NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
15175 | 1xnt | 4282 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H MET 1 H MET 1 -6.153 18.164 13.011 2 HA MET 1 HA MET 1 -3.957 18.109 12.779 3 1HB MET 1 1HB MET 1 -2.926 15.837 13.039 4 2HB MET 1 2HB MET 1 -4.215 16.151 14.201 5 1HG MET 1 1HG MET 1 -5.792 15.016 12.527 6 2HG MET 1 2HG MET 1 -4.337 14.456 11.702 7 1HE MET 1 1HE MET 1 -4.213 12.383 11.723 8 2HE MET 1 2HE MET 1 -4.052 11.228 13.045 9 3HE MET 1 3HE MET 1 -5.655 11.738 12.520 10 HA PRO 2 HA PRO 2 -2.785 17.545 8.518 11 1HB PRO 2 1HB PRO 2 -0.077 17.787 8.765 12 2HB PRO 2 2HB PRO 2 -1.192 19.148 8.950 13 1HG PRO 2 1HG PRO 2 0.390 17.747 10.988 14 2HG PRO 2 2HG PRO 2 -0.346 19.354 11.042 15 1HD PRO 2 1HD PRO 2 -1.324 16.927 12.241 16 2HD PRO 2 2HD PRO 2 -2.069 18.540 12.280 17 H GLU 3 H GLU 3 -3.484 15.130 8.878 18 HA GLU 3 HA GLU 3 -1.199 13.426 8.074 19 1HB GLU 3 1HB GLU 3 -2.730 13.167 10.618 20 2HB GLU 3 2HB GLU 3 -2.389 11.675 9.741 21 1HG GLU 3 1HG GLU 3 -0.053 11.989 9.874 22 2HG GLU 3 2HG GLU 3 -0.218 13.702 10.260 23 H ILE 4 H ILE 4 -2.331 11.039 7.813 24 HA ILE 4 HA ILE 4 -4.860 11.504 6.277 25 HB ILE 4 HB ILE 4 -2.672 9.529 5.601 26 1HG1 ILE 4 1HG1 ILE 4 -1.851 11.832 5.316 27 2HG1 ILE 4 2HG1 ILE 4 -2.085 11.062 3.752 28 1HG2 ILE 4 1HG2 ILE 4 -5.181 10.435 4.183 29 2HG2 ILE 4 2HG2 ILE 4 -3.899 9.522 3.387 30 3HG2 ILE 4 3HG2 ILE 4 -4.784 8.807 4.734 31 1HD1 ILE 4 1HD1 ILE 4 -4.499 12.164 3.977 32 2HD1 ILE 4 2HD1 ILE 4 -3.632 13.270 5.038 33 3HD1 ILE 4 3HD1 ILE 4 -3.128 13.083 3.360 34 H ARG 5 H ARG 5 -6.512 10.105 6.778 35 HA ARG 5 HA ARG 5 -5.839 7.759 8.511 36 1HB ARG 5 1HB ARG 5 -7.032 9.602 9.713 37 2HB ARG 5 2HB ARG 5 -8.372 9.427 8.580 38 1HG ARG 5 1HG ARG 5 -8.127 6.856 9.334 39 2HG ARG 5 2HG ARG 5 -7.519 7.633 10.797 40 1HD ARG 5 1HD ARG 5 -9.649 9.173 10.470 41 2HD ARG 5 2HD ARG 5 -10.245 7.781 9.566 42 HE ARG 5 HE ARG 5 -9.331 6.651 11.905 43 1HH1 ARG 5 1HH1 ARG 5 -11.495 9.306 11.190 44 2HH1 ARG 5 2HH1 ARG 5 -12.414 9.077 12.635 45 1HH2 ARG 5 1HH2 ARG 5 -10.552 6.390 13.762 46 2HH2 ARG 5 2HH2 ARG 5 -11.890 7.445 14.076 47 H LEU 6 H LEU 6 -6.439 5.832 7.652 48 HA LEU 6 HA LEU 6 -7.922 5.752 5.132 49 1HB LEU 6 1HB LEU 6 -6.195 3.980 6.652 50 2HB LEU 6 2HB LEU 6 -7.653 3.126 6.153 51 HG LEU 6 HG LEU 6 -7.272 3.915 3.814 52 1HD1 LEU 6 1HD1 LEU 6 -5.885 5.918 4.603 53 2HD1 LEU 6 2HD1 LEU 6 -4.549 4.785 4.809 54 3HD1 LEU 6 3HD1 LEU 6 -5.251 5.039 3.211 55 1HD2 LEU 6 1HD2 LEU 6 -5.071 2.364 5.205 56 2HD2 LEU 6 2HD2 LEU 6 -6.483 1.713 4.372 57 3HD2 LEU 6 3HD2 LEU 6 -5.197 2.494 3.450 58 H ARG 7 H ARG 7 -9.923 4.560 4.851 59 HA ARG 7 HA ARG 7 -11.602 4.519 7.326 60 1HB ARG 7 1HB ARG 7 -12.178 6.112 5.372 61 2HB ARG 7 2HB ARG 7 -12.663 4.655 4.505 62 1HG ARG 7 1HG ARG 7 -14.632 5.543 5.581 63 2HG ARG 7 2HG ARG 7 -14.157 4.090 6.460 64 1HD ARG 7 1HD ARG 7 -13.736 5.252 8.356 65 2HD ARG 7 2HD ARG 7 -12.851 6.507 7.487 66 HE ARG 7 HE ARG 7 -14.802 7.802 7.556 67 1HH1 ARG 7 1HH1 ARG 7 -15.639 4.420 7.853 68 2HH1 ARG 7 2HH1 ARG 7 -17.322 4.752 8.068 69 1HH2 ARG 7 1HH2 ARG 7 -16.989 8.186 7.837 70 2HH2 ARG 7 2HH2 ARG 7 -18.080 6.860 8.059 71 H HIS 8 H HIS 8 -11.357 2.951 4.143 72 HA HIS 8 HA HIS 8 -11.429 0.292 5.342 73 1HB HIS 8 1HB HIS 8 -13.500 -0.397 4.112 74 2HB HIS 8 2HB HIS 8 -13.816 0.769 5.395 75 HD1 HIS 8 HD1 HIS 8 -15.053 2.837 4.721 76 HD2 HIS 8 HD2 HIS 8 -13.298 0.954 1.442 77 HE1 HIS 8 HE1 HIS 8 -15.811 4.115 2.671 78 H VAL 9 H VAL 9 -11.291 -1.397 3.570 79 HA VAL 9 HA VAL 9 -9.497 -0.430 1.472 80 HB VAL 9 HB VAL 9 -9.050 -2.571 2.598 81 1HG1 VAL 9 1HG1 VAL 9 -11.787 -2.956 2.444 82 2HG1 VAL 9 2HG1 VAL 9 -11.167 -4.089 1.245 83 3HG1 VAL 9 3HG1 VAL 9 -10.607 -4.179 2.915 84 1HG2 VAL 9 1HG2 VAL 9 -9.765 -2.763 -0.342 85 2HG2 VAL 9 2HG2 VAL 9 -8.187 -2.394 0.355 86 3HG2 VAL 9 3HG2 VAL 9 -8.868 -4.013 0.520 87 H VAL 10 H VAL 10 -10.776 0.852 0.093 88 HA VAL 10 HA VAL 10 -13.355 0.261 -0.869 89 HB VAL 10 HB VAL 10 -12.482 2.448 -1.301 90 1HG1 VAL 10 1HG1 VAL 10 -10.049 1.268 -1.662 91 2HG1 VAL 10 2HG1 VAL 10 -10.471 1.661 -3.322 92 3HG1 VAL 10 3HG1 VAL 10 -10.410 2.932 -2.103 93 1HG2 VAL 10 1HG2 VAL 10 -13.647 0.900 -3.315 94 2HG2 VAL 10 2HG2 VAL 10 -13.510 2.657 -3.312 95 3HG2 VAL 10 3HG2 VAL 10 -12.288 1.680 -4.125 96 H SER 11 H SER 11 -10.251 -0.515 -2.539 97 HA SER 11 HA SER 11 -11.793 -2.632 -3.971 98 1HB SER 11 1HB SER 11 -10.636 -0.515 -5.190 99 2HB SER 11 2HB SER 11 -9.278 -1.637 -5.190 100 HG SER 11 HG SER 11 -11.887 -2.035 -6.234 101 H CYS 12 H CYS 12 -10.665 -4.651 -4.303 102 HA CYS 12 HA CYS 12 -8.080 -4.949 -2.855 103 1HB CYS 12 1HB CYS 12 -8.930 -7.075 -1.842 104 2HB CYS 12 2HB CYS 12 -9.767 -5.642 -1.248 105 HG CYS 12 HG CYS 12 -11.296 -6.719 -3.592 106 H SER 13 H SER 13 -6.661 -5.887 -4.213 107 HA SER 13 HA SER 13 -7.702 -7.835 -6.230 108 1HB SER 13 1HB SER 13 -5.860 -5.505 -6.532 109 2HB SER 13 2HB SER 13 -5.518 -6.945 -7.487 110 HG SER 13 HG SER 13 -7.808 -5.296 -7.471 111 H SER 14 H SER 14 -6.812 -8.561 -3.677 112 HA SER 14 HA SER 14 -5.298 -10.773 -3.867 113 1HB SER 14 1HB SER 14 -3.492 -8.399 -4.019 114 2HB SER 14 2HB SER 14 -2.978 -9.763 -3.035 115 HG SER 14 HG SER 14 -3.303 -11.096 -4.862 116 H GLN 15 H GLN 15 -6.979 -10.662 -2.111 117 HA GLN 15 HA GLN 15 -5.643 -10.118 0.477 118 1HB GLN 15 1HB GLN 15 -6.835 -8.236 0.830 119 2HB GLN 15 2HB GLN 15 -7.695 -8.452 -0.675 120 1HG GLN 15 1HG GLN 15 -8.600 -10.006 1.737 121 2HG GLN 15 2HG GLN 15 -9.002 -8.301 1.602 122 1HE2 GLN 15 2HE2 GLN 15 -8.712 -10.341 -1.302 123 2HE2 GLN 15 1HE2 GLN 15 -10.367 -10.315 -1.679 124 H ASP 16 H ASP 16 -6.236 -11.608 2.067 125 HA ASP 16 HA ASP 16 -7.861 -13.900 1.135 126 1HB ASP 16 1HB ASP 16 -5.617 -13.542 2.897 127 2HB ASP 16 2HB ASP 16 -6.928 -14.284 3.808 128 H SER 17 H SER 17 -8.840 -14.801 3.622 129 HA SER 17 HA SER 17 -11.025 -12.844 4.029 130 1HB SER 17 1HB SER 17 -12.089 -14.796 5.270 131 2HB SER 17 2HB SER 17 -11.817 -15.056 3.550 132 HG SER 17 HG SER 17 -10.931 -16.814 4.426 133 H THR 18 H THR 18 -9.196 -15.074 6.168 134 HA THR 18 HA THR 18 -9.740 -13.601 8.556 135 HB THR 18 HB THR 18 -7.403 -14.854 9.147 136 HG1 THR 18 HG1 THR 18 -6.933 -15.688 7.208 137 1HG2 THR 18 1HG2 THR 18 -9.801 -15.186 10.017 138 2HG2 THR 18 2HG2 THR 18 -9.945 -16.433 8.778 139 3HG2 THR 18 3HG2 THR 18 -8.735 -16.590 10.052 140 H HIS 19 H HIS 19 -6.713 -13.773 6.649 141 HA HIS 19 HA HIS 19 -5.861 -11.198 7.874 142 1HB HIS 19 1HB HIS 19 -4.277 -13.039 6.053 143 2HB HIS 19 2HB HIS 19 -3.647 -11.718 7.036 144 HD1 HIS 19 HD1 HIS 19 -2.696 -14.696 7.386 145 HD2 HIS 19 HD2 HIS 19 -5.629 -12.847 9.701 146 HE1 HIS 19 HE1 HIS 19 -2.809 -15.985 9.563 147 H CYS 20 H CYS 20 -7.546 -10.073 6.563 148 HA CYS 20 HA CYS 20 -6.965 -9.952 3.656 149 1HB CYS 20 1HB CYS 20 -9.057 -8.608 3.528 150 2HB CYS 20 2HB CYS 20 -9.313 -10.197 4.232 151 HG CYS 20 HG CYS 20 -10.372 -8.061 5.640 152 H ALA 21 H ALA 21 -7.115 -7.720 2.676 153 HA ALA 21 HA ALA 21 -5.026 -6.064 3.691 154 1HB ALA 21 1HB ALA 21 -6.790 -6.146 1.388 155 2HB ALA 21 2HB ALA 21 -6.585 -4.490 1.959 156 3HB ALA 21 3HB ALA 21 -5.174 -5.455 1.526 157 H GLU 22 H GLU 22 -8.461 -6.131 4.322 158 HA GLU 22 HA GLU 22 -8.825 -3.450 5.221 159 1HB GLU 22 1HB GLU 22 -10.452 -5.633 4.999 160 2HB GLU 22 2HB GLU 22 -10.242 -5.554 6.748 161 1HG GLU 22 1HG GLU 22 -10.888 -3.145 6.684 162 2HG GLU 22 2HG GLU 22 -11.188 -3.299 4.953 163 H ASN 23 H ASN 23 -7.023 -6.082 6.602 164 HA ASN 23 HA ASN 23 -7.129 -5.287 9.362 165 1HB ASN 23 1HB ASN 23 -5.203 -6.897 7.712 166 2HB ASN 23 2HB ASN 23 -4.834 -6.504 9.390 167 1HD2 ASN 23 1HD2 ASN 23 -7.097 -8.276 7.300 168 2HD2 ASN 23 2HD2 ASN 23 -7.787 -9.204 8.543 169 H LEU 24 H LEU 24 -5.650 -3.887 6.604 170 HA LEU 24 HA LEU 24 -3.402 -2.601 7.810 171 1HB LEU 24 1HB LEU 24 -5.081 -1.643 5.469 172 2HB LEU 24 2HB LEU 24 -3.419 -1.177 5.832 173 HG LEU 24 HG LEU 24 -4.084 -4.088 5.485 174 1HD1 LEU 24 1HD1 LEU 24 -5.001 -2.659 3.542 175 2HD1 LEU 24 2HD1 LEU 24 -3.309 -2.342 3.158 176 3HD1 LEU 24 3HD1 LEU 24 -3.923 -3.995 3.138 177 1HD2 LEU 24 1HD2 LEU 24 -1.708 -2.319 5.511 178 2HD2 LEU 24 2HD2 LEU 24 -1.876 -3.993 6.041 179 3HD2 LEU 24 3HD2 LEU 24 -1.676 -3.627 4.328 180 H LEU 25 H LEU 25 -6.851 -1.963 7.790 181 HA LEU 25 HA LEU 25 -6.829 0.779 8.555 182 1HB LEU 25 1HB LEU 25 -8.726 -1.532 8.905 183 2HB LEU 25 2HB LEU 25 -9.054 -0.009 9.708 184 HG LEU 25 HG LEU 25 -10.183 -0.215 7.486 185 1HD1 LEU 25 1HD1 LEU 25 -8.073 1.950 7.687 186 2HD1 LEU 25 2HD1 LEU 25 -9.486 2.002 6.642 187 3HD1 LEU 25 3HD1 LEU 25 -9.686 2.001 8.393 188 1HD2 LEU 25 1HD2 LEU 25 -8.306 -1.517 6.416 189 2HD2 LEU 25 2HD2 LEU 25 -8.883 -0.163 5.445 190 3HD2 LEU 25 3HD2 LEU 25 -7.377 -0.019 6.351 191 H LYS 26 H LYS 26 -5.938 -2.111 10.245 192 HA LYS 26 HA LYS 26 -5.755 -0.567 12.793 193 1HB LYS 26 1HB LYS 26 -5.973 -3.585 12.552 194 2HB LYS 26 2HB LYS 26 -6.086 -2.616 14.020 195 1HG LYS 26 1HG LYS 26 -8.024 -2.320 11.715 196 2HG LYS 26 2HG LYS 26 -8.308 -3.416 13.068 197 1HD LYS 26 1HD LYS 26 -7.927 -1.395 14.594 198 2HD LYS 26 2HD LYS 26 -8.055 -0.405 13.139 199 1HE LYS 26 1HE LYS 26 -10.271 -0.424 13.835 200 2HE LYS 26 2HE LYS 26 -10.258 -1.816 12.753 201 1HZ LYS 26 1HZ LYS 26 -9.791 -3.219 14.712 202 2HZ LYS 26 2HZ LYS 26 -9.987 -1.857 15.708 203 3HZ LYS 26 3HZ LYS 26 -11.296 -2.435 14.798 204 H ALA 27 H ALA 27 -3.694 0.093 11.707 205 HA ALA 27 HA ALA 27 -1.542 -1.444 10.894 206 1HB ALA 27 1HB ALA 27 -1.739 1.109 12.445 207 2HB ALA 27 2HB ALA 27 -0.153 0.369 12.230 208 3HB ALA 27 3HB ALA 27 -1.107 0.832 10.821 209 H ASP 28 H ASP 28 -1.954 -0.367 14.274 210 HA ASP 28 HA ASP 28 0.026 -2.198 15.289 211 1HB ASP 28 1HB ASP 28 -2.206 -0.783 16.776 212 2HB ASP 28 2HB ASP 28 -0.756 -1.483 17.496 213 H THR 29 H THR 29 -2.654 -2.681 17.261 214 HA THR 29 HA THR 29 -3.828 -4.606 17.796 215 HB THR 29 HB THR 29 -4.979 -5.624 15.667 216 HG1 THR 29 HG1 THR 29 -4.382 -4.756 13.879 217 1HG2 THR 29 1HG2 THR 29 -5.863 -3.956 17.425 218 2HG2 THR 29 2HG2 THR 29 -5.526 -2.713 16.221 219 3HG2 THR 29 3HG2 THR 29 -6.679 -3.998 15.862 220 H TYR 30 H TYR 30 -3.321 -6.383 14.850 221 HA TYR 30 HA TYR 30 -0.774 -7.524 15.384 222 1HB TYR 30 1HB TYR 30 -1.459 -9.674 16.412 223 2HB TYR 30 2HB TYR 30 -1.820 -8.304 17.465 224 HD1 TYR 30 HD1 TYR 30 -4.149 -7.459 17.684 225 HD2 TYR 30 HD2 TYR 30 -3.221 -11.004 15.443 226 HE1 TYR 30 HE1 TYR 30 -6.541 -8.112 17.727 227 HE2 TYR 30 HE2 TYR 30 -5.613 -11.658 15.486 228 HH TYR 30 HH TYR 30 -8.085 -9.515 16.416 229 H ARG 31 H ARG 31 -2.392 -6.760 13.122 230 HA ARG 31 HA ARG 31 -2.218 -9.282 11.585 231 1HB ARG 31 1HB ARG 31 -4.742 -7.710 12.037 232 2HB ARG 31 2HB ARG 31 -4.504 -8.574 10.518 233 1HG ARG 31 1HG ARG 31 -4.263 -9.846 13.259 234 2HG ARG 31 2HG ARG 31 -5.702 -9.938 12.245 235 1HD ARG 31 1HD ARG 31 -4.812 -11.643 11.078 236 2HD ARG 31 2HD ARG 31 -3.395 -10.673 10.678 237 HE ARG 31 HE ARG 31 -3.291 -11.720 13.389 238 1HH1 ARG 31 1HH1 ARG 31 -2.684 -12.441 10.022 239 2HH1 ARG 31 2HH1 ARG 31 -1.508 -13.654 10.390 240 1HH2 ARG 31 1HH2 ARG 31 -1.757 -13.292 13.820 241 2HH2 ARG 31 2HH2 ARG 31 -0.985 -14.130 12.515 242 H LYS 32 H LYS 32 -1.902 -8.903 9.330 243 HA LYS 32 HA LYS 32 -1.608 -6.036 8.536 244 1HB LYS 32 1HB LYS 32 0.328 -8.206 7.693 245 2HB LYS 32 2HB LYS 32 0.488 -6.467 7.483 246 1HG LYS 32 1HG LYS 32 1.087 -6.110 9.694 247 2HG LYS 32 2HG LYS 32 0.231 -7.532 10.267 248 1HD LYS 32 1HD LYS 32 2.027 -8.777 8.736 249 2HD LYS 32 2HD LYS 32 2.957 -7.320 9.088 250 1HE LYS 32 1HE LYS 32 2.277 -7.735 11.557 251 2HE LYS 32 2HE LYS 32 1.867 -9.364 11.018 252 1HZ LYS 32 1HZ LYS 32 4.193 -9.329 9.980 253 2HZ LYS 32 2HZ LYS 32 4.496 -8.028 11.026 254 3HZ LYS 32 3HZ LYS 32 4.067 -9.544 11.661 255 H TRP 33 H TRP 33 -0.722 -6.602 5.875 256 HA TRP 33 HA TRP 33 -3.266 -7.580 4.723 257 1HB TRP 33 1HB TRP 33 -2.249 -5.472 3.834 258 2HB TRP 33 2HB TRP 33 -0.833 -6.384 3.366 259 HD1 TRP 33 HD1 TRP 33 -4.367 -7.754 2.877 260 HE1 TRP 33 HE1 TRP 33 -4.803 -8.009 0.333 261 HE3 TRP 33 HE3 TRP 33 -0.174 -5.548 1.099 262 HZ2 TRP 33 HZ2 TRP 33 -3.492 -7.334 -2.135 263 HZ3 TRP 33 HZ3 TRP 33 0.242 -5.373 -1.348 264 HH2 TRP 33 HH2 TRP 33 -1.416 -6.254 -2.958 265 H ARG 34 H ARG 34 -3.415 -9.433 3.494 266 HA ARG 34 HA ARG 34 -0.934 -10.936 2.880 267 1HB ARG 34 1HB ARG 34 -3.091 -11.769 4.749 268 2HB ARG 34 2HB ARG 34 -2.556 -12.995 3.601 269 1HG ARG 34 1HG ARG 34 -0.957 -13.381 5.190 270 2HG ARG 34 2HG ARG 34 -0.153 -12.028 4.394 271 1HD ARG 34 1HD ARG 34 -1.609 -10.578 6.049 272 2HD ARG 34 2HD ARG 34 -1.667 -12.072 6.985 273 HE ARG 34 HE ARG 34 0.636 -10.342 6.698 274 1HH1 ARG 34 1HH1 ARG 34 -0.355 -13.676 7.065 275 2HH1 ARG 34 2HH1 ARG 34 1.143 -14.146 7.788 276 1HH2 ARG 34 1HH2 ARG 34 2.556 -10.994 7.642 277 2HH2 ARG 34 2HH2 ARG 34 2.774 -12.646 8.114 278 H ALA 35 H ALA 35 -1.064 -11.784 0.838 279 HA ALA 35 HA ALA 35 -3.118 -11.089 -0.966 280 1HB ALA 35 1HB ALA 35 -0.754 -11.996 -1.463 281 2HB ALA 35 2HB ALA 35 -1.455 -13.601 -1.259 282 3HB ALA 35 3HB ALA 35 -2.052 -12.533 -2.529 283 H ALA 36 H ALA 36 -4.754 -12.399 -1.977 284 HA ALA 36 HA ALA 36 -6.346 -13.895 -0.123 285 1HB ALA 36 1HB ALA 36 -6.836 -12.620 -2.470 286 2HB ALA 36 2HB ALA 36 -6.833 -14.297 -3.016 287 3HB ALA 36 3HB ALA 36 -7.945 -13.785 -1.746 288 H LYS 37 H LYS 37 -3.791 -14.835 -2.291 289 HA LYS 37 HA LYS 37 -4.177 -17.647 -1.451 290 1HB LYS 37 1HB LYS 37 -3.622 -18.363 -3.800 291 2HB LYS 37 2HB LYS 37 -5.190 -17.572 -3.653 292 1HG LYS 37 1HG LYS 37 -4.057 -15.407 -4.302 293 2HG LYS 37 2HG LYS 37 -2.607 -16.346 -4.656 294 1HD LYS 37 1HD LYS 37 -5.104 -17.377 -5.874 295 2HD LYS 37 2HD LYS 37 -4.552 -15.821 -6.493 296 1HE LYS 37 1HE LYS 37 -2.636 -18.128 -6.192 297 2HE LYS 37 2HE LYS 37 -3.644 -17.969 -7.630 298 1HZ LYS 37 1HZ LYS 37 -1.940 -15.770 -6.614 299 2HZ LYS 37 2HZ LYS 37 -1.390 -16.904 -7.750 300 3HZ LYS 37 3HZ LYS 37 -2.698 -15.888 -8.130 301 H ALA 38 H ALA 38 -2.100 -18.827 -2.602 302 HA ALA 38 HA ALA 38 0.239 -17.395 -1.472 303 1HB ALA 38 1HB ALA 38 -0.280 -19.820 -0.905 304 2HB ALA 38 2HB ALA 38 0.128 -20.217 -2.574 305 3HB ALA 38 3HB ALA 38 1.352 -19.529 -1.507 306 H GLY 39 H GLY 39 2.279 -18.527 -3.009 307 1HA GLY 39 1HA GLY 39 3.461 -18.176 -5.014 308 2HA GLY 39 2HA GLY 39 1.904 -18.255 -5.845 309 H GLU 40 H GLU 40 3.077 -16.048 -3.359 310 HA GLU 40 HA GLU 40 1.875 -13.715 -4.308 311 1HB GLU 40 1HB GLU 40 4.036 -14.391 -2.433 312 2HB GLU 40 2HB GLU 40 4.161 -12.770 -3.109 313 1HG GLU 40 1HG GLU 40 1.416 -13.346 -2.387 314 2HG GLU 40 2HG GLU 40 2.484 -13.620 -1.016 315 H LYS 41 H LYS 41 2.195 -13.754 -6.599 316 HA LYS 41 HA LYS 41 4.922 -13.138 -7.584 317 1HB LYS 41 1HB LYS 41 3.968 -13.308 -9.831 318 2HB LYS 41 2HB LYS 41 3.501 -14.722 -8.893 319 1HG LYS 41 1HG LYS 41 1.340 -13.448 -8.342 320 2HG LYS 41 2HG LYS 41 1.810 -12.324 -9.616 321 1HD LYS 41 1HD LYS 41 0.637 -13.779 -10.938 322 2HD LYS 41 2HD LYS 41 2.159 -14.670 -10.924 323 1HE LYS 41 1HE LYS 41 -0.139 -15.107 -8.993 324 2HE LYS 41 2HE LYS 41 0.244 -16.140 -10.370 325 1HZ LYS 41 1HZ LYS 41 2.466 -16.476 -9.374 326 2HZ LYS 41 2HZ LYS 41 1.954 -15.616 -8.001 327 3HZ LYS 41 3HZ LYS 41 1.204 -17.083 -8.416 328 H THR 42 H THR 42 1.684 -11.723 -7.408 329 HA THR 42 HA THR 42 2.776 -9.044 -7.071 330 HB THR 42 HB THR 42 1.348 -8.196 -9.068 331 HG1 THR 42 HG1 THR 42 0.370 -9.741 -10.067 332 1HG2 THR 42 1HG2 THR 42 3.997 -8.703 -8.829 333 2HG2 THR 42 2HG2 THR 42 3.607 -9.750 -10.192 334 3HG2 THR 42 3HG2 THR 42 3.271 -8.020 -10.283 335 H ILE 43 H ILE 43 1.292 -7.893 -5.830 336 HA ILE 43 HA ILE 43 -1.532 -8.884 -5.824 337 HB ILE 43 HB ILE 43 -1.518 -8.361 -3.319 338 1HG1 ILE 43 1HG1 ILE 43 1.465 -8.709 -3.661 339 2HG1 ILE 43 2HG1 ILE 43 0.679 -7.152 -3.389 340 1HG2 ILE 43 1HG2 ILE 43 -1.155 -10.670 -4.666 341 2HG2 ILE 43 2HG2 ILE 43 0.332 -10.629 -3.728 342 3HG2 ILE 43 3HG2 ILE 43 -1.223 -10.575 -2.909 343 1HD1 ILE 43 1HD1 ILE 43 -0.467 -8.504 -1.386 344 2HD1 ILE 43 2HD1 ILE 43 1.008 -9.459 -1.517 345 3HD1 ILE 43 3HD1 ILE 43 1.105 -7.729 -1.189 346 H SER 44 H SER 44 -3.107 -7.276 -5.619 347 HA SER 44 HA SER 44 -2.063 -4.497 -5.291 348 1HB SER 44 1HB SER 44 -3.989 -5.555 -7.337 349 2HB SER 44 2HB SER 44 -3.949 -3.850 -6.911 350 HG SER 44 HG SER 44 -2.108 -5.423 -8.275 351 H VAL 45 H VAL 45 -3.424 -3.062 -4.193 352 HA VAL 45 HA VAL 45 -6.048 -3.958 -3.227 353 HB VAL 45 HB VAL 45 -4.484 -5.040 -1.628 354 1HG1 VAL 45 1HG1 VAL 45 -2.704 -3.214 -1.943 355 2HG1 VAL 45 2HG1 VAL 45 -3.639 -2.262 -0.791 356 3HG1 VAL 45 3HG1 VAL 45 -2.946 -3.807 -0.302 357 1HG2 VAL 45 1HG2 VAL 45 -6.262 -2.786 -0.744 358 2HG2 VAL 45 2HG2 VAL 45 -6.490 -4.525 -0.560 359 3HG2 VAL 45 3HG2 VAL 45 -5.326 -3.676 0.456 360 H VAL 46 H VAL 46 -7.265 -2.128 -3.446 361 HA VAL 46 HA VAL 46 -5.904 0.500 -3.221 362 HB VAL 46 HB VAL 46 -8.753 -0.009 -4.091 363 1HG1 VAL 46 1HG1 VAL 46 -7.936 2.293 -3.367 364 2HG1 VAL 