 81 24.104 14.268 -11.230 595 HA2 GLY 81 HA2 GLY 81 25.202 14.990 -8.733 596 HA3 GLY 81 HA3 GLY 81 25.971 15.231 -10.294 597 H CYS 82 H CYS 82 23.671 16.693 -8.047 598 HA CYS 82 HA CYS 82 23.415 18.692 -7.129 599 HB2 CYS 82 HB2 CYS 82 25.946 18.300 -6.961 600 HB3 CYS 82 HB3 CYS 82 26.094 19.525 -8.236 601 HG CYS 82 HG CYS 82 24.643 21.365 -6.905 602 H GLY 83 H GLY 83 24.199 19.047 -10.559 603 HA2 GLY 83 HA2 GLY 83 23.450 21.811 -10.785 604 HA3 GLY 83 HA3 GLY 83 23.657 20.660 -12.107 605 H VAL 84 H VAL 84 21.309 19.677 -9.801 606 HA VAL 84 HA VAL 84 18.996 20.560 -11.458 607 HB VAL 84 HB VAL 84 19.708 17.678 -10.749 608 HG11 VAL 84 HG11 VAL 84 17.724 17.054 -12.081 609 HG12 VAL 84 HG12 VAL 84 17.249 18.029 -10.700 610 HG13 VAL 84 HG13 VAL 84 17.325 18.770 -12.321 611 HG21 VAL 84 HG21 VAL 84 19.783 17.357 -13.238 612 HG22 VAL 84 HG22 VAL 84 19.682 19.120 -13.428 613 HG23 VAL 84 HG23 VAL 84 21.076 18.375 -12.602 614 H ASN 85 H ASN 85 17.214 21.039 -10.241 615 HA ASN 85 HA ASN 85 17.107 20.039 -7.424 616 HB2 ASN 85 HB2 ASN 85 18.132 22.402 -7.901 617 HB3 ASN 85 HB3 ASN 85 16.467 22.911 -8.165 618 HD21 ASN 85 HD22 ASN 85 18.526 21.120 -5.803 619 HD22 ASN 85 HD21 ASN 85 17.708 21.769 -4.388 620 H LEU 86 H LEU 86 15.279 20.081 -10.212 621 HA LEU 86 HA LEU 86 13.025 20.038 -10.731 622 HB2 LEU 86 HB2 LEU 86 13.020 18.342 -8.219 623 HB3 LEU 86 HB3 LEU 86 11.810 18.328 -9.505 624 HG LEU 86 HG LEU 86 14.660 17.343 -9.709 625 HD11 LEU 86 HD11 LEU 86 12.790 16.003 -8.488 626 HD12 LEU 86 HD12 LEU 86 12.035 15.853 -10.101 627 HD13 LEU 86 HD13 LEU 86 13.649 15.188 -9.810 628 HD21 LEU 86 HD21 LEU 86 13.822 16.569 -11.996 629 HD22 LEU 86 HD22 LEU 86 12.414 17.638 -11.747 630 HD23 LEU 86 HD23 LEU 86 14.058 18.317 -11.866 631 HA PRO 87 HA PRO 87 11.733 23.507 -7.881 632 HB2 PRO 87 HB2 PRO 87 10.979 24.525 -10.630 633 HB3 PRO 87 HB3 PRO 87 11.511 25.447 -9.190 634 HG2 PRO 87 HG2 PRO 87 13.286 24.891 -11.136 635 HG3 PRO 87 HG3 PRO 87 13.759 24.656 -9.419 636 HD2 PRO 87 HD2 PRO 87 12.851 22.576 -11.419 637 HD3 PRO 87 HD3 PRO 87 14.207 22.517 -10.256 638 HA PRO 88 HA PRO 88 7.261 22.935 -9.475 639 HB2 PRO 88 HB2 PRO 88 7.173 20.356 -10.953 640 HB3 PRO 88 HB3 PRO 88 6.491 21.939 -11.401 641 HG2 PRO 88 HG2 PRO 88 8.667 20.838 -12.620 642 HG3 PRO 88 HG3 PRO 88 8.521 22.618 -12.362 643 HD2 PRO 88 HD2 PRO 88 10.040 20.577 -10.715 644 HD3 PRO 88 HD3 PRO 88 10.549 22.193 -11.297 645 H GLU 89 H GLU 89 5.486 20.812 -9.412 646 HA GLU 89 HA GLU 89 5.285 19.929 -6.763 647 HB2 GLU 89 HB2 GLU 89 3.584 18.335 -7.675 648 HB3 GLU 89 HB3 GLU 89 3.378 20.011 -8.175 649 HG2 GLU 89 HG2 GLU 89 4.345 19.519 -10.386 650 HG3 GLU 89 HG3 GLU 89 4.695 17.866 -9.896 651 H TRP 90 H TRP 90 7.503 18.687 -9.008 652 HA TRP 90 HA TRP 90 7.804 15.962 -8.191 653 HB2 TRP 90 HB2 TRP 90 9.635 18.000 -9.445 654 HB3 TRP 90 HB3 TRP 90 10.104 16.322 -9.112 655 HD1 TRP 90 HD1 TRP 90 7.786 18.366 -11.390 656 HE1 TRP 90 HE1 TRP 90 6.643 16.837 -13.091 657 HE3 TRP 90 HE3 TRP 90 9.883 13.947 -9.983 658 HZ2 TRP 90 HZ2 TRP 90 6.641 14.010 -13.760 659 HZ3 TRP 90 HZ3 TRP 90 9.513 11.912 -11.323 660 HH2 TRP 90 HH2 TRP 90 7.894 11.922 -13.203 661 H VAL 91 H VAL 91 8.593 18.858 -6.440 662 HA VAL 91 HA VAL 91 10.006 17.171 -4.395 663 HB VAL 91 HB VAL 91 11.198 19.094 -3.612 664 HG11 VAL 91 HG11 VAL 91 12.729 19.394 -5.491 665 HG12 VAL 91 HG12 VAL 91 12.263 17.710 -5.247 666 HG13 VAL 91 HG13 VAL 91 11.537 18.638 -6.567 667 HG21 VAL 91 HG21 VAL 91 11.246 21.228 -4.821 668 HG22 VAL 91 HG22 VAL 91 9.988 20.662 -5.926 669 HG23 VAL 91 HG23 VAL 91 9.615 20.918 -4.210 670 H THR 92 H THR 92 7.001 18.373 -4.895 671 HA THR 92 HA THR 92 6.550 19.214 -2.078 672 HB THR 92 HB THR 92 4.348 19.897 -2.752 673 HG1 THR 92 HG1 THR 92 3.543 19.490 -4.727 674 HG21 THR 92 HG21 THR 92 6.336 20.823 -4.887 675 HG22 THR 92 HG22 THR 92 4.850 21.646 -4.378 676 HG23 THR 92 HG23 THR 92 6.200 21.489 -3.243 677 H GLN 93 H GLN 93 6.888 16.313 -3.459 678 HA GLN 93 HA GLN 93 4.519 14.935 -2.463 679 HB2 GLN 93 HB2 GLN 93 7.131 13.770 -3.495 680 HB3 GLN 93 HB3 GLN 93 5.597 12.927 -3.261 681 HG2 GLN 93 HG2 GLN 93 6.258 15.023 -5.348 682 HG3 GLN 93 HG3 GLN 93 5.765 13.362 -5.600 683 HE21 GLN 93 HE22 GLN 93 4.644 16.430 -5.958 684 HE22 GLN 93 HE21 GLN 93 2.936 16.162 -5.648 685 H GLU 94 H GLU 94 5.238 12.750 -1.145 686 HA GLU 94 HA GLU 94 5.417 13.899 1.495 687 HB2 GLU 94 HB2 GLU 94 3.992 11.990 1.000 688 HB3 GLU 94 HB3 GLU 94 5.402 10.978 0.650 689 HG2 GLU 94 HG2 GLU 94 6.196 11.136 2.916 690 HG3 GLU 94 HG3 GLU 94 4.946 12.314 3.334 691 H ILE 95 H ILE 95 7.765 12.033 -0.428 692 HA ILE 95 HA ILE 95 9.908 13.132 1.318 693 HB ILE 95 HB ILE 95 9.903 10.253 0.357 694 HG12 ILE 95 HG12 ILE 95 9.570 11.341 3.177 695 HG13 ILE 95 HG13 ILE 95 8.377 10.448 2.227 696 HG21 ILE 95 HG21 ILE 95 12.169 11.235 0.338 697 HG22 ILE 95 HG22 ILE 95 11.964 11.754 2.034 698 HG23 ILE 95 HG23 ILE 95 12.040 10.032 1.586 699 HD11 ILE 95 HD11 ILE 95 10.045 8.499 2.185 700 HD12 ILE 95 HD12 ILE 95 10.921 9.367 3.465 701 HD13 ILE 95 HD13 ILE 95 9.243 8.863 3.731 702 H PHE 96 H PHE 96 11.627 13.908 0.257 703 HA PHE 96 HA PHE 96 12.101 13.105 -2.534 704 HB2 PHE 96 HB2 PHE 96 11.047 15.231 -2.821 705 HB3 PHE 96 HB3 PHE 96 12.058 15.963 -1.577 706 HD1 PHE 96 HD2 PHE 96 12.038 14.649 -5.101 707 HD2 PHE 96 HD1 PHE 96 14.342 16.621 -2.014 708 HE1 PHE 96 HE2 PHE 96 13.871 15.064 -6.711 709 HE2 PHE 96 HE1 PHE 96 16.125 17.115 -3.673 710 HZ PHE 96 HZ PHE 96 15.889 16.325 -6.014 711 H GLU 97 H GLU 97 14.168 12.520 -2.918 712 HA GLU 97 HA GLU 97 16.328 13.361 -1.048 713 HB2 GLU 97 HB2 GLU 97 15.870 10.484 -1.926 714 HB3 GLU 97 HB3 GLU 97 17.289 11.103 -1.081 715 HG2 GLU 97 HG2 GLU 97 15.841 11.755 0.848 716 HG3 GLU 97 HG3 GLU 97 14.465 11.008 0.028 717 H ASP 98 H ASP 98 18.454 13.310 -1.966 718 HA ASP 98 HA ASP 98 18.551 13.133 -4.949 719 HB2 ASP 98 HB2 ASP 98 18.350 15.458 -4.292 720 HB3 ASP 98 HB3 ASP 98 19.693 15.294 -3.155 721 H TRP 99 H TRP 99 19.646 11.325 -5.272 722 HA TRP 99 HA TRP 99 21.962 10.556 -3.582 723 HB2 TRP 99 HB2 TRP 99 20.498 8.981 -5.718 724 HB3 TRP 99 HB3 TRP 99 21.694 8.366 -4.587 725 HD1 TRP 99 HD1 TRP 99 19.887 10.106 -2.156 726 HE1 TRP 99 HE1 TRP 99 17.868 8.819 -1.185 727 HE3 TRP 99 HE3 TRP 99 19.390 6.533 -5.785 728 HZ2 TRP 99 HZ2 TRP 99 16.265 6.567 -1.911 729 HZ3 TRP 99 HZ3 TRP 99 17.581 4.840 -5.639 730 HH2 TRP 99 HH2 TRP 99 16.018 4.838 -3.700 731 H GLN 100 H GLN 100 23.499 12.036 -4.341 732 HA GLN 100 HA GLN 100 24.191 12.209 -7.167 733 HB2 GLN 100 HB2 GLN 100 25.638 13.249 -4.700 734 HB3 GLN 100 HB3 GLN 100 26.011 13.660 -6.384 735 HG2 GLN 100 HG2 GLN 100 23.693 14.601 -6.626 736 HG3 GLN 100 HG3 GLN 100 23.394 14.258 -4.924 737 HE21 GLN 100 HE22 GLN 100 22.881 16.624 -4.998 738 HE22 GLN 100 HE21 GLN 100 24.236 17.732 -4.689 739 H LEU 101 H LEU 101 25.313 10.745 -8.245 740 HA LEU 101 HA LEU 101 27.564 9.189 -7.063 741 HB2 LEU 101 HB2 LEU 101 25.113 8.087 -8.505 742 HB3 LEU 101 HB3 LEU 101 26.596 7.167 -8.315 743 HG LEU 101 HG LEU 101 24.791 8.079 -6.031 744 HD11 LEU 101 HD11 LEU 101 25.360 5.312 -7.159 745 HD12 LEU 101 HD12 LEU 101 24.273 5.729 -5.809 746 HD13 LEU 101 HD13 LEU 101 23.882 6.280 -7.442 747 HD21 LEU 101 HD21 LEU 101 27.154 7.966 -5.277 748 HD22 LEU 101 HD22 LEU 101 26.210 6.631 -4.626 749 HD23 LEU 101 HD23 LEU 101 27.306 6.349 -6.000 750 H GLU 102 H GLU 102 28.758 7.989 -8.802 751 HA GLU 102 HA GLU 102 29.625 9.726 -10.889 752 HB2 GLU 102 HB2 GLU 102 29.998 6.761 -10.339 753 HB3 GLU 102 HB3 GLU 102 30.802 7.565 -11.679 754 HG2 GLU 102 HG2 GLU 102 31.179 8.051 -8.730 755 HG3 GLU 102 HG3 GLU 102 32.306 7.333 -9.884 756 H ASP 103 H ASP 103 29.887 8.890 -13.118 757 HA ASP 103 HA ASP 103 27.224 8.196 -14.293 758 HB2 ASP 103 HB2 ASP 103 28.116 10.608 -14.314 759 HB3 ASP 103 HB3 ASP 103 29.252 10.061 -15.538 760 HA PRO 104 HA PRO 104 30.121 4.908 -15.492 761 HB2 PRO 104 HB2 PRO 104 27.562 3.433 -15.941 762 HB3 PRO 104 HB3 PRO 104 29.066 2.889 -15.124 763 HG2 PRO 104 HG2 PRO 104 26.919 3.598 -13.665 764 HG3 PRO 104 HG3 PRO 104 28.551 4.217 -13.203 765 HD2 PRO 104 HD2 PRO 104 26.417 5.613 -14.877 766 HD3 PRO 104 HD3 PRO 104 27.281 6.207 -13.436 767 H ASP 105 H ASP 105 27.713 6.320 -17.490 768 HA ASP 105 HA ASP 105 27.730 4.769 -19.834 769 HB2 ASP 105 HB2 ASP 105 26.154 6.555 -19.168 770 HB3 ASP 105 HB3 ASP 105 27.408 7.764 -19.425 771 H GLY 106 H GLY 106 29.684 4.061 -20.621 772 HA2 GLY 106 HA2 GLY 106 31.454 4.257 -22.153 773 HA3 GLY 106 HA3 GLY 106 31.475 6.006 -21.951 774 H GLN 107 H GLN 107 31.487 4.267 -18.946 775 HA GLN 107 HA GLN 107 34.326 4.978 -18.477 776 HB2 GLN 107 HB2 GLN 107 32.245 3.961 -16.528 777 HB3 GLN 107 HB3 GLN 107 33.850 4.569 -16.128 778 HG2 GLN 107 HG2 GLN 107 31.632 6.216 -17.409 779 HG3 GLN 107 HG3 GLN 107 31.928 6.057 -15.681 780 HE21 GLN 107 HE22 GLN 107 31.848 8.451 -16.118 781 HE22 GLN 107 HE21 GLN 107 33.428 9.228 -16.310 782 H SER 108 H SER 108 33.083 2.341 -16.637 783 HA SER 108 HA SER 108 34.227 0.171 -18.204 784 HB2 SER 108 HB2 SER 108 35.921 -0.483 -16.636 785 HB3 SER 108 HB3 SER 108 36.215 1.219 -16.995 786 HG SER 108 HG SER 108 36.325 0.896 -14.771 787 H LEU 109 H LEU 109 33.883 -1.943 -17.050 788 HA LEU 109 HA LEU 109 31.251 -2.114 -15.889 789 HB2 LEU 109 HB2 LEU 109 33.514 -4.157 -15.792 790 HB3 LEU 109 HB3 LEU 109 31.804 -4.473 -15.536 791 HG LEU 109 HG LEU 109 33.140 -3.663 -18.149 792 HD11 LEU 109 HD11 LEU 109 32.436 -5.886 -18.863 793 HD12 LEU 109 HD12 LEU 109 33.421 -5.987 -17.385 794 HD13 LEU 109 HD13 LEU 109 31.653 -6.168 -17.287 795 HD21 LEU 109 HD21 LEU 109 30.898 -3.968 -19.195 796 HD22 LEU 109 HD22 LEU 109 30.175 -4.066 -17.571 797 HD23 LEU 109 HD23 LEU 109 30.957 -2.571 -18.108 798 H GLU 110 H GLU 110 34.466 -2.068 -14.431 799 HA GLU 110 HA GLU 110 33.678 -2.499 -11.710 800 HB2 GLU 110 HB2 GLU 110 36.009 -2.570 -12.568 801 HB3 GLU 110 HB3 GLU 110 35.977 -0.816 -12.789 802 HG2 GLU 110 HG2 GLU 110 35.665 -0.496 -10.361 803 HG3 GLU 110 HG3 GLU 110 35.586 -2.242 -10.119 804 H VAL 111 H VAL 111 33.766 0.544 -13.623 805 HA VAL 111 HA VAL 111 32.839 2.171 -11.390 806 HB VAL 111 HB VAL 111 32.940 2.678 -14.361 807 HG11 VAL 111 HG11 VAL 111 32.150 4.582 -12.116 808 HG12 VAL 111 HG12 VAL 111 32.634 5.104 -13.737 809 HG13 VAL 111 HG13 VAL 111 31.178 4.128 -13.540 810 HG21 VAL 111 HG21 VAL 111 35.133 2.540 -13.138 811 HG22 VAL 111 HG22 VAL 111 34.815 4.157 -13.773 812 HG23 VAL 111 HG23 VAL 111 34.580 3.814 -12.046 813 H PHE 112 H PHE 112 31.112 0.410 -14.053 814 HA PHE 112 HA PHE 112 28.486 1.368 -13.301 815 HB2 PHE 112 HB2 PHE 112 29.576 -1.008 -14.783 816 HB3 PHE 112 HB3 PHE 112 27.949 -1.115 -14.129 817 HD1 PHE 112 HD2 PHE 112 26.138 0.373 -14.840 818 HD2 PHE 112 HD1 PHE 112 30.012 0.416 -16.725 819 HE1 PHE 112 HE2 PHE 112 25.170 1.555 -16.806 820 HE2 PHE 112 HE1 PHE 112 29.050 1.621 -18.672 821 HZ PHE 112 HZ PHE 112 26.641 2.206 -18.704 822 H ARG 113 H ARG 113 30.309 -1.532 -12.225 823 HA ARG 113 HA ARG 113 28.391 -2.455 -10.300 824 HB2 ARG 113 HB2 ARG 113 31.419 -2.742 -10.456 825 HB3 ARG 113 HB3 ARG 113 30.408 -3.630 -9.306 826 HG2 ARG 113 HG2 ARG 113 29.230 -4.778 -11.097 827 HG3 ARG 113 HG3 ARG 113 30.009 -3.799 -12.331 828 HD2 ARG 113 HD2 ARG 113 32.213 -4.661 -11.614 829 HD3 ARG 113 HD3 ARG 113 31.396 -5.739 -10.451 830 HE ARG 113 HE ARG 113 30.197 -6.685 -12.533 831 HH11 ARG 113 HH11 ARG 113 33.590 -5.677 -12.557 832 HH12 ARG 113 HH12 ARG 113 33.999 -6.832 -13.791 833 HH21 ARG 113 HH21 ARG 113 30.832 -8.172 -13.984 834 HH22 ARG 113 HH22 ARG 113 32.472 -8.206 -14.599 835 H THR 114 H THR 114 31.050 -0.120 -9.932 836 HA THR 114 HA THR 114 30.803 0.332 -7.109 837 HB THR 114 HB THR 114 31.776 2.172 -9.336 838 HG1 THR 114 HG1 THR 114 33.052 0.389 -9.138 839 HG21 THR 114 HG21 THR 114 31.303 3.598 -7.442 840 HG22 THR 114 HG22 THR 114 32.076 2.444 -6.321 841 HG23 THR 114 HG23 THR 114 33.046 3.326 -7.527 842 H VAL 115 H VAL 115 29.201 2.049 -9.838 843 HA VAL 115 HA VAL 115 27.504 3.661 -8.102 844 HB VAL 115 HB VAL 115 27.424 2.950 -11.054 845 HG11 VAL 115 HG11 VAL 115 25.089 3.467 -10.430 846 HG12 VAL 115 HG12 VAL 115 25.631 4.943 -9.580 847 HG13 VAL 115 HG13 VAL 115 25.806 4.796 -11.344 848 HG21 VAL 115 HG21 VAL 115 29.265 4.413 -10.362 849 HG22 VAL 115 HG22 VAL 115 28.063 5.378 -11.236 850 HG23 VAL 115 HG23 VAL 115 28.136 5.462 -9.472 851 H ARG 116 H ARG 116 26.893 0.605 -9.852 852 HA ARG 116 HA ARG 116 24.173 0.235 -9.297 853 HB2 ARG 116 HB2 ARG 116 25.614 -1.130 -10.841 854 HB3 ARG 116 HB3 ARG 116 26.371 -1.889 -9.439 855 HG2 ARG 116 HG2 ARG 116 24.020 -2.710 -8.790 856 HG3 ARG 116 HG3 ARG 116 23.490 -2.132 -10.378 857 HD2 ARG 116 HD2 ARG 116 23.925 -4.482 -10.572 858 HD3 ARG 116 HD3 ARG 116 25.221 -3.621 -11.416 859 HE ARG 116 HE ARG 116 25.799 -4.288 -8.597 860 HH11 ARG 116 HH11 ARG 116 25.836 -5.784 -11.752 861 HH12 ARG 116 HH12 ARG 116 27.397 -6.547 -11.501 862 HH21 ARG 116 HH21 ARG 116 27.604 -5.570 -8.193 863 HH22 ARG 116 HH22 ARG 116 28.169 -6.652 -9.430 864 H GLY 117 H GLY 117 26.886 -0.823 -7.195 865 HA2 GLY 117 HA2 GLY 117 25.299 -2.087 -5.189 866 HA3 GLY 117 HA3 GLY 117 26.908 -1.394 -4.944 867 H GLN 118 H GLN 118 26.226 1.353 -5.532 868 HA GLN 118 HA GLN 118 25.024 2.109 -2.961 869 HB2 GLN 118 HB2 GLN 118 26.148 3.749 -5.266 870 HB3 GLN 118 HB3 GLN 118 25.533 4.429 -3.743 871 HG2 GLN 118 HG2 GLN 118 27.208 3.232 -2.442 872 HG3 GLN 118 HG3 GLN 118 27.770 2.346 -3.855 873 HE21 GLN 118 HE22 GLN 118 29.053 3.452 -5.482 874 HE22 GLN 118 HE21 GLN 118 29.824 4.985 -5.056 875 H VAL 119 H VAL 119 24.026 2.535 -6.423 876 HA VAL 119 HA VAL 119 21.461 3.652 -5.888 877 HB VAL 119 HB VAL 119 22.211 1.729 -8.135 878 HG11 VAL 119 HG11 VAL 119 19.875 3.644 -7.817 879 HG12 VAL 119 HG12 VAL 119 20.323 2.841 -9.349 880 HG13 VAL 119 HG13 VAL 119 19.782 1.870 -7.975 881 HG21 VAL 119 HG21 VAL 119 22.094 4.784 -8.075 882 HG22 VAL 119 HG22 VAL 119 23.590 3.821 -8.120 883 HG23 VAL 119 HG23 VAL 119 22.479 3.770 -9.485 884 H LYS 120 H LYS 120 22.385 0.168 -5.961 885 HA LYS 120 HA LYS 120 19.843 -0.932 -5.296 886 HB2 LYS 120 HB2 LYS 120 21.857 -2.236 -6.018 887 HB3 LYS 120 HB3 LYS 