46 2HG1 VAL 46 -6.882 2.256 -4.780 365 3HG1 VAL 46 3HG1 VAL 46 -8.633 2.195 -4.984 366 1HG2 VAL 46 1HG2 VAL 46 -6.634 -1.055 -5.446 367 2HG2 VAL 46 2HG2 VAL 46 -8.087 -0.458 -6.244 368 3HG2 VAL 46 3HG2 VAL 46 -6.663 0.571 -6.122 369 H LEU 47 H LEU 47 -6.130 1.662 -1.395 370 HA LEU 47 HA LEU 47 -8.216 0.818 0.561 371 1HB LEU 47 1HB LEU 47 -5.894 2.669 1.118 372 2HB LEU 47 2HB LEU 47 -6.860 1.755 2.274 373 HG LEU 47 HG LEU 47 -5.905 -0.268 0.693 374 1HD1 LEU 47 1HD1 LEU 47 -4.480 1.800 -0.284 375 2HD1 LEU 47 2HD1 LEU 47 -3.438 1.351 1.066 376 3HD1 LEU 47 3HD1 LEU 47 -3.831 0.164 -0.178 377 1HD2 LEU 47 1HD2 LEU 47 -5.845 0.182 3.263 378 2HD2 LEU 47 2HD2 LEU 47 -4.605 -0.860 2.566 379 3HD2 LEU 47 3HD2 LEU 47 -4.230 0.819 2.954 380 H GLN 48 H GLN 48 -9.535 2.405 1.557 381 HA GLN 48 HA GLN 48 -10.018 4.782 -0.142 382 1HB GLN 48 1HB GLN 48 -11.917 3.298 0.519 383 2HB GLN 48 2HB GLN 48 -11.609 3.701 2.207 384 1HG GLN 48 1HG GLN 48 -13.307 5.212 1.599 385 2HG GLN 48 2HG GLN 48 -11.838 6.172 1.427 386 1HE2 GLN 48 2HE2 GLN 48 -12.349 7.511 -0.350 387 2HE2 GLN 48 1HE2 GLN 48 -12.829 6.926 -1.869 388 H LEU 49 H LEU 49 -9.936 6.903 0.703 389 HA LEU 49 HA LEU 49 -8.368 7.191 3.208 390 1HB LEU 49 1HB LEU 49 -8.812 8.956 0.796 391 2HB LEU 49 2HB LEU 49 -8.197 9.622 2.304 392 HG LEU 49 HG LEU 49 -6.348 9.024 0.789 393 1HD1 LEU 49 1HD1 LEU 49 -6.403 8.586 3.410 394 2HD1 LEU 49 2HD1 LEU 49 -6.236 6.908 2.897 395 3HD1 LEU 49 3HD1 LEU 49 -5.017 8.096 2.436 396 1HD2 LEU 49 1HD2 LEU 49 -7.873 6.989 -0.078 397 2HD2 LEU 49 2HD2 LEU 49 -6.115 6.967 -0.220 398 3HD2 LEU 49 3HD2 LEU 49 -6.903 6.110 1.105 399 H GLU 50 H GLU 50 -9.466 7.835 4.967 400 HA GLU 50 HA GLU 50 -12.245 8.323 5.074 401 1HB GLU 50 1HB GLU 50 -10.691 7.731 6.990 402 2HB GLU 50 2HB GLU 50 -10.241 9.435 7.043 403 1HG GLU 50 1HG GLU 50 -13.155 8.935 6.977 404 2HG GLU 50 2HG GLU 50 -12.343 8.353 8.430 405 H LYS 51 H LYS 51 -10.018 10.433 3.667 406 HA LYS 51 HA LYS 51 -11.964 12.573 3.542 407 1HB LYS 51 1HB LYS 51 -10.375 14.283 4.544 408 2HB LYS 51 2HB LYS 51 -11.102 13.177 5.709 409 1HG LYS 51 1HG LYS 51 -9.108 12.213 6.223 410 2HG LYS 51 2HG LYS 51 -8.578 12.193 4.542 411 1HD LYS 51 1HD LYS 51 -7.987 14.559 4.660 412 2HD LYS 51 2HD LYS 51 -8.612 14.659 6.306 413 1HE LYS 51 1HE LYS 51 -6.604 12.529 5.841 414 2HE LYS 51 2HE LYS 51 -5.997 14.180 5.722 415 1HZ LYS 51 1HZ LYS 51 -7.098 14.613 7.892 416 2HZ LYS 51 2HZ LYS 51 -7.426 12.954 8.013 417 3HZ LYS 51 3HZ LYS 51 -5.817 13.500 7.973 418 H GLU 52 H GLU 52 -11.600 13.718 1.662 419 HA GLU 52 HA GLU 52 -9.435 12.872 -0.080 420 1HB GLU 52 1HB GLU 52 -11.863 13.701 -0.696 421 2HB GLU 52 2HB GLU 52 -11.110 15.294 -0.625 422 1HG GLU 52 1HG GLU 52 -9.250 14.080 -2.100 423 2HG GLU 52 2HG GLU 52 -10.619 13.059 -2.539 424 H GLU 53 H GLU 53 -7.449 13.602 0.306 425 HA GLU 53 HA GLU 53 -7.029 16.511 0.705 426 1HB GLU 53 1HB GLU 53 -5.148 15.743 2.397 427 2HB GLU 53 2HB GLU 53 -6.801 15.954 2.957 428 1HG GLU 53 1HG GLU 53 -5.749 13.824 3.767 429 2HG GLU 53 2HG GLU 53 -7.209 13.554 2.823 430 H GLN 54 H GLN 54 -4.432 16.755 0.798 431 HA GLN 54 HA GLN 54 -3.487 15.493 -1.709 432 1HB GLN 54 1HB GLN 54 -2.268 17.716 -0.032 433 2HB GLN 54 2HB GLN 54 -1.666 17.165 -1.595 434 1HG GLN 54 1HG GLN 54 -3.583 17.947 -2.739 435 2HG GLN 54 2HG GLN 54 -4.500 18.113 -1.252 436 1HE2 GLN 54 2HE2 GLN 54 -1.129 19.231 -1.624 437 2HE2 GLN 54 1HE2 GLN 54 -1.490 20.881 -1.470 438 H ILE 55 H ILE 55 -1.258 14.544 -1.721 439 HA ILE 55 HA ILE 55 -0.596 13.345 0.944 440 HB ILE 55 HB ILE 55 0.042 12.237 -1.807 441 1HG1 ILE 55 1HG1 ILE 55 -1.745 10.502 -0.747 442 2HG1 ILE 55 2HG1 ILE 55 -2.334 12.002 -0.030 443 1HG2 ILE 55 1HG2 ILE 55 1.437 11.654 0.325 444 2HG2 ILE 55 2HG2 ILE 55 0.012 10.729 0.799 445 3HG2 ILE 55 3HG2 ILE 55 0.861 10.337 -0.697 446 1HD1 ILE 55 1HD1 ILE 55 -1.671 11.971 -2.952 447 2HD1 ILE 55 2HD1 ILE 55 -3.183 11.236 -2.418 448 3HD1 ILE 55 3HD1 ILE 55 -2.865 12.939 -2.087 449 H HIS 56 H HIS 56 1.309 13.998 1.805 450 HA HIS 56 HA HIS 56 3.354 15.157 -0.047 451 1HB HIS 56 1HB HIS 56 2.349 16.726 1.647 452 2HB HIS 56 2HB HIS 56 3.036 15.711 2.915 453 HD1 HIS 56 HD1 HIS 56 3.950 18.237 0.330 454 HD2 HIS 56 HD2 HIS 56 5.917 15.758 3.044 455 HE1 HIS 56 HE1 HIS 56 6.345 19.052 0.438 456 H SER 57 H SER 57 2.765 12.884 2.580 457 HA SER 57 HA SER 57 5.382 11.622 2.004 458 1HB SER 57 1HB SER 57 4.612 12.832 4.653 459 2HB SER 57 2HB SER 57 5.706 11.456 4.580 460 HG SER 57 HG SER 57 6.499 13.809 4.419 461 H VAL 58 H VAL 58 5.479 9.442 2.835 462 HA VAL 58 HA VAL 58 2.911 8.320 3.820 463 HB VAL 58 HB VAL 58 4.387 7.406 1.338 464 1HG1 VAL 58 1HG1 VAL 58 2.007 6.283 2.835 465 2HG1 VAL 58 2HG1 VAL 58 2.310 5.905 1.139 466 3HG1 VAL 58 3HG1 VAL 58 3.487 5.446 2.369 467 1HG2 VAL 58 1HG2 VAL 58 1.816 8.903 1.818 468 2HG2 VAL 58 2HG2 VAL 58 3.145 9.316 0.734 469 3HG2 VAL 58 3HG2 VAL 58 2.067 7.977 0.338 470 H ASP 59 H ASP 59 3.175 6.215 4.771 471 HA ASP 59 HA ASP 59 5.962 5.250 5.151 472 1HB ASP 59 1HB ASP 59 5.373 6.702 7.102 473 2HB ASP 59 2HB ASP 59 3.984 5.667 7.417 474 H ILE 60 H ILE 60 5.643 3.333 4.072 475 HA ILE 60 HA ILE 60 3.478 1.557 5.073 476 HB ILE 60 HB ILE 60 4.376 2.141 2.246 477 1HG1 ILE 60 1HG1 ILE 60 1.553 1.598 2.960 478 2HG1 ILE 60 2HG1 ILE 60 2.262 3.038 3.691 479 1HG2 ILE 60 1HG2 ILE 60 3.340 -0.446 3.314 480 2HG2 ILE 60 2HG2 ILE 60 2.718 0.113 1.761 481 3HG2 ILE 60 3HG2 ILE 60 4.449 -0.147 1.975 482 1HD1 ILE 60 1HD1 ILE 60 3.124 3.551 1.287 483 2HD1 ILE 60 2HD1 ILE 60 1.896 2.394 0.772 484 3HD1 ILE 60 3HD1 ILE 60 1.424 3.848 1.652 485 H GLY 61 H GLY 61 4.171 -0.522 5.484 486 1HA GLY 61 1HA GLY 61 7.094 -0.962 5.167 487 2HA GLY 61 2HA GLY 61 6.183 -1.619 6.507 488 H ASN 62 H ASN 62 7.795 -2.754 4.221 489 HA ASN 62 HA ASN 62 5.851 -4.368 2.718 490 1HB ASN 62 1HB ASN 62 7.909 -5.399 1.723 491 2HB ASN 62 2HB ASN 62 7.849 -3.645 1.550 492 1HD2 ASN 62 2HD2 ASN 62 9.711 -2.567 2.217 493 2HD2 ASN 62 1HD2 ASN 62 10.865 -3.190 3.292 494 H ASP 63 H ASP 63 5.376 -6.536 3.106 495 HA ASP 63 HA ASP 63 6.647 -7.743 5.536 496 1HB ASP 63 1HB ASP 63 4.158 -7.302 5.631 497 2HB ASP 63 2HB ASP 63 3.964 -8.455 4.310 498 H GLY 64 H GLY 64 8.319 -8.176 3.697 499 1HA GLY 64 1HA GLY 64 9.368 -10.198 2.849 500 2HA GLY 64 2HA GLY 64 7.763 -10.895 2.618 501 H SER 65 H SER 65 6.822 -8.264 1.449 502 HA SER 65 HA SER 65 7.170 -8.858 -1.314 503 1HB SER 65 1HB SER 65 6.500 -6.157 -0.128 504 2HB SER 65 2HB SER 65 6.077 -6.749 -1.731 505 HG SER 65 HG SER 65 4.375 -6.915 -0.140 506 H ALA 66 H ALA 66 8.000 -6.985 -2.820 507 HA ALA 66 HA ALA 66 10.623 -5.979 -1.827 508 1HB ALA 66 1HB ALA 66 10.953 -8.098 -3.110 509 2HB ALA 66 2HB ALA 66 10.170 -7.341 -4.498 510 3HB ALA 66 3HB ALA 66 11.702 -6.710 -3.898 511 H PHE 67 H PHE 67 8.323 -5.942 -4.561 512 HA PHE 67 HA PHE 67 9.063 -3.088 -5.043 513 1HB PHE 67 1HB PHE 67 7.403 -4.941 -6.778 514 2HB PHE 67 2HB PHE 67 8.006 -3.354 -7.226 515 HD1 PHE 67 HD1 PHE 67 10.756 -3.328 -6.267 516 HD2 PHE 67 HD2 PHE 67 8.526 -6.522 -8.076 517 HE1 PHE 67 HE1 PHE 67 12.868 -4.358 -7.050 518 HE2 PHE 67 HE2 PHE 67 10.632 -7.556 -8.853 519 HZ PHE 67 HZ PHE 67 12.810 -6.476 -8.344 520 H VAL 68 H VAL 68 7.634 -1.478 -4.574 521 HA VAL 68 HA VAL 68 4.783 -2.236 -4.074 522 HB VAL 68 HB VAL 68 6.455 -0.451 -2.280 523 1HG1 VAL 68 1HG1 VAL 68 4.037 0.182 -2.478 524 2HG1 VAL 68 2HG1 VAL 68 3.604 -1.450 -1.969 525 3HG1 VAL 68 3HG1 VAL 68 4.467 -0.380 -0.863 526 1HG2 VAL 68 1HG2 VAL 68 5.326 -3.240 -1.915 527 2HG2 VAL 68 2HG2 VAL 68 7.033 -2.808 -2.020 528 3HG2 VAL 68 3HG2 VAL 68 6.075 -2.287 -0.633 529 H GLU 69 H GLU 69 3.738 -1.158 -5.638 530 HA GLU 69 HA GLU 69 4.588 1.618 -6.338 531 1HB GLU 69 1HB GLU 69 4.402 0.030 -8.217 532 2HB GLU 69 2HB GLU 69 2.732 -0.311 -7.774 533 1HG GLU 69 1HG GLU 69 1.956 1.624 -8.695 534 2HG GLU 69 2HG GLU 69 3.347 2.559 -8.150 535 H VAL 70 H VAL 70 3.099 3.346 -6.195 536 HA VAL 70 HA VAL 70 0.465 2.678 -4.965 537 HB VAL 70 HB VAL 70 2.175 5.010 -4.102 538 1HG1 VAL 70 1HG1 VAL 70 -0.552 4.025 -3.502 539 2HG1 VAL 70 2HG1 VAL 70 0.399 4.558 -2.115 540 3HG1 VAL 70 3HG1 VAL 70 0.090 5.666 -3.451 541 1HG2 VAL 70 1HG2 VAL 70 1.859 2.224 -2.998 542 2HG2 VAL 70 2HG2 VAL 70 3.345 3.134 -3.272 543 3HG2 VAL 70 3HG2 VAL 70 2.275 3.573 -1.941 544 H LEU 71 H LEU 71 -1.192 3.622 -5.964 545 HA LEU 71 HA LEU 71 -0.645 5.893 -7.823 546 1HB LEU 71 1HB LEU 71 -2.184 3.411 -8.101 547 2HB LEU 71 2HB LEU 71 -3.125 4.837 -8.526 548 HG LEU 71 HG LEU 71 -1.205 5.557 -9.994 549 1HD1 LEU 71 1HD1 LEU 71 0.389 3.973 -8.689 550 2HD1 LEU 71 2HD1 LEU 71 -0.247 2.710 -9.743 551 3HD1 LEU 71 3HD1 LEU 71 0.593 4.098 -10.436 552 1HD2 LEU 71 1HD2 LEU 71 -3.296 3.992 -10.584 553 2HD2 LEU 71 2HD2 LEU 71 -2.060 4.374 -11.782 554 3HD2 LEU 71 3HD2 LEU 71 -2.008 2.835 -10.921 555 H VAL 72 H VAL 72 -2.422 7.473 -7.955 556 HA VAL 72 HA VAL 72 -3.950 7.668 -5.389 557 HB VAL 72 HB VAL 72 -3.771 10.164 -5.818 558 1HG1 VAL 72 1HG1 VAL 72 -1.412 8.424 -5.121 559 2HG1 VAL 72 2HG1 VAL 72 -1.345 10.181 -4.976 560 3HG1 VAL 72 3HG1 VAL 72 -2.511 9.261 -4.024 561 1HG2 VAL 72 1HG2 VAL 72 -3.047 9.955 -8.191 562 2HG2 VAL 72 2HG2 VAL 72 -1.898 10.892 -7.237 563 3HG2 VAL 72 3HG2 VAL 72 -1.544 9.215 -7.645 564 H GLY 73 H GLY 73 -6.032 8.736 -5.533 565 1HA GLY 73 1HA GLY 73 -7.180 9.645 -7.972 566 2HA GLY 73 2HA GLY 73 -7.648 7.968 -7.706 567 H SER 74 H SER 74 -9.606 9.755 -7.730 568 HA SER 74 HA SER 74 -10.302 10.235 -4.889 569 1HB SER 74 1HB SER 74 -10.235 12.326 -6.066 570 2HB SER 74 2HB SER 74 -11.161 11.661 -7.402 571 HG SER 74 HG SER 74 -11.987 12.264 -4.769 572 H SER 75 H SER 75 -12.704 10.213 -4.547 573 HA SER 75 HA SER 75 -13.797 7.688 -5.452 574 1HB SER 75 1HB SER 75 -15.729 8.315 -4.025 575 2HB SER 75 2HB SER 75 -14.211 8.525 -3.158 576 HG SER 75 HG SER 75 -14.594 10.584 -3.065 577 H ALA 76 H ALA 76 -13.597 10.655 -6.942 578 HA ALA 76 HA ALA 76 -16.138 11.277 -7.920 579 1HB ALA 76 1HB ALA 76 -13.668 12.236 -8.405 580 2HB ALA 76 2HB ALA 76 -13.923 11.335 -9.900 581 3HB ALA 76 3HB ALA 76 -15.051 12.609 -9.435 582 H GLY 77 H GLY 77 -17.336 10.618 -9.777 583 1HA GLY 77 1HA GLY 77 -18.007 9.169 -11.521 584 2HA GLY 77 2HA GLY 77 -16.426 8.391 -11.434 585 H GLY 78 H GLY 78 -16.143 7.227 -9.151 586 1HA GLY 78 1HA GLY 78 -17.745 6.141 -7.405 587 2HA GLY 78 2HA GLY 78 -18.542 5.483 -8.836 588 H ALA 79 H ALA 79 -18.044 3.309 -8.426 589 HA ALA 79 HA ALA 79 -15.369 2.414 -7.763 590 1HB ALA 79 1HB ALA 79 -17.442 1.129 -7.211 591 2HB ALA 79 2HB ALA 79 -17.674 0.824 -8.932 592 3HB ALA 79 3HB ALA 79 -16.263 0.167 -8.104 593 H GLY 80 H GLY 80 -14.477 3.819 -9.633 594 1HA GLY 80 1HA GLY 80 -14.751 2.649 -12.317 595 2HA GLY 80 2HA GLY 80 -13.757 4.042 -11.890 596 H GLU 81 H GLU 81 -12.125 3.077 -9.927 597 HA GLU 81 HA GLU 81 -10.136 1.877 -9.616 598 1HB GLU 81 1HB GLU 81 -12.065 -0.115 -10.698 599 2HB GLU 81 2HB GLU 81 -10.359 -0.562 -10.739 600 1HG GLU 81 1HG GLU 81 -11.664 0.540 -8.246 601 2HG GLU 81 2HG GLU 81 -11.647 -1.187 -8.609 602 H GLN 82 H GLN 82 -10.647 3.464 -12.150 603 HA GLN 82 HA GLN 82 -8.286 2.455 -13.612 604 1HB GLN 82 1HB GLN 82 -10.612 1.581 -14.561 605 2HB GLN 82 2HB GLN 82 -10.656 3.190 -15.283 606 1HG GLN 82 1HG GLN 82 -8.480 2.811 -16.336 607 2HG GLN 82 2HG GLN 82 -8.356 1.233 -15.559 608 1HE2 GLN 82 2HE2 GLN 82 -8.777 -0.362 -17.090 609 2HE2 GLN 82 1HE2 GLN 82 -10.001 -0.287 -18.264 610 H ASP 83 H ASP 83 -9.276 4.900 -11.991 611 HA ASP 83 HA ASP 83 -8.377 6.927 -13.989 612 1HB ASP 83 1HB ASP 83 -10.906 6.941 -13.417 613 2HB ASP 83 2HB ASP 83 -10.403 7.562 -11.845 614 H TYR 84 H TYR 84 -6.532 5.769 -12.356 615 HA TYR 84 HA TYR 84 -6.082 7.795 -10.226 616 1HB TYR 84 1HB TYR 84 -5.280 4.870 -10.327 617 2HB TYR 84 2HB TYR 84 -4.601 6.014 -9.174 618 HD1 TYR 84 HD1 TYR 84 -8.049 5.210 -10.472 619 HD2 TYR 84 HD2 TYR 84 -5.540 5.902 -7.061 620 HE1 TYR 84 HE1 TYR 84 -9.994 4.879 -8.984 621 HE2 TYR 84 HE2 TYR 84 -7.491 5.570 -5.568 622 HH TYR 84 HH TYR 84 -10.422 5.852 -6.279 623 H GLU 85 H GLU 85 -3.892 8.535 -10.066 624 HA GLU 85 HA GLU 85 -2.310 8.022 -12.534 625 1HB GLU 85 1HB GLU 85 -1.692 10.237 -12.660 626 2HB GLU 85 2HB GLU 85 -3.276 10.407 -11.925 627 1HG GLU 85 1HG GLU 85 -2.193 11.670 -10.389 628 2HG GLU 85 2HG GLU 85 -1.671 10.131 -9.717 629 H VAL 86 H VAL 86 -0.116 7.560 -12.365 630 HA VAL 86 HA VAL 86 0.691 6.098 -10.062 631 HB VAL 86 HB VAL 86 2.496 7.270 -12.192 632 1HG1 VAL 86 1HG1 VAL 86 3.532 6.256 -10.109 633 2HG1 VAL 86 2HG1 VAL 86 2.782 4.728 -10.569 634 3HG1 VAL 86 3HG1 VAL 86 3.988 5.470 -11.621 635 1HG2 VAL 86 1HG2 VAL 86 0.530 5.028 -12.209 636 2HG2 VAL 86 2HG2 VAL 86 1.066 6.061 -13.534 637 3HG2 VAL 86 3HG2 VAL 86 2.085 4.730 -12.985 638 H LEU 87 H LEU 87 0.463 7.493 -8.235 639 HA LEU 87 HA LEU 87 1.774 10.028 -7.929 640 1HB LEU 87 1HB LEU 87 -0.012 8.999 -6.422 641 2HB LEU 87 2HB LEU 87 1.261 7.993 -5.740 642 HG LEU 87 HG LEU 87 2.528 10.240 -5.378 643 1HD1 LEU 87 1HD1 LEU 87 -0.155 11.109 -6.281 644 2HD1 LEU 87 2HD1 LEU 87 0.436 11.911 -4.827 645 3HD1 LEU 87 3HD1 LEU 87 1.380 11.976 -6.314 646 1HD2 LEU 87 1HD2 LEU 87 0.226 9.095 -3.845 647 2HD2 LEU 87 2HD2 LEU 87 1.926 9.210 -3.392 648 3HD2 LEU 87 3HD2 LEU 87 0.891 10.635 -3.302 649 H LEU 88 H LEU 88 2.793 6.701 -7.129 650 HA LEU 88 HA LEU 88 5.589 7.582 -7.440 651 1HB LEU 88 1HB LEU 88 6.327 6.681 -5.317 652 2HB LEU 88 2HB LEU 88 5.081 7.896 -5.045 653 HG LEU 88 HG LEU 88 3.568 5.637 -5.280 654 1HD1 LEU 88 1HD1 LEU 88 6.316 4.878 -4.462 655 2HD1 LEU 88 2HD1 LEU 88 5.016 4.220 -3.469 656 3HD1 LEU 88 3HD1 LEU 88 5.051 3.898 -5.202 657 1HD2 LEU 88 1HD2 LEU 88 4.796 7.094 -2.949 658 2HD2 LEU 88 2HD2 LEU 88 3.125 7.119 -3.513 659 3HD2 LEU 88 3HD2 LEU 88 3.748 5.705 -2.662 660 H VAL 89 H VAL 89 6.615 6.126 -8.672 661 HA VAL 89 HA VAL 89 5.432 3.777 -9.687 662 HB VAL 89 HB VAL 89 7.755 3.156 -10.391 663 1HG1 VAL 89 1HG1 VAL 89 6.220 4.980 -11.470 664 2HG1 VAL 89 2HG1 VAL 89 7.393 6.116 -10.802 665 3HG1 VAL 89 3HG1 VAL 89 7.912 4.892 -11.960 666 1HG2 VAL 89 1HG2 VAL 89 8.739 4.143 -8.219 667 2HG2 VAL 89 2HG2 VAL 89 9.631 4.447 -9.710 668 3HG2 VAL 89 3HG2 VAL 89 8.612 5.710 -9.018 669 H THR 90 H THR 90 6.908 1.578 -9.417 670 HA THR 90 HA THR 90 6.259 0.684 -6.754 671 HB THR 90 HB THR 90 6.320 -0.642 -9.033 672 HG1 THR 90 HG1 THR 90 6.071 -2.358 -7.802 673 1HG2 THR 90 1HG2 THR 90 8.899 -0.254 -9.143 674 2HG2 THR 90 2HG2 THR 90 8.979 -1.549 -7.948 675 3HG2 THR 90 3HG2 THR 90 8.266 -1.853 -9.533 676 H SER 91 H SER 91 7.536 0.522 -5.007 677 HA SER 91 HA SER 91 10.285 1.583 -5.188 678 1HB SER 91 1HB SER 91 10.024 1.620 -2.640 679 2HB SER 91 2HB SER 91 8.974 2.710 -3.536 680 HG SER 91 HG SER 91 7.286 1.376 -3.194 681 H SER 92 H SER 92 11.931 0.197 -5.104 682 HA SER 92 HA SER 92 11.438 -2.641 -4.459 683 1HB SER 92 1HB SER 92 13.770 -2.948 -5.303 684 2HB SER 92 2HB SER 92 12.713 -2.170 -6.477 685 HG SER 92 HG SER 92 14.876 -1.203 -6.036 686 H PHE 93 H PHE 93 11.425 -2.930 -2.237 687 HA PHE 93 HA PHE 93 13.565 -1.641 -0.622 688 1HB PHE 93 1HB PHE 93 11.191 -3.255 0.314 689 2HB PHE 93 2HB PHE 93 12.269 -2.303 1.326 690 HD1 PHE 93 HD1 PHE 93 12.618 0.197 -0.052 691 HD2 PHE 93 HD2 PHE 93 9.084 -2.241 0.249 692 HE1 PHE 93 HE1 PHE 93 11.206 2.193 -0.439 693 HE2 PHE 93 HE2 PHE 93 7.678 -0.235 -0.136 694 HZ PHE 93 HZ PHE 93 8.745 1.977 -0.479 695 H MET 94 H MET 94 12.123 -4.831 -1.229 696 HA MET 94 HA MET 94 14.684 -6.065 -0.298 697 1HB MET 94 1HB MET 94 11.876 -7.210 -0.177 698 2HB MET 94 2HB MET 94 13.339 -8.008 0.395 699 1HG MET 94 1HG MET 94 13.677 -6.375 2.109 700 2HG MET 94 2HG MET 94 12.439 -5.317 1.432 701 1HE MET 94 1HE MET 94 13.122 -8.860 2.177 702 2HE MET 94 2HE MET 94 11.892 -9.423 3.310 703 3HE MET 94 3HE MET 94 11.534 -9.347 1.593 704 H SER 95 H SER 95 13.952 -8.713 -1.259 705 HA SER 95 HA SER 95 13.367 -8.500 -4.113 706 1HB SER 95 1HB SER 95 15.519 -8.867 -4.953 707 2HB SER 95 2HB SER 95 15.897 -7.854 -3.568 708 HG SER 95 HG SER 95 17.167 -9.792 -3.700 709 HA PRO 96 HA PRO 96 12.575 -12.825 -3.310 710 1HB PRO 96 1HB PRO 96 13.720 -14.278 -5.295 711 2HB PRO 96 2HB PRO 96 12.331 -13.225 -5.556 712 1HG PRO 96 1HG PRO 96 15.152 -12.833 -6.351 713 2HG PRO 96 2HG PRO 96 13.676 -12.196 -7.086 714 1HD PRO 96 1HD PRO 96 15.452 -10.799 -5.379 715 2HD PRO 96 2HD PRO 96 13.848 -10.250 -5.913 716 H SER 97 H SER 97 15.614 -11.732 -2.692 717 HA SER 97 HA SER 97 16.978 -14.289 -2.250 718 1HB SER 97 1HB SER 97 17.988 -11.878 -2.773 719 2HB SER 97 2HB SER 97 17.904 -11.716 -1.021 720 HG SER 97 HG SER 97 19.384 -13.503 -2.606 721 H GLU 98 H GLU 98 15.287 -11.795 -0.402 722 HA GLU 98 HA GLU 98 15.805 -12.773 2.235 723 1HB GLU 98 1HB GLU 98 13.665 -11.595 2.822 724 2HB GLU 98 2HB GLU 98 14.760 -10.589 1.878 725 1HG GLU 98 1HG GLU 98 12.956 -10.234 0.546 726 2HG GLU 98 2HG GLU 98 13.331 -11.817 -0.108 727 H SER 99 H SER 99 13.501 -13.712 -0.246 728 HA SER 99 HA SER 99 12.039 -15.562 1.468 729 1HB SER 99 1HB SER 99 11.256 -14.495 -0.756 730 2HB SER 99 2HB SER 99 12.217 -15.746 -1.541 731 HG SER 99 HG SER 99 10.988 -17.294 -0.431 732 H ARG 100 H ARG 100 15.170 -15.661 0.161 733 HA ARG 100 HA ARG 100 15.174 -18.631 0.051 734 1HB ARG 100 1HB ARG 100 17.233 -16.668 -0.998 735 2HB ARG 100 2HB ARG 100 17.245 -18.417 -1.231 736 1HG ARG 100 1HG ARG 100 14.911 -16.715 -2.112 737 2HG ARG 100 2HG ARG 100 16.301 -17.001 -3.160 738 1HD ARG 100 1HD ARG 100 15.839 -19.533 -2.422 739 2HD ARG 100 2HD ARG 100 14.201 -18.904 -2.235 740 HE ARG 100 HE ARG 100 14.933 -17.980 -4.722 741 1HH1 ARG 100 1HH1 ARG 100 14.976 -21.137 -3.213 742 2HH1 ARG 100 2HH1 ARG 100 14.747 -21.966 -4.713 743 1HH2 ARG 100 1HH2 ARG 100 14.634 -19.096 -6.637 744 2HH2 ARG 100 2HH2 ARG 100 14.554 -20.826 -6.630 745 H SER 101 H SER 101 17.245 -15.900 1.224 746 HA SER 101 HA SER 101 18.197 -17.794 3.343 747 1HB SER 101 1HB SER 101 19.656 -15.806 1.659 748 2HB SER 101 2HB SER 101 20.226 -16.089 3.301 749 HG SER 101 HG SER 101 21.195 -17.707 2.325 750 H GLY 102 H GLY 102 15.900 -16.009 3.630 751 1HA GLY 102 1HA GLY 102 15.036 -14.436 5.137 752 2HA GLY 102 2HA GLY 102 16.265 -15.066 6.225 753 H SER 103 H SER 103 17.273 -13.477 3.290 754 HA SER 103 HA SER 103 18.854 -11.537 4.670 755 1HB SER 103 1HB SER 103 18.084 -12.069 1.840 756 2HB SER 103 2HB SER 103 18.602 -10.429 2.217 757 HG SER 103 HG SER 103 20.003 -12.850 2.722 758 H ASN 104 H ASN 104 17.419 -10.550 6.106 759 HA ASN 104 HA ASN 104 15.784 -9.100 6.894 760 1HB ASN 104 1HB ASN 104 15.630 -6.925 5.780 761 2HB ASN 104 2HB ASN 104 17.306 -7.444 5.891 762 1HD2 ASN 104 2HD2 ASN 104 18.380 -8.122 3.880 763 2HD2 ASN 104 1HD2 ASN 104 17.733 -7.705 2.367 764 HA PRO 105 HA PRO 105 12.468 -11.003 4.327 765 1HB PRO 105 1HB PRO 105 11.165 -12.133 6.437 766 2HB PRO 105 2HB PRO 105 12.519 -12.901 5.601 767 1HG PRO 105 1HG PRO 105 12.447 -11.589 8.252 768 2HG PRO 105 2HG PRO 105 13.463 -12.919 7.676 769 1HD PRO 105 1HD PRO 105 14.264 -10.243 7.942 770 2HD PRO 105 2HD PRO 105 15.119 -11.497 7.020 771 H ASN 106 H ASN 106 12.408 -9.004 7.205 772 HA ASN 106 HA ASN 106 9.817 -7.862 6.248 773 1HB ASN 106 1HB ASN 106 10.404 -9.107 8.811 774 2HB ASN 106 2HB ASN 106 9.873 -7.440 9.027 775 1HD2 ASN 106 2HD2 ASN 106 8.852 -9.600 6.359 776 2HD2 ASN 106 1HD2 ASN 106 7.215 -9.642 6.804 777 H ARG 107 H ARG 107 10.344 -5.907 5.489 778 HA ARG 107 HA ARG 107 11.964 -4.104 7.232 779 1HB ARG 107 1HB ARG 107 12.586 -5.038 4.546 780 2HB ARG 107 2HB ARG 107 12.401 -3.285 4.562 781 1HG ARG 107 1HG ARG 107 13.969 -4.461 6.797 782 2HG ARG 107 2HG ARG 107 14.719 -4.513 5.202 783 1HD ARG 107 1HD ARG 107 13.664 -1.934 5.351 784 2HD ARG 107 2HD ARG 107 14.293 -2.229 6.972 785 HE ARG 107 HE ARG 107 16.461 -2.128 6.074 786 1HH1 ARG 107 1HH1 ARG 107 14.155 -2.784 3.528 787 2HH1 ARG 107 2HH1 ARG 107 15.348 -2.673 2.281 788 1HH2 ARG 107 1HH2 ARG 107 17.972 -1.993 4.429 789 2HH2 ARG 107 2HH2 ARG 107 17.486 -2.230 2.784 790 H VAL 108 H VAL 108 11.565 -1.734 6.499 791 HA VAL 108 HA VAL 108 8.842 -1.388 5.368 792 HB VAL 108 HB VAL 108 8.174 0.075 7.157 793 1HG1 VAL 108 1HG1 VAL 108 9.374 -2.524 8.147 794 2HG1 VAL 108 2HG1 VAL 108 8.219 -1.557 9.061 795 3HG1 VAL 108 3HG1 VAL 108 7.740 -2.290 7.530 796 1HG2 VAL 108 1HG2 VAL 108 10.976 -0.405 8.149 797 2HG2 VAL 108 2HG2 VAL 108 10.196 1.138 7.800 798 3HG2 VAL 108 3HG2 VAL 108 9.692 0.192 9.201 799 H ARG 109 H ARG 109 8.448 1.000 4.795 800 HA ARG 109 HA ARG 109 10.813 2.689 4.572 801 1HB ARG 109 1HB ARG 109 10.377 0.822 2.525 802 2HB ARG 109 2HB ARG 109 9.754 2.337 1.876 803 1HG ARG 109 1HG ARG 109 11.943 2.698 1.331 804 2HG ARG 109 2HG ARG 109 12.063 3.213 3.011 805 1HD ARG 109 1HD ARG 109 12.978 1.155 3.707 806 2HD ARG 109 2HD ARG 109 12.435 0.321 2.251 807 HE ARG 109 HE ARG 109 14.391 1.056 1.171 808 1HH1 ARG 109 1HH1 ARG 109 13.806 2.986 4.029 809 2HH1 ARG 109 2HH1 ARG 109 15.301 3.841 3.880 810 1HH2 ARG 109 1HH2 ARG 109 16.316 2.185 1.019 811 2HH2 ARG 109 2HH2 ARG 109 16.710 3.393 2.197 812 H MET 110 H MET 110 10.279 4.762 3.554 813 HA MET 110 HA MET 110 7.361 5.401 3.695 814 1HB MET 110 1HB MET 110 9.725 7.084 4.581 815 2HB MET 110 2HB MET 110 8.045 7.617 4.599 816 1HG MET 110 1HG MET 110 7.464 6.177 6.333 817 2HG MET 110 2HG MET 110 8.777 5.055 5.972 818 1HE MET 110 1HE MET 110 10.779 5.070 6.380 819 2HE MET 110 2HE MET 110 11.816 6.476 6.660 820 3HE MET 110 3HE MET 110 11.303 5.472 8.013 821 H PHE 111 H PHE 111 6.788 7.397 2.440 822 HA PHE 111 HA PHE 111 8.600 7.890 0.116 823 1HB PHE 111 1HB PHE 111 5.592 7.760 -0.180 824 2HB PHE 111 2HB PHE 111 6.809 7.759 -1.448 825 HD1 PHE 111 HD1 PHE 111 5.730 5.735 1.524 826 HD2 PHE 111 HD2 PHE 111 7.428 5.730 -2.420 827 HE1 PHE 111 HE1 PHE 111 5.723 3.265 1.522 828 HE2 PHE 111 HE2 PHE 111 7.414 3.249 -2.419 829 HZ PHE 111 HZ PHE 111 6.559 2.012 -0.443 830 H GLY 112 H GLY 112 9.188 9.986 0.687 831 1HA GLY 112 1HA GLY 112 7.272 11.865 1.805 832 2HA GLY 112 2HA GLY 112 8.933 12.201 1.390 833 HA PRO 113 HA PRO 113 6.522 14.331 -1.885 834 1HB PRO 113 1HB PRO 113 8.255 16.429 -2.086 835 2HB PRO 113 2HB PRO 113 6.944 16.356 -0.898 836 1HG PRO 113 1HG PRO 113 9.862 15.934 -0.521 837 2HG PRO 113 2HG PRO 113 8.665 16.616 0.592 838 1HD PRO 113 1HD PRO 113 9.667 14.016 0.739 839 2HD PRO 113 2HD PRO 113 8.154 14.561 1.476 840 H ASP 114 H ASP 114 9.977 13.684 -1.650 841 HA ASP 114 HA ASP 114 10.647 14.057 -4.407 842 1HB ASP 114 1HB ASP 114 12.158 13.736 -2.258 843 2HB ASP 114 2HB ASP 114 12.084 12.037 -2.725 844 H LYS 115 H LYS 115 9.209 11.395 -2.651 845 HA LYS 115 HA LYS 115 9.564 9.598 -4.970 846 1HB LYS 115 1HB LYS 115 8.910 9.269 -2.104 847 2HB LYS 115 2HB LYS 115 8.072 8.165 -3.194 848 1HG LYS 115 1HG LYS 115 10.015 7.121 -3.858 849 2HG LYS 115 2HG LYS 115 10.994 8.572 -3.643 850 1HD LYS 115 1HD LYS 115 9.783 7.115 -1.291 851 2HD LYS 115 2HD LYS 115 11.356 6.667 -1.950 852 1HE LYS 115 1HE LYS 115 11.813 9.271 -1.754 853 2HE LYS 115 2HE LYS 115 10.540 9.178 -0.538 854 1HZ LYS 115 1HZ LYS 115 11.795 7.392 0.545 855 2HZ LYS 115 2HZ LYS 115 13.042 7.580 -0.593 856 3HZ LYS 115 3HZ LYS 115 12.674 8.841 0.485 857 H LEU 116 H LEU 116 7.421 12.028 -4.323 858 HA LEU 116 HA LEU 116 5.231 10.502 -5.689 859 1HB LEU 116 1HB LEU 116 3.618 12.072 -4.502 860 2HB LEU 116 2HB LEU 116 4.365 10.826 -3.508 861 HG LEU 116 HG LEU 116 6.151 12.629 -2.974 862 1HD1 LEU 116 1HD1 LEU 116 4.440 14.112 -4.721 863 2HD1 LEU 116 2HD1 LEU 116 4.315 14.811 -3.112 864 3HD1 LEU 116 3HD1 LEU 116 5.887 14.663 -3.889 865 1HD2 LEU 116 1HD2 LEU 116 3.297 12.707 -1.984 866 2HD2 LEU 116 2HD2 LEU 116 4.658 11.839 -1.275 867 3HD2 LEU 116 3HD2 LEU 116 4.605 13.601 -1.210 868 H VAL 117 H VAL 117 4.187 11.512 -7.338 869 HA VAL 117 HA VAL 117 5.582 13.589 -8.746 870 HB VAL 117 HB VAL 117 4.069 11.975 -9.865 871 1HG1 VAL 117 1HG1 VAL 117 2.401 11.838 -8.071 872 2HG1 VAL 117 2HG1 VAL 117 1.886 13.478 -8.430 873 3HG1 VAL 117 3HG1 VAL 117 1.650 12.203 -9.620 874 1HG2 VAL 117 1HG2 VAL 117 4.477 14.443 -10.675 875 2HG2 VAL 117 2HG2 VAL 117 3.232 13.471 -11.460 876 3HG2 VAL 117 3HG2 VAL 117 2.781 14.665 -10.242 877 H ARG 118 H ARG 118 5.317 15.826 -8.691 878 HA ARG 118 HA ARG 118 3.866 16.951 -6.424 879 1HB ARG 118 1HB ARG 118 5.718 17.951 -8.522 880 2HB ARG 118 2HB ARG 118 4.577 19.130 -7.875 881 1HG ARG 118 1HG ARG 118 5.406 17.936 -5.572 882 2HG ARG 118 2HG ARG 118 6.866 17.792 -6.551 883 1HD ARG 118 1HD ARG 118 5.685 20.437 -6.834 884 2HD ARG 118 2HD ARG 118 6.013 20.064 -5.144 885 HE ARG 118 HE ARG 118 8.326 20.085 -5.618 886 1HH1 ARG 118 1HH1 ARG 118 6.474 20.052 -8.589 887 2HH1 ARG 118 2HH1 ARG 118 7.863 20.352 -9.571 888 1HH2 ARG 118 1HH2 ARG 118 10.091 20.469 -6.932 889 2HH2 ARG 118 2HH2 ARG 118 9.886 20.587 -8.648 890 H ALA 119 H ALA 119 3.364 16.705 -9.909 891 HA ALA 119 HA ALA 119 1.199 18.558 -10.107 892 1HB ALA 119 1HB ALA 119 1.899 16.118 -11.756 893 2HB ALA 119 2HB ALA 119 0.628 17.260 -12.190 894 3HB ALA 119 3HB ALA 119 2.306 17.796 -12.114 895 H ALA 120 H ALA 120 1.363 15.309 -8.863 896 HA ALA 120 HA ALA 120 -1.620 15.204 -8.756 897 1HB ALA 120 1HB ALA 120 0.033 13.323 -9.780 898 2HB ALA 120 2HB ALA 120 -0.057 12.773 -8.107 899 3HB ALA 120 3HB ALA 120 -1.530 12.949 -9.058 900 H ALA 121 H ALA 121 1.316 14.473 -6.804 901 HA ALA 121 HA ALA 121 0.121 13.799 -4.376 902 1HB ALA 121 1HB ALA 121 2.593 15.446 -4.920 903 2HB ALA 121 2HB ALA 121 2.145 14.888 -3.311 904 3HB ALA 121 3HB ALA 121 2.500 13.718 -4.579 905 H GLU 122 H GLU 122 0.479 17.065 -5.732 906 HA GLU 122 HA GLU 122 -0.585 18.277 -3.275 907 1HB GLU 122 1HB GLU 122 -0.396 20.410 -4.479 908 2HB GLU 122 2HB GLU 122 1.097 19.487 -4.634 909 1HG GLU 122 1HG GLU 122 0.843 19.956 -6.856 910 2HG GLU 122 2HG GLU 122 -0.255 18.577 -6.809 911 H LYS 123 H LYS 123 -2.058 16.560 -5.683 912 HA LYS 123 HA LYS 123 -4.452 18.286 -5.832 913 1HB LYS 123 1HB LYS 123 -4.012 15.553 -7.066 914 2HB LYS 123 2HB LYS 123 -5.281 16.706 -7.471 915 1HG LYS 123 1HG LYS 123 -3.368 18.328 -8.057 916 2HG LYS 123 2HG LYS 123 -2.322 16.909 -8.026 917 1HD LYS 123 1HD LYS 123 -3.237 16.022 -9.932 918 2HD LYS 123 2HD LYS 123 -4.845 16.655 -9.579 919 1HE LYS 123 1HE LYS 123 -2.677 18.617 -10.195 920 2HE LYS 123 2HE LYS 123 -3.356 17.690 -11.532 921 1HZ LYS 123 1HZ LYS 123 -4.993 19.194 -9.568 922 2HZ LYS 123 2HZ LYS 123 -4.510 19.823 -11.070 923 3HZ LYS 123 3HZ LYS 123 -5.525 18.466 -11.007 924 H ARG 124 H ARG 124 -6.270 17.830 -4.630 925 HA ARG 124 HA ARG 124 -6.015 16.078 -2.370 926 1HB ARG 124 1HB ARG 124 -8.430 17.499 -3.520 927 2HB ARG 124 2HB ARG 124 -8.413 16.664 -1.966 928 1HG ARG 124 1HG ARG 124 -7.020 18.226 -0.979 929 2HG ARG 124 2HG ARG 124 -6.265 18.672 -2.509 930 1HD ARG 124 1HD ARG 124 -8.836 19.444 -2.982 931 2HD ARG 124 2HD ARG 124 -8.729 19.723 -1.244 932 HE ARG 124 HE ARG 124 -6.410 20.807 -2.540 933 1HH1 ARG 124 1HH1 ARG 124 -9.833 21.379 -2.101 934 2HH1 ARG 124 2HH1 ARG 124 -9.676 23.088 -2.307 935 1HH2 ARG 124 1HH2 ARG 124 -6.254 23.024 -2.801 936 2HH2 ARG 124 2HH2 ARG 124 -7.673 24.012 -2.698 937 H TRP 125 H TRP 125 -6.023 13.924 -2.577 938 HA TRP 125 HA TRP 125 -8.025 12.640 -4.409 939 1HB TRP 125 1HB TRP 125 -5.463 11.445 -3.290 940 2HB TRP 125 2HB TRP 125 -6.537 10.706 -4.470 941 HD1 TRP 125 HD1 TRP 125 -3.583 12.922 -4.169 942 HE1 TRP 125 HE1 TRP 125 -2.923 13.846 -6.483 943 HE3 TRP 125 HE3 TRP 125 -7.706 11.596 -6.864 944 HZ2 TRP 125 HZ2 TRP 125 -3.992 13.989 -9.130 945 HZ3 TRP 125 HZ3 TRP 125 -7.859 12.118 -9.275 946 HH2 TRP 125 HH2 TRP 125 -6.011 13.320 -10.415 947 H ASP 126 H ASP 126 -8.935 10.573 -3.492 948 HA ASP 126 HA ASP 126 -8.783 10.436 -0.529 949 1HB ASP 126 1HB ASP 126 -11.218 10.211 -0.323 950 2HB ASP 126 2HB ASP 126 -10.784 11.766 -1.029 951 H ARG 127 H ARG 127 -8.107 8.812 -3.160 952 HA ARG 127 HA ARG 127 -8.782 6.188 -1.962 953 1HB ARG 127 1HB ARG 127 -9.172 6.860 -4.899 954 2HB ARG 127 2HB ARG 127 -9.403 5.279 -4.165 955 1HG ARG 127 1HG ARG 127 -10.994 7.048 -2.642 956 2HG ARG 127 2HG ARG 127 -11.262 7.505 -4.322 957 1HD ARG 127 1HD ARG 127 -11.480 4.923 -4.709 958 2HD ARG 127 2HD ARG 127 -11.778 4.877 -2.978 959 HE ARG 127 HE ARG 127 -13.548 6.761 -3.731 960 1HH1 ARG 127 1HH1 ARG 127 -12.816 3.621 -5.100 961 2HH1 ARG 127 2HH1 ARG 127 -14.405 3.424 -5.745 962 1HH2 ARG 127 1HH2 ARG 127 -15.602 6.438 -4.571 963 2HH2 ARG 127 2HH2 ARG 127 -15.962 4.992 -5.448 964 H VAL 128 H VAL 128 -7.043 4.714 -2.298 965 HA VAL 128 HA VAL 128 -4.887 5.642 -4.123 966 HB VAL 128 HB VAL 128 -4.485 6.429 -1.754 967 1HG1 VAL 128 1HG1 VAL 128 -5.164 3.798 -1.100 968 2HG1 VAL 128 2HG1 VAL 128 -3.421 3.874 -0.848 969 3HG1 VAL 128 3HG1 VAL 128 -4.484 5.007 -0.014 970 1HG2 VAL 128 1HG2 VAL 128 -2.574 4.634 -3.233 971 2HG2 VAL 128 2HG2 VAL 128 -2.607 6.396 -3.167 972 3HG2 VAL 128 3HG2 VAL 128 -2.087 5.471 -1.759 973 H LYS 129 H LYS 129 -3.749 4.009 -5.110 974 HA LYS 129 HA LYS 129 -4.766 1.247 -4.645 975 1HB LYS 129 1HB LYS 129 -4.840 2.451 -6.946 976 2HB LYS 129 2HB LYS 129 -3.109 2.127 -6.992 977 1HG LYS 129 1HG LYS 129 -3.387 -0.124 -7.252 978 2HG LYS 129 2HG LYS 129 -4.833 -0.166 -6.244 979 1HD LYS 129 1HD LYS 129 -6.173 0.784 -8.034 980 2HD LYS 129 2HD LYS 129 -4.737 1.015 -9.031 981 1HE LYS 129 1HE LYS 129 -4.514 -1.636 -8.503 982 2HE LYS 129 2HE LYS 129 -6.269 -1.465 -8.472 983 1HZ LYS 129 1HZ LYS 129 -5.938 -0.179 -10.637 984 2HZ LYS 129 2HZ LYS 129 -4.398 -0.889 -10.681 985 3HZ LYS 129 3HZ LYS 129 -5.786 -1.870 -10.688 986 H ILE 130 H ILE 130 -3.441 -0.041 -3.479 987 HA ILE 130 HA ILE 130 -0.502 0.524 -3.525 988 HB ILE 130 HB ILE 130 -2.183 -1.036 -1.517 989 1HG1 ILE 130 1HG1 ILE 130 -2.554 1.407 -1.448 990 2HG1 ILE 130 2HG1 ILE 130 -1.694 0.858 -0.012 991 1HG2 ILE 130 1HG2 ILE 130 0.781 -0.436 -1.680 992 2HG2 ILE 130 2HG2 ILE 130 -0.009 -0.831 -0.154 993 3HG2 ILE 130 3HG2 ILE 130 -0.005 -2.001 -1.474 994 1HD1 ILE 130 1HD1 ILE 130 0.281 1.482 -1.964 995 2HD1 ILE 130 2HD1 ILE 130 -0.874 2.814 -1.950 996 3HD1 ILE 130 3HD1 ILE 130 -0.061 2.339 -0.461 997 H VAL 131 H VAL 131 0.656 -0.889 -4.814 998 HA VAL 131 HA VAL 131 -0.380 -3.664 -5.076 999 HB VAL 131 HB VAL 131 0.968 -1.987 -7.202 1000 1HG1 VAL 131 1HG1 VAL 131 -0.133 -4.788 -7.120 1001 2HG1 VAL 131 2HG1 VAL 131 0.113 -3.916 -8.633 1002 3HG1 VAL 131 3HG1 VAL 131 1.486 -4.269 -7.584 1003 1HG2 VAL 131 1HG2 VAL 131 -1.873 -2.516 -6.471 1004 2HG2 VAL 131 2HG2 VAL 131 -1.150 -1.080 -7.196 1005 3HG2 VAL 131 3HG2 VAL 131 -1.470 -2.503 -8.187 1006 H CYS 132 H CYS 132 1.032 -5.112 -4.291 1007 HA CYS 132 HA CYS 132 3.887 -4.364 -4.003 1008 1HB CYS 132 1HB CYS 132 3.540 -5.372 -1.997 1009 2HB CYS 132 2HB CYS 132 2.001 -6.024 -2.513 1010 HG CYS 132 HG CYS 132 3.707 -7.988 -1.913 1011 H SER 133 H SER 133 5.556 -5.892 -4.867 1012 HA SER 133 HA SER 133 4.613 -7.853 -6.863 1013 1HB SER 133 1HB SER 133 5.239 -5.156 -7.573 1014 2HB SER 133 2HB SER 133 6.507 -6.181 -8.231 1015 HG SER 133 HG SER 133 3.847 -5.978 -8.894 1016 H GLN 134 H GLN 134 5.882 -9.543 -6.786 1017 HA GLN 134 HA GLN 134 8.561 -9.838 -7.228 1018 1HB GLN 134 1HB GLN 134 8.567 -8.472 -4.854 1019 2HB GLN 134 2HB GLN 134 8.553 -10.118 -4.289 1020 1HG GLN 134 1HG GLN 134 10.549 -8.935 -6.226 1021 2HG GLN 134 2HG GLN 134 10.859 -9.391 -4.558 1022 1HE2 GLN 134 2HE2 GLN 134 11.956 -10.458 -7.215 1023 2HE2 GLN 134 1HE2 GLN 134 11.725 -12.130 -7.100 1024 HA PRO 135 HA PRO 135 6.471 -13.857 -6.647 1025 1HB PRO 135 1HB PRO 135 8.130 -15.283 -8.278 1026 2HB PRO 135 2HB PRO 135 6.798 -14.284 -8.879 1027 1HG PRO 135 1HG PRO 135 9.718 -13.757 -8.914 1028 2HG PRO 135 2HG PRO 135 8.464 -13.246 -10.053 1029 1HD PRO 135 1HD PRO 135 9.615 -11.626 -8.087 1030 2HD PRO 135 2HD PRO 135 8.085 -11.295 -8.923 1031 H TYR 136 H TYR 136 6.990 -14.440 -4.525 1032 HA TYR 136 HA TYR 136 9.628 -15.763 -4.161 1033 1HB TYR 136 1HB TYR 136 9.516 -14.816 -1.736 1034 2HB TYR 136 2HB TYR 136 10.079 -13.770 -3.036 1035 HD1 TYR 136 HD1 TYR 136 6.873 -14.777 -1.340 1036 HD2 TYR 136 HD2 TYR 136 9.118 -11.675 -3.278 1037 HE1 TYR 136 HE1 TYR 136 5.054 -13.165 -0.857 1038 HE2 TYR 136 HE2 TYR 136 7.287 -10.066 -2.803 1039 HH TYR 136 HH TYR 136 4.809 -10.178 -2.349 1040 H SER 137 H SER 137 6.225 -15.835 -3.490 1041 HA SER 137 HA SER 137 6.686 -18.133 -1.643 1042 1HB SER 137 1HB SER 137 4.881 -15.937 -1.529 1043 2HB SER 137 2HB SER 137 3.918 -17.393 -1.742 1044 HG SER 137 HG SER 137 4.610 -18.136 0.137 1045 H LYS 138 H LYS 138 4.502 -19.595 -1.828 1046 HA LYS 138 HA LYS 138 3.622 -20.091 -4.561 1047 1HB LYS 138 1HB LYS 138 5.983 -21.080 -4.414 1048 2HB LYS 138 2HB LYS 138 5.310 -22.244 -3.272 1049 1HG LYS 138 1HG LYS 138 3.704 -23.016 -4.934 1050 2HG LYS 138 2HG LYS 138 4.243 -21.780 -6.072 1051 1HD LYS 138 1HD LYS 138 6.616 -22.923 -5.586 1052 2HD LYS 138 2HD LYS 138 5.584 -24.314 -5.251 1053 1HE LYS 138 1HE LYS 138 5.881 -24.573 -7.535 1054 2HE LYS 138 2HE LYS 138 4.425 -23.577 -7.522 1055 1HZ LYS 138 1HZ LYS 138 6.108 -21.639 -7.523 1056 2HZ LYS 138 2HZ LYS 138 7.200 -22.798 -8.114 1057 3HZ LYS 138 3HZ LYS 138 5.783 -22.453 -8.978 1058 H ASP 139 H ASP 139 4.020 -21.423 -1.281 1059 HA ASP 139 HA ASP 139 1.296 -22.591 -1.499 1060 1HB ASP 139 1HB ASP 139 2.018 -23.962 0.484 1061 2HB ASP 139 2HB ASP 139 2.939 -24.286 -0.980 1062 H SER 140 H SER 140 3.399 -20.568 0.406 1063 HA SER 140 HA SER 140 1.165 -19.892 2.234 1064 1HB SER 140 1HB SER 140 3.238 -18.579 3.288 1065 2HB SER 140 2HB SER 140 2.961 -20.283 3.617 1066 HG SER 140 HG SER 140 4.919 -19.036 2.126 1067 HA PRO 141 HA PRO 141 0.915 -15.955 0.080 1068 1HB PRO 141 1HB PRO 141 -0.931 -14.788 1.707 1069 2HB PRO 141 2HB PRO 141 -1.330 -16.061 0.546 1070 1HG PRO 141 1HG PRO 141 -1.243 -16.180 3.474 1071 2HG PRO 141 2HG PRO 141 -2.048 -17.258 2.327 1072 1HD PRO 141 1HD PRO 141 0.453 -17.684 3.702 1073 2HD PRO 141 2HD PRO 141 -0.376 -18.768 2.564 1074 H PHE 142 