120 22.628 -1.903 -4.472 888 HG2 LYS 120 HG2 LYS 120 20.714 -3.044 -3.308 889 HG3 LYS 120 HG3 LYS 120 20.023 -3.429 -4.882 890 HD2 LYS 120 HD2 LYS 120 22.184 -4.700 -5.397 891 HD3 LYS 120 HD3 LYS 120 22.706 -4.338 -3.735 892 HE2 LYS 120 HE2 LYS 120 20.485 -5.381 -2.961 893 HE3 LYS 120 HE3 LYS 120 20.274 -5.961 -4.624 894 HZ1 LYS 120 HZ1 LYS 120 22.561 -6.655 -2.815 895 HZ2 LYS 120 HZ2 LYS 120 21.343 -7.661 -3.220 896 HZ3 LYS 120 HZ3 LYS 120 22.422 -7.185 -4.357 897 H GLU 121 H GLU 121 22.541 -0.120 -2.996 898 HA GLU 121 HA GLU 121 20.871 -0.706 -0.735 899 HB2 GLU 121 HB2 GLU 121 22.670 -0.420 0.529 900 HB3 GLU 121 HB3 GLU 121 23.515 -0.490 -0.999 901 HG2 GLU 121 HG2 GLU 121 24.533 1.321 -0.036 902 HG3 GLU 121 HG3 GLU 121 23.282 2.142 -0.963 903 H ARG 122 H ARG 122 21.314 2.388 -2.431 904 HA ARG 122 HA ARG 122 19.855 3.905 -0.470 905 HB2 ARG 122 HB2 ARG 122 20.162 4.257 -3.487 906 HB3 ARG 122 HB3 ARG 122 19.372 5.417 -2.425 907 HG2 ARG 122 HG2 ARG 122 22.286 4.638 -2.030 908 HG3 ARG 122 HG3 ARG 122 21.759 5.920 -3.121 909 HD2 ARG 122 HD2 ARG 122 22.367 7.009 -1.150 910 HD3 ARG 122 HD3 ARG 122 20.591 6.997 -1.129 911 HE ARG 122 HE ARG 122 21.848 4.724 0.278 912 HH11 ARG 122 HH11 ARG 122 20.846 8.053 0.869 913 HH12 ARG 122 HH12 ARG 122 20.844 7.792 2.592 914 HH21 ARG 122 HH21 ARG 122 21.828 4.475 2.274 915 HH22 ARG 122 HH22 ARG 122 21.407 5.756 3.426 916 H VAL 123 H VAL 123 18.662 2.089 -3.347 917 HA VAL 123 HA VAL 123 15.892 2.508 -2.708 918 HB VAL 123 HB VAL 123 17.370 0.392 -4.321 919 HG11 VAL 123 HG11 VAL 123 14.372 0.496 -3.903 920 HG12 VAL 123 HG12 VAL 123 15.291 -0.509 -5.076 921 HG13 VAL 123 HG13 VAL 123 15.462 -0.810 -3.358 922 HG21 VAL 123 HG21 VAL 123 16.195 1.445 -6.184 923 HG22 VAL 123 HG22 VAL 123 15.403 2.579 -5.067 924 HG23 VAL 123 HG23 VAL 123 17.179 2.609 -5.290 925 H GLU 124 H GLU 124 18.024 -0.250 -1.652 926 HA GLU 124 HA GLU 124 15.934 -1.506 -0.141 927 HB2 GLU 124 HB2 GLU 124 18.916 -1.526 0.387 928 HB3 GLU 124 HB3 GLU 124 17.698 -2.598 1.120 929 HG2 GLU 124 HG2 GLU 124 17.078 -3.450 -1.072 930 HG3 GLU 124 HG3 GLU 124 18.357 -2.499 -1.830 931 H ASN 125 H ASN 125 18.098 1.117 0.780 932 HA ASN 125 HA ASN 125 17.084 1.121 3.455 933 HB2 ASN 125 HB2 ASN 125 18.940 2.342 3.786 934 HB3 ASN 125 HB3 ASN 125 19.242 2.379 2.068 935 HD21 ASN 125 HD22 ASN 125 18.135 4.098 0.792 936 HD22 ASN 125 HD21 ASN 125 18.025 5.680 1.575 937 H LEU 126 H LEU 126 15.988 2.634 0.499 938 HA LEU 126 HA LEU 126 14.111 4.430 1.807 939 HB2 LEU 126 HB2 LEU 126 15.034 5.021 -0.330 940 HB3 LEU 126 HB3 LEU 126 14.502 3.501 -1.051 941 HG LEU 126 HG LEU 126 12.142 4.173 -0.806 942 HD11 LEU 126 HD11 LEU 126 12.386 5.734 1.154 943 HD12 LEU 126 HD12 LEU 126 13.258 6.872 0.101 944 HD13 LEU 126 HD13 LEU 126 11.553 6.466 -0.202 945 HD21 LEU 126 HD21 LEU 126 13.965 6.129 -2.232 946 HD22 LEU 126 HD22 LEU 126 13.289 4.617 -2.878 947 HD23 LEU 126 HD23 LEU 126 12.215 5.987 -2.501 948 H ILE 127 H ILE 127 13.711 1.200 0.162 949 HA ILE 127 HA ILE 127 10.867 1.219 0.655 950 HB ILE 127 HB ILE 127 10.909 -1.206 0.303 951 HG12 ILE 127 HG12 ILE 127 13.918 -0.895 0.198 952 HG13 ILE 127 HG13 ILE 127 12.949 -1.991 1.191 953 HG21 ILE 127 HG21 ILE 127 12.528 0.360 -1.791 954 HG22 ILE 127 HG22 ILE 127 11.404 -0.985 -2.095 955 HG23 ILE 127 HG23 ILE 127 10.783 0.565 -1.527 956 HD11 ILE 127 HD11 ILE 127 14.025 -3.249 -0.536 957 HD12 ILE 127 HD12 ILE 127 12.292 -3.180 -0.926 958 HD13 ILE 127 HD13 ILE 127 13.456 -2.142 -1.796 959 H ALA 128 H ALA 128 13.520 0.364 2.815 960 HA ALA 128 HA ALA 128 11.898 -0.852 4.783 961 HB1 ALA 128 HB1 ALA 128 14.415 -0.844 4.744 962 HB2 ALA 128 HB2 ALA 128 14.399 0.898 5.121 963 HB3 ALA 128 HB3 ALA 128 13.790 -0.273 6.304 964 H LYS 129 H LYS 129 12.273 2.523 3.896 965 HA LYS 129 HA LYS 129 11.109 3.644 6.362 966 HB2 LYS 129 HB2 LYS 129 12.001 4.925 3.743 967 HB3 LYS 129 HB3 LYS 129 11.413 5.813 5.151 968 HG2 LYS 129 HG2 LYS 129 13.280 5.156 6.499 969 HG3 LYS 129 HG3 LYS 129 13.800 3.935 5.348 970 HD2 LYS 129 HD2 LYS 129 15.293 5.814 5.193 971 HD3 LYS 129 HD3 LYS 129 14.365 5.717 3.688 972 HE2 LYS 129 HE2 LYS 129 12.851 7.505 4.493 973 HE3 LYS 129 HE3 LYS 129 13.718 7.544 6.034 974 HZ1 LYS 129 HZ1 LYS 129 15.733 8.232 4.764 975 HZ2 LYS 129 HZ2 LYS 129 14.862 8.362 3.374 976 HZ3 LYS 129 HZ3 LYS 129 14.534 9.324 4.645 977 H ILE 130 H ILE 130 10.040 3.075 3.017 978 HA ILE 130 HA ILE 130 7.358 4.158 3.758 979 HB ILE 130 HB ILE 130 7.113 4.908 1.396 980 HG12 ILE 130 HG12 ILE 130 9.115 5.417 0.102 981 HG13 ILE 130 HG13 ILE 130 10.133 4.563 1.241 982 HG21 ILE 130 HG21 ILE 130 7.638 6.369 3.341 983 HG22 ILE 130 HG22 ILE 130 9.368 6.196 2.977 984 HG23 ILE 130 HG23 ILE 130 8.269 6.965 1.805 985 HD11 ILE 130 HD11 ILE 130 9.000 2.430 0.600 986 HD12 ILE 130 HD12 ILE 130 7.930 3.353 -0.483 987 HD13 ILE 130 HD13 ILE 130 9.679 3.264 -0.808 988 H SER 131 H SER 131 8.431 1.136 3.324 989 HA SER 131 HA SER 131 6.346 0.005 1.675 990 HB2 SER 131 HB2 SER 131 8.275 -1.311 2.313 991 HB3 SER 131 HB3 SER 131 7.878 -1.149 4.035 992 HG SER 131 HG SER 131 6.077 -2.437 3.730 Start of MODEL 19 1 H MET 1 H1 MET 1 2.892 0.226 2.077 2 HA MET 1 HA MET 1 3.608 -0.340 -0.023 3 HB2 MET 1 HB2 MET 1 1.703 -1.882 -0.521 4 HB3 MET 1 HB3 MET 1 0.707 -0.485 -0.953 5 HG2 MET 1 HG2 MET 1 2.364 0.104 -2.743 6 HG3 MET 1 HG3 MET 1 3.358 -1.265 -2.249 7 HE1 MET 1 HE1 MET 1 2.233 -2.806 -5.554 8 HE2 MET 1 HE2 MET 1 2.962 -1.247 -5.115 9 HE3 MET 1 HE3 MET 1 3.520 -2.743 -4.333 10 H LYS 2 H LYS 2 4.529 1.416 -0.861 11 HA LYS 2 HA LYS 2 2.869 3.797 -1.628 12 HB2 LYS 2 HB2 LYS 2 5.456 3.776 -0.009 13 HB3 LYS 2 HB3 LYS 2 4.844 5.214 -0.827 14 HG2 LYS 2 HG2 LYS 2 2.695 5.024 0.406 15 HG3 LYS 2 HG3 LYS 2 3.334 3.624 1.282 16 HD2 LYS 2 HD2 LYS 2 5.110 5.027 2.273 17 HD3 LYS 2 HD3 LYS 2 4.462 6.449 1.409 18 HE2 LYS 2 HE2 LYS 2 2.283 6.153 2.553 19 HE3 LYS 2 HE3 LYS 2 2.890 4.715 3.388 20 HZ1 LYS 2 HZ1 LYS 2 4.503 6.143 4.542 21 HZ2 LYS 2 HZ2 LYS 2 4.005 7.467 3.705 22 HZ3 LYS 2 HZ3 LYS 2 3.000 6.740 4.777 23 H LYS 3 H LYS 3 3.917 5.218 -3.196 24 HA LYS 3 HA LYS 3 5.306 3.557 -5.272 25 HB2 LYS 3 HB2 LYS 3 3.661 6.086 -5.671 26 HB3 LYS 3 HB3 LYS 3 4.450 5.167 -6.926 27 HG2 LYS 3 HG2 LYS 3 2.328 4.365 -7.121 28 HG3 LYS 3 HG3 LYS 3 3.091 3.133 -6.129 29 HD2 LYS 3 HD2 LYS 3 0.822 3.571 -5.358 30 HD3 LYS 3 HD3 LYS 3 1.976 4.025 -4.111 31 HE2 LYS 3 HE2 LYS 3 1.828 6.413 -5.138 32 HE3 LYS 3 HE3 LYS 3 0.399 5.827 -5.992 33 HZ1 LYS 3 HZ1 LYS 3 -0.268 6.850 -3.926 34 HZ2 LYS 3 HZ2 LYS 3 -0.475 5.242 -3.682 35 HZ3 LYS 3 HZ3 LYS 3 0.854 6.027 -3.064 36 H VAL 4 H VAL 4 7.103 4.161 -6.276 37 HA VAL 4 HA VAL 4 8.549 6.616 -5.328 38 HB VAL 4 HB VAL 4 9.968 4.010 -5.831 39 HG11 VAL 4 HG11 VAL 4 11.394 5.977 -6.159 40 HG12 VAL 4 HG12 VAL 4 10.870 6.636 -4.589 41 HG13 VAL 4 HG13 VAL 4 11.835 5.147 -4.677 42 HG21 VAL 4 HG21 VAL 4 9.133 5.222 -3.185 43 HG22 VAL 4 HG22 VAL 4 8.640 3.647 -3.848 44 HG23 VAL 4 HG23 VAL 4 10.321 3.910 -3.389 45 H MET 5 H MET 5 9.659 7.774 -6.827 46 HA MET 5 HA MET 5 9.757 6.746 -9.619 47 HB2 MET 5 HB2 MET 5 7.765 8.018 -9.634 48 HB3 MET 5 HB3 MET 5 8.491 9.325 -8.699 49 HG2 MET 5 HG2 MET 5 8.227 9.969 -11.010 50 HG3 MET 5 HG3 MET 5 9.925 9.940 -10.562 51 HE1 MET 5 HE1 MET 5 7.103 8.410 -12.838 52 HE2 MET 5 HE2 MET 5 8.019 9.816 -13.422 53 HE3 MET 5 HE3 MET 5 8.156 8.268 -14.263 54 H PHE 6 H PHE 6 11.564 7.114 -10.606 55 HA PHE 6 HA PHE 6 13.688 8.697 -9.206 56 HB2 PHE 6 HB2 PHE 6 14.032 6.563 -11.324 57 HB3 PHE 6 HB3 PHE 6 15.283 7.290 -10.313 58 HD1 PHE 6 HD2 PHE 6 15.235 6.819 -7.777 59 HD2 PHE 6 HD1 PHE 6 12.827 4.672 -10.619 60 HE1 PHE 6 HE2 PHE 6 14.666 5.164 -6.012 61 HE2 PHE 6 HE1 PHE 6 12.230 3.034 -8.848 62 HZ PHE 6 HZ PHE 6 13.105 3.313 -6.526 63 H VAL 7 H VAL 7 14.614 10.424 -10.102 64 HA VAL 7 HA VAL 7 14.212 11.050 -13.000 65 HB VAL 7 HB VAL 7 14.032 12.819 -10.578 66 HG11 VAL 7 HG11 VAL 7 15.184 13.794 -13.237 67 HG12 VAL 7 HG12 VAL 7 14.516 14.831 -11.966 68 HG13 VAL 7 HG13 VAL 7 15.955 13.891 -11.628 69 HG21 VAL 7 HG21 VAL 7 12.086 12.127 -11.978 70 HG22 VAL 7 HG22 VAL 7 12.326 13.870 -11.916 71 HG23 VAL 7 HG23 VAL 7 12.827 12.977 -13.377 72 H CYS 8 H CYS 8 15.953 11.000 -14.214 73 HA CYS 8 HA CYS 8 18.608 11.731 -13.027 74 HB2 CYS 8 HB2 CYS 8 18.286 9.247 -13.350 75 HB3 CYS 8 HB3 CYS 8 18.111 9.510 -15.082 76 HG CYS 8 HG CYS 8 20.645 10.106 -13.004 77 H LYS 9 H LYS 9 20.171 12.248 -15.099 78 HA LYS 9 HA LYS 9 18.884 14.611 -16.175 79 HB2 LYS 9 HB2 LYS 9 21.450 13.980 -15.508 80 HB3 LYS 9 HB3 LYS 9 21.588 13.873 -17.252 81 HG2 LYS 9 HG2 LYS 9 20.479 16.245 -15.669 82 HG3 LYS 9 HG3 LYS 9 22.142 16.103 -16.193 83 HD2 LYS 9 HD2 LYS 9 19.750 16.328 -18.080 84 HD3 LYS 9 HD3 LYS 9 20.815 17.639 -17.576 85 HE2 LYS 9 HE2 LYS 9 22.779 16.345 -18.531 86 HE3 LYS 9 HE3 LYS 9 21.619 15.193 -19.213 87 HZ1 LYS 9 HZ1 LYS 9 21.733 18.105 -19.847 88 HZ2 LYS 9 HZ2 LYS 9 22.188 16.898 -20.843 89 HZ3 LYS 9 HZ3 LYS 9 20.607 17.078 -20.457 90 H ARG 10 H ARG 10 20.067 11.698 -17.846 91 HA ARG 10 HA ARG 10 18.142 12.316 -20.069 92 HB2 ARG 10 HB2 ARG 10 19.516 11.691 -21.780 93 HB3 ARG 10 HB3 ARG 10 20.453 12.770 -20.770 94 HG2 ARG 10 HG2 ARG 10 20.777 9.748 -20.999 95 HG3 ARG 10 HG3 ARG 10 21.783 10.987 -21.736 96 HD2 ARG 10 HD2 ARG 10 22.263 11.818 -19.341 97 HD3 ARG 10 HD3 ARG 10 21.601 10.242 -18.808 98 HE ARG 10 HE ARG 10 23.614 9.856 -20.835 99 HH11 ARG 10 HH21 ARG 10 23.428 10.769 -17.442 100 HH12 ARG 10 HH22 ARG 10 25.093 10.325 -17.142 101 HH21 ARG 10 HH11 ARG 10 25.767 9.281 -20.329 102 HH22 ARG 10 HH12 ARG 10 26.333 9.612 -18.690 103 H ASN 11 H ASN 11 17.978 10.552 -17.662 104 HA ASN 11 HA ASN 11 17.219 8.507 -16.996 105 HB2 ASN 11 HB2 ASN 11 15.304 9.777 -17.990 106 HB3 ASN 11 HB3 ASN 11 15.513 8.892 -19.489 107 HD21 ASN 11 HD22 ASN 11 15.264 7.977 -15.932 108 HD22 ASN 11 HD21 ASN 11 14.157 6.675 -16.289 109 H SER 12 H SER 12 19.662 8.089 -18.305 110 HA SER 12 HA SER 12 19.311 5.791 -20.118 111 HB2 SER 12 HB2 SER 12 21.808 6.094 -20.336 112 HB3 SER 12 HB3 SER 12 20.854 7.543 -20.714 113 HG SER 12 HG SER 12 22.641 7.946 -19.228 114 H CYS 13 H CYS 13 20.891 6.395 -16.979 115 HA CYS 13 HA CYS 13 21.164 3.413 -16.611 116 HB2 CYS 13 HB2 CYS 13 23.462 3.918 -15.687 117 HB3 CYS 13 HB3 CYS 13 23.247 4.193 -17.415 118 HG CYS 13 HG CYS 13 22.993 6.749 -17.403 119 H ARG 14 H ARG 14 21.807 6.217 -14.435 120 HA ARG 14 HA ARG 14 21.472 4.603 -12.131 121 HB2 ARG 14 HB2 ARG 14 21.228 7.624 -12.487 122 HB3 ARG 14 HB3 ARG 14 21.260 6.831 -10.906 123 HG2 ARG 14 HG2 ARG 14 23.441 5.761 -11.517 124 HG3 ARG 14 HG3 ARG 14 23.484 6.735 -12.992 125 HD2 ARG 14 HD2 ARG 14 23.376 7.830 -10.150 126 HD3 ARG 14 HD3 ARG 14 24.846 7.685 -11.120 127 HE ARG 14 HE ARG 14 22.678 9.679 -11.405 128 HH11 ARG 14 HH11 ARG 14 25.764 8.637 -12.733 129 HH12 ARG 14 HH12 ARG 14 25.584 9.714 -14.125 130 HH21 ARG 14 HH21 ARG 14 22.815 11.274 -12.927 131 HH22 ARG 14 HH22 ARG 14 24.175 11.313 -14.034 132 H SER 15 H SER 15 18.888 6.734 -13.465 133 HA SER 15 HA SER 15 16.924 5.937 -11.474 134 HB2 SER 15 HB2 SER 15 15.322 6.907 -13.259 135 HB3 SER 15 HB3 SER 15 16.579 7.975 -12.653 136 HG SER 15 HG SER 15 16.613 6.526 -15.122 137 H GLN 16 H GLN 16 17.940 4.547 -14.534 138 HA GLN 16 HA GLN 16 15.653 2.714 -14.820 139 HB2 GLN 16 HB2 GLN 16 18.431 2.805 -16.117 140 HB3 GLN 16 HB3 GLN 16 17.171 1.741 -16.631 141 HG2 GLN 16 HG2 GLN 16 17.077 4.790 -16.781 142 HG3 GLN 16 HG3 GLN 16 17.447 3.700 -18.098 143 HE21 GLN 16 HE22 GLN 16 15.653 4.967 -19.179 144 HE22 GLN 16 HE21 GLN 16 14.012 4.442 -18.837 145 H MET 17 H MET 17 18.982 2.438 -13.601 146 HA MET 17 HA MET 17 18.788 -0.353 -12.805 147 HB2 MET 17 HB2 MET 17 20.720 1.881 -12.043 148 HB3 MET 17 HB3 MET 17 20.953 0.177 -11.634 149 HG2 MET 17 HG2 MET 17 21.268 -0.444 -13.925 150 HG3 MET 17 HG3 MET 17 20.573 1.054 -14.517 151 HE1 MET 17 HE1 MET 17 24.907 0.433 -13.134 152 HE2 MET 17 HE2 MET 17 23.536 -0.076 -12.116 153 HE3 MET 17 HE3 MET 17 23.789 -0.820 -13.720 154 H ALA 18 H ALA 18 18.141 2.750 -11.129 155 HA ALA 18 HA ALA 18 17.676 1.647 -8.525 156 HB1 ALA 18 HB1 ALA 18 17.987 4.080 -9.084 157 HB2 ALA 18 HB2 ALA 18 16.375 4.088 -9.818 158 HB3 ALA 18 HB3 ALA 18 16.558 3.763 -8.082 159 H GLU 19 H GLU 19 15.380 2.173 -11.264 160 HA GLU 19 HA GLU 19 13.160 0.860 -10.008 161 HB2 GLU 19 HB2 GLU 19 13.103 2.245 -12.107 162 HB3 GLU 19 HB3 GLU 19 13.861 0.900 -12.962 163 HG2 GLU 19 HG2 GLU 19 11.887 -0.541 -12.170 164 HG3 GLU 19 HG3 GLU 19 11.145 0.941 -11.576 165 H GLY 20 H GLY 20 15.898 -0.503 -11.886 166 HA2 GLY 20 HA2 GLY 20 15.225 -3.230 -11.928 167 HA3 GLY 20 HA3 GLY 20 16.868 -2.590 -11.784 168 H PHE 21 H PHE 21 17.047 -1.576 -9.252 169 HA PHE 21 HA PHE 21 16.894 -3.989 -7.612 170 HB2 PHE 21 HB2 PHE 21 17.661 -1.108 -6.996 171 HB3 PHE 21 HB3 PHE 21 17.687 -2.393 -5.786 172 HD1 PHE 21 HD1 PHE 21 18.843 -4.661 -6.545 173 HD2 PHE 21 HD2 PHE 21 19.669 -0.772 -8.237 174 HE1 PHE 21 HE1 PHE 21 21.022 -5.483 -7.374 175 HE2 PHE 21 HE2 PHE 21 21.835 -1.602 -9.068 176 HZ PHE 21 HZ PHE 21 22.499 -4.000 -8.660 177 H ALA 22 H ALA 22 14.990 -0.960 -7.608 178 HA ALA 22 HA ALA 22 13.469 -1.696 -5.308 179 HB1 ALA 22 HB1 ALA 22 12.073 0.198 -5.927 180 HB2 ALA 22 HB2 ALA 22 13.769 0.603 -6.193 181 HB3 ALA 22 HB3 ALA 22 12.765 0.188 -7.586 182 H LYS 23 H LYS 23 12.769 -2.404 -8.784 183 HA LYS 23 HA LYS 23 10.137 -3.484 -8.275 184 HB2 LYS 23 HB2 LYS 23 10.186 -4.308 -10.502 185 HB3 LYS 23 HB3 LYS 23 11.021 -2.751 -10.495 186 HG2 LYS 23 HG2 LYS 23 13.192 -4.082 -10.369 187 HG3 LYS 23 HG3 LYS 23 12.265 -5.531 -10.720 188 HD2 LYS 23 HD2 LYS 23 12.294 -3.049 -12.492 189 HD3 LYS 23 HD3 LYS 23 13.446 -4.359 -12.688 190 HE2 LYS 23 HE2 LYS 23 10.460 -4.908 -12.781 191 HE3 LYS 23 HE3 LYS 23 11.323 -4.305 -14.193 192 HZ1 LYS 23 HZ1 LYS 23 12.049 -6.833 -12.784 193 HZ2 LYS 23 HZ2 LYS 23 11.221 -6.735 -14.187 194 HZ3 LYS 23 HZ3 LYS 23 12.776 -6.239 -14.143 195 H THR 24 H THR 24 13.282 -4.863 -8.007 196 HA THR 24 HA THR 24 12.366 -7.633 -7.606 197 HB THR 24 HB THR 24 15.133 -6.491 -7.175 198 HG1 THR 24 HG1 THR 24 14.865 -6.062 -9.264 199 HG21 THR 24 HG21 THR 24 14.800 -8.824 -6.342 200 HG22 THR 