H PHE 142 0.633 -13.482 1.039 1075 HA PHE 142 HA PHE 142 1.921 -12.699 3.433 1076 1HB PHE 142 1HB PHE 142 3.748 -13.640 1.385 1077 2HB PHE 142 2HB PHE 142 4.015 -11.922 1.669 1078 HD1 PHE 142 HD1 PHE 142 4.094 -11.188 4.204 1079 HD2 PHE 142 HD2 PHE 142 4.740 -15.196 2.810 1080 HE1 PHE 142 HE1 PHE 142 5.294 -11.726 6.308 1081 HE2 PHE 142 HE2 PHE 142 5.941 -15.736 4.911 1082 HZ PHE 142 HZ PHE 142 6.218 -14.000 6.661 1083 H GLY 143 H GLY 143 3.218 -10.320 2.524 1084 1HA GLY 143 1HA GLY 143 2.180 -8.879 0.429 1085 2HA GLY 143 2HA GLY 143 0.879 -8.818 1.615 1086 H LEU 144 H LEU 144 0.920 -7.010 2.776 1087 HA LEU 144 HA LEU 144 3.562 -5.735 3.341 1088 1HB LEU 144 1HB LEU 144 0.961 -4.669 2.463 1089 2HB LEU 144 2HB LEU 144 1.669 -3.774 3.805 1090 HG LEU 144 HG LEU 144 3.798 -3.608 2.516 1091 1HD1 LEU 144 1HD1 LEU 144 2.185 -5.259 0.633 1092 2HD1 LEU 144 2HD1 LEU 144 3.222 -4.023 -0.080 1093 3HD1 LEU 144 3HD1 LEU 144 3.922 -5.279 0.941 1094 1HD2 LEU 144 1HD2 LEU 144 2.011 -1.836 2.459 1095 2HD2 LEU 144 2HD2 LEU 144 3.017 -1.873 1.010 1096 3HD2 LEU 144 3HD2 LEU 144 1.398 -2.573 0.979 1097 H SER 145 H SER 145 3.762 -4.641 5.419 1098 HA SER 145 HA SER 145 2.396 -6.149 7.574 1099 1HB SER 145 1HB SER 145 4.843 -4.413 7.412 1100 2HB SER 145 2HB SER 145 4.092 -4.728 8.974 1101 HG SER 145 HG SER 145 5.204 -6.513 8.872 1102 H PHE 146 H PHE 146 2.503 -2.933 6.172 1103 HA PHE 146 HA PHE 146 0.081 -2.124 7.472 1104 1HB PHE 146 1HB PHE 146 0.936 -0.460 9.056 1105 2HB PHE 146 2HB PHE 146 1.610 -2.037 9.464 1106 HD1 PHE 146 HD1 PHE 146 2.310 1.210 7.846 1107 HD2 PHE 146 HD2 PHE 146 3.972 -2.483 9.249 1108 HE1 PHE 146 HE1 PHE 146 4.579 2.124 7.497 1109 HE2 PHE 146 HE2 PHE 146 6.249 -1.590 8.893 1110 HZ PHE 146 HZ PHE 146 6.573 0.703 7.991 1111 H VAL 147 H VAL 147 -0.346 0.254 7.092 1112 HA VAL 147 HA VAL 147 1.373 1.536 5.062 1113 HB VAL 147 HB VAL 147 -0.481 1.878 3.494 1114 1HG1 VAL 147 1HG1 VAL 147 1.010 -0.248 3.541 1115 2HG1 VAL 147 2HG1 VAL 147 -0.446 -1.069 4.104 1116 3HG1 VAL 147 3HG1 VAL 147 -0.437 -0.266 2.534 1117 1HG2 VAL 147 1HG2 VAL 147 -2.009 0.520 5.682 1118 2HG2 VAL 147 2HG2 VAL 147 -2.501 1.853 4.637 1119 3HG2 VAL 147 3HG2 VAL 147 -2.501 0.201 4.018 1120 H ARG 148 H ARG 148 1.568 3.628 5.703 1121 HA ARG 148 HA ARG 148 -0.739 4.912 7.113 1122 1HB ARG 148 1HB ARG 148 2.080 5.597 7.890 1123 2HB ARG 148 2HB ARG 148 0.611 5.738 8.834 1124 1HG ARG 148 1HG ARG 148 1.825 3.080 8.065 1125 2HG ARG 148 2HG ARG 148 2.179 3.902 9.580 1126 1HD ARG 148 1HD ARG 148 -0.662 3.364 8.737 1127 2HD ARG 148 2HD ARG 148 0.280 2.146 9.595 1128 HE ARG 148 HE ARG 148 0.562 4.502 11.084 1129 1HH1 ARG 148 1HH1 ARG 148 -2.062 2.439 10.037 1130 2HH1 ARG 148 2HH1 ARG 148 -3.039 2.814 11.413 1131 1HH2 ARG 148 1HH2 ARG 148 -0.738 4.959 12.848 1132 2HH2 ARG 148 2HH2 ARG 148 -2.299 4.223 12.988 1133 H PHE 149 H PHE 149 -1.369 6.515 5.705 1134 HA PHE 149 HA PHE 149 0.650 7.934 4.075 1135 1HB PHE 149 1HB PHE 149 -2.366 8.195 4.226 1136 2HB PHE 149 2HB PHE 149 -1.340 9.092 3.111 1137 HD1 PHE 149 HD1 PHE 149 0.540 7.344 2.005 1138 HD2 PHE 149 HD2 PHE 149 -3.476 6.423 3.206 1139 HE1 PHE 149 HE1 PHE 149 0.510 5.432 0.426 1140 HE2 PHE 149 HE2 PHE 149 -3.506 4.508 1.625 1141 HZ PHE 149 HZ PHE 149 -1.514 4.014 0.237 1142 H HIS 150 H HIS 150 0.867 10.282 4.200 1143 HA HIS 150 HA HIS 150 -0.356 11.624 6.519 1144 1HB HIS 150 1HB HIS 150 2.404 12.377 6.670 1145 2HB HIS 150 2HB HIS 150 1.410 11.625 7.906 1146 HD1 HIS 150 HD1 HIS 150 4.391 11.073 6.007 1147 HD2 HIS 150 HD2 HIS 150 1.384 8.597 7.484 1148 HE1 HIS 150 HE1 HIS 150 5.355 8.734 6.063 1149 H SER 151 H SER 151 -0.971 13.578 5.836 1150 HA SER 151 HA SER 151 -0.007 14.651 3.295 1151 1HB SER 151 1HB SER 151 -1.825 16.106 3.431 1152 2HB SER 151 2HB SER 151 -2.399 14.783 4.433 1153 HG SER 151 HG SER 151 -2.658 16.790 5.475 Start of MODEL 2 1 H MET 1 H MET 1 -0.414 16.664 14.851 2 HA MET 1 HA MET 1 1.300 18.313 13.075 3 1HB MET 1 1HB MET 1 2.384 16.112 12.548 4 2HB MET 1 2HB MET 1 2.680 16.655 14.200 5 1HG MET 1 1HG MET 1 0.966 15.177 15.060 6 2HG MET 1 2HG MET 1 0.466 14.736 13.428 7 1HE MET 1 1HE MET 1 1.965 13.568 16.351 8 2HE MET 1 2HE MET 1 3.542 12.852 16.034 9 3HE MET 1 3HE MET 1 3.360 14.610 16.082 10 HA PRO 2 HA PRO 2 -1.651 16.962 10.022 11 1HB PRO 2 1HB PRO 2 -0.118 17.216 7.780 12 2HB PRO 2 2HB PRO 2 -0.729 18.601 8.697 13 1HG PRO 2 1HG PRO 2 2.014 17.579 8.474 14 2HG PRO 2 2HG PRO 2 1.445 19.177 8.969 15 1HD PRO 2 1HD PRO 2 2.346 17.029 10.659 16 2HD PRO 2 2HD PRO 2 1.753 18.630 11.153 17 H GLU 3 H GLU 3 -2.320 15.003 9.167 18 HA GLU 3 HA GLU 3 -0.412 13.064 8.091 19 1HB GLU 3 1HB GLU 3 -1.074 11.267 9.709 20 2HB GLU 3 2HB GLU 3 -0.147 12.567 10.458 21 1HG GLU 3 1HG GLU 3 -2.019 13.460 11.539 22 2HG GLU 3 2HG GLU 3 -3.150 12.708 10.414 23 H ILE 4 H ILE 4 -1.777 10.883 7.747 24 HA ILE 4 HA ILE 4 -4.587 11.545 7.042 25 HB ILE 4 HB ILE 4 -2.454 10.539 5.137 26 1HG1 ILE 4 1HG1 ILE 4 -4.406 12.846 4.943 27 2HG1 ILE 4 2HG1 ILE 4 -2.738 13.003 5.492 28 1HG2 ILE 4 1HG2 ILE 4 -5.420 10.222 5.055 29 2HG2 ILE 4 2HG2 ILE 4 -4.612 10.671 3.552 30 3HG2 ILE 4 3HG2 ILE 4 -4.161 9.184 4.386 31 1HD1 ILE 4 1HD1 ILE 4 -3.426 11.752 2.832 32 2HD1 ILE 4 2HD1 ILE 4 -3.184 13.490 3.011 33 3HD1 ILE 4 3HD1 ILE 4 -1.868 12.375 3.375 34 H ARG 5 H ARG 5 -5.877 9.925 7.736 35 HA ARG 5 HA ARG 5 -4.617 7.286 8.339 36 1HB ARG 5 1HB ARG 5 -6.823 8.868 9.592 37 2HB ARG 5 2HB ARG 5 -6.924 7.108 9.664 38 1HG ARG 5 1HG ARG 5 -4.651 7.025 10.640 39 2HG ARG 5 2HG ARG 5 -4.575 8.786 10.595 40 1HD ARG 5 1HD ARG 5 -6.884 8.542 11.922 41 2HD ARG 5 2HD ARG 5 -6.159 7.002 12.387 42 HE ARG 5 HE ARG 5 -4.344 9.262 12.710 43 1HH1 ARG 5 1HH1 ARG 5 -6.898 7.389 14.196 44 2HH1 ARG 5 2HH1 ARG 5 -6.419 7.823 15.799 45 1HH2 ARG 5 1HH2 ARG 5 -3.762 9.798 14.800 46 2HH2 ARG 5 2HH2 ARG 5 -4.665 9.174 16.139 47 H LEU 6 H LEU 6 -5.809 5.363 7.795 48 HA LEU 6 HA LEU 6 -7.369 5.663 5.309 49 1HB LEU 6 1HB LEU 6 -5.637 3.664 6.475 50 2HB LEU 6 2HB LEU 6 -7.184 2.931 6.066 51 HG LEU 6 HG LEU 6 -7.005 3.767 3.768 52 1HD1 LEU 6 1HD1 LEU 6 -4.455 5.021 4.815 53 2HD1 LEU 6 2HD1 LEU 6 -4.755 4.775 3.094 54 3HD1 LEU 6 3HD1 LEU 6 -5.813 5.829 4.033 55 1HD2 LEU 6 1HD2 LEU 6 -4.587 2.306 4.851 56 2HD2 LEU 6 2HD2 LEU 6 -6.038 1.603 4.138 57 3HD2 LEU 6 3HD2 LEU 6 -4.900 2.493 3.126 58 H ARG 7 H ARG 7 -9.475 4.725 5.057 59 HA ARG 7 HA ARG 7 -11.008 4.590 7.608 60 1HB ARG 7 1HB ARG 7 -11.682 6.206 5.754 61 2HB ARG 7 2HB ARG 7 -12.125 4.788 4.804 62 1HG ARG 7 1HG ARG 7 -13.705 4.084 6.539 63 2HG ARG 7 2HG ARG 7 -13.231 5.450 7.549 64 1HD ARG 7 1HD ARG 7 -13.858 6.788 5.297 65 2HD ARG 7 2HD ARG 7 -14.929 5.400 5.104 66 HE ARG 7 HE ARG 7 -15.119 6.487 7.774 67 1HH1 ARG 7 1HH1 ARG 7 -16.122 7.003 4.462 68 2HH1 ARG 7 2HH1 ARG 7 -17.548 7.865 4.923 69 1HH2 ARG 7 1HH2 ARG 7 -16.975 7.610 8.323 70 2HH2 ARG 7 2HH2 ARG 7 -18.027 8.209 7.084 71 H HIS 8 H HIS 8 -10.947 3.003 4.424 72 HA HIS 8 HA HIS 8 -10.997 0.352 5.640 73 1HB HIS 8 1HB HIS 8 -13.144 -0.313 4.545 74 2HB HIS 8 2HB HIS 8 -13.368 0.877 5.825 75 HD1 HIS 8 HD1 HIS 8 -14.665 2.912 5.186 76 HD2 HIS 8 HD2 HIS 8 -13.015 1.036 1.849 77 HE1 HIS 8 HE1 HIS 8 -15.504 4.183 3.161 78 H VAL 9 H VAL 9 -10.994 -1.355 3.874 79 HA VAL 9 HA VAL 9 -9.308 -0.430 1.667 80 HB VAL 9 HB VAL 9 -8.821 -2.566 2.790 81 1HG1 VAL 9 1HG1 VAL 9 -11.551 -2.934 2.807 82 2HG1 VAL 9 2HG1 VAL 9 -11.035 -4.051 1.543 83 3HG1 VAL 9 3HG1 VAL 9 -10.361 -4.184 3.167 84 1HG2 VAL 9 1HG2 VAL 9 -9.708 -2.824 -0.098 85 2HG2 VAL 9 2HG2 VAL 9 -8.107 -2.362 0.478 86 3HG2 VAL 9 3HG2 VAL 9 -8.697 -4.004 0.736 87 H VAL 10 H VAL 10 -10.693 0.876 0.401 88 HA VAL 10 HA VAL 10 -13.310 0.262 -0.428 89 HB VAL 10 HB VAL 10 -12.515 2.467 -0.858 90 1HG1 VAL 10 1HG1 VAL 10 -10.068 1.313 -1.388 91 2HG1 VAL 10 2HG1 VAL 10 -10.572 1.864 -2.980 92 3HG1 VAL 10 3HG1 VAL 10 -10.466 3.008 -1.644 93 1HG2 VAL 10 1HG2 VAL 10 -13.737 0.959 -2.846 94 2HG2 VAL 10 2HG2 VAL 10 -13.594 2.716 -2.837 95 3HG2 VAL 10 3HG2 VAL 10 -12.408 1.739 -3.703 96 H SER 11 H SER 11 -10.328 -0.383 -2.366 97 HA SER 11 HA SER 11 -11.902 -2.535 -3.696 98 1HB SER 11 1HB SER 11 -10.798 -0.352 -4.925 99 2HB SER 11 2HB SER 11 -9.512 -1.540 -5.113 100 HG SER 11 HG SER 11 -12.206 -1.664 -5.963 101 H CYS 12 H CYS 12 -10.819 -4.552 -4.018 102 HA CYS 12 HA CYS 12 -8.128 -4.798 -2.742 103 1HB CYS 12 1HB CYS 12 -8.882 -6.972 -1.762 104 2HB CYS 12 2HB CYS 12 -9.758 -5.590 -1.112 105 HG CYS 12 HG CYS 12 -11.126 -7.859 -2.331 106 H SER 13 H SER 13 -6.698 -5.999 -3.934 107 HA SER 13 HA SER 13 -7.790 -7.722 -6.113 108 1HB SER 13 1HB SER 13 -5.863 -5.448 -6.300 109 2HB SER 13 2HB SER 13 -5.590 -6.846 -7.334 110 HG SER 13 HG SER 13 -7.770 -6.608 -8.042 111 H SER 14 H SER 14 -6.868 -8.538 -3.550 112 HA SER 14 HA SER 14 -5.497 -10.821 -3.809 113 1HB SER 14 1HB SER 14 -3.545 -8.577 -4.065 114 2HB SER 14 2HB SER 14 -3.073 -9.982 -3.115 115 HG SER 14 HG SER 14 -3.314 -11.259 -4.879 116 H GLN 15 H GLN 15 -7.042 -10.639 -1.945 117 HA GLN 15 HA GLN 15 -5.535 -9.986 0.542 118 1HB GLN 15 1HB GLN 15 -6.898 -8.219 0.888 119 2HB GLN 15 2HB GLN 15 -7.866 -8.626 -0.513 120 1HG GLN 15 1HG GLN 15 -8.322 -10.108 2.071 121 2HG GLN 15 2HG GLN 15 -8.967 -8.487 1.861 122 1HE2 GLN 15 2HE2 GLN 15 -8.695 -10.643 -0.952 123 2HE2 GLN 15 1HE2 GLN 15 -10.363 -10.891 -1.125 124 H ASP 16 H ASP 16 -6.031 -11.352 2.330 125 HA ASP 16 HA ASP 16 -7.490 -13.845 1.581 126 1HB ASP 16 1HB ASP 16 -4.990 -13.404 2.820 127 2HB ASP 16 2HB ASP 16 -6.046 -14.000 4.098 128 H SER 17 H SER 17 -9.066 -14.710 3.025 129 HA SER 17 HA SER 17 -10.762 -12.820 4.311 130 1HB SER 17 1HB SER 17 -11.629 -14.968 3.569 131 2HB SER 17 2HB SER 17 -10.551 -15.825 4.668 132 HG SER 17 HG SER 17 -11.841 -15.365 6.281 133 H THR 18 H THR 18 -8.787 -15.367 5.912 134 HA THR 18 HA THR 18 -9.100 -14.344 8.549 135 HB THR 18 HB THR 18 -6.646 -15.530 8.658 136 HG1 THR 18 HG1 THR 18 -6.783 -17.252 7.114 137 1HG2 THR 18 1HG2 THR 18 -9.389 -16.792 8.513 138 2HG2 THR 18 2HG2 THR 18 -7.947 -17.674 9.016 139 3HG2 THR 18 3HG2 THR 18 -8.510 -16.294 9.959 140 H HIS 19 H HIS 19 -6.585 -13.761 6.109 141 HA HIS 19 HA HIS 19 -5.715 -11.379 7.699 142 1HB HIS 19 1HB HIS 19 -4.046 -13.003 5.750 143 2HB HIS 19 2HB HIS 19 -3.486 -11.664 6.752 144 HD1 HIS 19 HD1 HIS 19 -2.583 -12.282 9.000 145 HD2 HIS 19 HD2 HIS 19 -5.014 -15.287 7.437 146 HE1 HIS 19 HE1 HIS 19 -2.454 -14.224 10.620 147 H CYS 20 H CYS 20 -7.347 -10.136 6.576 148 HA CYS 20 HA CYS 20 -7.044 -9.899 3.637 149 1HB CYS 20 1HB CYS 20 -9.080 -8.467 3.784 150 2HB CYS 20 2HB CYS 20 -9.334 -10.076 4.443 151 HG CYS 20 HG CYS 20 -8.593 -8.558 6.794 152 H ALA 21 H ALA 21 -7.131 -7.644 2.743 153 HA ALA 21 HA ALA 21 -4.910 -6.110 3.669 154 1HB ALA 21 1HB ALA 21 -6.987 -5.883 1.575 155 2HB ALA 21 2HB ALA 21 -6.306 -4.349 2.118 156 3HB ALA 21 3HB ALA 21 -5.248 -5.604 1.471 157 H GLU 22 H GLU 22 -8.288 -6.085 4.545 158 HA GLU 22 HA GLU 22 -8.488 -3.427 5.558 159 1HB GLU 22 1HB GLU 22 -10.218 -5.524 5.347 160 2HB GLU 22 2HB GLU 22 -9.894 -5.544 7.082 161 1HG GLU 22 1HG GLU 22 -10.267 -2.927 6.847 162 2HG GLU 22 2HG GLU 22 -11.184 -3.410 5.419 163 H ASN 23 H ASN 23 -6.690 -6.161 6.717 164 HA ASN 23 HA ASN 23 -6.613 -5.518 9.514 165 1HB ASN 23 1HB ASN 23 -4.818 -7.038 7.648 166 2HB ASN 23 2HB ASN 23 -4.306 -6.724 9.305 167 1HD2 ASN 23 2HD2 ASN 23 -5.925 -8.960 7.412 168 2HD2 ASN 23 1HD2 ASN 23 -6.848 -9.720 8.619 169 H LEU 24 H LEU 24 -5.240 -4.029 6.740 170 HA LEU 24 HA LEU 24 -2.941 -2.791 7.897 171 1HB LEU 24 1HB LEU 24 -4.691 -1.766 5.636 172 2HB LEU 24 2HB LEU 24 -3.008 -1.334 5.947 173 HG LEU 24 HG LEU 24 -3.724 -4.231 5.567 174 1HD1 LEU 24 1HD1 LEU 24 -4.705 -2.734 3.696 175 2HD1 LEU 24 2HD1 LEU 24 -3.025 -2.457 3.238 176 3HD1 LEU 24 3HD1 LEU 24 -3.685 -4.092 3.222 177 1HD2 LEU 24 1HD2 LEU 24 -1.333 -2.494 5.563 178 2HD2 LEU 24 2HD2 LEU 24 -1.493 -4.195 5.999 179 3HD2 LEU 24 3HD2 LEU 24 -1.359 -3.727 4.303 180 H LEU 25 H LEU 25 -6.380 -2.110 7.992 181 HA LEU 25 HA LEU 25 -6.318 0.614 8.793 182 1HB LEU 25 1HB LEU 25 -8.207 -1.694 9.216 183 2HB LEU 25 2HB LEU 25 -8.498 -0.159 10.015 184 HG LEU 25 HG LEU 25 -9.714 -0.294 7.869 185 1HD1 LEU 25 1HD1 LEU 25 -8.709 1.879 8.767 186 2HD1 LEU 25 2HD1 LEU 25 -7.433 1.664 7.570 187 3HD1 LEU 25 3HD1 LEU 25 -9.104 1.853 7.049 188 1HD2 LEU 25 1HD2 LEU 25 -8.041 -1.800 6.754 189 2HD2 LEU 25 2HD2 LEU 25 -8.515 -0.422 5.760 190 3HD2 LEU 25 3HD2 LEU 25 -6.962 -0.414 6.596 191 H LYS 26 H LYS 26 -5.399 -2.310 10.437 192 HA LYS 26 HA LYS 26 -5.290 -0.843 13.037 193 1HB LYS 26 1HB LYS 26 -4.927 -3.829 12.633 194 2HB LYS 26 2HB LYS 26 -5.246 -2.972 14.138 195 1HG LYS 26 1HG LYS 26 -7.173 -3.038 11.799 196 2HG LYS 26 2HG LYS 26 -7.270 -4.124 13.187 197 1HD LYS 26 1HD LYS 26 -7.205 -1.123 13.523 198 2HD LYS 26 2HD LYS 26 -8.717 -1.998 13.278 199 1HE LYS 26 1HE LYS 26 -7.971 -3.501 15.224 200 2HE LYS 26 2HE LYS 26 -6.757 -2.266 15.560 201 1HZ LYS 26 1HZ LYS 26 -9.568 -1.482 15.200 202 2HZ LYS 26 2HZ LYS 26 -9.068 -2.135 16.686 203 3HZ LYS 26 3HZ LYS 26 -8.344 -0.719 16.098 204 H ALA 27 H ALA 27 -3.409 0.163 11.648 205 HA ALA 27 HA ALA 27 -1.014 -1.158 11.042 206 1HB ALA 27 1HB ALA 27 -1.693 1.625 11.895 207 2HB ALA 27 2HB ALA 27 0.008 1.160 11.863 208 3HB ALA 27 3HB ALA 27 -0.963 1.059 10.393 209 H ASP 28 H ASP 28 -2.313 -0.388 14.200 210 HA ASP 28 HA ASP 28 0.208 -1.430 15.433 211 1HB ASP 28 1HB ASP 28 -0.694 1.027 15.884 212 2HB ASP 28 2HB ASP 28 -1.760 0.187 17.009 213 H THR 29 H THR 29 -0.699 -3.612 15.152 214 HA THR 29 HA THR 29 -2.306 -4.398 17.474 215 HB THR 29 HB THR 29 -3.836 -5.756 15.806 216 HG1 THR 29 HG1 THR 29 -3.859 -5.041 13.833 217 1HG2 THR 29 1HG2 THR 29 -4.443 -3.884 17.442 218 2HG2 THR 29 2HG2 THR 29 -4.318 -2.787 16.066 219 3HG2 THR 29 3HG2 THR 29 -5.511 -4.087 16.053 220 H TYR 30 H TYR 30 -1.937 -6.170 14.404 221 HA TYR 30 HA TYR 30 0.446 -7.577 15.110 222 1HB TYR 30 1HB TYR 30 -0.564 -9.757 15.777 223 2HB TYR 30 2HB TYR 30 -0.885 -8.480 16.951 224 HD1 TYR 30 HD1 TYR 30 -3.119 -7.419 17.084 225 HD2 TYR 30 HD2 TYR 30 -2.341 -10.720 14.447 226 HE1 TYR 30 HE1 TYR 30 -5.558 -7.779 16.815 227 HE2 TYR 30 HE2 TYR 30 -4.780 -11.080 14.178 228 HH TYR 30 HH TYR 30 -7.049 -8.885 14.884 229 H ARG 31 H ARG 31 -2.715 -7.782 13.506 230 HA ARG 31 HA ARG 31 -1.646 -9.563 11.419 231 1HB ARG 31 1HB ARG 31 -4.098 -9.421 12.420 232 2HB ARG 31 2HB ARG 31 -4.294 -8.187 11.175 233 1HG ARG 31 1HG ARG 31 -3.894 -9.700 9.429 234 2HG ARG 31 2HG ARG 31 -3.066 -10.846 10.484 235 1HD ARG 31 1HD ARG 31 -5.881 -10.281 11.210 236 2HD ARG 31 2HD ARG 31 -5.655 -11.131 9.681 237 HE ARG 31 HE ARG 31 -4.014 -12.483 11.474 238 1HH1 ARG 31 1HH1 ARG 31 -7.410 -11.655 11.330 239 2HH1 ARG 31 2HH1 ARG 31 -7.890 -13.052 12.227 240 1HH2 ARG 31 1HH2 ARG 31 -4.682 -14.276 12.633 241 2HH2 ARG 31 2HH2 ARG 31 -6.366 -14.521 12.958 242 H LYS 32 H LYS 32 -1.993 -8.905 9.086 243 HA LYS 32 HA LYS 32 -1.935 -6.022 8.516 244 1HB LYS 32 1HB LYS 32 0.271 -6.105 7.408 245 2HB LYS 32 2HB LYS 32 0.413 -6.494 9.117 246 1HG LYS 32 1HG LYS 32 -0.101 -8.888 7.532 247 2HG LYS 32 2HG LYS 32 1.343 -8.047 6.973 248 1HD LYS 32 1HD LYS 32 2.496 -8.452 8.907 249 2HD LYS 32 2HD LYS 32 1.058 -8.298 9.916 250 1HE LYS 32 1HE LYS 32 0.292 -10.526 8.923 251 2HE LYS 32 2HE LYS 32 1.925 -10.685 8.274 252 1HZ LYS 32 1HZ LYS 32 1.235 -10.309 11.138 253 2HZ LYS 32 2HZ LYS 32 1.706 -11.775 10.421 254 3HZ LYS 32 3HZ LYS 32 2.802 -10.480 10.510 255 H TRP 33 H TRP 33 -0.863 -6.316 5.843 256 HA TRP 33 HA TRP 33 -3.198 -7.558 4.580 257 1HB TRP 33 1HB TRP 33 -2.162 -5.432 3.693 258 2HB TRP 33 2HB TRP 33 -0.756 -6.372 3.242 259 HD1 TRP 33 HD1 TRP 33 -4.277 -7.795 2.818 260 HE1 TRP 33 HE1 TRP 33 -4.743 -8.105 0.292 261 HE3 TRP 33 HE3 TRP 33 -0.159 -5.512 0.930 262 HZ2 TRP 33 HZ2 TRP 33 -3.499 -7.432 -2.207 263 HZ3 TRP 33 HZ3 TRP 33 0.199 -5.364 -1.524 264 HH2 TRP 33 HH2 TRP 33 -1.470 -6.310 -3.085 265 H ARG 34 H ARG 34 -3.226 -9.433 3.433 266 HA ARG 34 HA ARG 34 -0.705 -10.856 2.855 267 1HB ARG 34 1HB ARG 34 -2.612 -11.622 4.960 268 2HB ARG 34 2HB ARG 34 -2.327 -12.914 3.797 269 1HG ARG 34 1HG ARG 34 0.009 -12.928 4.218 270 2HG ARG 34 2HG ARG 34 -0.048 -11.368 5.038 271 1HD ARG 34 1HD ARG 34 -0.498 -12.348 7.019 272 2HD ARG 34 2HD ARG 34 -1.827 -13.276 6.325 273 HE ARG 34 HE ARG 34 0.443 -14.588 5.427 274 1HH1 ARG 34 1HH1 ARG 34 -0.787 -13.638 8.561 275 2HH1 ARG 34 2HH1 ARG 34 -0.030 -14.964 9.372 276 1HH2 ARG 34 1HH2 ARG 34 1.406 -16.288 6.518 277 2HH2 ARG 34 2HH2 ARG 34 1.199 -16.449 8.230 278 H ALA 35 H ALA 35 -0.892 -11.651 0.813 279 HA ALA 35 HA ALA 35 -3.076 -11.198 -0.880 280 1HB ALA 35 1HB ALA 35 -0.714 -11.932 -1.512 281 2HB ALA 35 2HB ALA 35 -1.225 -13.583 -1.159 282 3HB ALA 35 3HB ALA 35 -2.015 -12.671 -2.446 283 H ALA 36 H ALA 36 -4.693 -12.543 -1.753 284 HA ALA 36 HA ALA 36 -6.167 -14.077 0.129 285 1HB ALA 36 1HB ALA 36 -6.905 -12.887 -2.068 