24 HG22 THR 24 14.188 -9.289 -7.945 201 HG23 THR 24 HG23 THR 24 15.874 -8.766 -7.744 202 H LEU 25 H LEU 25 14.065 -5.222 -5.527 203 HA LEU 25 HA LEU 25 13.841 -6.935 -3.152 204 HB2 LEU 25 HB2 LEU 25 14.907 -4.084 -3.444 205 HB3 LEU 25 HB3 LEU 25 15.208 -5.162 -2.094 206 HG LEU 25 HG LEU 25 16.204 -5.593 -4.953 207 HD11 LEU 25 HD11 LEU 25 17.240 -3.718 -3.612 208 HD12 LEU 25 HD12 LEU 25 17.732 -4.954 -2.437 209 HD13 LEU 25 HD13 LEU 25 18.361 -5.013 -4.095 210 HD21 LEU 25 HD21 LEU 25 15.862 -7.770 -3.863 211 HD22 LEU 25 HD22 LEU 25 17.588 -7.390 -3.965 212 HD23 LEU 25 HD23 LEU 25 16.732 -7.195 -2.421 213 H GLY 26 H GLY 26 12.085 -4.231 -4.486 214 HA2 GLY 26 HA2 GLY 26 10.509 -3.755 -2.019 215 HA3 GLY 26 HA3 GLY 26 10.552 -2.793 -3.498 216 H ALA 27 H ALA 27 10.253 -6.032 -4.460 217 HA ALA 27 HA ALA 27 7.787 -5.753 -5.665 218 HB1 ALA 27 HB1 ALA 27 7.788 -8.221 -5.823 219 HB2 ALA 27 HB2 ALA 27 9.410 -7.565 -6.116 220 HB3 ALA 27 HB3 ALA 27 9.027 -8.313 -4.556 221 H GLY 28 H GLY 28 5.860 -5.220 -4.830 222 HA2 GLY 28 HA2 GLY 28 3.833 -5.583 -3.728 223 HA3 GLY 28 HA3 GLY 28 4.570 -6.847 -2.740 224 H LYS 29 H LYS 29 6.808 -4.870 -2.010 225 HA LYS 29 HA LYS 29 5.542 -3.451 0.251 226 HB2 LYS 29 HB2 LYS 29 8.393 -3.479 -0.840 227 HB3 LYS 29 HB3 LYS 29 7.904 -2.623 0.611 228 HG2 LYS 29 HG2 LYS 29 7.732 -4.509 1.881 229 HG3 LYS 29 HG3 LYS 29 7.104 -5.490 0.564 230 HD2 LYS 29 HD2 LYS 29 9.169 -6.442 1.066 231 HD3 LYS 29 HD3 LYS 29 9.431 -5.552 -0.439 232 HE2 LYS 29 HE2 LYS 29 10.513 -3.711 0.831 233 HE3 LYS 29 HE3 LYS 29 10.158 -4.546 2.352 234 HZ1 LYS 29 HZ1 LYS 29 11.946 -5.629 0.203 235 HZ2 LYS 29 HZ2 LYS 29 12.449 -5.015 1.645 236 HZ3 LYS 29 HZ3 LYS 29 11.591 -6.396 1.609 237 H ILE 30 H ILE 30 6.871 -2.649 -2.938 238 HA ILE 30 HA ILE 30 5.475 -0.042 -2.883 239 HB ILE 30 HB ILE 30 7.470 1.166 -3.705 240 HG12 ILE 30 HG12 ILE 30 9.719 0.373 -3.417 241 HG13 ILE 30 HG13 ILE 30 9.169 -1.217 -2.899 242 HG21 ILE 30 HG21 ILE 30 6.913 1.158 -1.272 243 HG22 ILE 30 HG22 ILE 30 8.066 -0.184 -1.037 244 HG23 ILE 30 HG23 ILE 30 8.640 1.389 -1.603 245 HD11 ILE 30 HD11 ILE 30 8.581 -1.813 -5.135 246 HD12 ILE 30 HD12 ILE 30 8.592 -0.108 -5.670 247 HD13 ILE 30 HD13 ILE 30 10.105 -0.936 -5.273 248 H ALA 31 H ALA 31 5.597 1.081 -5.001 249 HA ALA 31 HA ALA 31 5.946 -0.739 -7.343 250 HB1 ALA 31 HB1 ALA 31 3.643 1.204 -6.922 251 HB2 ALA 31 HB2 ALA 31 4.055 0.462 -8.478 252 HB3 ALA 31 HB3 ALA 31 3.545 -0.556 -7.131 253 H VAL 32 H VAL 32 6.932 0.295 -9.203 254 HA VAL 32 HA VAL 32 8.075 2.978 -8.658 255 HB VAL 32 HB VAL 32 10.183 1.759 -9.690 256 HG11 VAL 32 HG11 VAL 32 10.145 3.064 -7.711 257 HG12 VAL 32 HG12 VAL 32 9.347 1.774 -6.776 258 HG13 VAL 32 HG13 VAL 32 11.016 1.584 -7.362 259 HG21 VAL 32 HG21 VAL 32 9.074 -0.532 -8.046 260 HG22 VAL 32 HG22 VAL 32 9.186 -0.510 -9.828 261 HG23 VAL 32 HG23 VAL 32 10.653 -0.420 -8.847 262 H THR 33 H THR 33 8.829 4.189 -10.179 263 HA THR 33 HA THR 33 8.684 3.348 -13.037 264 HB THR 33 HB THR 33 7.642 6.026 -12.038 265 HG1 THR 33 HG1 THR 33 5.575 5.166 -12.449 266 HG21 THR 33 HG21 THR 33 6.595 6.137 -14.280 267 HG22 THR 33 HG22 THR 33 8.347 6.006 -14.424 268 HG23 THR 33 HG23 THR 33 7.337 4.578 -14.714 269 H SER 34 H SER 34 10.304 4.313 -14.333 270 HA SER 34 HA SER 34 12.244 6.186 -13.034 271 HB2 SER 34 HB2 SER 34 13.186 4.016 -13.525 272 HB3 SER 34 HB3 SER 34 12.553 4.078 -15.184 273 HG SER 34 HG SER 34 14.688 4.687 -15.196 274 H CYS 35 H CYS 35 12.691 8.107 -13.978 275 HA CYS 35 HA CYS 35 12.109 8.624 -16.810 276 HB2 CYS 35 HB2 CYS 35 10.621 10.430 -16.457 277 HB3 CYS 35 HB3 CYS 35 10.007 9.077 -15.485 278 HG CYS 35 HG CYS 35 11.276 9.896 -13.251 279 H GLY 36 H GLY 36 12.696 11.128 -17.208 280 HA2 GLY 36 HA2 GLY 36 14.689 12.167 -15.296 281 HA3 GLY 36 HA3 GLY 36 15.315 11.811 -16.914 282 H LEU 37 H LEU 37 15.505 14.384 -16.001 283 HA LEU 37 HA LEU 37 13.239 15.959 -16.932 284 HB2 LEU 37 HB2 LEU 37 14.759 17.886 -16.993 285 HB3 LEU 37 HB3 LEU 37 14.520 17.138 -15.432 286 HG LEU 37 HG LEU 37 16.928 16.208 -17.008 287 HD11 LEU 37 HD11 LEU 37 17.039 18.643 -17.337 288 HD12 LEU 37 HD12 LEU 37 16.796 18.909 -15.598 289 HD13 LEU 37 HD13 LEU 37 18.280 18.118 -16.180 290 HD21 LEU 37 HD21 LEU 37 16.458 16.965 -14.094 291 HD22 LEU 37 HD22 LEU 37 16.357 15.322 -14.726 292 HD23 LEU 37 HD23 LEU 37 17.911 16.172 -14.740 293 H GLU 38 H GLU 38 15.612 14.203 -18.497 294 HA GLU 38 HA GLU 38 14.456 14.866 -21.112 295 HB2 GLU 38 HB2 GLU 38 17.487 14.657 -20.797 296 HB3 GLU 38 HB3 GLU 38 16.581 14.878 -22.284 297 HG2 GLU 38 HG2 GLU 38 15.804 17.105 -21.475 298 HG3 GLU 38 HG3 GLU 38 16.791 16.904 -20.020 299 H SER 39 H SER 39 14.877 13.058 -22.656 300 HA SER 39 HA SER 39 15.695 10.470 -21.439 301 HB2 SER 39 HB2 SER 39 13.616 9.428 -22.372 302 HB3 SER 39 HB3 SER 39 13.412 10.457 -20.947 303 HG SER 39 HG SER 39 12.872 11.243 -23.654 304 H SER 40 H SER 40 16.739 9.142 -22.856 305 HA SER 40 HA SER 40 16.278 9.542 -25.789 306 HB2 SER 40 HB2 SER 40 18.291 10.760 -25.161 307 HB3 SER 40 HB3 SER 40 19.026 9.270 -24.545 308 HG SER 40 HG SER 40 19.362 10.037 -26.890 309 H ARG 41 H ARG 41 18.292 7.260 -23.840 310 HA ARG 41 HA ARG 41 16.458 5.063 -24.341 311 HB2 ARG 41 HB2 ARG 41 17.767 3.667 -25.704 312 HB3 ARG 41 HB3 ARG 41 17.732 5.198 -26.531 313 HG2 ARG 41 HG2 ARG 41 20.075 4.077 -24.922 314 HG3 ARG 41 HG3 ARG 41 19.908 4.070 -26.665 315 HD2 ARG 41 HD2 ARG 41 20.226 6.544 -24.914 316 HD3 ARG 41 HD3 ARG 41 21.470 5.806 -25.898 317 HE ARG 41 HE ARG 41 19.349 7.579 -26.792 318 HH11 ARG 41 HH11 ARG 41 21.561 5.136 -28.025 319 HH12 ARG 41 HH12 ARG 41 21.387 5.713 -29.661 320 HH21 ARG 41 HH21 ARG 41 19.166 8.213 -28.849 321 HH22 ARG 41 HH22 ARG 41 20.057 7.416 -30.118 322 H VAL 42 H VAL 42 17.101 3.056 -23.213 323 HA VAL 42 HA VAL 42 18.594 3.530 -20.748 324 HB VAL 42 HB VAL 42 17.937 0.768 -21.881 325 HG11 VAL 42 HG11 VAL 42 17.993 0.180 -19.445 326 HG12 VAL 42 HG12 VAL 42 19.560 0.736 -20.026 327 HG13 VAL 42 HG13 VAL 42 18.531 1.822 -19.071 328 HG21 VAL 42 HG21 VAL 42 15.836 1.933 -21.710 329 HG22 VAL 42 HG22 VAL 42 16.039 0.821 -20.346 330 HG23 VAL 42 HG23 VAL 42 16.271 2.572 -20.106 331 H HIS 43 H HIS 43 20.733 3.092 -20.282 332 HA HIS 43 HA HIS 43 22.618 2.828 -22.473 333 HB2 HIS 43 HB2 HIS 43 22.925 3.945 -20.120 334 HB3 HIS 43 HB3 HIS 43 23.281 2.311 -19.548 335 HD2 HIS 43 HD2 HIS 43 24.757 5.264 -21.323 336 HE1 HIS 43 HE1 HIS 43 27.624 2.162 -21.860 337 HE2 HIS 43 HE2 HIS 43 27.162 4.673 -22.159 338 HA PRO 44 HA PRO 44 21.692 -1.425 -22.727 339 HB2 PRO 44 HB2 PRO 44 23.525 -2.372 -24.564 340 HB3 PRO 44 HB3 PRO 44 22.188 -1.245 -24.978 341 HG2 PRO 44 HG2 PRO 44 25.069 -0.529 -24.343 342 HG3 PRO 44 HG3 PRO 44 24.090 -0.028 -25.763 343 HD2 PRO 44 HD2 PRO 44 24.338 1.556 -23.567 344 HD3 PRO 44 HD3 PRO 44 22.783 1.445 -24.453 345 H THR 45 H THR 45 24.988 -0.451 -21.796 346 HA THR 45 HA THR 45 25.810 -2.969 -20.667 347 HB THR 45 HB THR 45 26.704 -0.164 -19.928 348 HG1 THR 45 HG1 THR 45 28.326 -0.594 -21.476 349 HG21 THR 45 HG21 THR 45 28.855 -1.361 -19.371 350 HG22 THR 45 HG22 THR 45 27.521 -1.757 -18.288 351 HG23 THR 45 HG23 THR 45 27.986 -2.912 -19.559 352 H ALA 46 H ALA 46 23.625 -0.444 -19.447 353 HA ALA 46 HA ALA 46 23.718 -1.213 -16.676 354 HB1 ALA 46 HB1 ALA 46 21.388 -0.068 -18.273 355 HB2 ALA 46 HB2 ALA 46 21.595 -0.032 -16.517 356 HB3 ALA 46 HB3 ALA 46 22.706 0.895 -17.548 357 H ILE 47 H ILE 47 21.779 -2.453 -19.445 358 HA ILE 47 HA ILE 47 20.203 -4.366 -17.976 359 HB ILE 47 HB ILE 47 21.239 -4.392 -20.850 360 HG12 ILE 47 HG12 ILE 47 18.916 -4.057 -21.510 361 HG13 ILE 47 HG13 ILE 47 18.382 -4.077 -19.838 362 HG21 ILE 47 HG21 ILE 47 20.938 -6.734 -20.228 363 HG22 ILE 47 HG22 ILE 47 19.351 -6.378 -19.517 364 HG23 ILE 47 HG23 ILE 47 19.620 -6.244 -21.270 365 HD11 ILE 47 HD11 ILE 47 18.447 -1.817 -20.900 366 HD12 ILE 47 HD12 ILE 47 19.441 -1.907 -19.441 367 HD13 ILE 47 HD13 ILE 47 20.205 -1.954 -21.049 368 H ALA 48 H ALA 48 23.481 -4.604 -19.421 369 HA ALA 48 HA ALA 48 23.867 -7.369 -18.734 370 HB1 ALA 48 HB1 ALA 48 25.936 -5.199 -19.249 371 HB2 ALA 48 HB2 ALA 48 26.197 -6.956 -19.296 372 HB3 ALA 48 HB3 ALA 48 25.127 -6.191 -20.490 373 H MET 49 H MET 49 24.721 -4.360 -17.023 374 HA MET 49 HA MET 49 26.104 -5.704 -14.854 375 HB2 MET 49 HB2 MET 49 25.006 -2.882 -15.024 376 HB3 MET 49 HB3 MET 49 26.147 -3.473 -13.800 377 HG2 MET 49 HG2 MET 49 26.899 -3.773 -16.703 378 HG3 MET 49 HG3 MET 49 26.922 -2.184 -15.974 379 HE1 MET 49 HE1 MET 49 28.744 -5.430 -16.596 380 HE2 MET 49 HE2 MET 49 29.930 -5.569 -15.277 381 HE3 MET 49 HE3 MET 49 28.221 -5.932 -14.970 382 H MET 50 H MET 50 22.708 -4.733 -15.312 383 HA MET 50 HA MET 50 21.957 -5.538 -12.583 384 HB2 MET 50 HB2 MET 50 20.312 -5.061 -15.103 385 HB3 MET 50 HB3 MET 50 19.637 -5.417 -13.516 386 HG2 MET 50 HG2 MET 50 21.256 -2.961 -14.288 387 HG3 MET 50 HG3 MET 50 19.542 -3.029 -13.930 388 HE1 MET 50 HE1 MET 50 19.533 -3.690 -10.063 389 HE2 MET 50 HE2 MET 50 18.681 -3.925 -11.599 390 HE3 MET 50 HE3 MET 50 19.955 -5.070 -11.096 391 H GLU 51 H GLU 51 22.146 -7.162 -15.788 392 HA GLU 51 HA GLU 51 20.940 -9.592 -14.893 393 HB2 GLU 51 HB2 GLU 51 22.709 -8.828 -17.215 394 HB3 GLU 51 HB3 GLU 51 22.359 -10.521 -16.910 395 HG2 GLU 51 HG2 GLU 51 20.092 -8.505 -17.084 396 HG3 GLU 51 HG3 GLU 51 20.824 -9.183 -18.530 397 H GLU 52 H GLU 52 24.243 -8.398 -14.321 398 HA GLU 52 HA GLU 52 25.354 -10.920 -13.495 399 HB2 GLU 52 HB2 GLU 52 25.846 -8.203 -12.230 400 HB3 GLU 52 HB3 GLU 52 26.848 -9.640 -12.060 401 HG2 GLU 52 HG2 GLU 52 27.066 -9.508 -14.673 402 HG3 GLU 52 HG3 GLU 52 26.539 -7.833 -14.452 403 H VAL 53 H VAL 53 22.959 -8.865 -12.000 404 HA VAL 53 HA VAL 53 22.966 -10.310 -9.409 405 HB VAL 53 HB VAL 53 20.939 -8.215 -10.186 406 HG11 VAL 53 HG11 VAL 53 21.052 -7.658 -7.794 407 HG12 VAL 53 HG12 VAL 53 20.748 -9.373 -7.972 408 HG13 VAL 53 HG13 VAL 53 22.381 -8.812 -7.557 409 HG21 VAL 53 HG21 VAL 53 22.382 -6.413 -9.312 410 HG22 VAL 53 HG22 VAL 53 23.759 -7.541 -9.249 411 HG23 VAL 53 HG23 VAL 53 23.020 -7.079 -10.805 412 H GLY 54 H GLY 54 21.765 -10.903 -12.474 413 HA2 GLY 54 HA2 GLY 54 20.101 -12.225 -13.327 414 HA3 GLY 54 HA3 GLY 54 19.653 -12.725 -11.691 415 H ILE 55 H ILE 55 19.713 -9.281 -12.395 416 HA ILE 55 HA ILE 55 16.745 -9.152 -12.135 417 HB ILE 55 HB ILE 55 18.930 -7.104 -11.660 418 HG12 ILE 55 HG12 ILE 55 16.895 -8.443 -9.822 419 HG13 ILE 55 HG13 ILE 55 18.620 -8.797 -9.871 420 HG21 ILE 55 HG21 ILE 55 17.148 -5.545 -11.002 421 HG22 ILE 55 HG22 ILE 55 16.957 -5.976 -12.688 422 HG23 ILE 55 HG23 ILE 55 15.908 -6.724 -11.461 423 HD11 ILE 55 HD11 ILE 55 17.326 -6.225 -8.883 424 HD12 ILE 55 HD12 ILE 55 18.239 -7.424 -7.958 425 HD13 ILE 55 HD13 ILE 55 19.075 -6.411 -9.155 426 H ASP 56 H ASP 56 15.518 -8.662 -13.840 427 HA ASP 56 HA ASP 56 16.848 -7.892 -16.379 428 HB2 ASP 56 HB2 ASP 56 15.478 -9.874 -16.437 429 HB3 ASP 56 HB3 ASP 56 14.094 -8.985 -15.791 430 H ILE 57 H ILE 57 16.846 -5.907 -17.066 431 HA ILE 57 HA ILE 57 14.462 -4.164 -16.635 432 HB ILE 57 HB ILE 57 15.837 -2.197 -16.635 433 HG12 ILE 57 HG12 ILE 57 18.368 -3.778 -16.169 434 HG13 ILE 57 HG13 ILE 57 17.859 -3.367 -17.806 435 HG21 ILE 57 HG21 ILE 57 15.138 -3.232 -14.506 436 HG22 ILE 57 HG22 ILE 57 16.701 -4.082 -14.418 437 HG23 ILE 57 HG23 ILE 57 16.631 -2.302 -14.349 438 HD11 ILE 57 HD11 ILE 57 19.445 -1.711 -16.922 439 HD12 ILE 57 HD12 ILE 57 17.877 -0.988 -17.321 440 HD13 ILE 57 HD13 ILE 57 18.310 -1.301 -15.620 441 H SER 58 H SER 58 15.603 -6.048 -18.910 442 HA SER 58 HA SER 58 16.342 -4.310 -21.078 443 HB2 SER 58 HB2 SER 58 16.165 -6.297 -22.468 444 HB3 SER 58 HB3 SER 58 17.030 -6.651 -20.964 445 HG SER 58 HG SER 58 15.216 -7.631 -20.137 446 H GLY 59 H GLY 59 13.192 -5.173 -19.882 447 HA2 GLY 59 HA2 GLY 59 11.696 -4.419 -22.257 448 HA3 GLY 59 HA3 GLY 59 11.060 -4.668 -20.631 449 H GLN 60 H GLN 60 13.549 -2.355 -20.307 450 HA GLN 60 HA GLN 60 11.576 -0.202 -20.004 451 HB2 GLN 60 HB2 GLN 60 14.540 -0.485 -19.473 452 HB3 GLN 60 HB3 GLN 60 13.698 1.057 -19.301 453 HG2 GLN 60 HG2 GLN 60 12.280 0.178 -17.535 454 HG3 GLN 60 HG3 GLN 60 12.955 -1.445 -17.739 455 HE21 GLN 60 HE22 GLN 60 13.092 -0.183 -15.211 456 HE22 GLN 60 HE21 GLN 60 14.819 0.134 -14.912 457 H THR 61 H THR 61 11.807 1.825 -20.929 458 HA THR 61 HA THR 61 13.600 2.428 -23.106 459 HB THR 61 HB THR 61 11.743 3.408 -24.494 460 HG1 THR 61 HG1 THR 61 9.670 2.518 -24.250 461 HG21 THR 61 HG21 THR 61 11.605 0.372 -24.311 462 HG22 THR 61 HG22 THR 61 11.188 1.382 -25.711 463 HG23 THR 61 HG23 THR 61 12.869 1.291 -25.160 464 H SER 62 H SER 62 13.982 4.689 -23.062 465 HA SER 62 HA SER 62 13.387 5.766 -20.471 466 HB2 SER 62 HB2 SER 62 14.866 6.958 -22.800 467 HB3 SER 62 HB3 SER 62 14.877 7.541 -21.107 468 HG SER 62 HG SER 62 16.559 6.166 -21.039 469 H ASP 63 H ASP 63 12.409 7.688 -19.874 470 HA ASP 63 HA ASP 63 10.662 9.074 -21.840 471 HB2 ASP 63 HB2 ASP 63 9.650 7.399 -19.544 472 HB3 ASP 63 HB3 ASP 63 8.736 8.799 -20.093 473 HA PRO 64 HA PRO 64 11.650 12.505 -19.377 474 HB2 PRO 64 HB2 PRO 64 10.247 14.483 -20.546 475 HB3 PRO 64 HB3 PRO 64 11.404 13.485 -21.477 476 HG2 PRO 64 HG2 PRO 64 8.392 13.159 -21.287 477 HG3 PRO 64 HG3 PRO 64 9.407 13.181 -22.763 478 HD2 PRO 64 HD2 PRO 64 8.603 10.851 -21.487 479 HD3 PRO 64 HD3 PRO 64 10.115 10.998 -22.427 480 H ILE 65 H ILE 65 11.158 13.790 -17.652 481 HA ILE 65 HA ILE 65 9.150 13.191 -15.815 482 HB ILE 65 HB ILE 65 11.375 14.381 -15.511 483 HG12 ILE 65 HG12 ILE 65 8.937 15.528 -14.152 484 HG13 ILE 65 HG13 ILE 65 9.838 14.057 -13.704 485 HG21 ILE 65 HG21 ILE 65 11.004 16.226 -17.228 486 HG22 ILE 65 HG22 ILE 65 9.840 16.954 -16.089 487 HG23 ILE 65 HG23 ILE 65 11.533 16.796 -15.640 488 HD11 ILE 65 HD11 ILE 65 10.575 15.719 -12.192 489 HD12 ILE 65 HD12 ILE 65 11.872 15.609 -13.400 490 HD13 ILE 65 HD13 ILE 65 10.700 16.949 -13.456 491 H GLU 66 H GLU 66 9.129 15.634 -18.361 492 HA GLU 66 HA GLU 66 6.855 17.131 -17.674 493 HB2 GLU 66 HB2 GLU 66 7.814 16.410 -20.475 494 HB3 GLU 66 HB3 GLU 66 6.774 17.770 -20.042 495 HG2 GLU 66 HG2 GLU 66 8.646 18.657 -18.587 496 HG3 GLU 66 HG3 GLU 66 9.695 17.390 -19.244 497 H ASN 67 H ASN 67 6.851 13.872 -19.023 498 HA ASN 67 HA ASN 67 3.973 14.070 -19.728 499 HB2 ASN 67 HB2 ASN 67 4.314 12.434 -21.185 500 HB3 ASN 67 HB3 ASN 67 6.022 12.761 -21.004 501 HD21 ASN 67 HD22 ASN 67 7.033 11.437 -18.978 502 HD22 ASN 67 HD21 ASN 67 6.390 9.822 -18.784 503 H PHE 68 H PHE 68 5.700 13.337 -16.914 504 HA PHE 68 HA PHE 68 3.893 11.155 -16.042 505 HB2 PHE 68 HB2 PHE 68 6.619 12.125 -15.182 506 HB3 PHE 68 HB3 PHE 68 5.686 11.033 -14.184 507 HD1 PHE 68 HD1 PHE 68 4.540 8.993 -15.727 508 HD2 PHE 68 HD2 PHE 68 8.279 11.023 -16.403 509 HE1 PHE 68 HE1 PHE 68 5.365 7.042 -17.010 510 HE2 PHE 68 HE2 PHE 68 9.096 9.065 -17.702 511 HZ PHE 68 HZ PHE 68 7.640 7.071 -18.000 512 H ASN 69 H ASN 69 3.490 11.056 -13.627 513 HA ASN 69 HA ASN 69 2.078 13.589 -12.878 514 HB2 ASN 69 HB2 ASN 69 0.287 12.004 -12.021 515 HB3 ASN 69 HB3 ASN 69 0.458 12.173 -13.760 516 HD21 ASN 69 HD22 ASN 69 1.738 10.008 -11.148 517 HD22 ASN 69 HD21 ASN 69 1.455 8.540 -12.073 518 H ALA 70 H ALA 70 3.736 14.306 -11.462 519 HA ALA 70 HA ALA 70 5.023 12.919 -9.466 520 HB1 ALA 70 HB1 ALA 70 5.229 15.090 -8.299 521 HB2 ALA 70 HB2 ALA 70 5.482 15.265 -10.048 522 HB3 ALA 70 HB3 ALA 70 3.940 15.762 -9.315 523 H ASP 71 H ASP 71 1.697 14.120 -9.350 524 HA ASP 71 HA ASP 71 1.182 14.042 -6.574 525 HB2 ASP 71 HB2 ASP 71 -0.656 13.603 -8.964 526 HB3 ASP 71 HB3 ASP 71 -1.222 13.872 -7.312 527 H ASP 72 H ASP 72 1.404 11.327 -8.784 528 HA ASP 72 HA ASP 72 0.090 9.523 -6.808 529 HB2 ASP 72 HB2 ASP 72 -0.607 9.546 -9.275 530 HB3 ASP 72 HB3 ASP 72 0.958 8.776 -9.581 531 H TYR 73 H TYR 73 3.130 10.691 -7.195 532 HA TYR 73 HA TYR 73 4.447 8.094 -6.496 533 HB2 TYR 73 HB2 TYR 73 5.875 10.622 -7.287 534 HB3 TYR 73 HB3 TYR 73 6.503 8.983 -7.184 535 HD1 TYR 73 HD1 TYR 73 4.362 7.484 -8.762 536 HD2 TYR 73 HD2 TYR 73 6.373 11.235 -9.472 537 HE1 TYR 73 HE1 TYR 73 3.831 7.312 -11.179 538 HE2 TYR 73 HE2 TYR 73 5.808 11.072 -11.888 539 HH TYR 73 HH TYR 73 3.957 8.324 -13.248 540 H ASP 74 H ASP 74 4.014 7.918 -4.335 541 HA ASP 74 HA ASP 74 3.861 9.953 -2.385 542 HB2 ASP 74 HB2 ASP 74 4.932 7.114 -2.091 543 HB3 ASP 74 HB3 ASP 74 4.429 8.151 -0.761 544 H VAL 75 H VAL 75 6.701 8.302 -3.708 545 HA VAL 75 HA VAL 75 8.439 10.334 -2.380 546 HB VAL 75 HB VAL 75 9.179 7.466 -2.995 547 HG11 VAL 75 HG11 VAL 75 11.104 8.926 -3.165 548 HG12 VAL 75 HG12 VAL 75 10.714 9.719 -1.634 549 HG13 VAL 75 HG13 VAL 75 11.217 8.021 -1.660 550 HG21 VAL 75 HG21 VAL 75 7.714 7.364 -1.116 551 HG22 VAL 75 HG22 VAL 75 9.365 7.308 -0.463 552 HG23 VAL 75 HG23 VAL 75 8.420 8.812 -0.382 553 H VAL 76 H VAL 76 9.858 11.402 -3.686 554 HA VAL 76 HA VAL 76 10.352 10.376 -6.462 555 HB VAL 76 HB VAL 76 9.857 13.210 -5.587 556 HG11 VAL 76 HG11 VAL 76 10.974 12.308 -8.292 557 HG12 VAL 76 HG12 VAL 76 10.477 13.962 -7.842 558 HG13 VAL 76 HG13 VAL 76 11.871 13.243 -7.071 559 HG21 VAL 76 HG21 VAL 76 8.230 13.167 -7.456 560 HG22 VAL 76 HG22 VAL 76 8.666 11.477 -7.792 561 HG23 VAL 76 HG23 VAL 76 7.866 11.918 -6.257 562 H ILE 77 H ILE 77 12.422 10.285 -7.108 563 HA ILE 77 HA ILE 77 14.538 11.130 -5.164 564 HB ILE 77 HB ILE 77 14.514 8.693 -6.949 565 HG12 ILE 77 HG12 ILE 77 12.737 8.363 -5.271 566 HG13 ILE 77 HG13 ILE 77 14.080 7.268 -5.055 567 HG21 ILE 77 HG21 ILE 77 16.755 9.382 -6.422 568 HG22 ILE 77 HG22 ILE 77 16.349 9.609 -4.714 569 HG23 ILE 77 HG23 ILE 77 16.385 7.966 -5.433 570 HD11 ILE 77 HD11 ILE 77 13.196 8.156 -2.923 571 HD12 ILE 77 HD12 ILE 77 14.905 8.500 -3.140 572 HD13 ILE 77 HD13 ILE 77 13.691 9.784 -3.380 573 H SER 78 H SER 78 16.129 12.406 -6.020 574 HA SER 78 HA SER 78 16.495 12.482 -9.000 575 HB2 SER 78 HB2 SER 78 16.134 14.650 -7.975 576 HB3 SER 78 HB3 SER 78 17.531 14.393 -6.896 577 HG SER 78 HG SER 78 18.112 15.575 -8.805 578 H LEU 79 H LEU 79 18.230 11.778 -9.967 579 HA LEU 79 HA LEU 79 20.722 11.108 -8.455 580 HB2 LEU 79 HB2 LEU 79 19.589 9.284 -10.611 581 HB3 LEU 79 HB3 LEU 79 20.946 9.009 -9.527 582 HG LEU 79 HG LEU 79 18.963 9.176 -7.657 583 HD11 LEU 79 HD11 LEU 79 17.630 8.035 -10.153 584 HD12 LEU 79 HD12 LEU 79 16.979 8.005 -8.493 585 HD13 LEU 79 HD13 LEU 79 17.165 9.546 -9.339 586 HD21 LEU 79 HD21 LEU 79 19.493 6.671 -9.312 587 HD22 LEU 79 HD22 LEU 79 20.519 7.266 -7.975 588 HD23 LEU 79 HD23 LEU 79 18.858 6.756 -7.655 589 H CYS 80 H CYS 80 20.464 13.489 -9.712 590 HA CYS 80 HA CYS 80 21.138 13.225 -12.579 591 HB2 CYS 80 HB2 CYS 80 20.511 15.651 -10.859 592 HB3 CYS 80 HB3 CYS 80 20.770 15.661 -12.612 593 HG CYS 80 HG CYS 80 18.412 14.250 -10.782 594 H GLY 81 H GLY 81 23.047 13.841 -9.706 595 HA2 GLY 81 HA2 GLY 81 25.373 14.114 -9.589 596 HA3 GLY 81 HA3 GLY 81 25.472 14.308 -11.343 597 H CYS 82 H CYS 82 23.625 15.985 -8.808 598 HA CYS 82 HA CYS 82 23.199 18.150 -8.305 599 HB2 CYS 82 HB2 CYS 82 26.066 18.629 -9.212 600 HB3 CYS 82 HB3 CYS 82 25.098 19.735 -8.229 601 HG CYS 82 HG CYS 82 26.833 18.512 -6.692 602 H GLY 83 H GLY 83 23.356 20.576 -9.194 603 HA2 GLY 83 HA2 GLY 83 22.765 22.099 -10.812 604 HA3 GLY 83 HA3 GLY 83 23.136 20.911 -12.060 605 H VAL 84 H VAL 84 20.842 19.730 -9.819 606 HA VAL 84 HA VAL 84 18.469 20.545 -11.442 607 HB VAL 84 HB VAL 84 19.209 17.679 -10.721 608 HG11 VAL 84 HG11 VAL 84 16.747 18.747 -12.182 609 HG12 VAL 84 HG12 VAL 84 17.154 17.037 -11.909 610 HG13 VAL 84 HG13 VAL 84 16.752 18.048 -10.538 611 HG21 VAL 84 HG21 VAL 84 18.988 19.079 -13.419 612 HG22 VAL 84 HG22 VAL 84 20.462 18.407 -12.679 613 HG23 VAL 84 HG23 VAL 84 19.171 17.327 -13.193 614 H ASN 85 H ASN 85 16.871 21.219 -10.166 615 HA ASN 85 HA ASN 85 16.741 20.293 -7.312 616 HB2 ASN 85 HB2 ASN 85 16.359 23.093 -8.461 617 HB3 ASN 85 HB3 ASN 85 16.164 22.652 -6.764 618 HD21 ASN 85 HD22 ASN 85 18.144 21.750 -5.629 619 HD22 ASN 85 HD21 ASN 85 19.708 22.313 -6.184 620 H LEU 86 H LEU 86 14.897 20.270 -10.129 621 HA LEU 86 HA LEU 86 12.640 20.221 -10.629 622 HB2 LEU 86 HB2 LEU 86 12.706 18.457 -8.161 623 HB3 LEU 86 HB3 LEU 86 11.484 18.435 -9.444 624 HG LEU 86 HG LEU 86 14.365 17.560 -9.695 625 HD11 LEU 86 HD11 LEU 86 13.434 15.368 -9.815 626 HD12 LEU 86 HD12 LEU 86 12.578 16.143 -8.460 627 HD13 LEU 86 HD13 LEU 86 11.787 15.991 -10.046 628 HD21 LEU 86 HD21 LEU 86 12.074 17.790 -11.698 629 HD22 LEU 86 HD22 LEU 86 13.678 18.558 -11.821 630 HD23 LEU 86 HD23 LEU 86 13.530 16.806 -11.991 631 HA PRO 87 HA PRO 87 11.281 23.592 -7.684 632 HB2 PRO 87 HB2 PRO 87 10.493 24.637 -10.410 633 HB3 PRO 87 HB3 PRO 87 11.006 25.553 -8.958 634 HG2 PRO 87 HG2 PRO 87 12.795 25.079 -10.913 635 HG3 PRO 87 HG3 PRO 87 13.276 24.810 -9.202 636 HD2 PRO 87 HD2 PRO 87 12.403 22.757 -11.251 637 HD3 PRO 87 HD3 PRO 87 13.770 22.714 -10.101 638 HA PRO 88 HA PRO 88 6.819 22.946 -9.284 639 HB2 PRO 88 HB2 PRO 88 6.785 20.396 -10.802 640 HB3 PRO 88 HB3 PRO 88 6.079 21.976 -11.228 641 HG2 PRO 88 HG2 PRO 88 8.276 20.946 -12.475 642 HG3 PRO 88 HG3 PRO 88 8.096 22.714 -12.172 643 HD2 PRO 88 HD2 PRO 88 9.644 20.668 -10.566 644 HD3 PRO 88 HD3 PRO 88 10.127 22.300 -11.124 645 H GLU 89 H GLU 89 5.104 20.690 -9.254 646 HA GLU 89 HA GLU 89 5.059 19.920 -6.524 647 HB2 GLU 89 HB2 GLU 89 3.334 18.275 -7.247 648 HB3 GLU 89 HB3 GLU 89 3.013 19.940 -7.680 649 HG2 GLU 89 HG2 GLU 89 4.379 18.233 -9.752 650 HG3 GLU 89 HG3 GLU 89 2.706 17.853 -9.368 651 H TRP 90 H TRP 90 7.135 18.703 -8.859 652 HA TRP 90 HA TRP 90 7.544 15.981 -8.108 653 HB2 TRP 90 HB2 TRP 90 9.270 18.105 -9.371 654 HB3 TRP 90 HB3 TRP 90 9.820 16.448 -9.076 655 HD1 TRP 90 HD1 TRP 90 7.453 18.433 -11.331 656 HE1 TRP 90 HE1 TRP 90 6.355 16.878 -13.047 657 HE3 TRP 90 HE3 TRP 90 9.472 14.028 -9.785 658 HZ2 TRP 90 HZ2 TRP 90 6.365 14.044 -13.676 659 HZ3 TRP 90 HZ3 TRP 90 9.129 11.967 -11.097 660 HH2 TRP 90 HH2 TRP 90 7.583 11.952 -13.031 661 H VAL 91 H VAL 91 8.290 18.858 -6.306 662 HA VAL 91 HA VAL 91 9.790 17.164 -4.332 663 HB VAL 91 HB VAL 91 10.957 19.113 -3.529 664 HG11 VAL 91 HG11 VAL 91 12.041 17.770 -5.176 665 HG12 VAL 91 HG12 VAL 91 11.266 18.667 -6.489 666 HG13 VAL 91 HG13 VAL 91 12.450 19.472 -5.438 667 HG21 VAL 91 HG21 VAL 91 9.670 20.664 -5.819 668 HG22 VAL 91 HG22 VAL 91 9.325 20.904 -4.096 669 HG23 VAL 91 HG23 VAL 91 10.936 21.259 -4.735 670 H THR 92 H THR 92 6.757 18.344 -4.756 671 HA THR 92 HA THR 92 6.356 19.125 -1.913 672 HB THR 92 HB THR 92 4.165 19.849 -2.525 673 HG1 THR 92 HG1 THR 92 3.289 19.478 -4.465 674 HG21 THR 92 HG21 THR 92 6.109 20.791 -4.690 675 HG22 THR 92 HG22 THR 92 4.643 21.625 -4.128 676 HG23 THR 92 HG23 THR 92 6.019 21.428 -3.033 677 H GLN 93 H GLN 93 6.629 16.256 -3.398 678 HA GLN 93 HA GLN 93 4.281 14.857 -2.379 679 HB2 GLN 93 HB2 GLN 93 6.899 13.726 -3.439 680 HB3 GLN 93 HB3 GLN 93 5.389 12.861 -3.180 681 HG2 GLN 93 HG2 GLN 93 5.998 14.961 -5.274 682 HG3 GLN 93 HG3 GLN 93 5.506 13.292 -5.519 683 HE21 GLN 93 HE22 GLN 93 4.379 16.370 -5.842 684 HE22 GLN 93 HE21 GLN 93 2.667 16.092 -5.534 685 H GLU 94 H GLU 94 5.022 12.669 -1.090 686 HA GLU 94 HA GLU 94 5.255 13.764 1.561 687 HB2 GLU 94 HB2 GLU 94 3.844 11.850 1.066 688 HB3 GLU 94 HB3 GLU 94 5.260 10.859 0.683 689 HG2 GLU 94 HG2 GLU 94 6.093 11.007 2.926 690 HG3 GLU 94 HG3 GLU 94 4.845 12.176 3.382 691 H ILE 95 H ILE 95 7.622 11.975 -0.429 692 HA ILE 95 HA ILE 95 9.740 13.138 1.303 693 HB ILE 95 HB ILE 95 9.920 10.268 0.353 694 HG12 ILE 95 HG12 ILE 95 9.258 11.228 3.157 695 HG13 ILE 95 HG13 ILE 95 8.200 10.325 2.065 696 HG21 ILE 95 HG21 ILE 95 11.679 11.835 2.281 697 HG22 ILE 95 HG22 ILE 95 11.931 10.158 1.768 698 HG23 ILE 95 HG23 ILE 95 12.101 11.438 0.597 699 HD11 ILE 95 HD11 ILE 95 8.997 8.748 3.597 700 HD12 ILE 95 HD12 ILE 95 9.900 8.446 2.094 701 HD13 ILE 95 HD13 ILE 95 10.675 9.292 3.453 702 H PHE 96 H PHE 96 11.404 13.989 0.204 703 HA PHE 96 HA PHE 96 11.858 13.154 -2.606 704 HB2 PHE 96 HB2 PHE 96 10.893 15.337 -2.800 705 HB3 PHE 96 HB3 PHE 96 11.982 15.991 -1.573 706 HD1 PHE 96 HD1 PHE 96 11.778 14.744 -5.100 707 HD2 PHE 96 HD2 PHE 96 14.309 16.484 -2.058 708 HE1 PHE 96 HE1 PHE 96 13.585 15.056 -6.764 709 HE2 PHE 96 HE2 PHE 96 16.080 16.860 -3.758 710 HZ PHE 96 HZ PHE 96 15.716 16.153 -6.111 711 H GLU 97 H GLU 97 13.902 12.495 -2.998 712 HA GLU 97 HA GLU 97 16.067 13.222 -1.073 713 HB2 GLU 97 HB2 GLU 97 15.636 10.457 -2.215 714 HB3 GLU 97 HB3 GLU 97 17.044 10.969 -1.314 715 HG2 GLU 97 HG2 GLU 97 14.211 10.791 -0.231 716 HG3 GLU 97 HG3 GLU 97 15.504 9.634 0.035 717 H ASP 98 H ASP 98 18.153 13.309 -1.951 718 HA ASP 98 HA ASP 98 18.387 12.837 -4.848 719 HB2 ASP 98 HB2 ASP 98 19.500 14.789 -5.346 720 HB3 ASP 98 HB3 ASP 98 18.055 15.275 -4.496 721 H TRP 99 H TRP 99 19.918 11.447 -5.286 722 HA TRP 99 HA TRP 99 22.167 11.061 -3.333 723 HB2 TRP 99 HB2 TRP 99 21.099 8.833 -5.036 724 HB3 TRP 99 HB3 TRP 99 22.116 8.769 -3.613 725 HD1 TRP 99 HD1 TRP 99 18.651 8.636 -4.824 726 HE1 TRP 99 HE1 TRP 99 16.984 8.084 -2.935 727 HE3 TRP 99 HE3 TRP 99 21.698 9.411 -0.782 728 HZ2 TRP 99 HZ2 TRP 99 17.040 7.704 -0.111 729 HZ3 TRP 99 HZ3 TRP 99 20.845 8.986 1.513 730 HH2 TRP 99 HH2 TRP 99 18.540 8.138 1.872 731 H GLN 100 H GLN 100 23.857 12.068 -4.255 732 HA GLN 100 HA GLN 100 24.042 12.238 -7.194 733 HB2 GLN 100 HB2 GLN 100 25.772 13.565 -5.084 734 HB3 GLN 100 HB3 GLN 100 25.650 13.992 -6.790 735 HG2 GLN 100 HG2 GLN 100 23.465 14.300 -4.668 736 HG3 GLN 100 HG3 GLN 100 24.431 15.583 -5.362 737 HE21 GLN 100 HE22 GLN 100 21.659 15.761 -5.382 738 HE22 GLN 100 HE21 GLN 100 21.137 15.630 -7.068 739 H LEU 101 H LEU 101 25.174 10.799 -8.317 740 HA LEU 101 HA LEU 101 27.488 9.287 -7.127 741 HB2 LEU 101 HB2 LEU 101 25.216 8.235 -8.841 742 HB3 LEU 101 HB3 LEU 101 26.609 7.301 -8.309 743 HG LEU 101 HG LEU 101 24.376 8.364 -6.523 744 HD11 LEU 101 HD11 LEU 101 25.196 5.557 -7.351 745 HD12 LEU 101 HD12 LEU 101 23.880 5.992 -6.224 746 HD13 LEU 101 HD13 LEU 101 23.769 6.465 -7.923 747 HD21 LEU 101 HD21 LEU 101 25.478 7.021 -4.742 748 HD22 LEU 101 HD22 LEU 101 26.850 6.740 -5.846 749 HD23 LEU 101 HD23 LEU 101 26.493 8.371 -5.258 750 H GLU 102 H GLU 102 28.637 8.006 -8.848 751 HA GLU 102 HA GLU 102 29.825 9.737 -10.780 752 HB2 GLU 102 HB2 GLU 102 29.903 6.724 -10.386 753 HB3 GLU 102 HB3 GLU 102 30.982 7.620 -11.433 754 HG2 GLU 102 HG2 GLU 102 32.148 7.036 -9.474 755 HG3 GLU 102 HG3 GLU 102 31.905 8.786 -9.460 756 H ASP 103 H ASP 103 30.059 9.065 -13.062 757 HA ASP 103 HA ASP 103 27.443 8.278 -14.298 758 HB2 ASP 103 HB2 ASP 103 28.208 10.731 -14.368 759 HB3 ASP 103 HB3 ASP 103 29.364 10.207 -15.590 760 HA PRO 104 HA PRO 104 30.374 5.060 -15.533 761 HB2 PRO 104 HB2 PRO 104 27.849 3.602 -16.182 762 HB3 PRO 104 HB3 PRO 104 29.298 3.042 -15.279 763 HG2 PRO 104 HG2 PRO 104 27.056 3.707 -13.942 764 HG3 PRO 104 HG3 PRO 104 28.649 4.318 -13.359 765 HD2 PRO 104 HD2 PRO 104 26.639 5.752 -15.154 766 HD3 PRO 104 HD3 PRO 104 27.370 6.310 -13.621 767 H ASP 105 H ASP 105 28.090 6.586 -17.603 768 HA ASP 105 HA ASP 105 28.197 5.065 -19.962 769 HB2 ASP 105 HB2 ASP 105 26.595 6.832 -19.433 770 HB3 ASP 105 HB3 ASP 105 27.877 8.043 -19.495 771 H GLY 106 H GLY 106 30.073 4.373 -20.856 772 HA2 GLY 106 HA2 GLY 106 31.921 4.544 -22.258 773 HA3 GLY 106 HA3 GLY 106 31.963 6.292 -22.022 774 H GLN 107 H GLN 107 31.854 4.451 -19.082 775 HA GLN 107 HA GLN 107 34.690 5.132 -18.495 776 HB2 GLN 107 HB2 GLN 107 32.554 4.118 -16.605 777 HB3 GLN 107 HB3 GLN 107 34.150 4.730 -16.172 778 HG2 GLN 107 HG2 GLN 107 31.941 6.379 -17.478 779 HG3 GLN 107 HG3 GLN 107 32.207 6.207 -15.752 780 HE21 GLN 107 HE22 GLN 107 32.148 8.602 -16.102 781 HE22 GLN 107 HE21 GLN 107 33.726 9.383 -16.316 782 H SER 108 H SER 108 33.271 2.475 -16.780 783 HA SER 108 HA SER 108 34.433 0.313 -18.345 784 HB2 SER 108 HB2 SER 108 36.049 -0.440 -16.735 785 HB3 SER 108 HB3 SER 108 36.421 1.252 -17.083 786 HG SER 108 HG SER 108 36.470 0.910 -14.853 787 H LEU 109 H LEU 109 33.974 -1.822 -17.274 788 HA LEU 109 HA LEU 109 31.330 -1.921 -16.147 789 HB2 LEU 109 HB2 LEU 109 33.524 -4.033 -16.081 790 HB3 LEU 109 HB3 LEU 109 31.806 -4.305 -15.795 791 HG LEU 109 HG LEU 109 33.086 -3.469 -18.428 792 HD11 LEU 109 HD11 LEU 109 33.440 -5.799 -17.739 793 HD12 LEU 109 HD12 LEU 109 31.687 -6.019 -17.543 794 HD13 LEU 109 HD13 LEU 109 32.370 -5.693 -19.154 795 HD21 LEU 109 HD21 LEU 109 30.145 -3.955 -17.767 796 HD22 LEU 109 HD22 LEU 109 30.875 -2.425 -18.298 797 HD23 LEU 109 HD23 LEU 109 30.821 -3.798 -19.405 798 H GLU 110 H GLU 110 34.516 -2.038 -14.608 799 HA GLU 110 HA GLU 110 33.641 -2.437 -11.910 800 HB2 GLU 110 HB2 GLU 110 35.988 -2.535 -12.722 801 HB3 GLU 110 HB3 GLU 110 35.993 -0.778 -12.911 802 HG2 GLU 110 HG2 GLU 110 35.630 -0.497 -10.485 803 HG3 GLU 110 HG3 GLU 110 35.496 -2.242 -10.280 804 H VAL 111 H VAL 111 33.802 0.608 -13.808 805 HA VAL 111 HA VAL 111 32.861 2.226 -11.567 806 HB VAL 111 HB VAL 111 33.078 2.812 -14.519 807 HG11 VAL 111 HG11 VAL 111 32.297 4.664 -12.227 808 HG12 VAL 111 HG12 VAL 111 32.823 5.213 -13.827 809 HG13 VAL 111 HG13 VAL 111 31.334 4.273 -13.673 810 HG21 VAL 111 HG21 VAL 111 34.681 3.789 -12.106 811 HG22 VAL 111 HG22 VAL 111 35.233 2.553 -13.246 812 HG23 VAL 111 HG23 VAL 111 34.981 4.205 -13.811 813 H PHE 112 H PHE 112 31.172 0.536 -14.274 814 HA PHE 112 HA PHE 112 28.532 1.526 -13.566 815 HB2 PHE 112 HB2 PHE 112 29.599 -0.872 -15.046 816 HB3 PHE 112 HB3 PHE 112 27.945 -0.897 -14.459 817 HD1 PHE 112 HD1 PHE 112 26.213 0.597 -15.303 818 HD2 PHE 112 HD2 PHE 112 30.207 0.607 -16.923 819 HE1 PHE 112 HE1 PHE 112 25.400 1.814 -17.318 820 HE2 PHE 112 HE2 PHE 112 29.402 1.845 -18.911 821 HZ PHE 112 HZ PHE 112 27.013 2.472 -19.094 822 H ARG 113 H ARG 113 30.344 -1.375 -12.482 823 HA ARG 113 HA ARG 113 28.397 -2.313 -10.595 824 HB2 ARG 113 HB2 ARG 113 31.423 -2.611 -10.698 825 HB3 ARG 113 HB3 ARG 113 30.389 -3.493 -9.573 826 HG2 ARG 113 HG2 ARG 113 29.229 -4.623 -11.400 827 HG3 ARG 113 HG3 ARG 113 30.064 -3.660 -12.608 828 HD2 ARG 113 HD2 ARG 113 32.231 -4.553 -11.800 829 HD3 ARG 113 HD3 ARG 113 31.349 -5.619 -10.683 830 HE ARG 113 HE ARG 113 30.237 -6.580 -12.780 831 HH11 ARG 113 HH21 ARG 113 33.599 -5.475 -12.819 832 HH12 ARG 113 HH22 ARG 113 34.025 -6.603 -14.065 833 HH21 ARG 113 HH11 ARG 113 30.904 -8.033 -14.244 834 HH22 ARG 113 HH12 ARG 113 32.532 -8.004 -14.887 835 H THR 114 H THR 114 31.063 0.010 -10.174 836 HA THR 114 HA THR 114 30.749 0.524 -7.375 837 HB THR 114 HB THR 114 31.712 2.347 -9.620 838 HG1 THR 114 HG1 THR 114 33.006 0.558 -9.340 839 HG21 THR 114 HG21 THR 114 31.935 2.683 -6.605 840 HG22 THR 114 HG22 THR 114 32.923 3.560 -7.802 841 HG23 THR 114 HG23 THR 114 31.174 3.798 -7.770 842 H VAL 115 H VAL 115 29.149 2.173 -10.172 843 HA VAL 115 HA VAL 115 27.440 3.784 -8.447 844 HB VAL 115 HB VAL 115 27.331 3.044 -11.388 845 HG11 VAL 115 HG11 VAL 115 25.648 4.841 -11.663 846 HG12 VAL 115 HG12 VAL 115 24.982 3.485 -10.753 847 HG13 VAL 115 HG13 VAL 115 25.485 4.972 -9.893 848 HG21 VAL 115 HG21 VAL 115 27.890 5.503 -11.551 849 HG22 VAL 115 HG22 VAL 115 27.966 5.570 -9.792 850 HG23 VAL 115 HG23 VAL 115 29.126 4.560 -10.702 851 H ARG 116 H ARG 116 26.861 0.698 -10.150 852 HA ARG 116 HA ARG 116 24.189 0.233 -9.496 853 HB2 ARG 116 HB2 ARG 116 25.688 -1.144 -11.000 854 HB3 ARG 116 HB3 ARG 116 26.461 -1.815 -9.565 855 HG2 ARG 116 HG2 ARG 116 24.198 -2.689 -8.855 856 HG3 ARG 116 HG3 ARG 116 23.573 -2.155 -10.429 857 HD2 ARG 116 HD2 ARG 116 24.051 -4.490 -10.626 858 HD3 ARG 116 HD3 ARG 116 25.302 -3.610 -11.524 859 HE ARG 116 HE ARG 116 25.998 -4.258 -8.717 860 HH11 ARG 116 HH12 ARG 116 25.923 -5.758 -11.868 861 HH12 ARG 116 HH11 ARG 116 27.502 -6.491 -11.684 862 HH21 ARG 116 HH21 ARG 116 27.840 -5.517 -8.385 863 HH22 ARG 116 HH22 ARG 116 28.362 -6.590 -9.648 864 H GLY 117 H GLY 117 26.995 -0.699 -7.439 865 HA2 GLY 117 HA2 GLY 117 25.526 -1.857 -5.304 866 HA3 GLY 117 HA3 GLY 117 27.132 -1.138 -5.169 867 H GLN 118 H GLN 118 26.418 1.582 -5.845 868 HA GLN 118 HA GLN 118 25.328 2.437 -3.275 869 HB2 GLN 118 HB2 GLN 118 26.110 4.077 -5.704 870 HB3 GLN 118 HB3 GLN 118 25.670 4.713 -4.110 871 HG2 GLN 118 HG2 GLN 118 27.628 3.754 -3.079 872 HG3 GLN 118 HG3 GLN 118 28.020 2.802 -4.510 873 HE21 GLN 118 HE22 GLN 118 28.814 3.906 -6.433 874 HE22 GLN 118 HE21 GLN 118 29.372 5.586 -6.380 875 H VAL 119 H VAL 119 24.115 2.762 -6.689 876 HA VAL 119 HA VAL 119 21.582 3.875 -6.082 877 HB VAL 119 HB VAL 119 22.239 1.858 -8.278 878 HG11 VAL 119 HG11 VAL 119 20.289 2.906 -9.450 879 HG12 VAL 119 HG12 VAL 119 19.831 1.974 -8.024 880 HG13 VAL 119 HG13 VAL 119 19.892 3.753 -7.934 881 HG21 VAL 119 HG21 VAL 119 23.579 3.978 -8.416 882 HG22 VAL 119 HG22 VAL 119 22.430 3.818 -9.741 883 HG23 VAL 119 HG23 VAL 119 22.056 4.904 -8.384 884 H LYS 120 H LYS 120 22.516 0.402 -6.071 885 HA LYS 120 HA LYS 120 20.026 -0.693 -5.231 886 HB2 LYS 120 HB2 LYS 120 22.018 -1.998 -6.012 887 HB3 LYS 120 HB3 LYS 120 22.868 -1.594 -4.530 888 HG2 LYS 120 HG2 LYS 120 21.052 -2.726 -3.212 889 HG3 LYS 120 HG3 LYS 120 20.272 -3.173 -4.721 890 HD2 LYS 120 HD2 LYS 120 22.445 -4.399 -5.346 891 HD3 LYS 120 HD3 LYS 120 23.015 -4.024 -3.704 892 HE2 LYS 120 HE2 LYS 120 20.838 -5.102 -2.856 893 HE3 LYS 120 HE3 LYS 120 20.579 -5.681 -4.513 894 HZ1 LYS 120 HZ1 LYS 120 22.934 -6.355 -2.795 895 HZ2 LYS 120 HZ2 LYS 120 21.714 -7.373 -3.158 896 HZ3 LYS 120 HZ3 LYS 120 22.738 -6.882 -4.334 897 H GLU 121 H GLU 121 22.817 0.305 -3.119 898 HA GLU 121 HA GLU 121 21.327 -0.274 -0.746 899 HB2 GLU 121 HB2 GLU 121 23.148 0.278 0.457 900 HB3 GLU 121 HB3 GLU 121 23.909 -0.070 -1.089 901 HG2 GLU 121 HG2 GLU 121 23.961 2.414 -1.538 902 HG3 GLU 121 HG3 GLU 121 23.287 2.686 0.064 903 H ARG 122 H ARG 122 21.518 2.807 -2.524 904 HA ARG 122 HA ARG 122 20.106 4.233 -0.412 905 HB2 ARG 122 HB2 ARG 122 20.148 4.829 -3.422 906 HB3 ARG 122 HB3 ARG 122 19.608 5.922 -2.156 907 HG2 ARG 122 HG2 ARG 122 22.440 5.016 -2.725 908 HG3 ARG 122 HG3 ARG 122 21.765 6.633 -2.800 909 HD2 ARG 122 HD2 ARG 122 21.418 6.417 -0.261 910 HD3 ARG 122 HD3 ARG 122 22.447 4.957 -0.377 911 HE ARG 122 HE ARG 122 23.888 6.961 -1.671 912 HH11 ARG 122 HH11 ARG 122 22.737 6.500 1.611 913 HH12 ARG 122 HH12 ARG 122 24.033 7.432 2.297 914 HH21 ARG 122 HH21 ARG 122 25.530 8.148 -0.715 915 HH22 ARG 122 HH22 ARG 122 25.572 8.328 1.007 916 H VAL 123 H VAL 123 18.859 2.504 -3.321 917 HA VAL 123 HA VAL 123 16.123 2.839 -2.564 918 HB VAL 123 HB VAL 123 17.597 0.840 -4.314 919 HG11 VAL 123 HG11 VAL 123 14.601 0.781 -3.814 920 HG12 VAL 123 HG12 VAL 123 15.528 -0.148 -5.038 921 HG13 VAL 123 HG13 VAL 123 15.763 -0.483 -3.331 922 HG21 VAL 123 HG21 VAL 123 17.234 3.115 -5.146 923 HG22 VAL 123 HG22 VAL 123 16.306 1.930 -6.080 924 HG23 VAL 123 HG23 VAL 123 15.483 2.947 -4.875 925 H GLU 124 H GLU 124 18.303 0.051 -1.671 926 HA GLU 124 HA GLU 124 16.266 -1.264 -0.150 927 HB2 GLU 124 HB2 GLU 124 19.262 -1.228 0.335 928 HB3 GLU 124 HB3 GLU 124 18.081 -2.316 1.100 929 HG2 GLU 124 HG2 GLU 124 17.424 -3.174 -1.095 930 HG3 GLU 124 HG3 GLU 124 18.711 -2.237 -1.851 931 H ASN 125 H ASN 125 18.414 1.379 0.824 932 HA ASN 125 HA ASN 125 17.462 1.229 3.509 933 HB2 ASN 125 HB2 ASN 125 19.266 2.472 3.900 934 HB3 ASN 125 HB3 ASN 125 19.558 2.558 2.173 935 HD21 ASN 125 HD22 ASN 125 18.374 4.336 0.969 936 HD22 ASN 125 HD21 ASN 125 18.343 5.885 1.807 937 H LEU 126 H LEU 126 16.208 2.783 0.708 938 HA LEU 126 HA LEU 126 14.361 4.557 2.148 939 HB2 LEU 126 HB2 LEU 126 15.372 5.273 0.055 940 HB3 LEU 126 HB3 LEU 126 14.855 3.794 -0.755 941 HG LEU 126 HG LEU 126 12.482 4.512 -0.468 942 HD11 LEU 126 HD11 LEU 126 13.714 7.180 0.331 943 HD12 LEU 126 HD12 LEU 126 11.986 6.845 0.053 944 HD13 LEU 126 HD13 LEU 126 12.805 6.111 1.421 945 HD21 LEU 126 HD21 LEU 126 12.558 6.100 -2.303 946 HD22 LEU 126 HD22 LEU 126 14.317 6.346 -2.008 947 HD23 LEU 126 HD23 LEU 126 13.696 4.773 -2.556 948 H ILE 127 H ILE 127 14.022 1.495 0.213 949 HA ILE 127 HA ILE 127 11.174 1.471 0.544 950 HB ILE 127 HB ILE 127 11.209 -0.869 -0.094 951 HG12 ILE 127 HG12 ILE 127 14.218 -0.677 0.179 952 HG13 ILE 127 HG13 ILE 127 13.113 -1.833 0.917 953 HG21 ILE 127 HG21 ILE 127 11.323 1.068 -1.724 954 HG22 ILE 127 HG22 ILE 127 13.070 0.808 -1.845 955 HG23 ILE 127 HG23 ILE 127 11.932 -0.455 -2.380 956 HD11 ILE 127 HD11 ILE 127 14.347 -2.937 -0.814 957 HD12 ILE 127 HD12 ILE 127 12.672 -2.757 -1.378 958 HD13 ILE 127 HD13 ILE 127 13.951 -1.679 -1.994 959 H ALA 128 H ALA 128 13.690 0.302 2.738 960 HA ALA 128 HA ALA 128 11.888 -1.135 4.414 961 HB1 ALA 128 HB1 ALA 128 14.567 0.195 5.055 962 HB2 ALA 128 HB2 ALA 128 13.765 -1.047 6.034 963 HB3 ALA 128 HB3 ALA 128 14.344 -1.450 4.406 964 H LYS 129 H LYS 129 12.397 2.314 4.057 965 HA LYS 129 HA LYS 129 11.135 3.039 6.636 966 HB2 LYS 129 HB2 LYS 129 11.954 4.722 4.231 967 HB3 LYS 129 HB3 LYS 129 11.330 5.356 5.749 968 HG2 LYS 129 HG2 LYS 129 13.244 4.511 6.987 969 HG3 LYS 129 HG3 LYS 129 13.892 3.724 5.534 970 HD2 LYS 129 HD2 LYS 129 14.005 5.961 4.409 971 HD3 LYS 129 HD3 LYS 129 13.500 6.733 5.916 972 HE2 LYS 129 HE2 LYS 129 16.018 5.049 5.528 973 HE3 LYS 129 HE3 LYS 129 15.956 6.811 5.463 974 HZ1 LYS 129 HZ1 LYS 129 15.198 6.812 7.799 975 HZ2 LYS 129 HZ2 LYS 129 15.326 5.180 7.881 976 HZ3 LYS 129 HZ3 LYS 129 16.653 6.102 7.659 977 H ILE 130 H ILE 130 10.215 2.852 3.223 978 HA ILE 130 HA ILE 130 7.528 3.952 3.868 979 HB ILE 130 HB ILE 130 7.348 4.515 1.501 980 HG12 ILE 130 HG12 ILE 130 10.262 4.198 0.956 981 HG13 ILE 130 HG13 ILE 130 9.348 2.681 1.005 982 HG21 ILE 130 HG21 ILE 130 9.843 5.650 2.823 983 HG22 ILE 130 HG22 ILE 130 8.830 6.415 1.577 984 HG23 ILE 130 HG23 ILE 130 8.169 6.122 3.187 985 HD11 ILE 130 HD11 ILE 130 8.675 5.073 -0.737 986 HD12 ILE 130 HD12 ILE 130 9.469 3.566 -1.235 987 HD13 ILE 130 HD13 ILE 130 7.782 3.534 -0.685 988 H SER 131 H SER 131 8.603 0.849 3.527 989 HA SER 131 HA SER 131 6.659 -0.396 1.887 990 HB2 SER 131 HB2 SER 131 7.059 -2.395 3.316 991 HB3 SER 131 HB3 SER 131 8.542 -1.636 2.710 992 HG SER 131 HG SER 131 7.422 -1.016 5.250 Start of MODEL 20 1 H MET 1 H1 MET 1 2.429 0.080 1.648 2 HA MET 1 HA MET 1 3.260 -0.282 -0.441 3 HB2 MET 1 HB2 MET 1 1.541 -1.766 -1.310 4 HB3 MET 1 HB3 MET 1 0.377 -0.443 -1.436 5 HG2 MET 1 HG2 MET 1 1.736 0.652 -3.148 6 HG3 MET 1 HG3 MET 1 3.022 -0.531 -2.946 7 HE1 MET 1 HE1 MET 1 1.824 -3.649 -4.823 8 HE2 MET 1 HE2 MET 1 3.204 -2.764 -4.154 9 HE3 MET 1 HE3 MET 1 1.923 -3.374 -3.072 10 H LYS 2 H LYS 2 4.249 1.505 -1.033 11 HA LYS 2 HA LYS 2 2.684 3.923 -1.866 12 HB2 LYS 2 HB2 LYS 2 5.197 3.862 -0.143 13 HB3 LYS 2 HB3 LYS 2 4.607 5.303 -0.958 14 HG2 LYS 2 HG2 LYS 2 2.439 5.126 0.226 15 HG3 LYS 2 HG3 LYS 2 3.034 3.702 1.104 16 HD2 LYS 2 HD2 LYS 2 4.799 5.049 2.161 17 HD3 LYS 2 HD3 LYS 2 4.268 6.487 1.259 18 HE2 LYS 2 HE2 LYS 2 2.050 6.372 2.321 19 HE3 LYS 2 HE3 LYS 2 2.497 4.888 3.177 20 HZ1 LYS 2 HZ1 LYS 2 3.852 7.521 3.549 21 HZ2 LYS 2 HZ2 LYS 2 2.719 6.909 4.569 22 HZ3 LYS 2 HZ3 LYS 2 4.161 6.157 4.413 23 H LYS 3 H LYS 3 3.972 5.335 -3.341 24 HA LYS 3 HA LYS 3 5.423 3.587 -5.295 25 HB2 LYS 3 HB2 LYS 3 3.809 6.105 -5.887 26 HB3 LYS 3 HB3 LYS 3 4.662 5.125 -7.054 27 HG2 LYS 3 HG2 LYS 3 2.562 4.275 -7.333 28 HG3 LYS 3 HG3 LYS 3 3.247 3.128 -6.191 29 HD2 LYS 3 HD2 LYS 3 0.945 3.625 -5.585 30 HD3 LYS 3 HD3 LYS 3 2.013 4.237 -4.331 31 HE2 LYS 3 HE2 LYS 3 1.928 6.446 -5.832 32 HE3 LYS 3 HE3 LYS 3 0.432 5.740 -6.429 33 HZ1 LYS 3 HZ1 LYS 3 1.114 6.402 -3.607 34 HZ2 LYS 3 HZ2 LYS 3 0.034 7.200 -4.541 35 HZ3 LYS 3 HZ3 LYS 3 -0.312 5.671 -4.048 36 H VAL 4 H VAL 4 7.245 4.184 -6.277 37 HA VAL 4 HA VAL 4 8.632 6.660 -5.300 38 HB VAL 4 HB VAL 4 10.110 4.069 -5.740 39 HG11 VAL 4 HG11 VAL 4 10.970 6.703 -4.500 40 HG12 VAL 4 HG12 VAL 4 11.944 5.220 -4.627 41 HG13 VAL 4 HG13 VAL 4 11.480 6.069 -6.083 42 HG21 VAL 4 HG21 VAL 4 8.726 3.721 -3.778 43 HG22 VAL 4 HG22 VAL 4 10.399 3.982 -3.285 44 HG23 VAL 4 HG23 VAL 4 9.214 5.288 -3.110 45 H MET 5 H MET 5 9.740 7.843 -6.785 46 HA MET 5 HA MET 5 9.826 6.839 -9.592 47 HB2 MET 5 HB2 MET 5 7.850 8.147 -9.536 48 HB3 MET 5 HB3 MET 5 8.626 9.428 -8.598 49 HG2 MET 5 HG2 MET 5 8.331 10.110 -10.903 50 HG3 MET 5 HG3 MET 5 10.032 10.035 -10.480 51 HE1 MET 5 HE1 MET 5 8.210 8.486 -14.189 52 HE2 MET 5 HE2 MET 5 7.157 8.630 -12.770 53 HE3 MET 5 HE3 MET 5 8.117 10.022 -13.320 54 H PHE 6 H PHE 6 11.624 7.221 -10.616 55 HA PHE 6 HA PHE 6 13.792 8.732 -9.209 56 HB2 PHE 6 HB2 PHE 6 14.073 6.554 -11.300 57 HB3 PHE 6 HB3 PHE 6 15.336 7.240 -10.284 58 HD1 PHE 6 HD2 PHE 6 15.274 6.805 -7.753 59 HD2 PHE 6 HD1 PHE 6 12.787 4.701 -10.570 60 HE1 PHE 6 HE2 PHE 6 14.677 5.158 -5.989 61 HE2 PHE 6 HE1 PHE 6 12.207 3.050 -8.811 62 HZ PHE 6 HZ PHE 6 13.097 3.315 -6.497 63 H VAL 7 H VAL 7 14.764 10.443 -10.121 64 HA VAL 7 HA VAL 7 14.341 11.094 -13.014 65 HB VAL 7 HB VAL 7 14.276 12.836 -10.565 66 HG11 VAL 7 HG11 VAL 7 16.184 13.889 -11.682 67 HG12 VAL 7 HG12 VAL 7 15.345 13.820 -13.262 68 HG13 VAL 7 HG13 VAL 7 14.745 14.853 -11.949 69 HG21 VAL 7 HG21 VAL 7 12.970 13.035 -13.313 70 HG22 VAL 7 HG22 VAL 7 12.256 12.220 -11.882 71 HG23 VAL 7 HG23 VAL 7 12.565 13.948 -11.837 72 H CYS 8 H CYS 8 16.096 10.736 -14.234 73 HA CYS 8 HA CYS 8 18.794 11.478 -13.123 74 HB2 CYS 8 HB2 CYS 8 18.607 9.098 -13.385 75 HB3 CYS 8 HB3 CYS 8 18.024 9.246 -15.049 76 HG CYS 8 HG CYS 8 20.528 8.286 -14.935 77 H LYS 9 H LYS 9 20.356 12.104 -15.052 78 HA LYS 9 HA LYS 9 19.186 14.523 -16.049 79 HB2 LYS 9 HB2 LYS 9 21.645 14.006 -15.377 80 HB3 LYS 9 HB3 LYS 9 21.847 13.454 -17.045 81 HG2 LYS 9 HG2 LYS 9 20.923 15.769 -17.752 82 HG3 LYS 9 HG3 LYS 9 20.967 16.200 -16.038 83 HD2 LYS 9 HD2 LYS 9 22.919 17.108 -17.035 84 HD3 LYS 9 HD3 LYS 9 23.454 15.744 -16.042 85 HE2 LYS 9 HE2 LYS 9 23.657 14.324 -18.076 86 HE3 LYS 9 HE3 LYS 9 22.984 15.622 -19.067 87 HZ1 LYS 9 HZ1 LYS 9 25.418 15.589 -19.193 88 HZ2 LYS 9 HZ2 LYS 9 24.929 16.987 -18.519 89 HZ3 LYS 9 HZ3 LYS 9 25.567 15.810 -17.582 90 H ARG 10 H ARG 10 20.134 11.629 -17.882 91 HA ARG 10 HA ARG 10 18.202 12.440 -20.027 92 HB2 ARG 10 HB2 ARG 10 19.509 11.840 -21.815 93 HB3 ARG 10 HB3 ARG 10 20.475 12.883 -20.803 94 HG2 ARG 10 HG2 ARG 10 20.785 9.862 -21.105 95 HG3 ARG 10 HG3 ARG 10 21.777 11.120 -21.843 96 HD2 ARG 10 HD2 ARG 10 22.326 11.884 -19.450 97 HD3 ARG 10 HD3 ARG 10 21.657 10.307 -18.943 98 HE ARG 10 HE ARG 10 23.654 10.001 -21.022 99 HH11 ARG 10 HH11 ARG 10 23.415 10.587 -17.564 100 HH12 ARG 10 HH12 ARG 10 25.045 10.033 -17.270 101 HH21 ARG 10 HH21 ARG 10 25.764 9.189 -20.487 102 HH22 ARG 10 HH22 ARG 10 26.318 9.478 -18.843 103 H ASN 11 H ASN 11 17.971 10.669 -17.742 104 HA ASN 11 HA ASN 11 17.396 