286 2HB ALA 36 2HB ALA 36 -6.471 -14.412 -2.843 287 3HB ALA 36 3HB ALA 36 -7.721 -14.378 -1.599 288 H LYS 37 H LYS 37 -3.605 -14.982 -2.058 289 HA LYS 37 HA LYS 37 -3.828 -17.770 -1.074 290 1HB LYS 37 1HB LYS 37 -3.213 -18.558 -3.377 291 2HB LYS 37 2HB LYS 37 -4.813 -17.823 -3.297 292 1HG LYS 37 1HG LYS 37 -2.543 -15.993 -3.881 293 2HG LYS 37 2HG LYS 37 -2.987 -17.127 -5.156 294 1HD LYS 37 1HD LYS 37 -5.107 -16.218 -5.420 295 2HD LYS 37 2HD LYS 37 -5.160 -15.598 -3.770 296 1HE LYS 37 1HE LYS 37 -4.883 -13.702 -5.228 297 2HE LYS 37 2HE LYS 37 -3.336 -13.970 -4.424 298 1HZ LYS 37 1HZ LYS 37 -3.971 -15.141 -7.067 299 2HZ LYS 37 2HZ LYS 37 -3.268 -13.603 -6.904 300 3HZ LYS 37 3HZ LYS 37 -2.449 -14.973 -6.330 301 H ALA 38 H ALA 38 -1.672 -18.880 -2.126 302 HA ALA 38 HA ALA 38 0.561 -17.258 -1.040 303 1HB ALA 38 1HB ALA 38 0.145 -19.686 -0.364 304 2HB ALA 38 2HB ALA 38 0.662 -20.133 -1.990 305 3HB ALA 38 3HB ALA 38 1.782 -19.314 -0.902 306 H GLY 39 H GLY 39 2.692 -18.345 -2.462 307 1HA GLY 39 1HA GLY 39 3.890 -18.087 -4.469 308 2HA GLY 39 2HA GLY 39 2.350 -18.247 -5.319 309 H GLU 40 H GLU 40 3.371 -15.873 -2.915 310 HA GLU 40 HA GLU 40 2.149 -13.617 -3.928 311 1HB GLU 40 1HB GLU 40 4.656 -14.023 -2.347 312 2HB GLU 40 2HB GLU 40 4.227 -12.404 -2.898 313 1HG GLU 40 1HG GLU 40 2.023 -13.967 -1.682 314 2HG GLU 40 2HG GLU 40 3.314 -13.480 -0.593 315 H LYS 41 H LYS 41 2.265 -13.587 -6.160 316 HA LYS 41 HA LYS 41 4.910 -13.076 -7.432 317 1HB LYS 41 1HB LYS 41 3.242 -14.711 -8.451 318 2HB LYS 41 2HB LYS 41 2.216 -13.321 -8.799 319 1HG LYS 41 1HG LYS 41 3.569 -12.572 -10.478 320 2HG LYS 41 2HG LYS 41 5.046 -13.053 -9.640 321 1HD LYS 41 1HD LYS 41 5.047 -15.150 -10.558 322 2HD LYS 41 2HD LYS 41 3.287 -15.266 -10.555 323 1HE LYS 41 1HE LYS 41 4.430 -13.222 -12.375 324 2HE LYS 41 2HE LYS 41 4.753 -14.900 -12.813 325 1HZ LYS 41 1HZ LYS 41 2.349 -15.329 -12.565 326 2HZ LYS 41 2HZ LYS 41 2.098 -13.666 -12.322 327 3HZ LYS 41 3HZ LYS 41 2.704 -14.223 -13.804 328 H THR 42 H THR 42 1.615 -11.712 -7.501 329 HA THR 42 HA THR 42 2.666 -8.996 -7.157 330 HB THR 42 HB THR 42 1.532 -8.155 -9.232 331 HG1 THR 42 HG1 THR 42 0.546 -9.511 -10.515 332 1HG2 THR 42 1HG2 THR 42 4.024 -8.869 -9.034 333 2HG2 THR 42 2HG2 THR 42 3.546 -10.252 -10.019 334 3HG2 THR 42 3HG2 THR 42 3.354 -8.614 -10.645 335 H ILE 43 H ILE 43 1.240 -8.066 -5.773 336 HA ILE 43 HA ILE 43 -1.628 -8.935 -5.934 337 HB ILE 43 HB ILE 43 -1.675 -8.414 -3.436 338 1HG1 ILE 43 1HG1 ILE 43 1.325 -8.644 -3.757 339 2HG1 ILE 43 2HG1 ILE 43 0.457 -7.144 -3.429 340 1HG2 ILE 43 1HG2 ILE 43 -1.352 -10.719 -4.680 341 2HG2 ILE 43 2HG2 ILE 43 0.239 -10.645 -3.931 342 3HG2 ILE 43 3HG2 ILE 43 -1.210 -10.612 -2.927 343 1HD1 ILE 43 1HD1 ILE 43 -0.583 -8.639 -1.459 344 2HD1 ILE 43 2HD1 ILE 43 0.965 -9.466 -1.630 345 3HD1 ILE 43 3HD1 ILE 43 0.924 -7.745 -1.255 346 H SER 44 H SER 44 -3.204 -7.294 -5.604 347 HA SER 44 HA SER 44 -2.089 -4.534 -5.353 348 1HB SER 44 1HB SER 44 -4.042 -5.576 -7.378 349 2HB SER 44 2HB SER 44 -4.021 -3.874 -6.939 350 HG SER 44 HG SER 44 -2.208 -5.394 -8.373 351 H VAL 45 H VAL 45 -3.348 -3.115 -4.150 352 HA VAL 45 HA VAL 45 -5.988 -3.986 -3.163 353 HB VAL 45 HB VAL 45 -4.401 -5.057 -1.589 354 1HG1 VAL 45 1HG1 VAL 45 -2.618 -3.243 -1.978 355 2HG1 VAL 45 2HG1 VAL 45 -3.503 -2.286 -0.793 356 3HG1 VAL 45 3HG1 VAL 45 -2.805 -3.837 -0.330 357 1HG2 VAL 45 1HG2 VAL 45 -6.099 -2.755 -0.652 358 2HG2 VAL 45 2HG2 VAL 45 -6.394 -4.487 -0.499 359 3HG2 VAL 45 3HG2 VAL 45 -5.176 -3.706 0.509 360 H VAL 46 H VAL 46 -7.191 -2.169 -3.444 361 HA VAL 46 HA VAL 46 -5.854 0.465 -3.225 362 HB VAL 46 HB VAL 46 -8.702 -0.023 -4.101 363 1HG1 VAL 46 1HG1 VAL 46 -7.722 2.288 -3.495 364 2HG1 VAL 46 2HG1 VAL 46 -6.783 2.127 -4.979 365 3HG1 VAL 46 3HG1 VAL 46 -8.545 2.133 -5.048 366 1HG2 VAL 46 1HG2 VAL 46 -6.125 -0.398 -5.596 367 2HG2 VAL 46 2HG2 VAL 46 -7.619 -1.327 -5.706 368 3HG2 VAL 46 3HG2 VAL 46 -7.515 0.267 -6.455 369 H LEU 47 H LEU 47 -6.020 1.543 -1.351 370 HA LEU 47 HA LEU 47 -8.206 0.782 0.532 371 1HB LEU 47 1HB LEU 47 -5.810 2.482 1.236 372 2HB LEU 47 2HB LEU 47 -6.832 1.529 2.309 373 HG LEU 47 HG LEU 47 -5.902 -0.423 0.630 374 1HD1 LEU 47 1HD1 LEU 47 -4.392 1.646 -0.198 375 2HD1 LEU 47 2HD1 LEU 47 -3.397 1.100 1.151 376 3HD1 LEU 47 3HD1 LEU 47 -3.788 -0.010 -0.161 377 1HD2 LEU 47 1HD2 LEU 47 -5.891 -0.160 3.214 378 2HD2 LEU 47 2HD2 LEU 47 -4.635 -1.158 2.483 379 3HD2 LEU 47 3HD2 LEU 47 -4.265 0.487 2.998 380 H GLN 48 H GLN 48 -9.470 2.434 1.516 381 HA GLN 48 HA GLN 48 -9.733 4.861 -0.153 382 1HB GLN 48 1HB GLN 48 -11.638 3.268 0.831 383 2HB GLN 48 2HB GLN 48 -11.488 4.355 2.212 384 1HG GLN 48 1HG GLN 48 -11.651 5.566 -0.516 385 2HG GLN 48 2HG GLN 48 -13.130 4.923 0.197 386 1HE2 GLN 48 2HE2 GLN 48 -12.045 7.819 -0.237 387 2HE2 GLN 48 1HE2 GLN 48 -12.265 8.547 1.281 388 H LEU 49 H LEU 49 -9.845 6.989 0.859 389 HA LEU 49 HA LEU 49 -8.128 7.187 3.285 390 1HB LEU 49 1HB LEU 49 -8.750 9.252 1.144 391 2HB LEU 49 2HB LEU 49 -7.669 9.490 2.517 392 HG LEU 49 HG LEU 49 -7.271 7.253 0.525 393 1HD1 LEU 49 1HD1 LEU 49 -6.580 10.149 0.354 394 2HD1 LEU 49 2HD1 LEU 49 -5.345 8.997 -0.154 395 3HD1 LEU 49 3HD1 LEU 49 -6.925 8.998 -0.937 396 1HD2 LEU 49 1HD2 LEU 49 -6.186 7.582 2.971 397 2HD2 LEU 49 2HD2 LEU 49 -5.286 6.878 1.627 398 3HD2 LEU 49 3HD2 LEU 49 -5.072 8.581 2.037 399 H GLU 50 H GLU 50 -9.152 7.819 5.099 400 HA GLU 50 HA GLU 50 -11.907 8.220 5.384 401 1HB GLU 50 1HB GLU 50 -10.115 7.837 7.183 402 2HB GLU 50 2HB GLU 50 -9.905 9.588 7.172 403 1HG GLU 50 1HG GLU 50 -12.598 9.470 7.333 404 2HG GLU 50 2HG GLU 50 -12.193 7.960 8.149 405 H LYS 51 H LYS 51 -9.784 10.455 3.898 406 HA LYS 51 HA LYS 51 -11.913 12.425 3.692 407 1HB LYS 51 1HB LYS 51 -10.461 14.292 4.599 408 2HB LYS 51 2HB LYS 51 -11.051 13.167 5.823 409 1HG LYS 51 1HG LYS 51 -8.959 12.168 6.105 410 2HG LYS 51 2HG LYS 51 -8.397 12.658 4.507 411 1HD LYS 51 1HD LYS 51 -8.340 15.016 5.258 412 2HD LYS 51 2HD LYS 51 -8.868 14.508 6.863 413 1HE LYS 51 1HE LYS 51 -6.493 13.109 5.743 414 2HE LYS 51 2HE LYS 51 -6.266 14.792 6.222 415 1HZ LYS 51 1HZ LYS 51 -7.342 14.174 8.375 416 2HZ LYS 51 2HZ LYS 51 -7.233 12.550 7.901 417 3HZ LYS 51 3HZ LYS 51 -5.819 13.468 8.108 418 H GLU 52 H GLU 52 -11.618 13.660 1.830 419 HA GLU 52 HA GLU 52 -9.539 12.812 -0.007 420 1HB GLU 52 1HB GLU 52 -11.948 13.602 -0.576 421 2HB GLU 52 2HB GLU 52 -11.288 15.225 -0.392 422 1HG GLU 52 1HG GLU 52 -9.509 14.651 -2.050 423 2HG GLU 52 2HG GLU 52 -10.305 13.099 -2.309 424 H GLU 53 H GLU 53 -7.532 13.533 0.302 425 HA GLU 53 HA GLU 53 -7.053 16.433 0.610 426 1HB GLU 53 1HB GLU 53 -5.109 15.520 2.295 427 2HB GLU 53 2HB GLU 53 -6.656 16.149 2.846 428 1HG GLU 53 1HG GLU 53 -6.092 13.980 3.920 429 2HG GLU 53 2HG GLU 53 -7.567 13.871 2.962 430 H GLN 54 H GLN 54 -4.492 16.696 0.591 431 HA GLN 54 HA GLN 54 -3.605 15.375 -1.882 432 1HB GLN 54 1HB GLN 54 -2.219 17.449 -0.150 433 2HB GLN 54 2HB GLN 54 -1.697 16.931 -1.752 434 1HG GLN 54 1HG GLN 54 -3.563 17.904 -2.809 435 2HG GLN 54 2HG GLN 54 -4.464 18.016 -1.307 436 1HE2 GLN 54 2HE2 GLN 54 -1.046 18.989 -1.690 437 2HE2 GLN 54 1HE2 GLN 54 -1.318 20.639 -1.401 438 H ILE 55 H ILE 55 -0.933 15.029 -1.615 439 HA ILE 55 HA ILE 55 -0.479 13.420 0.845 440 HB ILE 55 HB ILE 55 -0.003 12.382 -1.969 441 1HG1 ILE 55 1HG1 ILE 55 -1.705 10.618 -0.802 442 2HG1 ILE 55 2HG1 ILE 55 -2.233 12.108 -0.023 443 1HG2 ILE 55 1HG2 ILE 55 1.661 11.610 -0.302 444 2HG2 ILE 55 2HG2 ILE 55 0.349 11.056 0.739 445 3HG2 ILE 55 3HG2 ILE 55 0.614 10.290 -0.828 446 1HD1 ILE 55 1HD1 ILE 55 -2.159 13.074 -2.471 447 2HD1 ILE 55 2HD1 ILE 55 -2.276 11.376 -2.933 448 3HD1 ILE 55 3HD1 ILE 55 -3.542 12.112 -1.951 449 H HIS 56 H HIS 56 1.434 14.016 1.685 450 HA HIS 56 HA HIS 56 3.508 15.158 -0.142 451 1HB HIS 56 1HB HIS 56 2.551 16.704 1.603 452 2HB HIS 56 2HB HIS 56 3.207 15.630 2.837 453 HD1 HIS 56 HD1 HIS 56 4.242 18.084 0.188 454 HD2 HIS 56 HD2 HIS 56 6.040 15.715 3.109 455 HE1 HIS 56 HE1 HIS 56 6.647 18.858 0.357 456 H SER 57 H SER 57 2.829 12.812 2.381 457 HA SER 57 HA SER 57 5.404 11.476 1.794 458 1HB SER 57 1HB SER 57 4.690 12.742 4.412 459 2HB SER 57 2HB SER 57 5.535 11.199 4.442 460 HG SER 57 HG SER 57 6.671 13.453 4.216 461 H VAL 58 H VAL 58 5.389 9.251 2.678 462 HA VAL 58 HA VAL 58 2.710 8.247 3.469 463 HB VAL 58 HB VAL 58 4.270 7.300 1.051 464 1HG1 VAL 58 1HG1 VAL 58 1.805 6.271 2.453 465 2HG1 VAL 58 2HG1 VAL 58 2.027 6.004 0.724 466 3HG1 VAL 58 3HG1 VAL 58 3.202 5.364 1.872 467 1HG2 VAL 58 1HG2 VAL 58 1.765 8.941 1.412 468 2HG2 VAL 58 2HG2 VAL 58 3.192 9.314 0.446 469 3HG2 VAL 58 3HG2 VAL 58 2.077 8.054 -0.081 470 H ASP 59 H ASP 59 2.800 5.999 4.222 471 HA ASP 59 HA ASP 59 5.538 5.051 4.937 472 1HB ASP 59 1HB ASP 59 3.285 5.769 6.715 473 2HB ASP 59 2HB ASP 59 4.029 4.210 7.066 474 H ILE 60 H ILE 60 5.809 2.920 4.438 475 HA ILE 60 HA ILE 60 3.399 1.184 4.155 476 HB ILE 60 HB ILE 60 5.647 1.307 2.130 477 1HG1 ILE 60 1HG1 ILE 60 4.219 3.372 2.145 478 2HG1 ILE 60 2HG1 ILE 60 4.115 2.460 0.643 479 1HG2 ILE 60 1HG2 ILE 60 3.271 -0.420 2.546 480 2HG2 ILE 60 2HG2 ILE 60 3.583 0.083 0.885 481 3HG2 ILE 60 3HG2 ILE 60 4.820 -0.792 1.787 482 1HD1 ILE 60 1HD1 ILE 60 2.160 1.682 2.678 483 2HD1 ILE 60 2HD1 ILE 60 1.991 3.336 2.088 484 3HD1 ILE 60 3HD1 ILE 60 1.947 1.988 0.953 485 H GLY 61 H GLY 61 3.780 -0.557 5.462 486 1HA GLY 61 1HA GLY 61 6.531 -1.230 6.188 487 2HA GLY 61 2HA GLY 61 5.110 -1.979 6.859 488 H ASN 62 H ASN 62 7.676 -2.512 4.904 489 HA ASN 62 HA ASN 62 6.361 -4.192 2.884 490 1HB ASN 62 1HB ASN 62 9.202 -3.489 3.555 491 2HB ASN 62 2HB ASN 62 8.867 -4.854 2.488 492 1HD2 ASN 62 2HD2 ASN 62 8.619 -1.331 2.789 493 2HD2 ASN 62 1HD2 ASN 62 8.227 -1.044 1.162 494 H ASP 63 H ASP 63 5.653 -6.232 3.338 495 HA ASP 63 HA ASP 63 6.893 -7.695 5.607 496 1HB ASP 63 1HB ASP 63 4.249 -7.443 4.734 497 2HB ASP 63 2HB ASP 63 4.710 -9.054 4.191 498 H GLY 64 H GLY 64 8.768 -7.592 3.842 499 1HA GLY 64 1HA GLY 64 10.223 -9.140 2.754 500 2HA GLY 64 2HA GLY 64 8.876 -10.267 2.600 501 H SER 65 H SER 65 7.548 -7.439 1.621 502 HA SER 65 HA SER 65 7.386 -8.094 -1.135 503 1HB SER 65 1HB SER 65 7.065 -5.411 0.243 504 2HB SER 65 2HB SER 65 6.541 -5.769 -1.392 505 HG SER 65 HG SER 65 5.355 -7.594 -0.236 506 H ALA 66 H ALA 66 8.236 -6.819 -2.934 507 HA ALA 66 HA ALA 66 10.955 -5.723 -2.372 508 1HB ALA 66 1HB ALA 66 10.525 -8.037 -3.708 509 2HB ALA 66 2HB ALA 66 10.406 -6.891 -5.044 510 3HB ALA 66 3HB ALA 66 11.873 -6.958 -4.068 511 H PHE 67 H PHE 67 8.404 -5.818 -4.891 512 HA PHE 67 HA PHE 67 9.086 -2.979 -5.525 513 1HB PHE 67 1HB PHE 67 7.361 -4.906 -7.109 514 2HB PHE 67 2HB PHE 67 7.892 -3.317 -7.627 515 HD1 PHE 67 HD1 PHE 67 10.685 -3.185 -6.864 516 HD2 PHE 67 HD2 PHE 67 8.449 -6.500 -8.423 517 HE1 PHE 67 HE1 PHE 67 12.773 -4.173 -7.747 518 HE2 PHE 67 HE2 PHE 67 10.530 -7.496 -9.298 519 HZ PHE 67 HZ PHE 67 12.702 -6.335 -8.970 520 H VAL 68 H VAL 68 7.820 -1.477 -4.617 521 HA VAL 68 HA VAL 68 4.950 -2.194 -4.107 522 HB VAL 68 HB VAL 68 6.702 -0.370 -2.434 523 1HG1 VAL 68 1HG1 VAL 68 3.809 -1.243 -2.234 524 2HG1 VAL 68 2HG1 VAL 68 4.697 -0.573 -0.865 525 3HG1 VAL 68 3HG1 VAL 68 4.434 0.403 -2.309 526 1HG2 VAL 68 1HG2 VAL 68 5.833 -3.235 -2.221 527 2HG2 VAL 68 2HG2 VAL 68 7.413 -2.526 -1.888 528 3HG2 VAL 68 3HG2 VAL 68 6.084 -2.295 -0.751 529 H GLU 69 H GLU 69 3.797 -1.147 -5.605 530 HA GLU 69 HA GLU 69 4.602 1.612 -6.419 531 1HB GLU 69 1HB GLU 69 4.332 -0.044 -8.239 532 2HB GLU 69 2HB GLU 69 2.674 -0.341 -7.724 533 1HG GLU 69 1HG GLU 69 1.899 1.568 -8.686 534 2HG GLU 69 2HG GLU 69 3.303 2.508 -8.183 535 H VAL 70 H VAL 70 3.135 3.335 -6.185 536 HA VAL 70 HA VAL 70 0.531 2.682 -4.880 537 HB VAL 70 HB VAL 70 2.235 5.029 -4.041 538 1HG1 VAL 70 1HG1 VAL 70 -0.425 3.965 -3.375 539 2HG1 VAL 70 2HG1 VAL 70 0.571 4.328 -1.965 540 3HG1 VAL 70 3HG1 VAL 70 0.229 5.587 -3.151 541 1HG2 VAL 70 1HG2 VAL 70 3.327 2.781 -3.561 542 2HG2 VAL 70 2HG2 VAL 70 2.983 3.760 -2.136 543 3HG2 VAL 70 3HG2 VAL 70 1.932 2.407 -2.553 544 H LEU 71 H LEU 71 -1.113 3.592 -5.944 545 HA LEU 71 HA LEU 71 -0.561 5.944 -7.703 546 1HB LEU 71 1HB LEU 71 -2.037 3.460 -8.113 547 2HB LEU 71 2HB LEU 71 -3.059 4.863 -8.416 548 HG LEU 71 HG LEU 71 -1.200 5.773 -9.877 549 1HD1 LEU 71 1HD1 LEU 71 -0.154 2.951 -9.493 550 2HD1 LEU 71 2HD1 LEU 71 0.459 4.104 -10.678 551 3HD1 LEU 71 3HD1 LEU 71 0.637 4.433 -8.954 552 1HD2 LEU 71 1HD2 LEU 71 -2.830 3.334 -10.417 553 2HD2 LEU 71 2HD2 LEU 71 -2.885 4.916 -11.194 554 3HD2 LEU 71 3HD2 LEU 71 -1.612 3.771 -11.615 555 H VAL 72 H VAL 72 -2.432 7.475 -7.853 556 HA VAL 72 HA VAL 72 -4.020 7.556 -5.326 557 HB VAL 72 HB VAL 72 -3.787 10.083 -5.584 558 1HG1 VAL 72 1HG1 VAL 72 -1.717 8.151 -4.651 559 2HG1 VAL 72 2HG1 VAL 72 -1.326 9.870 -4.621 560 3HG1 VAL 72 3HG1 VAL 72 -2.710 9.266 -3.712 561 1HG2 VAL 72 1HG2 VAL 72 -1.492 9.149 -7.319 562 2HG2 VAL 72 2HG2 VAL 72 -2.830 10.181 -7.812 563 3HG2 VAL 72 3HG2 VAL 72 -1.632 10.779 -6.668 564 H GLY 73 H GLY 73 -6.020 8.888 -5.532 565 1HA GLY 73 1HA GLY 73 -7.040 9.919 -7.929 566 2HA GLY 73 2HA GLY 73 -7.496 8.222 -7.883 567 H SER 74 H SER 74 -9.538 9.813 -7.865 568 HA SER 74 HA SER 74 -10.390 10.162 -5.050 569 1HB SER 74 1HB SER 74 -10.597 12.243 -6.195 570 2HB SER 74 2HB SER 74 -11.281 11.473 -7.617 571 HG SER 74 HG SER 74 -12.919 12.413 -6.388 572 H SER 75 H SER 75 -12.595 9.542 -4.581 573 HA SER 75 HA SER 75 -13.383 7.093 -6.020 574 1HB SER 75 1HB SER 75 -13.339 7.445 -3.421 575 2HB SER 75 2HB SER 75 -14.884 8.247 -3.682 576 HG SER 75 HG SER 75 -15.613 6.268 -3.623 577 H ALA 76 H ALA 76 -13.826 10.182 -6.774 578 HA ALA 76 HA ALA 76 -16.597 10.677 -6.868 579 1HB ALA 76 1HB ALA 76 -14.555 12.164 -7.563 580 2HB ALA 76 2HB ALA 76 -14.814 11.453 -9.156 581 3HB ALA 76 3HB ALA 76 -16.100 12.383 -8.386 582 H GLY 77 H GLY 77 -18.166 9.467 -7.805 583 1HA GLY 77 1HA GLY 77 -17.677 7.290 -9.582 584 2HA GLY 77 2HA GLY 77 -19.256 8.024 -9.299 585 H GLY 78 H GLY 78 -16.663 7.719 -11.510 586 1HA GLY 78 1HA GLY 78 -17.982 8.679 -13.758 587 2HA GLY 78 2HA GLY 78 -17.197 10.106 -13.078 588 H ALA 79 H ALA 79 -14.916 8.591 -12.021 589 HA ALA 79 HA ALA 79 -13.401 8.366 -14.557 590 1HB ALA 79 1HB ALA 79 -12.696 9.629 -12.333 591 2HB ALA 79 2HB ALA 79 -12.139 8.025 -11.861 592 3HB ALA 79 3HB ALA 79 -11.490 8.792 -13.309 593 H GLY 80 H GLY 80 -14.036 6.447 -11.613 594 1HA GLY 80 1HA GLY 80 -14.474 4.058 -11.707 595 2HA GLY 80 2HA GLY 80 -13.582 3.987 -13.228 596 H GLU 81 H GLU 81 -12.604 2.122 -11.847 597 HA GLU 81 HA GLU 81 -10.516 3.105 -9.975 598 1HB GLU 81 1HB GLU 81 -10.157 0.664 -9.534 599 2HB GLU 81 2HB GLU 81 -11.804 1.193 -9.195 600 1HG GLU 81 1HG GLU 81 -12.685 0.101 -11.040 601 2HG GLU 81 2HG GLU 81 -11.168 0.177 -11.939 602 H GLN 82 H GLN 82 -10.456 3.429 -12.994 603 HA GLN 82 HA GLN 82 -7.771 2.189 -13.384 604 1HB GLN 82 1HB GLN 82 -10.021 2.326 -15.415 605 2HB GLN 82 2HB GLN 82 -8.367 1.831 -15.783 606 1HG GLN 82 1HG GLN 82 -8.549 -0.156 -14.590 607 2HG GLN 82 2HG GLN 82 -9.819 0.472 -13.539 608 1HE2 GLN 82 2HE2 GLN 82 -11.764 1.359 -15.261 609 2HE2 GLN 82 1HE2 GLN 82 -12.305 0.104 -16.269 610 H ASP 83 H ASP 83 -8.893 4.967 -12.681 611 HA ASP 83 HA ASP 83 -7.397 6.427 -14.811 612 1HB ASP 83 1HB ASP 83 -9.954 6.660 -14.942 613 2HB ASP 83 2HB ASP 83 -9.837 7.556 -13.427 614 H TYR 84 H TYR 84 -6.220 5.567 -12.429 615 HA TYR 84 HA TYR 84 -6.294 7.794 -10.515 616 1HB TYR 84 1HB TYR 84 -4.977 5.092 -10.614 617 2HB TYR 84 2HB TYR 84 -4.374 6.315 -9.498 618 HD1 TYR 84 HD1 TYR 84 -7.831 5.379 -10.651 619 HD2 TYR 84 HD2 TYR 84 -5.134 5.881 -7.345 620 HE1 TYR 84 HE1 TYR 84 -9.669 4.856 -9.071 621 HE2 TYR 84 HE2 TYR 84 -6.974 5.361 -5.766 622 HH TYR 84 HH TYR 84 -9.544 3.830 -6.386 623 H GLU 85 H GLU 85 -3.836 8.205 -9.756 624 HA GLU 85 HA GLU 85 -2.271 8.883 -12.205 625 1HB GLU 85 1HB GLU 85 -1.563 10.716 -10.113 626 2HB GLU 85 2HB GLU 85 -2.272 11.078 -11.679 627 1HG GLU 85 1HG GLU 85 -4.006 10.157 -9.384 628 2HG GLU 85 2HG GLU 85 -3.538 11.848 -9.546 629 H VAL 86 H VAL 86 -0.218 8.123 -12.168 630 HA VAL 86 HA VAL 86 0.654 6.365 -10.100 631 HB VAL 86 HB VAL 86 2.348 7.758 -12.190 632 1HG1 VAL 86 1HG1 VAL 86 2.754 5.460 -10.306 633 2HG1 VAL 86 2HG1 VAL 86 3.517 5.397 -11.895 634 3HG1 VAL 86 3HG1 VAL 86 3.889 6.720 -10.790 635 1HG2 VAL 86 1HG2 VAL 86 0.468 5.422 -12.265 636 2HG2 VAL 86 2HG2 VAL 86 0.744 6.671 -13.480 637 3HG2 VAL 86 3HG2 VAL 86 1.920 5.375 -13.265 638 H LEU 87 H LEU 87 0.463 7.599 -8.136 639 HA LEU 87 HA LEU 87 1.790 10.067 -7.624 640 1HB LEU 87 1HB LEU 87 0.070 8.926 -6.143 641 2HB LEU 87 2HB LEU 87 1.351 7.833 -5.621 642 HG LEU 87 HG LEU 87 2.693 9.877 -4.961 643 1HD1 LEU 87 1HD1 LEU 87 0.199 11.140 -5.976 644 2HD1 LEU 87 2HD1 LEU 87 0.878 11.826 -4.501 645 3HD1 LEU 87 3HD1 LEU 87 1.850 11.757 -5.970 646 1HD2 LEU 87 1HD2 LEU 87 0.178 8.919 -3.692 647 2HD2 LEU 87 2HD2 LEU 87 1.821 8.943 -3.052 648 3HD2 LEU 87 3HD2 LEU 87 0.852 10.417 -3.048 649 H LEU 88 H LEU 88 2.853 6.764 -6.700 650 HA LEU 88 HA LEU 88 5.636 7.644 -7.243 651 1HB LEU 88 1HB LEU 88 6.462 6.671 -5.183 652 2HB LEU 88 2HB LEU 88 5.235 7.881 -4.821 653 HG LEU 88 HG LEU 88 3.775 5.524 -5.118 654 1HD1 LEU 88 1HD1 LEU 88 6.335 4.648 -4.818 655 2HD1 LEU 88 2HD1 LEU 88 5.839 4.774 -3.132 656 3HD1 LEU 88 3HD1 LEU 88 4.926 3.757 -4.244 657 1HD2 LEU 88 1HD2 LEU 88 4.710 7.268 -2.881 658 2HD2 LEU 88 2HD2 LEU 88 3.067 6.918 -3.415 659 3HD2 LEU 88 3HD2 LEU 88 3.952 5.735 -2.452 660 H VAL 89 H VAL 89 6.524 6.266 -8.649 661 HA VAL 89 HA VAL 89 5.326 3.936 -9.649 662 HB VAL 89 HB VAL 89 7.580 3.373 -10.552 663 1HG1 VAL 89 1HG1 VAL 89 6.628 6.243 -10.669 664 2HG1 VAL 89 2HG1 VAL 89 7.922 5.628 -11.698 665 3HG1 VAL 89 3HG1 VAL 89 6.299 4.946 -11.819 666 1HG2 VAL 89 1HG2 VAL 89 8.353 5.379 -8.472 667 2HG2 VAL 89 2HG2 VAL 89 9.194 3.918 -8.986 668 3HG2 VAL 89 3HG2 VAL 89 9.263 5.371 -9.981 669 H THR 90 H THR 90 6.686 1.719 -9.576 670 HA THR 90 HA THR 90 6.271 0.679 -6.938 671 HB THR 90 HB THR 90 6.279 -0.469 -9.356 672 HG1 THR 90 HG1 THR 90 6.968 -1.645 -6.888 673 1HG2 THR 90 1HG2 THR 90 8.806 -0.205 -9.551 674 2HG2 THR 90 2HG2 THR 90 8.944 -1.392 -8.253 675 3HG2 THR 90 3HG2 THR 90 8.194 -1.843 -9.784 676 H SER 91 H SER 91 7.650 0.496 -5.266 677 HA SER 91 HA SER 91 10.385 1.576 -5.585 678 1HB SER 91 1HB SER 91 10.226 1.443 -2.980 679 2HB SER 91 2HB SER 91 9.331 2.702 -3.823 680 HG SER 91 HG SER 91 8.379 0.850 -2.231 681 H SER 92 H SER 92 11.957 0.130 -5.836 682 HA SER 92 HA SER 92 11.622 -2.692 -5.183 683 1HB SER 92 1HB SER 92 13.901 -2.940 -6.003 684 2HB SER 92 2HB SER 92 13.042 -1.854 -7.092 685 HG SER 92 HG SER 92 14.320 -0.288 -6.505 686 H PHE 93 H PHE 93 11.041 -1.986 -2.899 687 HA PHE 93 HA PHE 93 12.900 -0.903 -1.071 688 1HB PHE 93 1HB PHE 93 10.488 -1.177 -0.617 689 2HB PHE 93 2HB PHE 93 10.716 -2.921 -0.552 690 HD1 PHE 93 HD1 PHE 93 12.562 0.036 0.829 691 HD2 PHE 93 HD2 PHE 93 10.678 -3.740 1.614 692 HE1 PHE 93 HE1 PHE 93 13.241 0.194 3.211 693 HE2 PHE 93 HE2 PHE 93 11.354 -3.585 3.998 694 HZ PHE 93 HZ PHE 93 12.637 -1.617 4.795 695 H MET 94 H MET 94 12.071 -4.364 -1.500 696 HA MET 94 HA MET 94 14.812 -4.986 -0.487 697 1HB MET 94 1HB MET 94 12.179 -6.381 -0.016 698 2HB MET 94 2HB MET 94 13.723 -7.185 0.267 699 1HG MET 94 1HG MET 94 14.343 -5.641 1.956 700 2HG MET 94 2HG MET 94 13.099 -4.488 1.471 701 1HE MET 94 1HE MET 94 14.080 -7.742 2.951 702 2HE MET 94 2HE MET 94 12.664 -8.408 3.775 703 3HE MET 94 3HE MET 94 12.791 -8.499 2.020 704 H SER 95 H SER 95 15.192 -7.500 -1.047 705 HA SER 95 HA SER 95 14.788 -7.747 -3.998 706 1HB SER 95 1HB SER 95 16.942 -8.653 -4.166 707 2HB SER 95 2HB SER 95 17.163 -7.499 -2.860 708 HG SER 95 HG SER 95 18.002 -9.493 -2.250 709 HA PRO 96 HA PRO 96 12.905 -11.722 -3.217 710 1HB PRO 96 1HB PRO 96 13.954 -13.352 -5.124 711 2HB PRO 96 2HB PRO 96 12.855 -12.023 -5.494 712 1HG PRO 96 1HG PRO 96 15.736 -12.248 -6.018 713 2HG PRO 96 2HG PRO 96 14.526 -11.211 -6.788 714 1HD PRO 96 1HD PRO 96 16.434 -10.476 -4.772 715 2HD PRO 96 2HD PRO 96 15.178 -9.452 -5.505 716 H SER 97 H SER 97 15.939 -11.349 -2.124 717 HA SER 97 HA SER 97 16.221 -14.224 -1.350 718 1HB SER 97 1HB SER 97 18.608 -13.942 -1.299 719 2HB SER 97 2HB SER 97 18.052 -13.291 -2.838 720 HG SER 97 HG SER 97 19.053 -11.996 -0.580 721 H GLU 98 H GLU 98 16.914 -10.880 -0.301 722 HA GLU 98 HA GLU 98 17.297 -11.624 2.466 723 1HB GLU 98 1HB GLU 98 17.413 -9.226 2.863 724 2HB GLU 98 2HB GLU 98 18.286 -9.595 1.385 725 1HG GLU 98 1HG GLU 98 15.796 -9.142 0.381 726 2HG GLU 98 2HG GLU 98 15.785 -8.052 1.769 727 H SER 99 H SER 99 14.473 -11.420 0.597 728 HA SER 99 HA SER 99 12.733 -10.365 2.699 729 1HB SER 99 1HB SER 99 10.932 -10.774 1.131 730 2HB SER 99 2HB SER 99 12.279 -10.049 0.257 731 HG SER 99 HG SER 99 12.857 -12.110 -0.455 732 H ARG 100 H ARG 100 13.946 -13.495 1.779 733 HA ARG 100 HA ARG 100 11.772 -15.020 2.944 734 1HB ARG 100 1HB ARG 100 14.610 -15.763 2.191 735 2HB ARG 100 2HB ARG 100 13.436 -16.923 2.814 736 1HG ARG 100 1HG ARG 100 12.979 -15.191 0.369 737 2HG ARG 100 2HG ARG 100 13.539 -16.861 0.306 738 1HD ARG 100 1HD ARG 100 11.366 -17.124 1.932 739 2HD ARG 100 2HD ARG 100 10.842 -15.797 0.896 740 HE ARG 100 HE ARG 100 10.732 -17.307 -0.912 741 1HH1 ARG 100 1HH1 ARG 100 12.547 -18.709 1.730 742 2HH1 ARG 100 2HH1 ARG 100 12.627 -20.265 0.980 743 1HH2 ARG 100 1HH2 ARG 100 10.864 -19.334 -1.845 744 2HH2 ARG 100 2HH2 ARG 100 11.687 -20.617 -1.021 745 H SER 101 H SER 101 15.107 -15.444 4.106 746 HA SER 101 HA SER 101 14.532 -14.339 6.738 747 1HB SER 101 1HB SER 101 13.387 -16.677 6.597 748 2HB SER 101 2HB SER 101 15.029 -17.314 6.667 749 HG SER 101 HG SER 101 15.288 -16.037 8.595 750 H GLY 102 H GLY 102 16.533 -13.939 4.745 751 1HA GLY 102 1HA GLY 102 18.948 -15.157 6.014 752 2HA GLY 102 2HA GLY 102 18.893 -14.550 4.359 753 H SER 103 H SER 103 17.280 -12.159 5.353 754 HA SER 103 HA SER 103 18.886 -10.692 7.218 755 1HB SER 103 1HB SER 103 19.778 -10.748 4.414 756 2HB SER 103 2HB SER 103 19.572 -9.124 5.059 757 HG SER 103 HG SER 103 21.597 -10.690 5.440 758 H ASN 104 H ASN 104 17.342 -9.376 8.000 759 HA ASN 104 HA ASN 104 15.350 -8.149 8.149 760 1HB ASN 104 1HB ASN 104 15.412 -6.135 6.563 761 2HB ASN 104 2HB ASN 104 16.790 -6.340 7.640 762 1HD2 ASN 104 2HD2 ASN 104 15.734 -6.994 4.261 763 2HD2 ASN 104 1HD2 ASN 104 17.299 -6.959 3.603 764 HA PRO 105 HA PRO 105 13.130 -10.231 4.637 765 1HB PRO 105 1HB PRO 105 11.547 -11.828 6.190 766 2HB PRO 105 2HB PRO 105 13.159 -12.302 5.637 767 1HG PRO 105 1HG PRO 105 12.265 -11.464 8.328 768 2HG PRO 105 2HG PRO 105 13.601 -12.526 7.861 769 1HD PRO 105 1HD PRO 105 13.818 -9.827 8.658 770 2HD PRO 105 2HD PRO 105 15.091 -10.804 7.895 771 H ASN 106 H ASN 106 12.068 -8.861 7.699 772 HA ASN 106 HA ASN 106 9.691 -7.723 6.294 773 1HB ASN 106 1HB ASN 106 9.857 -8.803 9.123 774 2HB ASN 106 2HB ASN 106 8.503 -7.855 8.513 775 1HD2 ASN 106 2HD2 ASN 106 8.352 -8.993 5.857 776 2HD2 ASN 106 1HD2 ASN 106 7.858 -10.602 6.006 777 H ARG 107 H ARG 107 10.090 -5.597 6.093 778 HA ARG 107 HA ARG 107 11.004 -4.101 8.496 779 1HB ARG 107 1HB ARG 107 12.493 -4.492 6.008 780 2HB ARG 107 2HB ARG 107 12.237 -2.786 6.357 781 1HG ARG 107 1HG ARG 107 13.026 -4.391 8.706 782 2HG ARG 107 2HG ARG 107 14.250 -4.313 7.439 783 1HD ARG 107 1HD ARG 107 13.387 -1.697 7.565 784 2HD ARG 107 2HD ARG 107 13.298 -2.202 9.253 785 HE ARG 107 HE ARG 107 15.775 -3.112 8.454 786 1HH1 ARG 107 1HH1 ARG 107 14.159 -0.013 8.306 787 2HH1 ARG 107 2HH1 ARG 107 15.638 0.876 8.405 788 1HH2 ARG 107 1HH2 ARG 107 17.664 -1.922 8.583 789 2HH2 ARG 107 2HH2 ARG 107 17.603 -0.191 8.561 790 H VAL 108 H VAL 108 11.068 -1.578 7.422 791 HA VAL 108 HA VAL 108 8.306 -1.220 6.316 792 HB VAL 108 HB VAL 108 9.835 0.416 8.346 793 1HG1 VAL 108 1HG1 VAL 108 7.253 1.031 6.891 794 2HG1 VAL 108 2HG1 VAL 108 7.724 1.828 8.393 795 3HG1 VAL 108 3HG1 VAL 108 8.713 2.019 6.946 796 1HG2 VAL 108 1HG2 VAL 108 7.373 -1.315 8.396 797 2HG2 VAL 108 2HG2 VAL 108 8.788 -1.384 9.448 798 3HG2 VAL 108 3HG2 VAL 108 7.628 -0.066 9.616 799 H ARG 109 H ARG 109 8.089 0.838 5.057 800 HA ARG 109 HA ARG 109 10.599 2.007 4.009 801 1HB ARG 109 1HB ARG 109 10.187 0.154 2.465 802 2HB ARG 109 2HB ARG 109 8.511 0.647 2.267 803 1HG ARG 109 1HG ARG 109 9.909 1.381 0.354 804 2HG ARG 109 2HG ARG 109 9.231 2.753 1.223 805 1HD ARG 109 1HD ARG 109 11.311 3.223 2.301 806 2HD ARG 109 2HD ARG 109 11.998 1.680 1.802 807 HE ARG 109 HE ARG 109 11.381 2.923 -0.592 808 1HH1 ARG 109 1HH1 ARG 109 13.244 3.813 2.231 809 2HH1 ARG 109 2HH1 ARG 109 14.317 4.824 1.327 810 1HH2 ARG 109 1HH2 ARG 109 12.791 4.241 -1.721 811 2HH2 ARG 109 2HH2 ARG 109 14.065 5.065 -0.885 812 H MET 110 H MET 110 10.295 4.184 3.974 813 HA MET 110 HA MET 110 7.483 5.193 3.933 814 1HB MET 110 1HB MET 110 9.988 6.562 4.953 815 2HB MET 110 2HB MET 110 8.338 7.170 5.092 816 1HG MET 110 1HG MET 110 7.785 5.695 6.763 817 2HG MET 110 2HG MET 110 8.836 4.427 6.137 818 1HE MET 110 1HE MET 110 8.092 6.865 8.616 819 2HE MET 110 2HE MET 110 9.578 7.487 9.330 820 3HE MET 110 3HE MET 110 9.014 8.108 7.773 821 H PHE 111 H PHE 111 7.025 7.094 2.701 822 HA PHE 111 HA PHE 111 9.003 7.723 0.551 823 1HB PHE 111 1HB PHE 111 5.998 7.732 0.173 824 2HB PHE 111 2HB PHE 111 7.239 7.861 -1.068 825 HD1 PHE 111 HD1 PHE 111 5.959 5.552 1.581 826 HD2 PHE 111 HD2 PHE 111 8.013 5.929 -2.170 827 HE1 PHE 111 HE1 PHE 111 5.954 3.094 1.327 828 HE2 PHE 111 HE2 PHE 111 8.001 3.460 -2.422 829 HZ PHE 111 HZ PHE 111 6.960 2.042 -0.667 830 H GLY 112 H GLY 112 8.757 9.961 -0.263 831 1HA GLY 112 1HA GLY 112 7.325 11.765 1.620 832 2HA GLY 112 2HA GLY 112 8.971 12.084 1.134 833 HA PRO 113 HA PRO 113 6.411 14.406 -1.907 834 1HB PRO 113 1HB PRO 113 8.130 16.520 -2.050 835 2HB PRO 113 2HB PRO 113 6.869 16.367 -0.817 836 1HG PRO 113 1HG PRO 113 9.801 15.946 -0.584 837 2HG PRO 113 2HG PRO 113 8.645 16.542 0.618 838 1HD PRO 113 1HD PRO 113 9.673 13.946 0.546 839 2HD PRO 113 2HD PRO 113 8.198 14.428 1.392 840 H ASP 114 H ASP 114 9.916 13.895 -1.885 841 HA ASP 114 HA ASP 114 10.365 14.357 -4.676 842 1HB ASP 114 1HB ASP 114 12.048 14.095 -2.649 843 2HB ASP 114 2HB ASP 114 12.036 12.401 -3.137 844 H LYS 115 H LYS 115 9.263 11.581 -2.848 845 HA LYS 115 HA LYS 115 9.553 9.792 -5.166 846 1HB LYS 115 1HB LYS 115 8.842 9.486 -2.290 847 2HB LYS 115 2HB LYS 115 8.191 8.293 -3.414 848 1HG LYS 115 1HG LYS 115 10.246 7.334 -2.862 849 2HG LYS 115 2HG LYS 115 10.658 8.226 -4.327 850 1HD LYS 115 1HD LYS 115 12.328 9.042 -2.982 851 2HD LYS 115 2HD LYS 115 11.062 10.176 -2.511 852 1HE LYS 115 1HE LYS 115 10.553 8.949 -0.535 853 2HE LYS 115 2HE LYS 115 11.471 7.544 -1.081 854 1HZ LYS 115 1HZ LYS 115 12.780 10.161 -0.688 855 2HZ LYS 115 2HZ LYS 115 12.544 9.099 0.616 856 3HZ LYS 115 3HZ LYS 115 13.480 8.616 -0.716 857 H LEU 116 H LEU 116 7.352 12.171 -4.477 858 HA LEU 116 HA LEU 116 5.179 10.578 -5.780 859 1HB LEU 116 1HB LEU 116 3.559 12.169 -4.598 860 2HB LEU 116 2HB LEU 116 4.303 10.908 -3.625 861 HG LEU 116 HG LEU 116 6.107 12.739 -3.113 862 1HD1 LEU 116 1HD1 LEU 116 4.419 14.215 -4.798 863 2HD1 LEU 116 2HD1 LEU 116 4.041 14.782 -3.175 864 3HD1 LEU 116 3HD1 LEU 116 5.695 14.857 -3.771 865 1HD2 LEU 116 1HD2 LEU 116 3.295 12.780 -1.994 866 2HD2 LEU 116 2HD2 LEU 116 4.631 11.774 -1.434 867 3HD2 LEU 116 3HD2 LEU 116 4.689 13.523 -1.214 868 H VAL 117 H VAL 117 4.147 11.475 -7.456 869 HA VAL 117 HA VAL 117 5.404 13.547 -8.962 870 HB VAL 117 HB VAL 117 3.916 11.813 -9.952 871 1HG1 VAL 117 1HG1 VAL 117 2.290 11.865 -8.045 872 2HG1 VAL 117 2HG1 VAL 117 1.668 13.366 -8.700 873 3HG1 VAL 117 3HG1 VAL 117 1.535 11.884 -9.639 874 1HG2 VAL 117 1HG2 VAL 117 4.293 14.040 -11.089 875 2HG2 VAL 117 2HG2 VAL 117 2.776 13.254 -11.530 876 3HG2 VAL 117 3HG2 VAL 117 2.775 14.589 -10.378 877 H ARG 118 H ARG 118 5.159 15.769 -8.872 878 HA ARG 118 HA ARG 118 3.616 16.919 -6.688 879 1HB ARG 118 1HB ARG 118 5.517 17.888 -8.747 880 2HB ARG 118 2HB ARG 118 4.308 19.065 -8.237 881 1HG ARG 118 1HG ARG 118 5.615 19.474 -6.445 882 2HG ARG 118 2HG ARG 118 5.146 17.885 -5.843 883 1HD ARG 118 1HD ARG 118 7.054 16.923 -7.216 884 2HD ARG 118 2HD ARG 118 7.585 18.581 -7.496 885 HE ARG 118 HE ARG 118 7.918 17.085 -5.035 886 1HH1 ARG 118 1HH1 ARG 118 7.432 20.286 -6.360 887 2HH1 ARG 118 2HH1 ARG 118 8.165 21.067 -5.003 888 1HH2 ARG 118 1HH2 ARG 118 8.861 18.139 -3.302 889 2HH2 ARG 118 2HH2 ARG 118 8.964 19.868 -3.290 890 H ALA 119 H ALA 119 3.197 16.589 -10.182 891 HA ALA 119 HA ALA 119 0.991 18.372 -10.478 892 1HB ALA 119 1HB ALA 119 2.449 17.090 -12.259 893 2HB ALA 119 2HB ALA 119 1.189 15.864 -12.107 894 3HB ALA 119 3HB ALA 119 0.772 17.499 -12.621 895 H ALA 120 H ALA 120 1.188 15.222 -9.040 896 HA ALA 120 HA ALA 120 -1.792 15.075 -8.971 897 1HB ALA 120 1HB ALA 120 -0.102 13.189 -10.002 898 2HB ALA 120 2HB ALA 120 -0.268 12.622 -8.341 899 3HB ALA 120 3HB ALA 120 -1.700 12.830 -9.349 900 H ALA 121 H ALA 121 1.167 14.328 -7.062 901 HA ALA 121 HA ALA 121 0.015 13.639 -4.621 902 1HB ALA 121 1HB ALA 121 2.470 13.735 -5.165 903 2HB ALA 121 2HB ALA 121 2.401 15.475 -4.893 904 3HB ALA 121 3HB ALA 121 2.052 14.362 -3.571 905 H GLU 122 H GLU 122 0.444 16.947 -5.899 906 HA GLU 122 HA GLU 122 -0.612 18.123 -3.428 907 1HB GLU 122 1HB GLU 122 -0.408 20.269 -4.586 908 2HB GLU 122 2HB GLU 122 1.063 19.328 -4.816 909 1HG GLU 122 1HG GLU 122 0.734 19.886 -7.012 910 2HG GLU 122 2HG GLU 122 -0.353 18.498 -6.972 911 H LYS 123 H LYS 123 -2.149 16.420 -5.785 912 HA LYS 123 HA LYS 123 -4.514 18.181 -5.923 913 1HB LYS 123 1HB LYS 123 -4.031 15.467 -7.171 914 2HB LYS 123 2HB LYS 123 -5.381 16.543 -7.524 915 1HG LYS 123 1HG LYS 123 -3.448 18.264 -8.046 916 2HG LYS 123 2HG LYS 123 -2.495 16.800 -8.273 917 1HD LYS 123 1HD LYS 123 -3.683 16.144 -10.133 918 2HD LYS 123 2HD LYS 123 -5.177 16.895 -9.571 919 1HE LYS 123 1HE LYS 123 -3.825 19.135 -9.908 920 2HE LYS 123 2HE LYS 123 -2.850 18.145 -10.993 921 1HZ LYS 123 1HZ LYS 123 -5.796 18.161 -11.175 922 2HZ LYS 123 2HZ LYS 123 -4.865 19.350 -11.955 923 3HZ LYS 123 3HZ LYS 123 -4.663 17.711 -12.353 924 H ARG 124 H ARG 124 -6.320 17.768 -4.698 925 HA ARG 124 HA ARG 124 -6.116 16.040 -2.426 926 1HB ARG 124 1HB ARG 124 -8.399 17.583 -3.657 927 2HB ARG 124 2HB ARG 124 -8.634 16.562 -2.237 928 1HG ARG 124 1HG ARG 124 -6.936 17.807 -1.006 929 2HG ARG 124 2HG ARG 124 -6.570 18.775 -2.433 930 1HD ARG 124 1HD ARG 124 -8.339 20.145 -2.085 931 2HD ARG 124 2HD ARG 124 -9.424 18.796 -1.746 932 HE ARG 124 HE ARG 124 -9.042 19.143 0.549 933 1HH1 ARG 124 1HH1 ARG 124 -6.529 20.696 -1.327 934 2HH1 ARG 124 2HH1 ARG 124 -5.822 21.449 0.060 935 1HH2 ARG 124 1HH2 ARG 124 -8.093 20.139 2.313 936 2HH2 ARG 124 2HH2 ARG 124 -6.696 21.138 2.098 937 H TRP 125 H TRP 125 -6.167 13.891 -2.543 938 HA TRP 125 HA TRP 125 -8.113 12.563 -4.403 939 1HB TRP 125 1HB TRP 125 -5.521 11.454 -3.270 940 2HB TRP 125 2HB TRP 125 -6.582 10.647 -4.418 941 HD1 TRP 125 HD1 TRP 125 -3.590 12.720 -4.288 942 HE1 TRP 125 HE1 TRP 125 -3.044 13.715 -6.599 943 HE3 TRP 125 HE3 TRP 125 -7.980 11.797 -6.719 944 HZ2 TRP 125 HZ2 TRP 125 -4.275 14.055 -9.142 945 HZ3 TRP 125 HZ3 TRP 125 -8.265 12.447 -9.085 946 HH2 TRP 125 HH2 TRP 125 -6.425 13.585 -10.304 947 H ASP 126 H ASP 126 -8.949 10.441 -3.461 948 HA ASP 126 HA ASP 126 -8.856 10.421 -0.487 949 1HB ASP 126 1HB ASP 126 -11.289 10.099 -0.345 950 2HB ASP 126 2HB ASP 126 -10.884 11.649 -1.075 951 H ARG 127 H ARG 127 -8.125 8.689 -3.081 952 HA ARG 127 HA ARG 127 -8.642 6.124 -1.714 953 1HB ARG 127 1HB ARG 127 -9.208 6.620 -4.656 954 2HB ARG 127 2HB ARG 127 -9.312 5.063 -3.836 955 1HG ARG 127 1HG ARG 127 -10.904 6.571 -2.225 956 2HG ARG 127 2HG ARG 127 -11.186 7.357 -3.778 957 1HD ARG 127 1HD ARG 127 -11.468 4.391 -3.216 958 2HD ARG 127 2HD ARG 127 -12.787 5.536 -3.427 959 HE ARG 127 HE ARG 127 -10.934 5.469 -5.681 960 1HH1 ARG 127 1HH1 ARG 127 -13.814 4.078 -4.267 961 2HH1 ARG 127 2HH1 ARG 127 -14.399 3.497 -5.785 962 1HH2 ARG 127 1HH2 ARG 127 -11.731 4.700 -7.623 963 2HH2 ARG 127 2HH2 ARG 127 -13.236 3.845 -7.666 964 H VAL 128 H VAL 128 -6.925 4.651 -2.109 965 HA VAL 128 HA VAL 128 -4.791 5.625 -3.938 966 HB VAL 128 HB VAL 128 -4.393 6.294 -1.529 967 1HG1 VAL 128 1HG1 VAL 128 -5.048 3.605 -1.029 968 2HG1 VAL 128 2HG1 VAL 128 -3.317 3.727 -0.716 969 3HG1 VAL 128 3HG1 VAL 128 -4.447 4.784 0.131 970 1HG2 VAL 128 1HG2 VAL 128 -2.418 4.466 -2.906 971 2HG2 VAL 128 2HG2 VAL 128 -2.579 6.208 -3.128 972 3HG2 VAL 128 3HG2 VAL 128 -2.013 5.564 -1.587 973 H LYS 129 H LYS 129 -3.619 4.002 -4.964 974 HA LYS 129 HA LYS 129 -4.691 1.243 -4.588 975 1HB LYS 129 1HB LYS 129 -4.999 2.297 -6.829 976 2HB LYS 129 2HB LYS 129 -3.248 2.419 -6.974 977 1HG LYS 129 1HG LYS 129 -3.475 -0.204 -6.330 978 2HG LYS 129 2HG LYS 129 -4.999 0.035 -7.187 979 1HD LYS 129 1HD LYS 129 -3.429 1.300 -8.918 980 2HD LYS 129 2HD LYS 129 -2.198 0.256 -8.207 981 1HE LYS 129 1HE LYS 129 -3.304 -1.714 -8.880 982 2HE LYS 129 2HE LYS 129 -4.838 -0.878 -9.119 983 1HZ LYS 129 1HZ LYS 129 -3.798 0.341 -10.965 984 2HZ LYS 129 2HZ LYS 129 -2.387 -0.581 -10.769 985 3HZ LYS 129 3HZ LYS 129 -3.836 -1.337 -11.234 986 H ILE 130 H ILE 130 -3.352 -0.037 -3.440 987 HA ILE 130 HA ILE 130 -0.411 0.471 -3.566 988 HB ILE 130 HB ILE 130 -2.020 -1.178 -1.577 989 1HG1 ILE 130 1HG1 ILE 130 -2.549 1.236 -1.447 990 2HG1 ILE 130 2HG1 ILE 130 -1.649 0.706 -0.029 991 1HG2 ILE 130 1HG2 ILE 130 0.893 -0.371 -1.745 992 2HG2 ILE 130 2HG2 ILE 130 0.146 -0.887 -0.233 993 3HG2 ILE 130 3HG2 ILE 130 0.220 -1.995 -1.603 994 1HD1 ILE 130 1HD1 ILE 130 0.249 1.514 -2.007 995 2HD1 ILE 130 2HD1 ILE 130 -0.972 2.778 -1.883 996 3HD1 ILE 130 3HD1 ILE 130 -0.084 2.267 -0.449 997 H VAL 131 H VAL 131 0.668 -0.906 -4.959 998 HA VAL 131 HA VAL 131 -0.375 -3.682 -5.209 999 HB VAL 131 HB VAL 131 0.906 -1.985 -7.360 1000 1HG1 VAL 131 