8.576 -17.039 105 HB2 ASN 11 HB2 ASN 11 15.426 9.860 -17.665 106 HB3 ASN 11 HB3 ASN 11 15.405 9.137 -19.255 107 HD21 ASN 11 HD22 ASN 11 15.825 7.554 -15.902 108 HD22 ASN 11 HD21 ASN 11 14.420 6.587 -16.162 109 H SER 12 H SER 12 19.604 8.227 -18.734 110 HA SER 12 HA SER 12 19.152 5.626 -20.044 111 HB2 SER 12 HB2 SER 12 21.576 6.011 -20.675 112 HB3 SER 12 HB3 SER 12 20.475 7.303 -21.200 113 HG SER 12 HG SER 12 22.457 7.996 -20.015 114 H CYS 13 H CYS 13 21.003 6.992 -17.344 115 HA CYS 13 HA CYS 13 21.673 4.252 -16.348 116 HB2 CYS 13 HB2 CYS 13 23.797 5.306 -15.610 117 HB3 CYS 13 HB3 CYS 13 23.515 5.615 -17.332 118 HG CYS 13 HG CYS 13 24.559 7.774 -16.210 119 H ARG 14 H ARG 14 22.309 4.339 -13.941 120 HA ARG 14 HA ARG 14 21.619 4.360 -11.768 121 HB2 ARG 14 HB2 ARG 14 21.325 7.341 -12.380 122 HB3 ARG 14 HB3 ARG 14 21.361 6.636 -10.751 123 HG2 ARG 14 HG2 ARG 14 23.585 5.631 -11.279 124 HG3 ARG 14 HG3 ARG 14 23.598 6.522 -12.807 125 HD2 ARG 14 HD2 ARG 14 23.407 7.781 -10.031 126 HD3 ARG 14 HD3 ARG 14 24.894 7.644 -10.966 127 HE ARG 14 HE ARG 14 22.691 9.560 -11.372 128 HH11 ARG 14 HH21 ARG 14 25.743 8.468 -12.722 129 HH12 ARG 14 HH22 ARG 14 25.464 9.353 -14.224 130 HH21 ARG 14 HH11 ARG 14 22.689 10.967 -12.996 131 HH22 ARG 14 HH12 ARG 14 23.972 10.964 -14.203 132 H SER 15 H SER 15 19.194 6.705 -12.812 133 HA SER 15 HA SER 15 16.986 5.878 -11.312 134 HB2 SER 15 HB2 SER 15 15.617 6.888 -13.160 135 HB3 SER 15 HB3 SER 15 16.994 7.876 -12.717 136 HG SER 15 HG SER 15 18.147 6.891 -14.605 137 H GLN 16 H GLN 16 17.945 4.547 -14.457 138 HA GLN 16 HA GLN 16 15.733 2.665 -14.651 139 HB2 GLN 16 HB2 GLN 16 18.455 2.745 -16.034 140 HB3 GLN 16 HB3 GLN 16 17.111 1.725 -16.538 141 HG2 GLN 16 HG2 GLN 16 16.932 4.791 -16.457 142 HG3 GLN 16 HG3 GLN 16 17.458 3.875 -17.852 143 HE21 GLN 16 HE22 GLN 16 15.510 5.275 -18.618 144 HE22 GLN 16 HE21 GLN 16 13.968 4.392 -18.629 145 H MET 17 H MET 17 19.012 2.334 -13.268 146 HA MET 17 HA MET 17 18.734 -0.507 -12.583 147 HB2 MET 17 HB2 MET 17 20.553 1.690 -11.484 148 HB3 MET 17 HB3 MET 17 20.631 -0.002 -11.013 149 HG2 MET 17 HG2 MET 17 21.235 -0.660 -13.296 150 HG3 MET 17 HG3 MET 17 21.154 1.027 -13.822 151 HE1 MET 17 HE1 MET 17 23.545 -1.383 -13.660 152 HE2 MET 17 HE2 MET 17 23.825 0.088 -14.636 153 HE3 MET 17 HE3 MET 17 25.002 -0.404 -13.390 154 H ALA 18 H ALA 18 17.974 2.592 -10.964 155 HA ALA 18 HA ALA 18 17.391 1.492 -8.389 156 HB1 ALA 18 HB1 ALA 18 16.370 3.621 -7.939 157 HB2 ALA 18 HB2 ALA 18 17.769 3.931 -8.975 158 HB3 ALA 18 HB3 ALA 18 16.133 3.960 -9.665 159 H GLU 19 H GLU 19 15.225 2.093 -11.206 160 HA GLU 19 HA GLU 19 12.925 0.808 -10.069 161 HB2 GLU 19 HB2 GLU 19 12.954 2.217 -12.134 162 HB3 GLU 19 HB3 GLU 19 13.719 0.877 -13.005 163 HG2 GLU 19 HG2 GLU 19 11.742 -0.569 -12.362 164 HG3 GLU 19 HG3 GLU 19 11.006 0.835 -11.610 165 H GLY 20 H GLY 20 15.704 -0.599 -11.868 166 HA2 GLY 20 HA2 GLY 20 14.913 -3.292 -11.983 167 HA3 GLY 20 HA3 GLY 20 16.576 -2.716 -11.838 168 H PHE 21 H PHE 21 16.805 -1.767 -9.287 169 HA PHE 21 HA PHE 21 16.647 -4.202 -7.690 170 HB2 PHE 21 HB2 PHE 21 17.389 -1.332 -6.986 171 HB3 PHE 21 HB3 PHE 21 17.464 -2.671 -5.841 172 HD1 PHE 21 HD2 PHE 21 18.687 -4.866 -6.716 173 HD2 PHE 21 HD1 PHE 21 19.360 -0.880 -8.228 174 HE1 PHE 21 HE2 PHE 21 20.842 -5.603 -7.684 175 HE2 PHE 21 HE1 PHE 21 21.531 -1.608 -9.163 176 HZ PHE 21 HZ PHE 21 22.270 -3.994 -8.891 177 H ALA 22 H ALA 22 14.738 -1.167 -7.634 178 HA ALA 22 HA ALA 22 13.168 -1.980 -5.386 179 HB1 ALA 22 HB1 ALA 22 11.760 -0.083 -6.006 180 HB2 ALA 22 HB2 ALA 22 13.468 0.350 -6.163 181 HB3 ALA 22 HB3 ALA 22 12.541 -0.023 -7.622 182 H LYS 23 H LYS 23 12.491 -2.513 -8.911 183 HA LYS 23 HA LYS 23 9.881 -3.648 -8.459 184 HB2 LYS 23 HB2 LYS 23 9.930 -4.370 -10.721 185 HB3 LYS 23 HB3 LYS 23 10.744 -2.803 -10.634 186 HG2 LYS 23 HG2 LYS 23 12.931 -4.092 -10.614 187 HG3 LYS 23 HG3 LYS 23 12.031 -5.549 -10.995 188 HD2 LYS 23 HD2 LYS 23 11.887 -3.015 -12.690 189 HD3 LYS 23 HD3 LYS 23 13.156 -4.195 -12.935 190 HE2 LYS 23 HE2 LYS 23 10.230 -5.017 -13.045 191 HE3 LYS 23 HE3 LYS 23 11.056 -4.304 -14.437 192 HZ1 LYS 23 HZ1 LYS 23 12.691 -6.104 -14.383 193 HZ2 LYS 23 HZ2 LYS 23 11.952 -6.804 -13.079 194 HZ3 LYS 23 HZ3 LYS 23 11.181 -6.722 -14.511 195 H THR 24 H THR 24 13.019 -5.034 -8.245 196 HA THR 24 HA THR 24 12.102 -7.813 -7.932 197 HB THR 24 HB THR 24 14.850 -6.674 -7.376 198 HG1 THR 24 HG1 THR 24 14.612 -6.213 -9.463 199 HG21 THR 24 HG21 THR 24 14.519 -9.005 -6.570 200 HG22 THR 24 HG22 THR 24 13.920 -9.467 -8.182 201 HG23 THR 24 HG23 THR 24 15.606 -8.957 -7.956 202 H LEU 25 H LEU 25 13.703 -5.459 -5.715 203 HA LEU 25 HA LEU 25 13.421 -7.268 -3.416 204 HB2 LEU 25 HB2 LEU 25 14.516 -4.417 -3.596 205 HB3 LEU 25 HB3 LEU 25 14.767 -5.525 -2.260 206 HG LEU 25 HG LEU 25 15.815 -5.933 -5.109 207 HD11 LEU 25 HD11 LEU 25 16.833 -4.063 -3.724 208 HD12 LEU 25 HD12 LEU 25 17.337 -5.328 -2.579 209 HD13 LEU 25 HD13 LEU 25 17.949 -5.348 -4.250 210 HD21 LEU 25 HD21 LEU 25 15.466 -8.110 -4.037 211 HD22 LEU 25 HD22 LEU 25 17.193 -7.730 -4.086 212 HD23 LEU 25 HD23 LEU 25 16.289 -7.542 -2.568 213 H GLY 26 H GLY 26 11.674 -4.535 -4.678 214 HA2 GLY 26 HA2 GLY 26 9.977 -4.260 -2.256 215 HA3 GLY 26 HA3 GLY 26 10.095 -3.181 -3.648 216 H ALA 27 H ALA 27 9.918 -6.397 -4.776 217 HA ALA 27 HA ALA 27 7.501 -6.117 -6.127 218 HB1 ALA 27 HB1 ALA 27 8.803 -8.682 -5.101 219 HB2 ALA 27 HB2 ALA 27 7.608 -8.570 -6.410 220 HB3 ALA 27 HB3 ALA 27 9.204 -7.840 -6.605 221 H GLY 28 H GLY 28 5.543 -5.604 -5.251 222 HA2 GLY 28 HA2 GLY 28 3.479 -6.227 -4.304 223 HA3 GLY 28 HA3 GLY 28 4.264 -7.478 -3.336 224 H LYS 29 H LYS 29 6.310 -5.169 -2.672 225 HA LYS 29 HA LYS 29 4.883 -3.939 -0.363 226 HB2 LYS 29 HB2 LYS 29 7.784 -3.941 -1.297 227 HB3 LYS 29 HB3 LYS 29 7.201 -2.944 0.019 228 HG2 LYS 29 HG2 LYS 29 7.045 -4.638 1.492 229 HG3 LYS 29 HG3 LYS 29 6.400 -5.770 0.300 230 HD2 LYS 29 HD2 LYS 29 8.450 -6.681 0.981 231 HD3 LYS 29 HD3 LYS 29 8.731 -6.030 -0.637 232 HE2 LYS 29 HE2 LYS 29 9.784 -3.992 0.395 233 HE3 LYS 29 HE3 LYS 29 9.473 -4.661 1.996 234 HZ1 LYS 29 HZ1 LYS 29 11.255 -5.927 -0.059 235 HZ2 LYS 29 HZ2 LYS 29 11.749 -5.181 1.321 236 HZ3 LYS 29 HZ3 LYS 29 10.909 -6.572 1.406 237 H ILE 30 H ILE 30 6.412 -3.006 -3.446 238 HA ILE 30 HA ILE 30 5.063 -0.357 -3.304 239 HB ILE 30 HB ILE 30 7.135 0.804 -3.924 240 HG12 ILE 30 HG12 ILE 30 9.329 -0.136 -3.632 241 HG13 ILE 30 HG13 ILE 30 8.665 -1.721 -3.263 242 HG21 ILE 30 HG21 ILE 30 8.251 0.727 -1.774 243 HG22 ILE 30 HG22 ILE 30 6.496 0.645 -1.536 244 HG23 ILE 30 HG23 ILE 30 7.514 -0.815 -1.368 245 HD11 ILE 30 HD11 ILE 30 9.710 -1.341 -5.566 246 HD12 ILE 30 HD12 ILE 30 8.121 -2.110 -5.560 247 HD13 ILE 30 HD13 ILE 30 8.288 -0.374 -5.963 248 H ALA 31 H ALA 31 5.458 0.943 -5.335 249 HA ALA 31 HA ALA 31 5.778 -0.711 -7.770 250 HB1 ALA 31 HB1 ALA 31 3.919 0.457 -8.885 251 HB2 ALA 31 HB2 ALA 31 3.349 -0.447 -7.465 252 HB3 ALA 31 HB3 ALA 31 3.538 1.314 -7.385 253 H VAL 32 H VAL 32 6.923 0.395 -9.467 254 HA VAL 32 HA VAL 32 8.062 3.038 -8.742 255 HB VAL 32 HB VAL 32 10.209 1.860 -9.688 256 HG11 VAL 32 HG11 VAL 32 9.221 1.605 -6.825 257 HG12 VAL 32 HG12 VAL 32 10.918 1.550 -7.354 258 HG13 VAL 32 HG13 VAL 32 9.986 3.017 -7.587 259 HG21 VAL 32 HG21 VAL 32 8.977 -0.531 -8.297 260 HG22 VAL 32 HG22 VAL 32 9.205 -0.379 -10.057 261 HG23 VAL 32 HG23 VAL 32 10.606 -0.385 -8.982 262 H THR 33 H THR 33 8.912 4.293 -10.239 263 HA THR 33 HA THR 33 8.752 3.521 -13.110 264 HB THR 33 HB THR 33 7.730 6.181 -12.045 265 HG1 THR 33 HG1 THR 33 6.195 4.711 -11.448 266 HG21 THR 33 HG21 THR 33 7.435 4.843 -14.777 267 HG22 THR 33 HG22 THR 33 6.723 6.397 -14.284 268 HG23 THR 33 HG23 THR 33 8.481 6.240 -14.416 269 H SER 34 H SER 34 10.425 4.364 -14.338 270 HA SER 34 HA SER 34 12.359 6.236 -13.054 271 HB2 SER 34 HB2 SER 34 13.199 3.996 -13.564 272 HB3 SER 34 HB3 SER 34 12.735 4.201 -15.274 273 HG SER 34 HG SER 34 14.982 4.765 -14.695 274 H CYS 35 H CYS 35 12.876 8.128 -13.995 275 HA CYS 35 HA CYS 35 12.194 8.763 -16.776 276 HB2 CYS 35 HB2 CYS 35 10.731 10.536 -16.319 277 HB3 CYS 35 HB3 CYS 35 10.142 9.163 -15.364 278 HG CYS 35 HG CYS 35 11.472 9.927 -13.153 279 H GLY 36 H GLY 36 12.756 11.284 -17.063 280 HA2 GLY 36 HA2 GLY 36 14.864 12.249 -15.243 281 HA3 GLY 36 HA3 GLY 36 15.406 11.915 -16.901 282 H LEU 37 H LEU 37 15.693 14.479 -16.018 283 HA LEU 37 HA LEU 37 13.367 16.066 -16.700 284 HB2 LEU 37 HB2 LEU 37 14.878 17.990 -16.881 285 HB3 LEU 37 HB3 LEU 37 14.755 17.220 -15.325 286 HG LEU 37 HG LEU 37 17.055 16.379 -17.110 287 HD11 LEU 37 HD11 LEU 37 18.426 18.253 -16.268 288 HD12 LEU 37 HD12 LEU 37 17.077 18.857 -17.239 289 HD13 LEU 37 HD13 LEU 37 17.002 18.952 -15.462 290 HD21 LEU 37 HD21 LEU 37 16.721 16.873 -14.116 291 HD22 LEU 37 HD22 LEU 37 16.755 15.288 -14.897 292 HD23 LEU 37 HD23 LEU 37 18.213 16.296 -14.889 293 H GLU 38 H GLU 38 15.445 14.302 -18.581 294 HA GLU 38 HA GLU 38 13.947 14.868 -20.958 295 HB2 GLU 38 HB2 GLU 38 15.806 15.327 -22.481 296 HB3 GLU 38 HB3 GLU 38 15.547 16.632 -21.337 297 HG2 GLU 38 HG2 GLU 38 17.481 15.940 -20.020 298 HG3 GLU 38 HG3 GLU 38 17.730 14.531 -21.071 299 H SER 39 H SER 39 14.606 13.272 -22.722 300 HA SER 39 HA SER 39 15.452 10.677 -21.497 301 HB2 SER 39 HB2 SER 39 13.885 9.656 -23.136 302 HB3 SER 39 HB3 SER 39 13.092 10.690 -21.932 303 HG SER 39 HG SER 39 12.416 11.010 -24.205 304 H SER 40 H SER 40 16.388 9.127 -22.871 305 HA SER 40 HA SER 40 17.318 9.917 -25.558 306 HB2 SER 40 HB2 SER 40 19.206 10.635 -24.227 307 HB3 SER 40 HB3 SER 40 19.240 9.105 -23.353 308 HG SER 40 HG SER 40 19.834 9.580 -26.108 309 H ARG 41 H ARG 41 18.422 7.252 -23.517 310 HA ARG 41 HA ARG 41 16.457 5.285 -24.237 311 HB2 ARG 41 HB2 ARG 41 18.210 3.739 -25.374 312 HB3 ARG 41 HB3 ARG 41 17.422 4.962 -26.333 313 HG2 ARG 41 HG2 ARG 41 19.777 4.710 -26.889 314 HG3 ARG 41 HG3 ARG 41 19.388 6.352 -26.403 315 HD2 ARG 41 HD2 ARG 41 20.559 6.120 -24.319 316 HD3 ARG 41 HD3 ARG 41 20.589 4.362 -24.459 317 HE ARG 41 HE ARG 41 22.369 4.425 -25.935 318 HH11 ARG 41 HH21 ARG 41 21.391 7.797 -25.472 319 HH12 ARG 41 HH22 ARG 41 22.919 8.367 -26.076 320 HH21 ARG 41 HH11 ARG 41 24.239 5.271 -26.716 321 HH22 ARG 41 HH12 ARG 41 24.457 6.989 -26.795 322 H VAL 42 H VAL 42 16.939 3.191 -23.043 323 HA VAL 42 HA VAL 42 18.439 3.628 -20.575 324 HB VAL 42 HB VAL 42 17.795 0.864 -21.706 325 HG11 VAL 42 HG11 VAL 42 18.394 1.925 -18.893 326 HG12 VAL 42 HG12 VAL 42 17.867 0.278 -19.272 327 HG13 VAL 42 HG13 VAL 42 19.428 0.845 -19.854 328 HG21 VAL 42 HG21 VAL 42 15.898 0.941 -20.124 329 HG22 VAL 42 HG22 VAL 42 16.125 2.708 -19.978 330 HG23 VAL 42 HG23 VAL 42 15.709 1.973 -21.550 331 H HIS 43 H HIS 43 20.614 3.192 -20.091 332 HA HIS 43 HA HIS 43 22.458 2.979 -22.326 333 HB2 HIS 43 HB2 HIS 43 22.868 4.088 -20.034 334 HB3 HIS 43 HB3 HIS 43 23.123 2.467 -19.396 335 HD2 HIS 43 HD2 HIS 43 24.774 5.244 -21.313 336 HE1 HIS 43 HE1 HIS 43 27.472 1.974 -21.668 337 HE2 HIS 43 HE2 HIS 43 27.142 4.481 -22.090 338 HA PRO 44 HA PRO 44 21.580 -1.255 -22.676 339 HB2 PRO 44 HB2 PRO 44 23.395 -2.147 -24.554 340 HB3 PRO 44 HB3 PRO 44 22.059 -1.010 -24.927 341 HG2 PRO 44 HG2 PRO 44 24.948 -0.319 -24.288 342 HG3 PRO 44 HG3 PRO 44 23.962 0.231 -25.683 343 HD2 PRO 44 HD2 PRO 44 24.230 1.738 -23.431 344 HD3 PRO 44 HD3 PRO 44 22.671 1.673 -24.319 345 H THR 45 H THR 45 24.889 -0.299 -21.728 346 HA THR 45 HA THR 45 25.706 -2.888 -20.718 347 HB THR 45 HB THR 45 26.676 -0.125 -19.922 348 HG1 THR 45 HG1 THR 45 28.298 -0.609 -21.493 349 HG21 THR 45 HG21 THR 45 28.809 -1.389 -19.430 350 HG22 THR 45 HG22 THR 45 27.489 -1.758 -18.325 351 HG23 THR 45 HG23 THR 45 27.893 -2.907 -19.624 352 H ALA 46 H ALA 46 23.598 -0.354 -19.394 353 HA ALA 46 HA ALA 46 23.724 -1.225 -16.662 354 HB1 ALA 46 HB1 ALA 46 21.373 0.016 -18.149 355 HB2 ALA 46 HB2 ALA 46 21.643 0.013 -16.396 356 HB3 ALA 46 HB3 ALA 46 22.735 0.936 -17.453 357 H ILE 47 H ILE 47 21.717 -2.337 -19.426 358 HA ILE 47 HA ILE 47 20.118 -4.257 -18.010 359 HB ILE 47 HB ILE 47 21.155 -4.237 -20.877 360 HG12 ILE 47 HG12 ILE 47 18.825 -3.857 -21.511 361 HG13 ILE 47 HG13 ILE 47 18.323 -3.890 -19.827 362 HG21 ILE 47 HG21 ILE 47 19.251 -6.233 -19.582 363 HG22 ILE 47 HG22 ILE 47 19.496 -6.057 -21.333 364 HG23 ILE 47 HG23 ILE 47 20.827 -6.581 -20.322 365 HD11 ILE 47 HD11 ILE 47 18.402 -1.626 -20.857 366 HD12 ILE 47 HD12 ILE 47 19.426 -1.749 -19.419 367 HD13 ILE 47 HD13 ILE 47 20.156 -1.783 -21.041 368 H ALA 48 H ALA 48 23.390 -4.535 -19.455 369 HA ALA 48 HA ALA 48 23.734 -7.313 -18.776 370 HB1 ALA 48 HB1 ALA 48 26.084 -6.934 -19.293 371 HB2 ALA 48 HB2 ALA 48 25.054 -6.158 -20.511 372 HB3 ALA 48 HB3 ALA 48 25.847 -5.177 -19.254 373 H MET 49 H MET 49 24.648 -4.316 -17.079 374 HA MET 49 HA MET 49 25.965 -5.616 -14.867 375 HB2 MET 49 HB2 MET 49 24.830 -2.829 -15.258 376 HB3 MET 49 HB3 MET 49 25.769 -3.301 -13.833 377 HG2 MET 49 HG2 MET 49 26.889 -3.723 -16.622 378 HG3 MET 49 HG3 MET 49 26.937 -2.154 -15.840 379 HE1 MET 49 HE1 MET 49 27.968 -6.002 -15.305 380 HE2 MET 49 HE2 MET 49 28.940 -5.205 -16.554 381 HE3 MET 49 HE3 MET 49 29.694 -5.700 -15.022 382 H MET 50 H MET 50 22.566 -4.890 -15.424 383 HA MET 50 HA MET 50 21.816 -5.659 -12.679 384 HB2 MET 50 HB2 MET 50 20.178 -5.204 -15.206 385 HB3 MET 50 HB3 MET 50 19.503 -5.582 -13.625 386 HG2 MET 50 HG2 MET 50 21.084 -3.095 -14.373 387 HG3 MET 50 HG3 MET 50 19.370 -3.195 -14.004 388 HE1 MET 50 HE1 MET 50 19.840 -5.226 -11.140 389 HE2 MET 50 HE2 MET 50 19.312 -3.824 -10.184 390 HE3 MET 50 HE3 MET 50 18.543 -4.158 -11.745 391 H GLU 51 H GLU 51 22.046 -7.296 -15.889 392 HA GLU 51 HA GLU 51 20.898 -9.757 -14.948 393 HB2 GLU 51 HB2 GLU 51 22.735 -9.099 -17.280 394 HB3 GLU 51 HB3 GLU 51 22.201 -10.743 -16.916 395 HG2 GLU 51 HG2 GLU 51 19.831 -10.019 -17.045 396 HG3 GLU 51 HG3 GLU 51 20.349 -8.419 -17.553 397 H GLU 52 H GLU 52 24.220 -8.493 -14.644 398 HA GLU 52 HA GLU 52 25.559 -10.845 -13.758 399 HB2 GLU 52 HB2 GLU 52 25.750 -7.971 -12.771 400 HB3 GLU 52 HB3 GLU 52 26.867 -9.238 -12.273 401 HG2 GLU 52 HG2 GLU 52 26.508 -8.224 -15.094 402 HG3 GLU 52 HG3 GLU 52 27.790 -7.793 -13.979 403 H VAL 53 H VAL 53 23.164 -8.904 -12.105 