1HG1 VAL 131 -0.179 -4.787 -7.256 1001 2HG1 VAL 131 2HG1 VAL 131 -0.027 -3.903 -8.773 1002 3HG1 VAL 131 3HG1 VAL 131 1.407 -4.250 -7.806 1003 1HG2 VAL 131 1HG2 VAL 131 -1.942 -2.666 -6.667 1004 2HG2 VAL 131 2HG2 VAL 131 -1.253 -1.095 -7.076 1005 3HG2 VAL 131 3HG2 VAL 131 -1.483 -2.312 -8.332 1006 H CYS 132 H CYS 132 1.053 -5.082 -4.377 1007 HA CYS 132 HA CYS 132 3.935 -4.371 -4.207 1008 1HB CYS 132 1HB CYS 132 3.021 -5.257 -2.158 1009 2HB CYS 132 2HB CYS 132 2.258 -6.591 -2.998 1010 HG CYS 132 HG CYS 132 5.372 -6.431 -2.935 1011 H SER 133 H SER 133 5.545 -5.711 -5.232 1012 HA SER 133 HA SER 133 4.584 -7.836 -7.061 1013 1HB SER 133 1HB SER 133 5.112 -5.168 -7.915 1014 2HB SER 133 2HB SER 133 6.405 -6.179 -8.546 1015 HG SER 133 HG SER 133 4.302 -5.974 -9.760 1016 H GLN 134 H GLN 134 5.911 -9.492 -6.936 1017 HA GLN 134 HA GLN 134 8.527 -9.823 -7.482 1018 1HB GLN 134 1HB GLN 134 8.778 -8.193 -5.321 1019 2HB GLN 134 2HB GLN 134 8.733 -9.746 -4.516 1020 1HG GLN 134 1HG GLN 134 10.416 -10.008 -6.819 1021 2HG GLN 134 2HG GLN 134 10.917 -8.568 -5.952 1022 1HE2 GLN 134 2HE2 GLN 134 10.036 -11.992 -5.290 1023 2HE2 GLN 134 1HE2 GLN 134 11.165 -12.201 -4.043 1024 HA PRO 135 HA PRO 135 6.903 -13.841 -6.233 1025 1HB PRO 135 1HB PRO 135 8.765 -15.356 -7.525 1026 2HB PRO 135 2HB PRO 135 7.439 -14.534 -8.359 1027 1HG PRO 135 1HG PRO 135 10.310 -13.927 -8.377 1028 2HG PRO 135 2HG PRO 135 9.050 -13.445 -9.521 1029 1HD PRO 135 1HD PRO 135 10.226 -11.867 -7.421 1030 2HD PRO 135 2HD PRO 135 8.958 -11.388 -8.570 1031 H TYR 136 H TYR 136 7.369 -13.911 -3.963 1032 HA TYR 136 HA TYR 136 10.041 -15.062 -3.296 1033 1HB TYR 136 1HB TYR 136 9.674 -13.800 -1.018 1034 2HB TYR 136 2HB TYR 136 10.351 -12.946 -2.397 1035 HD1 TYR 136 HD1 TYR 136 6.977 -13.793 -0.964 1036 HD2 TYR 136 HD2 TYR 136 9.437 -10.875 -2.937 1037 HE1 TYR 136 HE1 TYR 136 5.117 -12.157 -0.864 1038 HE2 TYR 136 HE2 TYR 136 7.575 -9.240 -2.839 1039 HH TYR 136 HH TYR 136 4.429 -10.075 -2.223 1040 H SER 137 H SER 137 6.820 -15.774 -3.333 1041 HA SER 137 HA SER 137 7.161 -17.589 -0.986 1042 1HB SER 137 1HB SER 137 5.287 -15.491 -1.179 1043 2HB SER 137 2HB SER 137 4.370 -16.970 -1.433 1044 HG SER 137 HG SER 137 4.657 -16.342 0.802 1045 H LYS 138 H LYS 138 4.948 -19.130 -1.229 1046 HA LYS 138 HA LYS 138 4.338 -19.938 -3.934 1047 1HB LYS 138 1HB LYS 138 6.715 -20.724 -3.738 1048 2HB LYS 138 2HB LYS 138 6.216 -21.755 -2.396 1049 1HG LYS 138 1HG LYS 138 4.798 -23.063 -3.790 1050 2HG LYS 138 2HG LYS 138 4.868 -21.881 -5.098 1051 1HD LYS 138 1HD LYS 138 7.208 -22.377 -5.499 1052 2HD LYS 138 2HD LYS 138 7.268 -23.431 -4.086 1053 1HE LYS 138 1HE LYS 138 6.145 -25.139 -5.138 1054 2HE LYS 138 2HE LYS 138 5.192 -24.039 -6.133 1055 1HZ LYS 138 1HZ LYS 138 7.469 -23.521 -7.206 1056 2HZ LYS 138 2HZ LYS 138 7.933 -25.019 -6.553 1057 3HZ LYS 138 3HZ LYS 138 6.644 -24.937 -7.651 1058 H ASP 139 H ASP 139 4.634 -20.965 -0.539 1059 HA ASP 139 HA ASP 139 2.040 -22.389 -0.830 1060 1HB ASP 139 1HB ASP 139 2.770 -23.603 1.252 1061 2HB ASP 139 2HB ASP 139 3.771 -23.928 -0.157 1062 H SER 140 H SER 140 3.888 -20.156 1.118 1063 HA SER 140 HA SER 140 1.499 -19.581 2.775 1064 1HB SER 140 1HB SER 140 3.409 -18.102 3.916 1065 2HB SER 140 2HB SER 140 3.217 -19.810 4.283 1066 HG SER 140 HG SER 140 5.387 -19.131 3.696 1067 HA PRO 141 HA PRO 141 1.116 -15.706 0.519 1068 1HB PRO 141 1HB PRO 141 -0.880 -14.630 2.028 1069 2HB PRO 141 2HB PRO 141 -1.141 -15.947 0.878 1070 1HG PRO 141 1HG PRO 141 -1.190 -16.004 3.809 1071 2HG PRO 141 2HG PRO 141 -1.877 -17.147 2.648 1072 1HD PRO 141 1HD PRO 141 0.570 -17.409 4.149 1073 2HD PRO 141 2HD PRO 141 -0.133 -18.553 2.984 1074 H PHE 142 H PHE 142 0.999 -13.268 1.126 1075 HA PHE 142 HA PHE 142 1.851 -12.268 3.647 1076 1HB PHE 142 1HB PHE 142 3.959 -13.449 2.031 1077 2HB PHE 142 2HB PHE 142 4.249 -11.723 2.239 1078 HD1 PHE 142 HD1 PHE 142 3.894 -10.803 4.694 1079 HD2 PHE 142 HD2 PHE 142 4.621 -14.918 3.712 1080 HE1 PHE 142 HE1 PHE 142 4.669 -11.220 7.013 1081 HE2 PHE 142 HE2 PHE 142 5.400 -15.336 6.029 1082 HZ PHE 142 HZ PHE 142 5.422 -13.487 7.681 1083 H GLY 143 H GLY 143 3.368 -10.026 2.783 1084 1HA GLY 143 1HA GLY 143 2.842 -8.747 0.435 1085 2HA GLY 143 2HA GLY 143 1.299 -8.604 1.271 1086 H LEU 144 H LEU 144 1.052 -6.912 2.607 1087 HA LEU 144 HA LEU 144 3.503 -5.380 3.347 1088 1HB LEU 144 1HB LEU 144 0.807 -4.600 2.410 1089 2HB LEU 144 2HB LEU 144 1.449 -3.614 3.721 1090 HG LEU 144 HG LEU 144 3.536 -3.289 2.408 1091 1HD1 LEU 144 1HD1 LEU 144 2.065 -5.120 0.565 1092 2HD1 LEU 144 2HD1 LEU 144 3.028 -3.835 -0.165 1093 3HD1 LEU 144 3HD1 LEU 144 3.794 -5.016 0.897 1094 1HD2 LEU 144 1HD2 LEU 144 1.704 -1.636 2.296 1095 2HD2 LEU 144 2HD2 LEU 144 2.546 -1.747 0.750 1096 3HD2 LEU 144 3HD2 LEU 144 0.980 -2.530 0.959 1097 H SER 145 H SER 145 3.763 -4.663 5.455 1098 HA SER 145 HA SER 145 2.325 -6.162 7.515 1099 1HB SER 145 1HB SER 145 4.423 -3.991 7.800 1100 2HB SER 145 2HB SER 145 3.881 -5.085 9.070 1101 HG SER 145 HG SER 145 5.817 -5.480 7.370 1102 H PHE 146 H PHE 146 2.318 -2.928 6.154 1103 HA PHE 146 HA PHE 146 -0.248 -2.285 7.224 1104 1HB PHE 146 1HB PHE 146 0.355 -0.580 8.890 1105 2HB PHE 146 2HB PHE 146 1.005 -2.146 9.370 1106 HD1 PHE 146 HD1 PHE 146 1.827 1.158 7.934 1107 HD2 PHE 146 HD2 PHE 146 3.392 -2.558 9.413 1108 HE1 PHE 146 HE1 PHE 146 4.107 2.129 7.948 1109 HE2 PHE 146 HE2 PHE 146 5.677 -1.590 9.423 1110 HZ PHE 146 HZ PHE 146 6.032 0.749 8.686 1111 H VAL 147 H VAL 147 -0.614 0.226 6.983 1112 HA VAL 147 HA VAL 147 1.172 1.490 5.000 1113 HB VAL 147 HB VAL 147 -0.713 1.894 3.415 1114 1HG1 VAL 147 1HG1 VAL 147 0.917 -0.043 3.208 1115 2HG1 VAL 147 2HG1 VAL 147 -0.324 -1.064 3.931 1116 3HG1 VAL 147 3HG1 VAL 147 -0.625 -0.273 2.384 1117 1HG2 VAL 147 1HG2 VAL 147 -2.157 0.426 5.553 1118 2HG2 VAL 147 2HG2 VAL 147 -2.756 1.633 4.416 1119 3HG2 VAL 147 3HG2 VAL 147 -2.566 -0.043 3.903 1120 H ARG 148 H ARG 148 1.233 3.666 5.417 1121 HA ARG 148 HA ARG 148 -1.117 4.947 6.712 1122 1HB ARG 148 1HB ARG 148 1.691 5.293 7.789 1123 2HB ARG 148 2HB ARG 148 0.192 5.884 8.498 1124 1HG ARG 148 1HG ARG 148 -0.480 3.345 8.511 1125 2HG ARG 148 2HG ARG 148 1.260 3.079 8.399 1126 1HD ARG 148 1HD ARG 148 0.827 5.081 10.391 1127 2HD ARG 148 2HD ARG 148 -0.284 3.752 10.716 1128 HE ARG 148 HE ARG 148 2.146 2.504 10.212 1129 1HH1 ARG 148 1HH1 ARG 148 1.020 4.964 12.428 1130 2HH1 ARG 148 2HH1 ARG 148 2.173 4.537 13.645 1131 1HH2 ARG 148 1HH2 ARG 148 3.620 1.986 11.812 1132 2HH2 ARG 148 2HH2 ARG 148 3.631 2.871 13.301 1133 H PHE 149 H PHE 149 -1.554 6.499 5.193 1134 HA PHE 149 HA PHE 149 0.642 7.889 3.795 1135 1HB PHE 149 1HB PHE 149 -2.366 8.276 3.621 1136 2HB PHE 149 2HB PHE 149 -1.171 8.997 2.544 1137 HD1 PHE 149 HD1 PHE 149 0.389 7.393 1.258 1138 HD2 PHE 149 HD2 PHE 149 -3.239 6.138 3.166 1139 HE1 PHE 149 HE1 PHE 149 0.359 5.355 -0.153 1140 HE2 PHE 149 HE2 PHE 149 -3.276 4.100 1.750 1141 HZ PHE 149 HZ PHE 149 -1.476 3.709 0.095 1142 H HIS 150 H HIS 150 0.765 10.285 3.859 1143 HA HIS 150 HA HIS 150 -0.659 11.644 6.040 1144 1HB HIS 150 1HB HIS 150 1.916 12.481 6.654 1145 2HB HIS 150 2HB HIS 150 0.949 11.365 7.603 1146 HD1 HIS 150 HD1 HIS 150 4.136 11.618 5.969 1147 HD2 HIS 150 HD2 HIS 150 1.455 8.509 6.677 1148 HE1 HIS 150 HE1 HIS 150 5.440 9.467 5.671 1149 H SER 151 H SER 151 -0.902 13.783 5.617 1150 HA SER 151 HA SER 151 0.306 14.795 3.098 1151 1HB SER 151 1HB SER 151 -2.287 14.888 4.128 1152 2HB SER 151 2HB SER 151 -1.677 16.521 4.374 1153 HG SER 151 HG SER 151 -2.611 16.210 2.292 Start of MODEL 3 1 H MET 1 H MET 1 -3.419 14.340 14.772 2 HA MET 1 HA MET 1 -5.251 14.219 12.981 3 1HB MET 1 1HB MET 1 -6.024 16.413 13.656 4 2HB MET 1 2HB MET 1 -5.261 15.618 15.029 5 1HG MET 1 1HG MET 1 -3.277 16.939 14.807 6 2HG MET 1 2HG MET 1 -3.780 17.550 13.231 7 1HE MET 1 1HE MET 1 -3.399 19.953 13.804 8 2HE MET 1 2HE MET 1 -3.978 20.781 15.248 9 3HE MET 1 3HE MET 1 -2.782 19.495 15.398 10 HA PRO 2 HA PRO 2 -3.445 17.222 9.738 11 1HB PRO 2 1HB PRO 2 -0.747 17.626 9.695 12 2HB PRO 2 2HB PRO 2 -1.861 18.604 10.661 13 1HG PRO 2 1HG PRO 2 0.124 16.646 11.543 14 2HG PRO 2 2HG PRO 2 -0.712 17.896 12.474 15 1HD PRO 2 1HD PRO 2 -1.297 15.058 12.344 16 2HD PRO 2 2HD PRO 2 -2.051 16.295 13.365 17 H GLU 3 H GLU 3 -2.011 14.189 10.542 18 HA GLU 3 HA GLU 3 -0.726 13.716 7.957 19 1HB GLU 3 1HB GLU 3 -1.525 11.709 10.089 20 2HB GLU 3 2HB GLU 3 -0.350 11.466 8.795 21 1HG GLU 3 1HG GLU 3 1.097 13.198 9.733 22 2HG GLU 3 2HG GLU 3 -0.097 13.548 10.986 23 H ILE 4 H ILE 4 -1.615 11.171 7.288 24 HA ILE 4 HA ILE 4 -4.518 11.569 6.700 25 HB ILE 4 HB ILE 4 -2.330 10.658 4.803 26 1HG1 ILE 4 1HG1 ILE 4 -4.188 13.055 4.741 27 2HG1 ILE 4 2HG1 ILE 4 -2.495 13.107 5.229 28 1HG2 ILE 4 1HG2 ILE 4 -5.338 10.757 4.488 29 2HG2 ILE 4 2HG2 ILE 4 -4.230 10.678 3.119 30 3HG2 ILE 4 3HG2 ILE 4 -4.283 9.358 4.287 31 1HD1 ILE 4 1HD1 ILE 4 -2.084 11.964 2.896 32 2HD1 ILE 4 2HD1 ILE 4 -3.664 12.641 2.504 33 3HD1 ILE 4 3HD1 ILE 4 -2.343 13.706 2.982 34 H ARG 5 H ARG 5 -5.724 9.816 7.263 35 HA ARG 5 HA ARG 5 -4.273 7.248 7.774 36 1HB ARG 5 1HB ARG 5 -6.492 8.650 9.217 37 2HB ARG 5 2HB ARG 5 -6.436 6.887 9.259 38 1HG ARG 5 1HG ARG 5 -3.987 7.116 9.947 39 2HG ARG 5 2HG ARG 5 -4.318 8.831 10.198 40 1HD ARG 5 1HD ARG 5 -5.748 8.433 11.989 41 2HD ARG 5 2HD ARG 5 -6.139 6.801 11.447 42 HE ARG 5 HE ARG 5 -3.346 7.023 12.160 43 1HH1 ARG 5 1HH1 ARG 5 -6.565 6.693 13.486 44 2HH1 ARG 5 2HH1 ARG 5 -6.002 5.920 14.927 45 1HH2 ARG 5 1HH2 ARG 5 -2.661 6.020 14.040 46 2HH2 ARG 5 2HH2 ARG 5 -3.816 5.542 15.238 47 H LEU 6 H LEU 6 -5.823 5.310 7.649 48 HA LEU 6 HA LEU 6 -7.300 5.497 5.079 49 1HB LEU 6 1HB LEU 6 -5.740 3.452 6.480 50 2HB LEU 6 2HB LEU 6 -7.278 2.827 5.892 51 HG LEU 6 HG LEU 6 -6.764 3.667 3.631 52 1HD1 LEU 6 1HD1 LEU 6 -5.007 5.377 4.907 53 2HD1 LEU 6 2HD1 LEU 6 -3.916 4.185 4.205 54 3HD1 LEU 6 3HD1 LEU 6 -5.035 5.074 3.172 55 1HD2 LEU 6 1HD2 LEU 6 -4.634 1.958 4.942 56 2HD2 LEU 6 2HD2 LEU 6 -6.101 1.402 4.135 57 3HD2 LEU 6 3HD2 LEU 6 -4.805 2.145 3.197 58 H ARG 7 H ARG 7 -9.378 4.261 4.949 59 HA ARG 7 HA ARG 7 -10.889 4.364 7.530 60 1HB ARG 7 1HB ARG 7 -11.434 6.144 5.739 61 2HB ARG 7 2HB ARG 7 -12.126 4.814 4.813 62 1HG ARG 7 1HG ARG 7 -13.873 4.511 6.284 63 2HG ARG 7 2HG ARG 7 -12.937 5.063 7.674 64 1HD ARG 7 1HD ARG 7 -13.361 7.298 7.249 65 2HD ARG 7 2HD ARG 7 -13.542 7.041 5.515 66 HE ARG 7 HE ARG 7 -15.829 6.576 5.860 67 1HH1 ARG 7 1HH1 ARG 7 -14.105 6.512 8.905 68 2HH1 ARG 7 2HH1 ARG 7 -15.557 6.408 9.837 69 1HH2 ARG 7 1HH2 ARG 7 -17.678 6.435 7.108 70 2HH2 ARG 7 2HH2 ARG 7 -17.557 6.363 8.834 71 H HIS 8 H HIS 8 -10.898 2.966 4.266 72 HA HIS 8 HA HIS 8 -11.273 0.277 5.322 73 1HB HIS 8 1HB HIS 8 -13.418 -0.109 4.095 74 2HB HIS 8 2HB HIS 8 -13.588 1.021 5.434 75 HD1 HIS 8 HD1 HIS 8 -14.759 3.136 4.851 76 HD2 HIS 8 HD2 HIS 8 -12.928 1.440 1.512 77 HE1 HIS 8 HE1 HIS 8 -15.359 4.609 2.879 78 H VAL 9 H VAL 9 -11.252 -1.330 3.504 79 HA VAL 9 HA VAL 9 -9.424 -0.423 1.410 80 HB VAL 9 HB VAL 9 -9.109 -2.622 2.470 81 1HG1 VAL 9 1HG1 VAL 9 -11.860 -2.824 2.345 82 2HG1 VAL 9 2HG1 VAL 9 -11.339 -3.942 1.084 83 3HG1 VAL 9 3HG1 VAL 9 -10.762 -4.145 2.738 84 1HG2 VAL 9 1HG2 VAL 9 -8.473 -2.197 0.047 85 2HG2 VAL 9 2HG2 VAL 9 -8.708 -3.893 0.470 86 3HG2 VAL 9 3HG2 VAL 9 -9.965 -3.021 -0.409 87 H VAL 10 H VAL 10 -10.561 0.935 0.006 88 HA VAL 10 HA VAL 10 -13.197 0.584 -0.933 89 HB VAL 10 HB VAL 10 -12.226 2.685 -1.417 90 1HG1 VAL 10 1HG1 VAL 10 -9.824 1.269 -1.743 91 2HG1 VAL 10 2HG1 VAL 10 -10.128 2.003 -3.309 92 3HG1 VAL 10 3HG1 VAL 10 -10.049 3.008 -1.863 93 1HG2 VAL 10 1HG2 VAL 10 -13.645 1.843 -3.273 94 2HG2 VAL 10 2HG2 VAL 10 -12.378 2.917 -3.865 95 3HG2 VAL 10 3HG2 VAL 10 -12.213 1.174 -4.055 96 H SER 11 H SER 11 -10.220 -0.364 -2.744 97 HA SER 11 HA SER 11 -11.886 -2.515 -3.967 98 1HB SER 11 1HB SER 11 -10.421 -0.390 -5.256 99 2HB SER 11 2HB SER 11 -9.733 -1.944 -5.722 100 HG SER 11 HG SER 11 -12.505 -1.319 -5.757 101 H CYS 12 H CYS 12 -10.563 -4.487 -4.550 102 HA CYS 12 HA CYS 12 -7.863 -4.628 -3.414 103 1HB CYS 12 1HB CYS 12 -8.452 -6.461 -1.830 104 2HB CYS 12 2HB CYS 12 -9.152 -4.907 -1.383 105 HG CYS 12 HG CYS 12 -11.344 -5.956 -2.809 106 H SER 13 H SER 13 -6.677 -6.182 -4.358 107 HA SER 13 HA SER 13 -8.021 -8.447 -5.726 108 1HB SER 13 1HB SER 13 -7.465 -6.369 -7.272 109 2HB SER 13 2HB SER 13 -5.823 -6.995 -7.169 110 HG SER 13 HG SER 13 -6.661 -8.088 -8.837 111 H SER 14 H SER 14 -6.892 -8.955 -3.447 112 HA SER 14 HA SER 14 -4.957 -10.881 -3.635 113 1HB SER 14 1HB SER 14 -2.894 -9.410 -2.811 114 2HB SER 14 2HB SER 14 -3.196 -9.700 -4.520 115 HG SER 14 HG SER 14 -2.943 -7.404 -3.546 116 H GLN 15 H GLN 15 -6.875 -10.695 -1.862 117 HA GLN 15 HA GLN 15 -5.443 -10.254 0.709 118 1HB GLN 15 1HB GLN 15 -7.952 -9.487 1.481 119 2HB GLN 15 2HB GLN 15 -6.633 -8.391 1.112 120 1HG GLN 15 1HG GLN 15 -8.319 -7.486 -0.175 121 2HG GLN 15 2HG GLN 15 -7.584 -8.558 -1.357 122 1HE2 GLN 15 2HE2 GLN 15 -8.605 -10.951 -1.143 123 2HE2 GLN 15 1HE2 GLN 15 -10.302 -10.979 -1.053 124 H ASP 16 H ASP 16 -6.016 -11.674 2.366 125 HA ASP 16 HA ASP 16 -7.637 -14.003 1.486 126 1HB ASP 16 1HB ASP 16 -5.309 -13.609 3.206 127 2HB ASP 16 2HB ASP 16 -6.549 -14.575 4.005 128 H SER 17 H SER 17 -8.886 -15.050 3.452 129 HA SER 17 HA SER 17 -10.856 -13.095 4.307 130 1HB SER 17 1HB SER 17 -11.909 -15.029 5.452 131 2HB SER 17 2HB SER 17 -11.511 -15.403 3.778 132 HG SER 17 HG SER 17 -10.760 -16.706 5.913 133 H THR 18 H THR 18 -8.804 -15.329 6.239 134 HA THR 18 HA THR 18 -9.227 -13.981 8.717 135 HB THR 18 HB THR 18 -6.787 -15.099 9.080 136 HG1 THR 18 HG1 THR 18 -6.499 -16.762 7.690 137 1HG2 THR 18 1HG2 THR 18 -8.872 -15.699 10.252 138 2HG2 THR 18 2HG2 THR 18 -9.401 -16.611 8.839 139 3HG2 THR 18 3HG2 THR 18 -7.988 -17.142 9.752 140 H HIS 19 H HIS 19 -6.347 -13.893 6.590 141 HA HIS 19 HA HIS 19 -5.569 -11.305 7.834 142 1HB HIS 19 1HB HIS 19 -4.041 -12.986 5.820 143 2HB HIS 19 2HB HIS 19 -3.411 -11.636 6.764 144 HD1 HIS 19 HD1 HIS 19 -2.059 -12.432 8.688 145 HD2 HIS 19 HD2 HIS 19 -5.204 -15.041 7.864 146 HE1 HIS 19 HE1 HIS 19 -1.908 -14.298 10.394 147 H CYS 20 H CYS 20 -7.377 -10.190 6.744 148 HA CYS 20 HA CYS 20 -7.195 -10.016 3.795 149 1HB CYS 20 1HB CYS 20 -9.283 -8.687 3.988 150 2HB CYS 20 2HB CYS 20 -9.431 -10.249 4.787 151 HG CYS 20 HG CYS 20 -9.632 -9.121 7.006 152 H ALA 21 H ALA 21 -7.290 -7.816 2.826 153 HA ALA 21 HA ALA 21 -5.092 -6.204 3.703 154 1HB ALA 21 1HB ALA 21 -7.157 -6.100 1.570 155 2HB ALA 21 2HB ALA 21 -6.422 -4.559 2.013 156 3HB ALA 21 3HB ALA 21 -5.408 -5.891 1.457 157 H GLU 22 H GLU 22 -8.465 -6.222 4.568 158 HA GLU 22 HA GLU 22 -8.726 -3.495 5.396 159 1HB GLU 22 1HB GLU 22 -10.429 -5.622 5.294 160 2HB GLU 22 2HB GLU 22 -10.117 -5.541 7.028 161 1HG GLU 22 1HG GLU 22 -10.551 -2.977 6.733 162 2HG GLU 22 2HG GLU 22 -11.347 -3.459 5.234 163 H ASN 23 H ASN 23 -6.913 -6.147 6.723 164 HA ASN 23 HA ASN 23 -6.857 -5.318 9.477 165 1HB ASN 23 1HB ASN 23 -5.021 -6.943 7.739 166 2HB ASN 23 2HB ASN 23 -4.571 -6.544 9.395 167 1HD2 ASN 23 2HD2 ASN 23 -6.139 -8.869 7.556 168 2HD2 ASN 23 1HD2 ASN 23 -7.101 -9.568 8.769 169 H LEU 24 H LEU 24 -5.486 -4.001 6.619 170 HA LEU 24 HA LEU 24 -3.188 -2.691 7.695 171 1HB LEU 24 1HB LEU 24 -4.949 -1.812 5.383 172 2HB LEU 24 2HB LEU 24 -3.272 -1.346 5.666 173 HG LEU 24 HG LEU 24 -3.968 -4.262 5.452 174 1HD1 LEU 24 1HD1 LEU 24 -4.848 -2.707 3.478 175 2HD1 LEU 24 2HD1 LEU 24 -3.153 -2.781 2.995 176 3HD1 LEU 24 3HD1 LEU 24 -4.090 -4.267 3.154 177 1HD2 LEU 24 1HD2 LEU 24 -1.581 -2.512 5.334 178 2HD2 LEU 24 2HD2 LEU 24 -1.742 -4.165 5.928 179 3HD2 LEU 24 3HD2 LEU 24 -1.598 -3.861 4.198 180 H LEU 25 H LEU 25 -6.630 -2.017 7.762 181 HA LEU 25 HA LEU 25 -6.577 0.750 8.395 182 1HB LEU 25 1HB LEU 25 -8.448 -1.544 8.897 183 2HB LEU 25 2HB LEU 25 -8.728 -0.032 9.741 184 HG LEU 25 HG LEU 25 -9.996 -0.229 7.589 185 1HD1 LEU 25 1HD1 LEU 25 -8.047 1.964 8.152 186 2HD1 LEU 25 2HD1 LEU 25 -8.940 2.010 6.634 187 3HD1 LEU 25 3HD1 LEU 25 -9.807 1.991 8.168 188 1HD2 LEU 25 1HD2 LEU 25 -8.120 -1.469 6.403 189 2HD2 LEU 25 2HD2 LEU 25 -8.855 -0.160 5.476 190 3HD2 LEU 25 3HD2 LEU 25 -7.292 0.082 6.257 191 H LYS 26 H LYS 26 -5.621 -2.060 10.206 192 HA LYS 26 HA LYS 26 -5.393 -0.395 12.677 193 1HB LYS 26 1HB LYS 26 -5.427 -3.428 12.527 194 2HB LYS 26 2HB LYS 26 -5.531 -2.428 13.975 195 1HG LYS 26 1HG LYS 26 -7.584 -2.390 11.745 196 2HG LYS 26 2HG LYS 26 -7.750 -3.336 13.226 197 1HD LYS 26 1HD LYS 26 -7.199 -0.962 14.339 198 2HD LYS 26 2HD LYS 26 -7.915 -0.383 12.833 199 1HE LYS 26 1HE LYS 26 -9.927 -1.721 13.246 200 2HE LYS 26 2HE LYS 26 -9.211 -2.373 14.720 201 1HZ LYS 26 1HZ LYS 26 -9.640 0.524 14.258 202 2HZ LYS 26 2HZ LYS 26 -10.764 -0.469 15.052 203 3HZ LYS 26 3HZ LYS 26 -9.216 -0.242 15.715 204 H ALA 27 H ALA 27 -3.419 0.314 11.347 205 HA ALA 27 HA ALA 27 -1.214 -1.308 10.737 206 1HB ALA 27 1HB ALA 27 -1.243 1.521 11.822 207 