404 HA VAL 53 HA VAL 53 23.413 -10.491 -9.599 405 HB VAL 53 HB VAL 53 24.008 -8.244 -9.244 406 HG11 VAL 53 HG11 VAL 53 22.520 -6.319 -9.570 407 HG12 VAL 53 HG12 VAL 53 22.987 -7.079 -11.091 408 HG13 VAL 53 HG13 VAL 53 21.355 -7.366 -10.410 409 HG21 VAL 53 HG21 VAL 53 21.242 -8.412 -8.054 410 HG22 VAL 53 HG22 VAL 53 22.639 -9.345 -7.463 411 HG23 VAL 53 HG23 VAL 53 22.669 -7.576 -7.431 412 H GLY 54 H GLY 54 21.920 -10.919 -12.265 413 HA2 GLY 54 HA2 GLY 54 20.197 -12.283 -12.815 414 HA3 GLY 54 HA3 GLY 54 19.856 -12.502 -11.096 415 H ILE 55 H ILE 55 19.724 -9.266 -12.460 416 HA ILE 55 HA ILE 55 16.736 -9.246 -12.214 417 HB ILE 55 HB ILE 55 18.813 -7.114 -11.653 418 HG12 ILE 55 HG12 ILE 55 16.763 -8.517 -9.890 419 HG13 ILE 55 HG13 ILE 55 18.501 -8.791 -9.869 420 HG21 ILE 55 HG21 ILE 55 15.766 -6.850 -11.634 421 HG22 ILE 55 HG22 ILE 55 16.913 -5.629 -11.069 422 HG23 ILE 55 HG23 ILE 55 16.870 -6.040 -12.771 423 HD11 ILE 55 HD11 ILE 55 18.848 -6.416 -9.153 424 HD12 ILE 55 HD12 ILE 55 17.081 -6.268 -8.955 425 HD13 ILE 55 HD13 ILE 55 17.980 -7.437 -7.986 426 H ASP 56 H ASP 56 15.516 -8.399 -13.834 427 HA ASP 56 HA ASP 56 16.929 -7.729 -16.384 428 HB2 ASP 56 HB2 ASP 56 15.577 -9.713 -16.526 429 HB3 ASP 56 HB3 ASP 56 14.174 -8.868 -15.864 430 H ILE 57 H ILE 57 16.950 -5.728 -17.014 431 HA ILE 57 HA ILE 57 14.555 -4.000 -16.588 432 HB ILE 57 HB ILE 57 15.876 -2.015 -16.524 433 HG12 ILE 57 HG12 ILE 57 18.457 -3.586 -16.286 434 HG13 ILE 57 HG13 ILE 57 17.868 -3.009 -17.838 435 HG21 ILE 57 HG21 ILE 57 16.936 -3.950 -14.415 436 HG22 ILE 57 HG22 ILE 57 16.732 -2.186 -14.267 437 HG23 ILE 57 HG23 ILE 57 15.313 -3.230 -14.408 438 HD11 ILE 57 HD11 ILE 57 18.452 -1.198 -15.464 439 HD12 ILE 57 HD12 ILE 57 19.459 -1.414 -16.905 440 HD13 ILE 57 HD13 ILE 57 17.849 -0.684 -17.067 441 H SER 58 H SER 58 15.697 -5.861 -18.901 442 HA SER 58 HA SER 58 16.367 -4.089 -21.068 443 HB2 SER 58 HB2 SER 58 16.900 -6.551 -20.853 444 HB3 SER 58 HB3 SER 58 15.203 -6.891 -21.263 445 HG SER 58 HG SER 58 16.587 -6.918 -23.121 446 H GLY 59 H GLY 59 13.267 -5.198 -19.821 447 HA2 GLY 59 HA2 GLY 59 11.632 -4.267 -22.023 448 HA3 GLY 59 HA3 GLY 59 11.096 -4.684 -20.401 449 H GLN 60 H GLN 60 13.509 -2.306 -19.994 450 HA GLN 60 HA GLN 60 11.429 -0.216 -19.635 451 HB2 GLN 60 HB2 GLN 60 14.244 -0.544 -18.545 452 HB3 GLN 60 HB3 GLN 60 13.371 0.980 -18.462 453 HG2 GLN 60 HG2 GLN 60 11.702 0.158 -17.046 454 HG3 GLN 60 HG3 GLN 60 12.046 -1.532 -17.431 455 HE21 GLN 60 HE22 GLN 60 14.202 1.174 -16.222 456 HE22 GLN 60 HE21 GLN 60 14.807 0.178 -14.893 457 H THR 61 H THR 61 11.790 1.884 -20.307 458 HA THR 61 HA THR 61 13.652 2.459 -22.538 459 HB THR 61 HB THR 61 11.784 3.735 -23.655 460 HG1 THR 61 HG1 THR 61 9.671 3.142 -23.128 461 HG21 THR 61 HG21 THR 61 11.322 0.722 -23.494 462 HG22 THR 61 HG22 THR 61 10.819 1.816 -24.804 463 HG23 THR 61 HG23 THR 61 12.536 1.520 -24.509 464 H SER 62 H SER 62 13.819 4.916 -22.822 465 HA SER 62 HA SER 62 13.610 6.150 -20.144 466 HB2 SER 62 HB2 SER 62 15.223 7.670 -20.710 467 HB3 SER 62 HB3 SER 62 15.787 6.126 -21.355 468 HG SER 62 HG SER 62 14.717 6.981 -23.421 469 H ASP 63 H ASP 63 12.502 7.922 -19.623 470 HA ASP 63 HA ASP 63 10.830 9.281 -21.685 471 HB2 ASP 63 HB2 ASP 63 9.797 7.741 -19.300 472 HB3 ASP 63 HB3 ASP 63 8.881 9.077 -19.996 473 HA PRO 64 HA PRO 64 11.816 12.835 -19.323 474 HB2 PRO 64 HB2 PRO 64 10.333 14.762 -20.518 475 HB3 PRO 64 HB3 PRO 64 11.581 13.835 -21.406 476 HG2 PRO 64 HG2 PRO 64 8.590 13.306 -21.323 477 HG3 PRO 64 HG3 PRO 64 9.644 13.433 -22.763 478 HD2 PRO 64 HD2 PRO 64 8.994 11.023 -21.615 479 HD3 PRO 64 HD3 PRO 64 10.584 11.319 -22.391 480 H ILE 65 H ILE 65 11.287 14.087 -17.599 481 HA ILE 65 HA ILE 65 9.320 13.392 -15.765 482 HB ILE 65 HB ILE 65 11.531 14.608 -15.463 483 HG12 ILE 65 HG12 ILE 65 9.139 15.725 -14.020 484 HG13 ILE 65 HG13 ILE 65 10.014 14.224 -13.639 485 HG21 ILE 65 HG21 ILE 65 11.118 16.495 -17.119 486 HG22 ILE 65 HG22 ILE 65 9.958 17.176 -15.949 487 HG23 ILE 65 HG23 ILE 65 11.661 17.031 -15.525 488 HD11 ILE 65 HD11 ILE 65 12.094 15.711 -13.312 489 HD12 ILE 65 HD12 ILE 65 10.963 17.085 -13.318 490 HD13 ILE 65 HD13 ILE 65 10.819 15.827 -12.088 491 H GLU 66 H GLU 66 9.206 15.931 -18.218 492 HA GLU 66 HA GLU 66 6.909 17.332 -17.365 493 HB2 GLU 66 HB2 GLU 66 7.920 16.888 -20.205 494 HB3 GLU 66 HB3 GLU 66 6.759 18.130 -19.708 495 HG2 GLU 66 HG2 GLU 66 8.502 19.053 -18.139 496 HG3 GLU 66 HG3 GLU 66 9.670 17.928 -18.836 497 H ASN 67 H ASN 67 6.965 14.185 -18.929 498 HA ASN 67 HA ASN 67 4.087 14.340 -19.609 499 HB2 ASN 67 HB2 ASN 67 4.468 12.723 -21.075 500 HB3 ASN 67 HB3 ASN 67 6.179 13.043 -20.847 501 HD21 ASN 67 HD22 ASN 67 7.151 11.700 -18.846 502 HD22 ASN 67 HD21 ASN 67 6.489 10.093 -18.650 503 H PHE 68 H PHE 68 5.828 13.624 -16.785 504 HA PHE 68 HA PHE 68 4.001 11.461 -15.892 505 HB2 PHE 68 HB2 PHE 68 6.760 12.379 -15.060 506 HB3 PHE 68 HB3 PHE 68 5.823 11.281 -14.078 507 HD1 PHE 68 HD1 PHE 68 4.621 9.300 -15.680 508 HD2 PHE 68 HD2 PHE 68 8.422 11.253 -16.267 509 HE1 PHE 68 HE1 PHE 68 5.419 7.348 -16.972 510 HE2 PHE 68 HE2 PHE 68 9.212 9.287 -17.572 511 HZ PHE 68 HZ PHE 68 7.719 7.329 -17.911 512 H ASN 69 H ASN 69 3.657 11.390 -13.461 513 HA ASN 69 HA ASN 69 2.353 13.973 -12.679 514 HB2 ASN 69 HB2 ASN 69 0.509 12.470 -11.800 515 HB3 ASN 69 HB3 ASN 69 0.666 12.637 -13.541 516 HD21 ASN 69 HD22 ASN 69 1.887 10.409 -10.960 517 HD22 ASN 69 HD21 ASN 69 1.541 8.958 -11.889 518 H ALA 70 H ALA 70 4.098 14.596 -11.303 519 HA ALA 70 HA ALA 70 5.301 13.183 -9.276 520 HB1 ALA 70 HB1 ALA 70 5.870 15.503 -9.853 521 HB2 ALA 70 HB2 ALA 70 4.333 16.060 -9.163 522 HB3 ALA 70 HB3 ALA 70 5.568 15.350 -8.111 523 H ASP 71 H ASP 71 2.048 14.577 -9.196 524 HA ASP 71 HA ASP 71 1.508 14.587 -6.444 525 HB2 ASP 71 HB2 ASP 71 0.201 15.685 -8.268 526 HB3 ASP 71 HB3 ASP 71 -0.380 14.095 -8.777 527 H ASP 72 H ASP 72 1.558 11.816 -8.606 528 HA ASP 72 HA ASP 72 0.078 10.095 -6.694 529 HB2 ASP 72 HB2 ASP 72 -0.213 9.887 -9.193 530 HB3 ASP 72 HB3 ASP 72 1.470 9.341 -9.265 531 H TYR 73 H TYR 73 3.431 10.827 -7.530 532 HA TYR 73 HA TYR 73 4.443 8.307 -6.470 533 HB2 TYR 73 HB2 TYR 73 6.028 10.755 -7.227 534 HB3 TYR 73 HB3 TYR 73 6.578 9.081 -7.150 535 HD1 TYR 73 HD1 TYR 73 4.385 7.702 -8.742 536 HD2 TYR 73 HD2 TYR 73 6.517 11.402 -9.401 537 HE1 TYR 73 HE1 TYR 73 3.845 7.591 -11.163 538 HE2 TYR 73 HE2 TYR 73 5.953 11.292 -11.813 539 HH TYR 73 HH TYR 73 4.005 8.621 -13.206 540 H ASP 74 H ASP 74 3.975 8.158 -4.311 541 HA ASP 74 HA ASP 74 4.014 10.091 -2.318 542 HB2 ASP 74 HB2 ASP 74 5.002 7.220 -2.097 543 HB3 ASP 74 HB3 ASP 74 4.441 8.215 -0.757 544 H VAL 75 H VAL 75 6.789 8.449 -3.776 545 HA VAL 75 HA VAL 75 8.607 10.340 -2.350 546 HB VAL 75 HB VAL 75 9.281 7.473 -3.030 547 HG11 VAL 75 HG11 VAL 75 11.315 7.992 -1.601 548 HG12 VAL 75 HG12 VAL 75 11.255 8.817 -3.159 549 HG13 VAL 75 HG13 VAL 75 10.853 9.694 -1.682 550 HG21 VAL 75 HG21 VAL 75 8.533 8.758 -0.382 551 HG22 VAL 75 HG22 VAL 75 7.785 7.358 -1.172 552 HG23 VAL 75 HG23 VAL 75 9.413 7.214 -0.509 553 H VAL 76 H VAL 76 10.013 11.415 -3.631 554 HA VAL 76 HA VAL 76 10.498 10.447 -6.426 555 HB VAL 76 HB VAL 76 10.059 13.274 -5.490 556 HG11 VAL 76 HG11 VAL 76 12.084 13.301 -6.943 557 HG12 VAL 76 HG12 VAL 76 11.190 12.410 -8.199 558 HG13 VAL 76 HG13 VAL 76 10.717 14.060 -7.713 559 HG21 VAL 76 HG21 VAL 76 8.435 13.306 -7.352 560 HG22 VAL 76 HG22 VAL 76 8.866 11.632 -7.762 561 HG23 VAL 76 HG23 VAL 76 8.053 12.008 -6.212 562 H ILE 77 H ILE 77 12.554 10.312 -7.055 563 HA ILE 77 HA ILE 77 14.715 11.216 -5.176 564 HB ILE 77 HB ILE 77 14.664 8.750 -6.929 565 HG12 ILE 77 HG12 ILE 77 12.994 8.338 -5.222 566 HG13 ILE 77 HG13 ILE 77 14.396 7.315 -5.008 567 HG21 ILE 77 HG21 ILE 77 16.591 9.592 -4.729 568 HG22 ILE 77 HG22 ILE 77 16.629 8.059 -5.630 569 HG23 ILE 77 HG23 ILE 77 16.925 9.581 -6.465 570 HD11 ILE 77 HD11 ILE 77 15.159 8.617 -3.105 571 HD12 ILE 77 HD12 ILE 77 13.890 9.834 -3.366 572 HD13 ILE 77 HD13 ILE 77 13.462 8.189 -2.887 573 H SER 78 H SER 78 16.266 12.483 -6.146 574 HA SER 78 HA SER 78 16.456 12.409 -9.132 575 HB2 SER 78 HB2 SER 78 17.382 14.577 -9.142 576 HB3 SER 78 HB3 SER 78 15.872 14.620 -8.204 577 HG SER 78 HG SER 78 17.781 15.740 -7.259 578 H LEU 79 H LEU 79 18.373 12.083 -10.116 579 HA LEU 79 HA LEU 79 20.728 11.181 -8.508 580 HB2 LEU 79 HB2 LEU 79 19.504 9.576 -10.799 581 HB3 LEU 79 HB3 LEU 79 20.866 9.149 -9.774 582 HG LEU 79 HG LEU 79 19.051 9.232 -7.823 583 HD11 LEU 79 HD11 LEU 79 17.127 9.948 -9.255 584 HD12 LEU 79 HD12 LEU 79 17.394 8.562 -10.311 585 HD13 LEU 79 HD13 LEU 79 16.873 8.327 -8.623 586 HD21 LEU 79 HD21 LEU 79 18.622 6.840 -8.156 587 HD22 LEU 79 HD22 LEU 79 19.184 6.954 -9.836 588 HD23 LEU 79 HD23 LEU 79 20.321 7.230 -8.481 589 H CYS 80 H CYS 80 20.575 13.630 -9.711 590 HA CYS 80 HA CYS 80 21.907 13.410 -12.393 591 HB2 CYS 80 HB2 CYS 80 20.374 15.718 -11.138 592 HB3 CYS 80 HB3 CYS 80 20.932 15.587 -12.823 593 HG CYS 80 HG CYS 80 18.313 15.275 -12.736 594 H GLY 81 H GLY 81 22.663 14.513 -9.163 595 HA2 GLY 81 HA2 GLY 81 24.692 15.502 -8.425 596 HA3 GLY 81 HA3 GLY 81 25.158 15.830 -10.080 597 H CYS 82 H CYS 82 25.703 17.857 -8.747 598 HA CYS 82 HA CYS 82 23.687 19.573 -7.704 599 HB2 CYS 82 HB2 CYS 82 26.540 20.051 -8.640 600 HB3 CYS 82 HB3 CYS 82 25.566 21.293 -7.833 601 HG CYS 82 HG CYS 82 26.360 18.275 -6.636 602 H GLY 83 H GLY 83 24.543 19.243 -11.054 603 HA2 GLY 83 HA2 GLY 83 23.947 21.892 -11.972 604 HA3 GLY 83 HA3 GLY 83 23.909 20.411 -12.940 605 H VAL 84 H VAL 84 21.786 19.854 -10.449 606 HA VAL 84 HA VAL 84 19.397 20.783 -11.983 607 HB VAL 84 HB VAL 84 20.060 17.970 -11.019 608 HG11 VAL 84 HG11 VAL 84 17.964 17.248 -12.108 609 HG12 VAL 84 HG12 VAL 84 17.649 18.280 -10.730 610 HG13 VAL 84 HG13 VAL 84 17.509 18.942 -12.386 611 HG21 VAL 84 HG21 VAL 84 19.711 19.203 -13.772 612 HG22 VAL 84 HG22 VAL 84 21.202 18.485 -13.077 613 HG23 VAL 84 HG23 VAL 84 19.814 17.458 -13.481 614 H ASN 85 H ASN 85 17.578 21.111 -10.976 615 HA ASN 85 HA ASN 85 17.075 20.193 -8.267 616 HB2 ASN 85 HB2 ASN 85 18.148 22.666 -8.325 617 HB3 ASN 85 HB3 ASN 85 16.506 23.136 -8.758 618 HD21 ASN 85 HD22 ASN 85 18.455 21.321 -6.371 619 HD22 ASN 85 HD21 ASN 85 17.345 21.571 -5.032 620 H LEU 86 H LEU 86 14.724 20.231 -7.831 621 HA LEU 86 HA LEU 86 13.079 20.282 -10.359 622 HB2 LEU 86 HB2 LEU 86 12.961 18.391 -7.989 623 HB3 LEU 86 HB3 LEU 86 11.782 18.457 -9.305 624 HG LEU 86 HG LEU 86 14.662 17.578 -9.558 625 HD11 LEU 86 HD11 LEU 86 12.866 16.134 -8.338 626 HD12 LEU 86 HD12 LEU 86 12.055 16.042 -9.911 627 HD13 LEU 86 HD13 LEU 86 13.696 15.388 -9.733 628 HD21 LEU 86 HD21 LEU 86 13.946 18.632 -11.650 629 HD22 LEU 86 HD22 LEU 86 13.824 16.879 -11.859 630 HD23 LEU 86 HD23 LEU 86 12.359 17.839 -11.540 631 HA PRO 87 HA PRO 87 11.547 23.268 -7.093 632 HB2 PRO 87 HB2 PRO 87 10.905 25.413 -8.741 633 HB3 PRO 87 HB3 PRO 87 12.485 25.114 -7.967 634 HG2 PRO 87 HG2 PRO 87 11.619 24.403 -10.781 635 HG3 PRO 87 HG3 PRO 87 13.134 25.194 -10.249 636 HD2 PRO 87 HD2 PRO 87 13.068 22.543 -10.764 637 HD3 PRO 87 HD3 PRO 87 14.004 23.178 -9.380 638 HA PRO 88 HA PRO 88 7.173 23.092 -8.997 639 HB2 PRO 88 HB2 PRO 88 7.202 20.525 -10.505 640 HB3 PRO 88 HB3 PRO 88 6.441 22.080 -10.945 641 HG2 PRO 88 HG2 PRO 88 8.661 21.155 -12.194 642 HG3 PRO 88 HG3 PRO 88 8.471 22.908 -11.821 643 HD2 PRO 88 HD2 PRO 88 9.979 20.791 -10.257 644 HD3 PRO 88 HD3 PRO 88 10.508 22.425 -10.775 645 H GLU 89 H GLU 89 5.432 20.854 -8.962 646 HA GLU 89 HA GLU 89 5.425 20.048 -6.236 647 HB2 GLU 89 HB2 GLU 89 3.675 18.422 -6.954 648 HB3 GLU 89 HB3 GLU 89 3.356 20.101 -7.348 649 HG2 GLU 89 HG2 GLU 89 4.670 18.428 -9.482 650 HG3 GLU 89 HG3 GLU 89 2.998 18.057 -9.069 651 H TRP 90 H TRP 90 7.467 18.837 -8.625 652 HA TRP 90 HA TRP 90 7.841 16.101 -7.908 653 HB2 TRP 90 HB2 TRP 90 9.598 18.215 -9.136 654 HB3 TRP 90 HB3 TRP 90 10.121 16.542 -8.873 655 HD1 TRP 90 HD1 TRP 90 7.849 18.614 -11.116 656 HE1 TRP 90 HE1 TRP 90 6.683 17.120 -12.843 657 HE3 TRP 90 HE3 TRP 90 9.725 14.122 -9.646 658 HZ2 TRP 90 HZ2 TRP 90 6.595 14.292 -13.509 659 HZ3 TRP 90 HZ3 TRP 90 9.299 12.091 -10.980 660 HH2 TRP 90 HH2 TRP 90 7.737 12.154 -12.898 661 H VAL 91 H VAL 91 8.690 18.948 -6.092 662 HA VAL 91 HA VAL 91 10.205 17.215 -4.164 663 HB VAL 91 HB VAL 91 11.373 19.160 -3.352 664 HG11 VAL 91 HG11 VAL 91 11.634 18.648 -6.292 665 HG12 VAL 91 HG12 VAL 91 12.812 19.566 -5.324 666 HG13 VAL 91 HG13 VAL 91 12.490 17.865 -4.962 667 HG21 VAL 91 HG21 VAL 91 11.324 21.319 -4.541 668 HG22 VAL 91 HG22 VAL 91 10.037 20.730 -5.600 669 HG23 VAL 91 HG23 VAL 91 9.733 20.951 -3.866 670 H THR 92 H THR 92 7.158 18.437 -4.510 671 HA THR 92 HA THR 92 6.820 19.181 -1.652 672 HB THR 92 HB THR 92 4.610 19.908 -2.215 673 HG1 THR 92 HG1 THR 92 3.710 19.565 -4.159 674 HG21 THR 92 HG21 THR 92 6.464 21.493 -2.740 675 HG22 THR 92 HG22 THR 92 6.511 20.869 -4.403 676 HG23 THR 92 HG23 THR 92 5.063 21.702 -3.805 677 H GLN 93 H GLN 93 7.031 16.326 -3.192 678 HA GLN 93 HA GLN 93 4.693 14.938 -2.174 679 HB2 GLN 93 HB2 GLN 93 7.281 13.809 -3.309 680 HB3 GLN 93 HB3 GLN 93 5.767 12.938 -3.035 681 HG2 GLN 93 HG2 GLN 93 6.341 15.087 -5.089 682 HG3 GLN 93 HG3 GLN 93 5.809 13.444 -5.360 683 HE21 GLN 93 HE22 GLN 93 4.732 16.563 -5.514 684 HE22 GLN 93 HE21 GLN 93 3.030 16.311 -5.137 685 H GLU 94 H GLU 94 5.367 12.711 -0.943 686 HA GLU 94 HA GLU 94 5.650 13.754 1.727 687 HB2 GLU 94 HB2 GLU 94 4.145 11.926 1.233 688 HB3 GLU 94 HB3 GLU 94 5.493 10.874 0.785 689 HG2 GLU 94 HG2 GLU 94 6.378 10.895 3.013 690 HG3 GLU 94 HG3 GLU 94 5.196 12.113 3.535 691 H ILE 95 H ILE 95 7.934 11.929 -0.321 692 HA ILE 95 HA ILE 95 10.106 12.967 1.427 693 HB ILE 95 HB ILE 95 10.163 10.127 0.375 694 HG12 ILE 95 HG12 ILE 95 9.676 11.043 3.235 695 HG13 ILE 95 HG13 ILE 95 8.518 10.224 2.177 696 HG21 ILE 95 HG21 ILE 95 12.394 11.203 0.550 697 HG22 ILE 95 HG22 ILE 95 12.066 11.594 2.255 698 HG23 ILE 95 HG23 ILE 95 12.229 9.915 1.713 699 HD11 ILE 95 HD11 ILE 95 10.131 8.265 2.066 700 HD12 ILE 95 HD12 ILE 95 10.996 9.024 3.425 701 HD13 ILE 95 HD13 ILE 95 9.302 8.541 3.613 702 H PHE 96 H PHE 96 11.771 13.821 0.330 703 HA PHE 96 HA PHE 96 12.175 13.097 -2.505 704 HB2 PHE 96 HB2 PHE 96 11.145 15.246 -2.656 705 HB3 PHE 96 HB3 PHE 96 12.196 15.906 -1.404 706 HD1 PHE 96 HD2 PHE 96 12.104 14.710 -4.972 707 HD2 PHE 96 HD1 PHE 96 14.462 16.607 -1.873 708 HE1 PHE 96 HE2 PHE 96 13.891 15.190 -6.605 709 HE2 PHE 96 HE1 PHE 96 16.192 17.175 -3.553 710 HZ PHE 96 HZ PHE 96 15.911 16.463 -5.916 711 H GLU 97 H GLU 97 14.264 12.642 -3.056 712 HA GLU 97 HA GLU 97 16.453 13.321 -1.163 713 HB2 GLU 97 HB2 GLU 97 16.080 10.523 -2.279 714 HB3 GLU 97 HB3 GLU 97 17.434 11.124 -1.327 715 HG2 GLU 97 HG2 GLU 97 15.876 11.515 0.595 716 HG3 GLU 97 HG3 GLU 97 14.571 10.789 -0.356 717 H ASP 98 H ASP 98 18.555 13.370 -2.112 718 HA ASP 98 HA ASP 98 18.675 13.312 -5.107 719 HB2 ASP 98 HB2 ASP 98 18.575 15.602 -4.379 720 HB3 ASP 98 HB3 ASP 98 19.801 15.321 -3.149 721 H TRP 99 H TRP 99 19.671 11.411 -5.418 722 HA TRP 99 HA TRP 99 21.973 10.540 -3.744 723 HB2 TRP 99 HB2 TRP 99 20.508 9.071 -5.948 724 HB3 TRP 99 HB3 TRP 99 21.717 8.400 -4.868 725 HD1 TRP 99 HD1 TRP 99 19.865 10.101 -2.403 726 HE1 TRP 99 HE1 TRP 99 17.861 8.781 -1.475 727 HE3 TRP 99 HE3 TRP 99 19.549 6.474 -5.998 728 HZ2 TRP 99 HZ2 TRP 99 16.275 6.519 -2.243 729 HZ3 TRP 99 HZ3 TRP 99 17.764 4.752 -5.894 730 HH2 TRP 99 HH2 TRP 99 16.113 4.763 -4.018 731 H GLN 100 H GLN 100 23.362 12.235 -4.494 732 HA GLN 100 HA GLN 100 24.170 12.358 -7.263 733 HB2 GLN 100 HB2 GLN 100 25.598 13.393 -4.781 734 HB3 GLN 100 HB3 GLN 100 25.967 13.797 -6.471 735 HG2 GLN 100 HG2 GLN 100 23.523 14.643 -6.623 736 HG3 GLN 100 HG3 GLN 100 23.470 14.499 -4.870 737 HE21 GLN 100 HE22 GLN 100 22.933 16.875 -5.214 738 HE22 GLN 100 HE21 GLN 100 24.316 17.987 -5.254 739 H LEU 101 H LEU 101 25.306 10.888 -8.314 740 HA LEU 101 HA LEU 101 27.590 9.428 -7.103 741 HB2 LEU 101 HB2 LEU 101 25.257 8.180 -8.615 742 HB3 LEU 101 HB3 LEU 101 26.776 7.349 -8.308 743 HG LEU 101 HG LEU 101 24.806 8.236 -6.153 744 HD11 LEU 101 HD11 LEU 101 24.319 5.883 -5.909 745 HD12 LEU 101 HD12 LEU 101 23.983 6.405 -7.563 746 HD13 LEU 101 HD13 LEU 101 25.459 5.467 -7.214 747 HD21 LEU 101 HD21 LEU 101 27.137 8.172 -5.290 748 HD22 LEU 101 HD22 LEU 101 26.182 6.836 -4.654 749 HD23 LEU 101 HD23 LEU 101 27.340 6.546 -5.974 750 H GLU 102 H GLU 102 28.895 8.332 -8.929 751 HA GLU 102 HA GLU 102 29.353 10.330 -10.998 752 HB2 GLU 102 HB2 GLU 102 31.285 9.066 -11.585 753 HB3 GLU 102 HB3 GLU 102 31.212 9.281 -9.835 754 HG2 GLU 102 HG2 GLU 102 30.325 6.936 -9.640 755 HG3 GLU 102 HG3 GLU 102 30.561 6.735 -11.384 756 H ASP 103 H ASP 103 30.040 9.252 -13.223 757 HA ASP 103 HA ASP 103 27.478 8.162 -14.282 758 HB2 ASP 103 HB2 ASP 103 28.006 10.614 -14.556 759 HB3 ASP 103 HB3 ASP 103 29.249 10.137 -15.714 760 HA PRO 104 HA PRO 104 30.456 4.952 -15.456 761 HB2 PRO 104 HB2 PRO 104 27.917 3.455 -15.900 762 HB3 PRO 104 HB3 PRO 104 29.423 2.937 -15.073 763 HG2 PRO 104 HG2 PRO 104 27.269 3.636 -13.617 764 HG3 PRO 104 HG3 PRO 104 28.879 4.290 -13.151 765 HD2 PRO 104 HD2 PRO 104 26.743 5.624 -14.863 766 HD3 PRO 104 HD3 PRO 104 27.590 6.252 -13.423 767 H ASP 105 H ASP 105 28.124 6.405 -17.513 768 HA ASP 105 HA ASP 105 28.171 4.822 -19.836 769 HB2 ASP 105 HB2 ASP 105 26.628 6.667 -19.398 770 HB3 ASP 105 HB3 ASP 105 27.956 7.824 -19.449 771 H GLY 106 H GLY 106 29.965 4.048 -20.768 772 HA2 GLY 106 HA2 GLY 106 31.833 4.061 -22.125 773 HA3 GLY 106 HA3 GLY 106 31.921 5.822 -22.011 774 H GLN 107 H GLN 107 31.819 4.175 -18.949 775 HA GLN 107 HA GLN 107 34.664 4.892 -18.472 776 HB2 GLN 107 HB2 GLN 107 32.607 3.974 -16.456 777 HB3 GLN 107 HB3 GLN 107 34.204 4.646 -16.120 778 HG2 GLN 107 HG2 GLN 107 31.861 6.105 -17.396 779 HG3 GLN 107 HG3 GLN 107 32.319 6.166 -15.706 780 HE21 GLN 107 HE22 GLN 107 32.038 8.503 -16.663 781 HE22 GLN 107 HE21 GLN 107 33.571 9.285 -17.075 782 H SER 108 H SER 108 33.204 2.291 -16.666 783 HA SER 108 HA SER 108 34.366 0.091 -18.144 784 HB2 SER 108 HB2 SER 108 35.948 -0.666 -16.508 785 HB3 SER 108 HB3 SER 108 36.350 1.023 -16.840 786 HG SER 108 HG SER 108 36.338 0.677 -14.610 787 H LEU 109 H LEU 109 33.826 -2.003 -17.069 788 HA LEU 109 HA LEU 109 31.146 -2.002 -15.996 789 HB2 LEU 109 HB2 LEU 109 33.215 -4.230 -15.932 790 HB3 LEU 109 HB3 LEU 109 31.472 -4.396 -15.741 791 HG LEU 109 HG LEU 109 32.972 -3.592 -18.268 792 HD11 LEU 109 HD11 LEU 109 31.275 -6.012 -17.557 793 HD12 LEU 109 HD12 LEU 109 32.113 -5.719 -19.103 794 HD13 LEU 109 HD13 LEU 109 33.053 -5.948 -17.612 795 HD21 LEU 109 HD21 LEU 109 30.754 -3.668 -19.400 796 HD22 LEU 109 HD22 LEU 109 29.964 -3.772 -17.814 797 HD23 LEU 109 HD23 LEU 109 30.893 -2.327 -18.260 798 H GLU 110 H GLU 110 34.315 -2.230 -14.460 799 HA GLU 110 HA GLU 110 33.403 -2.643 -11.775 800 HB2 GLU 110 HB2 GLU 110 35.782 -2.814 -12.619 801 HB3 GLU 110 HB3 GLU 110 35.821 -1.051 -12.686 802 HG2 GLU 110 HG2 GLU 110 36.849 -1.576 -10.650 803 HG3 GLU 110 HG3 GLU 110 35.230 -1.070 -10.185 804 H VAL 111 H VAL 111 33.771 0.431 -13.628 805 HA VAL 111 HA VAL 111 32.894 2.082 -11.393 806 HB VAL 111 HB VAL 111 33.079 2.607 -14.364 807 HG11 VAL 111 HG11 VAL 111 31.329 4.088 -13.557 808 HG12 VAL 111 HG12 VAL 111 32.299 4.526 -12.133 809 HG13 VAL 111 HG13 VAL 111 32.814 5.022 -13.758 810 HG21 VAL 111 HG21 VAL 111 34.662 3.661 -11.971 811 HG22 VAL 111 HG22 VAL 111 35.219 2.380 -13.059 812 HG23 VAL 111 HG23 VAL 111 34.982 4.018 -13.680 813 H PHE 112 H PHE 112 31.142 0.473 -14.096 814 HA PHE 112 HA PHE 112 28.523 1.460 -13.356 815 HB2 PHE 112 HB2 PHE 112 29.532 -0.960 -14.837 816 HB3 PHE 112 HB3 PHE 112 27.884 -0.940 -14.238 817 HD1 PHE 112 HD2 PHE 112 26.223 0.697 -15.001 818 HD2 PHE 112 HD1 PHE 112 30.132 0.443 -16.779 819 HE1 PHE 112 HE2 PHE 112 25.371 1.866 -17.028 820 HE2 PHE 112 HE1 PHE 112 29.297 1.622 -18.791 821 HZ PHE 112 HZ PHE 112 26.928 2.356 -18.905 822 H ARG 113 H ARG 113 30.195 -1.547 -12.311 823 HA ARG 113 HA ARG 113 28.342 -2.429 -10.338 824 HB2 ARG 113 HB2 ARG 113 31.361 -2.619 -10.619 825 HB3 ARG 113 HB3 ARG 113 30.532 -3.367 -9.259 826 HG2 ARG 113 HG2 ARG 113 29.430 -4.938 -10.574 827 HG3 ARG 113 HG3 ARG 113 29.547 -3.974 -12.051 828 HD2 ARG 113 HD2 ARG 113 31.034 -6.035 -11.983 829 HD3 ARG 113 HD3 ARG 113 31.805 -4.520 -12.406 830 HE ARG 113 HE ARG 113 32.969 -4.432 -10.350 831 HH11 ARG 113 HH21 ARG 113 31.150 -7.461 -10.409 832 HH12 ARG 113 HH22 ARG 113 32.143 -8.108 -9.131 833 HH21 ARG 113 HH11 ARG 113 34.094 -5.247 -8.922 834 HH22 ARG 113 HH12 ARG 113 33.818 -6.859 -8.248 835 H THR 114 H THR 114 31.016 -0.101 -9.963 836 HA THR 114 HA THR 114 30.736 0.381 -7.164 837 HB THR 114 HB THR 114 31.792 2.207 -9.361 838 HG1 THR 114 HG1 THR 114 32.956 0.318 -9.207 839 HG21 THR 114 HG21 THR 114 32.120 2.364 -6.338 840 HG22 THR 114 HG22 THR 114 33.136 3.235 -7.514 841 HG23 THR 114 HG23 THR 114 31.407 3.590 -7.417 842 H VAL 115 H VAL 115 29.117 2.016 -9.925 843 HA VAL 115 HA VAL 115 27.568 3.787 -8.150 844 HB VAL 115 HB VAL 115 27.470 3.172 -11.126 845 HG11 VAL 115 HG11 VAL 115 25.789 5.208 -9.587 846 HG12 VAL 115 HG12 VAL 115 25.975 5.124 -11.353 847 HG13 VAL 115 HG13 VAL 115 25.173 3.798 -10.504 848 HG21 VAL 115 HG21 VAL 115 28.329 5.588 -9.457 849 HG22 VAL 115 HG22 VAL 115 29.401 4.492 -10.362 850 HG23 VAL 115 HG23 VAL 115 28.278 5.554 -11.225 851 H ARG 116 H ARG 116 26.814 0.828 -9.997 852 HA ARG 116 HA ARG 116 24.093 0.524 -9.462 853 HB2 ARG 116 HB2 ARG 116 25.555 -0.845 -11.006 854 HB3 ARG 116 HB3 ARG 116 26.236 -1.661 -9.602 855 HG2 ARG 116 HG2 ARG 116 23.761 -2.332 -9.074 856 HG3 ARG 116 HG3 ARG 116 23.418 -1.818 -10.732 857 HD2 ARG 116 HD2 ARG 116 23.783 -4.167 -10.821 858 HD3 ARG 116 HD3 ARG 116 25.267 -3.434 -11.461 859 HE ARG 116 HE ARG 116 25.490 -3.852 -8.598 860 HH11 ARG 116 HH11 ARG 116 25.465 -5.845 -11.501 861 HH12 ARG 116 HH12 ARG 116 26.578 -6.993 -10.783 862 HH21 ARG 116 HH21 ARG 116 26.846 -5.383 -7.768 863 HH22 ARG 116 HH22 ARG 116 27.268 -6.771 -8.707 864 H GLY 117 H GLY 117 26.763 -0.699 -7.376 865 HA2 GLY 117 HA2 GLY 117 25.146 -1.929 -5.384 866 HA3 GLY 117 HA3 GLY 117 26.782 -1.302 -5.138 867 H GLN 118 H GLN 118 26.157 1.496 -5.693 868 HA GLN 118 HA GLN 118 25.044 2.225 -3.084 869 HB2 GLN 118 HB2 GLN 118 26.135 3.889 -5.381 870 HB3 GLN 118 HB3 GLN 118 25.553 4.555 -3.840 871 HG2 GLN 118 HG2 GLN 118 27.221 3.292 -2.585 872 HG3 GLN 118 HG3 GLN 118 27.774 2.467 -4.040 873 HE21 GLN 118 HE22 GLN 118 29.084 3.625 -5.604 874 HE22 GLN 118 HE21 GLN 118 29.827 5.160 -5.140 875 H VAL 119 H VAL 119 23.949 2.720 -6.496 876 HA VAL 119 HA VAL 119 21.405 3.846 -5.874 877 HB VAL 119 HB VAL 119 22.075 1.930 -8.150 878 HG11 VAL 119 HG11 VAL 119 19.783 3.901 -7.802 879 HG12 VAL 119 HG12 VAL 119 20.181 3.045 -9.315 880 HG13 VAL 119 HG13 VAL 119 19.643 2.128 -7.911 881 HG21 VAL 119 HG21 VAL 119 22.348 3.963 -9.500 882 HG22 VAL 119 HG22 VAL 119 22.030 4.982 -8.075 883 HG23 VAL 119 HG23 VAL 119 23.497 3.983 -8.169 884 H LYS 120 H LYS 120 22.312 0.370 -6.049 885 HA LYS 120 HA LYS 120 19.819 -0.780 -5.300 886 HB2 LYS 120 HB2 LYS 120 21.763 -2.070 -6.122 887 HB3 LYS 120 HB3 LYS 120 22.677 -1.685 -4.673 888 HG2 LYS 120 HG2 LYS 120 20.994 -2.864 -3.277 889 HG3 LYS 120 HG3 LYS 120 20.048 -3.217 -4.726 890 HD2 LYS 120 HD2 LYS 120 21.993 -4.533 -5.611 891 HD3 LYS 120 HD3 LYS 120 22.882 -4.218 -4.120 892 HE2 LYS 120 HE2 LYS 120 20.073 -5.295 -3.912 893 HE3 LYS 120 HE3 LYS 120 21.319 -6.419 -4.499 894 HZ1 LYS 120 HZ1 LYS 120 21.149 -6.593 -2.100 895 HZ2 LYS 120 HZ2 LYS 120 22.592 -5.905 -2.424 896 HZ3 LYS 120 HZ3 LYS 120 21.328 -4.984 -1.878 897 H GLU 121 H GLU 121 22.563 0.119 -3.078 898 HA GLU 121 HA GLU 121 21.018 -0.608 -0.774 899 HB2 GLU 121 HB2 GLU 121 22.803 -0.086 0.511 900 HB3 GLU 121 HB3 GLU 121 23.602 -0.378 -1.029 901 HG2 GLU 121 HG2 GLU 121 23.683 2.099 -1.399 902 HG3 GLU 121 HG3 GLU 121 22.949 2.342 0.181 903 H ARG 122 H ARG 122 21.241 2.566 -2.380 904 HA ARG 122 HA ARG 122 19.715 3.857 -0.274 905 HB2 ARG 122 HB2 ARG 122 19.906 4.545 -3.245 906 HB3 ARG 122 HB3 ARG 122 19.163 5.540 -1.988 907 HG2 ARG 122 HG2 ARG 122 22.102 4.846 -2.196 908 HG3 ARG 122 HG3 ARG 122 21.360 6.394 -2.571 909 HD2 ARG 122 HD2 ARG 122 21.606 5.074 0.151 910 HD3 ARG 122 HD3 ARG 122 22.499 6.479 -0.451 911 HE ARG 122 HE ARG 122 19.821 7.258 -0.620 912 HH11 ARG 122 HH21 ARG 122 22.011 6.386 1.973 913 HH12 ARG 122 HH22 ARG 122 21.110 7.276 3.164 914 HH21 ARG 122 HH11 ARG 122 18.659 8.367 0.994 915 HH22 ARG 122 HH12 ARG 122 19.319 8.388 2.606 916 H VAL 123 H VAL 123 18.604 2.177 -3.286 917 HA VAL 123 HA VAL 123 15.837 2.443 -2.644 918 HB VAL 123 HB VAL 123 17.403 0.458 -4.317 919 HG11 VAL 123 HG11 VAL 123 15.550 -0.889 -3.459 920 HG12 VAL 123 HG12 VAL 123 14.396 0.397 -3.908 921 HG13 VAL 123 HG13 VAL 123 15.330 -0.483 -5.155 922 HG21 VAL 123 HG21 VAL 123 16.183 1.512 -6.151 923 HG22 VAL 123 HG22 VAL 123 15.331 2.564 -4.996 924 HG23 VAL 123 HG23 VAL 123 17.102 2.692 -5.204 925 H GLU 124 H GLU 124 17.987 -0.371 -1.722 926 HA GLU 124 HA GLU 124 15.899 -1.675 -0.265 927 HB2 GLU 124 HB2 GLU 124 18.875 -1.661 0.350 928 HB3 GLU 124 HB3 GLU 124 17.660 -2.799 0.988 929 HG2 GLU 124 HG2 GLU 124 17.157 -3.582 -1.243 930 HG3 GLU 124 HG3 GLU 124 18.393 -2.532 -1.937 931 H ASN 125 H ASN 125 18.032 0.946 0.814 932 HA ASN 125 HA ASN 125 16.971 0.777 3.464 933 HB2 ASN 125 HB2 ASN 125 18.778 2.009 3.921 934 HB3 ASN 125 HB3 ASN 125 19.114 2.138 2.210 935 HD21 ASN 125 HD22 ASN 125 17.995 3.933 1.007 936 HD22 ASN 125 HD21 ASN 125 17.868 5.459 1.883 937 H LEU 126 H LEU 126 15.911 2.491 0.612 938 HA LEU 126 HA LEU 126 14.025 4.207 2.007 939 HB2 LEU 126 HB2 LEU 126 14.994 4.921 -0.095 940 HB3 LEU 126 HB3 LEU 126 14.475 3.445 -0.909 941 HG LEU 126 HG LEU 126 12.116 4.101 -0.711 942 HD11 LEU 126 HD11 LEU 126 11.492 6.369 0.014 943 HD12 LEU 126 HD12 LEU 126 12.201 5.482 1.356 944 HD13 LEU 126 HD13 LEU 126 13.171 6.696 0.495 945 HD21 LEU 126 HD21 LEU 126 12.210 5.963 -2.310 946 HD22 LEU 126 HD22 LEU 126 13.913 6.245 -1.879 947 HD23 LEU 126 HD23 LEU 126 13.432 4.733 -2.682 948 H ILE 127 H ILE 127 13.641 1.158 0.047 949 HA ILE 127 HA ILE 127 10.799 1.214 0.355 950 HB ILE 127 HB ILE 127 10.756 -1.118 -0.308 951 HG12 ILE 127 HG12 ILE 127 13.767 -1.060 0.026 952 HG13 ILE 127 HG13 ILE 127 12.582 -2.192 0.695 953 HG21 ILE 127 HG21 ILE 127 11.531 -0.700 -2.577 954 HG22 ILE 127 HG22 ILE 127 10.937 0.821 -1.916 955 HG23 ILE 127 HG23 ILE 127 12.691 0.529 -2.008 956 HD11 ILE 127 HD11 ILE 127 13.829 -3.284 -1.037 957 HD12 ILE 127 HD12 ILE 127 12.175 -3.025 -1.633 958 HD13 ILE 127 HD13 ILE 127 13.512 -1.976 -2.186 959 H ALA 128 H ALA 128 13.249 -0.145 2.556 960 HA ALA 128 HA ALA 128 11.355 -1.444 4.209 961 HB1 ALA 128 HB1 ALA 128 13.203 -1.424 5.883 962 HB2 ALA 128 HB2 ALA 128 13.798 -1.848 4.268 963 HB3 ALA 128 HB3 ALA 128 14.062 -0.210 4.911 964 H LYS 129 H LYS 129 12.030 1.982 3.885 965 HA LYS 129 HA LYS 129 10.708 2.753 6.429 966 HB2 LYS 129 HB2 LYS 129 11.722 4.423 4.087 967 HB3 LYS 129 HB3 LYS 129 11.057 5.065 5.589 968 HG2 LYS 129 HG2 LYS 129 12.873 4.097 6.890 969 HG3 LYS 129 HG3 LYS 129 13.535 3.304 5.455 970 HD2 LYS 129 HD2 LYS 129 13.821 5.554 4.377 971 HD3 LYS 129 HD3 LYS 129 13.302 6.314 5.885 972 HE2 LYS 129 HE2 LYS 129 15.733 4.477 5.553 973 HE3 LYS 129 HE3 LYS 129 15.787 6.242 5.520 974 HZ1 LYS 129 HZ1 LYS 129 16.348 5.439 7.726 975 HZ2 LYS 129 HZ2 LYS 129 14.944 6.260 7.822 976 HZ3 LYS 129 HZ3 LYS 129 14.948 4.619 7.879 977 H ILE 130 H ILE 130 9.933 2.764 2.946 978 HA ILE 130 HA ILE 130 7.271 3.916 3.608 979 HB ILE 130 HB ILE 130 7.124 4.715 1.322 980 HG12 ILE 130 HG12 ILE 130 9.203 4.917 -0.038 981 HG13 ILE 130 HG13 ILE 130 9.980 3.723 0.992 982 HG21 ILE 130 HG21 ILE 130 8.048 6.048 3.232 983 HG22 ILE 130 HG22 ILE 130 9.687 5.587 2.718 984 HG23 ILE 130 HG23 ILE 130 8.638 6.542 1.642 985 HD11 ILE 130 HD11 ILE 130 8.443 2.000 0.226 986 HD12 ILE 130 HD12 ILE 130 7.499 3.209 -0.688 987 HD13 ILE 130 HD13 ILE 130 9.167 2.828 -1.165 988 H SER 131 H SER 131 8.255 0.824 3.059 989 HA SER 131 HA SER 131 6.289 -0.290 1.332 990 HB2 SER 131 HB2 SER 131 7.613 -1.372 3.843 991 HB3 SER 131 HB3 SER 131 6.516 -2.328 2.817 992 HG SER 131 HG SER 131 8.956 -1.071 2.065
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