2HB ALA 27 2HB ALA 27 0.170 0.743 11.109 208 3HB ALA 27 3HB ALA 27 -1.262 1.042 10.124 209 H ASP 28 H ASP 28 -2.379 -0.349 13.891 210 HA ASP 28 HA ASP 28 0.020 -1.656 15.114 211 1HB ASP 28 1HB ASP 28 -1.546 0.770 15.880 212 2HB ASP 28 2HB ASP 28 -0.906 -0.237 17.179 213 H THR 29 H THR 29 -1.041 -3.738 15.019 214 HA THR 29 HA THR 29 -2.797 -4.213 17.317 215 HB THR 29 HB THR 29 -4.239 -5.631 15.460 216 HG1 THR 29 HG1 THR 29 -3.019 -4.428 13.836 217 1HG2 THR 29 1HG2 THR 29 -4.733 -2.790 16.390 218 2HG2 THR 29 2HG2 THR 29 -5.960 -3.886 15.757 219 3HG2 THR 29 3HG2 THR 29 -5.151 -4.254 17.280 220 H TYR 30 H TYR 30 -2.459 -6.246 14.408 221 HA TYR 30 HA TYR 30 -0.231 -7.778 15.331 222 1HB TYR 30 1HB TYR 30 -1.468 -9.814 16.101 223 2HB TYR 30 2HB TYR 30 -1.685 -8.428 17.171 224 HD1 TYR 30 HD1 TYR 30 -3.294 -10.581 14.646 225 HD2 TYR 30 HD2 TYR 30 -3.807 -7.240 17.295 226 HE1 TYR 30 HE1 TYR 30 -5.750 -10.704 14.324 227 HE2 TYR 30 HE2 TYR 30 -6.264 -7.361 16.973 228 HH TYR 30 HH TYR 30 -7.735 -8.741 14.584 229 H ARG 31 H ARG 31 -3.314 -7.830 13.568 230 HA ARG 31 HA ARG 31 -2.321 -9.884 11.709 231 1HB ARG 31 1HB ARG 31 -4.759 -9.611 12.490 232 2HB ARG 31 2HB ARG 31 -4.834 -8.242 11.382 233 1HG ARG 31 1HG ARG 31 -5.615 -10.152 10.158 234 2HG ARG 31 2HG ARG 31 -3.991 -9.806 9.566 235 1HD ARG 31 1HD ARG 31 -4.394 -12.243 10.026 236 2HD ARG 31 2HD ARG 31 -3.052 -11.565 10.945 237 HE ARG 31 HE ARG 31 -4.286 -11.929 12.921 238 1HH1 ARG 31 1HH1 ARG 31 -6.386 -12.119 10.130 239 2HH1 ARG 31 2HH1 ARG 31 -7.733 -12.684 11.056 240 1HH2 ARG 31 1HH2 ARG 31 -6.058 -12.660 14.081 241 2HH2 ARG 31 2HH2 ARG 31 -7.551 -12.986 13.269 242 H LYS 32 H LYS 32 -1.450 -9.483 9.720 243 HA LYS 32 HA LYS 32 -1.292 -6.626 8.838 244 1HB LYS 32 1HB LYS 32 0.619 -8.944 8.433 245 2HB LYS 32 2HB LYS 32 0.787 -7.385 7.630 246 1HG LYS 32 1HG LYS 32 1.472 -6.323 9.537 247 2HG LYS 32 2HG LYS 32 0.415 -7.282 10.572 248 1HD LYS 32 1HD LYS 32 2.615 -8.777 9.262 249 2HD LYS 32 2HD LYS 32 3.113 -7.604 10.481 250 1HE LYS 32 1HE LYS 32 1.155 -8.702 11.880 251 2HE LYS 32 2HE LYS 32 1.430 -10.064 10.794 252 1HZ LYS 32 1HZ LYS 32 3.640 -8.735 12.244 253 2HZ LYS 32 2HZ LYS 32 2.761 -10.020 12.923 254 3HZ LYS 32 3HZ LYS 32 3.643 -10.253 11.490 255 H TRP 33 H TRP 33 -0.537 -6.894 6.237 256 HA TRP 33 HA TRP 33 -2.960 -8.015 4.999 257 1HB TRP 33 1HB TRP 33 -1.990 -5.813 4.227 258 2HB TRP 33 2HB TRP 33 -0.588 -6.690 3.664 259 HD1 TRP 33 HD1 TRP 33 -4.176 -7.975 3.266 260 HE1 TRP 33 HE1 TRP 33 -4.697 -8.157 0.733 261 HE3 TRP 33 HE3 TRP 33 0.041 -5.884 1.392 262 HZ2 TRP 33 HZ2 TRP 33 -3.457 -7.475 -1.724 263 HZ3 TRP 33 HZ3 TRP 33 0.374 -5.678 -1.074 264 HH2 TRP 33 HH2 TRP 33 -1.383 -6.464 -2.634 265 H ARG 34 H ARG 34 -3.002 -9.758 3.633 266 HA ARG 34 HA ARG 34 -0.495 -11.099 2.868 267 1HB ARG 34 1HB ARG 34 -2.694 -12.520 4.418 268 2HB ARG 34 2HB ARG 34 -1.263 -13.287 3.730 269 1HG ARG 34 1HG ARG 34 0.045 -11.507 5.141 270 2HG ARG 34 2HG ARG 34 -1.455 -11.399 6.060 271 1HD ARG 34 1HD ARG 34 -1.274 -13.550 6.875 272 2HD ARG 34 2HD ARG 34 -0.391 -14.124 5.462 273 HE ARG 34 HE ARG 34 1.385 -12.375 6.638 274 1HH1 ARG 34 1HH1 ARG 34 -0.457 -15.111 7.806 275 2HH1 ARG 34 2HH1 ARG 34 0.718 -15.515 9.009 276 1HH2 ARG 34 1HH2 ARG 34 2.878 -12.936 8.204 277 2HH2 ARG 34 2HH2 ARG 34 2.587 -14.299 9.232 278 H ALA 35 H ALA 35 -0.743 -11.828 0.790 279 HA ALA 35 HA ALA 35 -2.945 -11.205 -0.822 280 1HB ALA 35 1HB ALA 35 -0.666 -11.969 -1.602 281 2HB ALA 35 2HB ALA 35 -1.163 -13.622 -1.244 282 3HB ALA 35 3HB ALA 35 -2.013 -12.693 -2.479 283 H ALA 36 H ALA 36 -4.644 -12.448 -1.714 284 HA ALA 36 HA ALA 36 -6.143 -14.005 0.121 285 1HB ALA 36 1HB ALA 36 -6.721 -12.755 -2.177 286 2HB ALA 36 2HB ALA 36 -6.577 -14.399 -2.799 287 3HB ALA 36 3HB ALA 36 -7.744 -14.035 -1.526 288 H LYS 37 H LYS 37 -3.551 -14.930 -1.998 289 HA LYS 37 HA LYS 37 -3.923 -17.746 -1.161 290 1HB LYS 37 1HB LYS 37 -3.305 -18.465 -3.480 291 2HB LYS 37 2HB LYS 37 -4.856 -17.633 -3.414 292 1HG LYS 37 1HG LYS 37 -2.460 -15.927 -3.848 293 2HG LYS 37 2HG LYS 37 -2.924 -16.980 -5.185 294 1HD LYS 37 1HD LYS 37 -5.183 -15.562 -3.916 295 2HD LYS 37 2HD LYS 37 -4.014 -14.506 -4.708 296 1HE LYS 37 1HE LYS 37 -4.256 -16.462 -6.586 297 2HE LYS 37 2HE LYS 37 -5.879 -16.478 -5.892 298 1HZ LYS 37 1HZ LYS 37 -6.009 -14.088 -6.243 299 2HZ LYS 37 2HZ LYS 37 -4.457 -14.088 -6.935 300 3HZ LYS 37 3HZ LYS 37 -5.728 -14.903 -7.707 301 H ALA 38 H ALA 38 -1.755 -18.858 -2.319 302 HA ALA 38 HA ALA 38 0.504 -17.355 -1.092 303 1HB ALA 38 1HB ALA 38 -0.110 -20.227 -1.597 304 2HB ALA 38 2HB ALA 38 1.583 -19.749 -1.717 305 3HB ALA 38 3HB ALA 38 0.693 -19.473 -0.221 306 H GLY 39 H GLY 39 2.668 -18.248 -2.440 307 1HA GLY 39 1HA GLY 39 3.917 -17.892 -4.399 308 2HA GLY 39 2HA GLY 39 2.450 -18.291 -5.301 309 H GLU 40 H GLU 40 3.195 -15.705 -3.005 310 HA GLU 40 HA GLU 40 1.728 -13.612 -3.851 311 1HB GLU 40 1HB GLU 40 4.636 -13.496 -3.091 312 2HB GLU 40 2HB GLU 40 3.584 -12.083 -3.175 313 1HG GLU 40 1HG GLU 40 2.993 -14.514 -1.464 314 2HG GLU 40 2HG GLU 40 3.808 -13.075 -0.864 315 H LYS 41 H LYS 41 4.949 -13.145 -5.005 316 HA LYS 41 HA LYS 41 5.831 -12.567 -7.091 317 1HB LYS 41 1HB LYS 41 4.372 -14.534 -7.878 318 2HB LYS 41 2HB LYS 41 3.174 -13.318 -8.318 319 1HG LYS 41 1HG LYS 41 4.413 -12.533 -10.074 320 2HG LYS 41 2HG LYS 41 5.945 -12.792 -9.240 321 1HD LYS 41 1HD LYS 41 5.809 -14.350 -11.099 322 2HD LYS 41 2HD LYS 41 5.657 -15.258 -9.594 323 1HE LYS 41 1HE LYS 41 3.839 -16.149 -10.668 324 2HE LYS 41 2HE LYS 41 3.052 -14.702 -10.040 325 1HZ LYS 41 1HZ LYS 41 4.437 -14.647 -12.641 326 2HZ LYS 41 2HZ LYS 41 2.847 -15.234 -12.526 327 3HZ LYS 41 3HZ LYS 41 3.196 -13.638 -12.070 328 H THR 42 H THR 42 2.353 -11.763 -7.087 329 HA THR 42 HA THR 42 2.973 -8.900 -6.964 330 HB THR 42 HB THR 42 1.651 -8.393 -9.037 331 HG1 THR 42 HG1 THR 42 0.748 -9.974 -10.062 332 1HG2 THR 42 1HG2 THR 42 4.241 -8.728 -8.880 333 2HG2 THR 42 2HG2 THR 42 3.933 -10.192 -9.810 334 3HG2 THR 42 3HG2 THR 42 3.485 -8.618 -10.468 335 H ILE 43 H ILE 43 1.275 -7.789 -6.032 336 HA ILE 43 HA ILE 43 -1.404 -9.055 -5.924 337 HB ILE 43 HB ILE 43 -1.321 -8.351 -3.360 338 1HG1 ILE 43 1HG1 ILE 43 1.519 -9.275 -3.730 339 2HG1 ILE 43 2HG1 ILE 43 1.096 -7.567 -3.631 340 1HG2 ILE 43 1HG2 ILE 43 -1.469 -10.685 -4.639 341 2HG2 ILE 43 2HG2 ILE 43 0.114 -10.894 -3.891 342 3HG2 ILE 43 3HG2 ILE 43 -1.301 -10.582 -2.888 343 1HD1 ILE 43 1HD1 ILE 43 -0.309 -8.737 -1.508 344 2HD1 ILE 43 2HD1 ILE 43 1.254 -9.554 -1.497 345 3HD1 ILE 43 3HD1 ILE 43 1.176 -7.797 -1.377 346 H SER 44 H SER 44 -3.084 -7.489 -5.804 347 HA SER 44 HA SER 44 -2.114 -4.667 -5.535 348 1HB SER 44 1HB SER 44 -4.448 -5.483 -7.240 349 2HB SER 44 2HB SER 44 -3.586 -3.953 -7.248 350 HG SER 44 HG SER 44 -2.862 -5.189 -8.964 351 H VAL 45 H VAL 45 -3.128 -3.449 -4.047 352 HA VAL 45 HA VAL 45 -5.826 -4.272 -3.090 353 HB VAL 45 HB VAL 45 -4.212 -5.197 -1.482 354 1HG1 VAL 45 1HG1 VAL 45 -2.775 -2.818 -2.034 355 2HG1 VAL 45 2HG1 VAL 45 -3.202 -2.754 -0.330 356 3HG1 VAL 45 3HG1 VAL 45 -2.304 -4.131 -0.966 357 1HG2 VAL 45 1HG2 VAL 45 -5.709 -2.744 -0.520 358 2HG2 VAL 45 2HG2 VAL 45 -6.295 -4.407 -0.541 359 3HG2 VAL 45 3HG2 VAL 45 -4.997 -3.942 0.559 360 H VAL 46 H VAL 46 -7.110 -2.510 -3.443 361 HA VAL 46 HA VAL 46 -5.881 0.192 -3.449 362 HB VAL 46 HB VAL 46 -8.759 -0.408 -4.100 363 1HG1 VAL 46 1HG1 VAL 46 -6.752 1.717 -4.859 364 2HG1 VAL 46 2HG1 VAL 46 -8.315 1.548 -5.659 365 3HG1 VAL 46 3HG1 VAL 46 -8.240 1.920 -3.937 366 1HG2 VAL 46 1HG2 VAL 46 -6.305 -0.908 -5.779 367 2HG2 VAL 46 2HG2 VAL 46 -7.740 -1.918 -5.593 368 3HG2 VAL 46 3HG2 VAL 46 -7.822 -0.436 -6.547 369 H LEU 47 H LEU 47 -5.928 1.285 -1.566 370 HA LEU 47 HA LEU 47 -8.035 0.624 0.432 371 1HB LEU 47 1HB LEU 47 -5.661 2.408 0.952 372 2HB LEU 47 2HB LEU 47 -6.592 1.449 2.101 373 HG LEU 47 HG LEU 47 -5.684 -0.505 0.410 374 1HD1 LEU 47 1HD1 LEU 47 -4.270 1.608 -0.500 375 2HD1 LEU 47 2HD1 LEU 47 -3.195 1.079 0.794 376 3HD1 LEU 47 3HD1 LEU 47 -3.633 -0.036 -0.501 377 1HD2 LEU 47 1HD2 LEU 47 -5.553 -0.140 3.002 378 2HD2 LEU 47 2HD2 LEU 47 -4.376 -1.199 2.228 379 3HD2 LEU 47 3HD2 LEU 47 -3.928 0.450 2.658 380 H GLN 48 H GLN 48 -9.118 2.383 1.549 381 HA GLN 48 HA GLN 48 -9.629 4.680 -0.262 382 1HB GLN 48 1HB GLN 48 -11.367 3.072 1.064 383 2HB GLN 48 2HB GLN 48 -11.186 4.366 2.249 384 1HG GLN 48 1HG GLN 48 -11.549 5.226 -0.571 385 2HG GLN 48 2HG GLN 48 -12.952 4.484 0.200 386 1HE2 GLN 48 2HE2 GLN 48 -12.051 7.447 -0.468 387 2HE2 GLN 48 1HE2 GLN 48 -12.423 8.272 0.967 388 H LEU 49 H LEU 49 -9.882 6.845 0.793 389 HA LEU 49 HA LEU 49 -7.829 7.222 2.924 390 1HB LEU 49 1HB LEU 49 -7.753 8.345 0.517 391 2HB LEU 49 2HB LEU 49 -8.891 9.471 1.255 392 HG LEU 49 HG LEU 49 -7.275 9.851 3.100 393 1HD1 LEU 49 1HD1 LEU 49 -5.873 7.677 1.659 394 2HD1 LEU 49 2HD1 LEU 49 -4.841 9.015 2.161 395 3HD1 LEU 49 3HD1 LEU 49 -5.789 8.135 3.360 396 1HD2 LEU 49 1HD2 LEU 49 -6.167 10.285 0.308 397 2HD2 LEU 49 2HD2 LEU 49 -7.298 11.349 1.144 398 3HD2 LEU 49 3HD2 LEU 49 -5.654 11.156 1.754 399 H GLU 50 H GLU 50 -8.617 7.800 4.866 400 HA GLU 50 HA GLU 50 -11.376 8.111 5.451 401 1HB GLU 50 1HB GLU 50 -9.305 7.605 6.984 402 2HB GLU 50 2HB GLU 50 -9.296 9.354 7.209 403 1HG GLU 50 1HG GLU 50 -11.822 9.107 7.708 404 2HG GLU 50 2HG GLU 50 -11.476 7.388 7.901 405 H LYS 51 H LYS 51 -9.642 10.356 3.707 406 HA LYS 51 HA LYS 51 -11.624 12.380 3.962 407 1HB LYS 51 1HB LYS 51 -10.212 14.130 5.058 408 2HB LYS 51 2HB LYS 51 -10.615 12.804 6.141 409 1HG LYS 51 1HG LYS 51 -8.417 11.750 5.628 410 2HG LYS 51 2HG LYS 51 -8.005 13.153 4.643 411 1HD LYS 51 1HD LYS 51 -8.691 14.466 6.855 412 2HD LYS 51 2HD LYS 51 -8.264 12.932 7.613 413 1HE LYS 51 1HE LYS 51 -6.084 13.059 6.250 414 2HE LYS 51 2HE LYS 51 -6.509 14.743 5.951 415 1HZ LYS 51 1HZ LYS 51 -6.833 14.811 8.495 416 2HZ LYS 51 2HZ LYS 51 -5.856 13.425 8.499 417 3HZ LYS 51 3HZ LYS 51 -5.260 14.881 7.858 418 H GLU 52 H GLU 52 -11.492 13.633 2.135 419 HA GLU 52 HA GLU 52 -9.442 13.050 0.178 420 1HB GLU 52 1HB GLU 52 -11.922 13.679 -0.229 421 2HB GLU 52 2HB GLU 52 -11.376 15.339 -0.005 422 1HG GLU 52 1HG GLU 52 -9.763 15.109 -1.812 423 2HG GLU 52 2HG GLU 52 -10.174 13.406 -2.001 424 H GLU 53 H GLU 53 -7.482 13.879 0.409 425 HA GLU 53 HA GLU 53 -7.146 16.792 0.634 426 1HB GLU 53 1HB GLU 53 -5.109 15.711 2.347 427 2HB GLU 53 2HB GLU 53 -6.341 16.900 2.736 428 1HG GLU 53 1HG GLU 53 -7.194 14.034 2.733 429 2HG GLU 53 2HG GLU 53 -6.126 14.557 4.027 430 H GLN 54 H GLN 54 -4.464 16.997 0.767 431 HA GLN 54 HA GLN 54 -3.638 15.697 -1.755 432 1HB GLN 54 1HB GLN 54 -2.191 17.771 -0.073 433 2HB GLN 54 2HB GLN 54 -1.749 17.259 -1.702 434 1HG GLN 54 1HG GLN 54 -3.568 18.327 -2.683 435 2HG GLN 54 2HG GLN 54 -4.521 18.284 -1.201 436 1HE2 GLN 54 2HE2 GLN 54 -1.151 19.453 -1.646 437 2HE2 GLN 54 1HE2 GLN 54 -1.471 21.037 -1.128 438 H ILE 55 H ILE 55 -1.038 15.210 -1.613 439 HA ILE 55 HA ILE 55 -0.456 13.763 0.918 440 HB ILE 55 HB ILE 55 -0.209 12.471 -1.814 441 1HG1 ILE 55 1HG1 ILE 55 -2.014 10.945 -0.570 442 2HG1 ILE 55 2HG1 ILE 55 -2.366 12.462 0.259 443 1HG2 ILE 55 1HG2 ILE 55 0.177 11.433 1.010 444 2HG2 ILE 55 2HG2 ILE 55 0.206 10.430 -0.440 445 3HG2 ILE 55 3HG2 ILE 55 1.440 11.667 -0.200 446 1HD1 ILE 55 1HD1 ILE 55 -2.216 13.334 -2.316 447 2HD1 ILE 55 2HD1 ILE 55 -2.835 11.700 -2.564 448 3HD1 ILE 55 3HD1 ILE 55 -3.719 12.833 -1.541 449 H HIS 56 H HIS 56 1.596 14.174 1.528 450 HA HIS 56 HA HIS 56 3.529 15.115 -0.557 451 1HB HIS 56 1HB HIS 56 2.785 16.750 1.277 452 2HB HIS 56 2HB HIS 56 3.685 15.725 2.397 453 HD1 HIS 56 HD1 HIS 56 5.434 17.651 2.783 454 HD2 HIS 56 HD2 HIS 56 5.235 16.279 -1.148 455 HE1 HIS 56 HE1 HIS 56 7.478 18.566 1.600 456 H SER 57 H SER 57 3.021 13.029 2.240 457 HA SER 57 HA SER 57 5.487 11.537 1.493 458 1HB SER 57 1HB SER 57 4.905 12.867 4.109 459 2HB SER 57 2HB SER 57 5.697 11.296 4.140 460 HG SER 57 HG SER 57 7.240 12.933 4.002 461 H VAL 58 H VAL 58 5.426 9.320 2.358 462 HA VAL 58 HA VAL 58 2.722 8.422 3.227 463 HB VAL 58 HB VAL 58 4.303 7.411 0.848 464 1HG1 VAL 58 1HG1 VAL 58 1.907 6.267 2.274 465 2HG1 VAL 58 2HG1 VAL 58 2.208 5.936 0.567 466 3HG1 VAL 58 3HG1 VAL 58 3.390 5.457 1.780 467 1HG2 VAL 58 1HG2 VAL 58 1.855 9.064 1.248 468 2HG2 VAL 58 2HG2 VAL 58 3.101 9.186 0.008 469 3HG2 VAL 58 3HG2 VAL 58 1.862 7.937 -0.108 470 H ASP 59 H ASP 59 2.790 6.130 4.036 471 HA ASP 59 HA ASP 59 5.493 5.209 4.886 472 1HB ASP 59 1HB ASP 59 3.246 6.132 6.609 473 2HB ASP 59 2HB ASP 59 4.097 4.683 7.137 474 H ILE 60 H ILE 60 5.671 3.033 4.525 475 HA ILE 60 HA ILE 60 3.283 1.315 4.792 476 HB ILE 60 HB ILE 60 4.707 1.902 2.226 477 1HG1 ILE 60 1HG1 ILE 60 2.280 1.151 1.507 478 2HG1 ILE 60 2HG1 ILE 60 1.930 1.418 3.212 479 1HG2 ILE 60 1HG2 ILE 60 3.945 -0.858 3.107 480 2HG2 ILE 60 2HG2 ILE 60 3.629 -0.390 1.436 481 3HG2 ILE 60 3HG2 ILE 60 5.276 -0.343 2.068 482 1HD1 ILE 60 1HD1 ILE 60 3.479 3.626 2.360 483 2HD1 ILE 60 2HD1 ILE 60 2.253 3.366 1.121 484 3HD1 ILE 60 3HD1 ILE 60 1.771 3.618 2.798 485 H GLY 61 H GLY 61 3.826 -0.700 5.544 486 1HA GLY 61 1HA GLY 61 6.676 -1.123 6.180 487 2HA GLY 61 2HA GLY 61 5.348 -1.936 6.982 488 H ASN 62 H ASN 62 7.814 -2.584 5.095 489 HA ASN 62 HA ASN 62 6.544 -4.171 2.982 490 1HB ASN 62 1HB ASN 62 8.808 -3.075 2.775 491 2HB ASN 62 2HB ASN 62 9.423 -4.273 3.915 492 1HD2 ASN 62 2HD2 ASN 62 9.469 -6.544 3.208 493 2HD2 ASN 62 1HD2 ASN 62 9.363 -6.944 1.561 494 H ASP 63 H ASP 63 5.812 -6.255 3.213 495 HA ASP 63 HA ASP 63 6.905 -7.850 5.498 496 1HB ASP 63 1HB ASP 63 4.424 -7.013 5.585 497 2HB ASP 63 2HB ASP 63 4.139 -8.282 4.393 498 H GLY 64 H GLY 64 8.401 -8.241 3.470 499 1HA GLY 64 1HA GLY 64 9.139 -10.278 2.367 500 2HA GLY 64 2HA GLY 64 7.450 -10.756 2.191 501 H SER 65 H SER 65 6.619 -8.080 1.291 502 HA SER 65 HA SER 65 6.915 -8.398 -1.535 503 1HB SER 65 1HB SER 65 5.868 -6.188 -1.682 504 2HB SER 65 2HB SER 65 5.056 -7.152 -0.452 505 HG SER 65 HG SER 65 5.997 -4.805 -0.100 506 H ALA 66 H ALA 66 7.798 -6.498 -2.897 507 HA ALA 66 HA ALA 66 10.289 -5.360 -1.753 508 1HB ALA 66 1HB ALA 66 10.630 -7.613 -3.053 509 2HB ALA 66 2HB ALA 66 10.360 -6.618 -4.484 510 3HB ALA 66 3HB ALA 66 11.698 -6.252 -3.398 511 H PHE 67 H PHE 67 8.335 -5.617 -4.738 512 HA PHE 67 HA PHE 67 8.925 -2.766 -5.326 513 1HB PHE 67 1HB PHE 67 7.329 -4.771 -6.950 514 2HB PHE 67 2HB PHE 67 7.858 -3.182 -7.488 515 HD1 PHE 67 HD1 PHE 67 10.590 -2.932 -6.624 516 HD2 PHE 67 HD2 PHE 67 8.538 -6.414 -8.081 517 HE1 PHE 67 HE1 PHE 67 12.750 -3.900 -7.349 518 HE2 PHE 67 HE2 PHE 67 10.694 -7.384 -8.799 519 HZ PHE 67 HZ PHE 67 12.806 -6.131 -8.439 520 H VAL 68 H VAL 68 7.517 -1.206 -4.754 521 HA VAL 68 HA VAL 68 4.685 -2.018 -4.227 522 HB VAL 68 HB VAL 68 6.269 0.086 -2.727 523 1HG1 VAL 68 1HG1 VAL 68 3.426 -0.879 -2.664 524 2HG1 VAL 68 2HG1 VAL 68 4.182 -0.337 -1.166 525 3HG1 VAL 68 3HG1 VAL 68 4.046 0.767 -2.534 526 1HG2 VAL 68 1HG2 VAL 68 5.553 -2.786 -2.147 527 2HG2 VAL 68 2HG2 VAL 68 7.131 -2.006 -2.032 528 3HG2 VAL 68 3HG2 VAL 68 5.879 -1.643 -0.844 529 H GLU 69 H GLU 69 3.463 -1.158 -5.765 530 HA GLU 69 HA GLU 69 4.198 1.468 -6.961 531 1HB GLU 69 1HB GLU 69 3.710 -0.453 -8.490 532 2HB GLU 69 2HB GLU 69 2.078 -0.526 -7.828 533 1HG GLU 69 1HG GLU 69 1.587 1.710 -8.624 534 2HG GLU 69 2HG GLU 69 3.260 1.942 -9.134 535 H VAL 70 H VAL 70 3.159 3.243 -6.176 536 HA VAL 70 HA VAL 70 0.543 2.805 -4.794 537 HB VAL 70 HB VAL 70 2.516 5.061 -4.364 538 1HG1 VAL 70 1HG1 VAL 70 -0.039 4.199 -2.987 539 2HG1 VAL 70 2HG1 VAL 70 1.119 5.306 -2.248 540 3HG1 VAL 70 3HG1 VAL 70 0.304 5.754 -3.746 541 1HG2 VAL 70 1HG2 VAL 70 2.056 2.453 -2.900 542 2HG2 VAL 70 2HG2 VAL 70 3.567 3.060 -3.576 543 3HG2 VAL 70 3HG2 VAL 70 2.866 3.829 -2.152 544 H LEU 71 H LEU 71 -1.207 3.751 -5.682 545 HA LEU 71 HA LEU 71 -0.772 5.954 -7.657 546 1HB LEU 71 1HB LEU 71 -2.285 3.455 -7.840 547 2HB LEU 71 2HB LEU 71 -3.290 4.860 -8.191 548 HG LEU 71 HG LEU 71 -1.461 5.641 -9.767 549 1HD1 LEU 71 1HD1 LEU 71 -0.475 2.826 -9.225 550 2HD1 LEU 71 2HD1 LEU 71 0.088 3.839 -10.555 551 3HD1 LEU 71 3HD1 LEU 71 0.388 4.327 -8.886 552 1HD2 LEU 71 1HD2 LEU 71 -3.180 3.223 -10.117 553 2HD2 LEU 71 2HD2 LEU 71 -3.233 4.770 -10.964 554 3HD2 LEU 71 3HD2 LEU 71 -2.006 3.575 -11.385 555 H VAL 72 H VAL 72 -2.634 7.483 -7.770 556 HA VAL 72 HA VAL 72 -4.131 7.668 -5.194 557 HB VAL 72 HB VAL 72 -3.823 10.176 -5.483 558 1HG1 VAL 72 1HG1 VAL 72 -2.717 8.806 -3.742 559 2HG1 VAL 72 2HG1 VAL 72 -1.387 8.503 -4.858 560 3HG1 VAL 72 3HG1 VAL 72 -1.699 10.139 -4.280 561 1HG2 VAL 72 1HG2 VAL 72 -2.718 9.540 -7.867 562 2HG2 VAL 72 2HG2 VAL 72 -2.327 11.023 -6.999 563 3HG2 VAL 72 3HG2 VAL 72 -1.269 9.620 -6.874 564 H GLY 73 H GLY 73 -6.108 8.994 -5.370 565 1HA GLY 73 1HA GLY 73 -7.138 10.065 -7.757 566 2HA GLY 73 2HA GLY 73 -7.644 8.381 -7.688 567 H SER 74 H SER 74 -9.667 9.968 -7.617 568 HA SER 74 HA SER 74 -10.414 10.286 -4.762 569 1HB SER 74 1HB SER 74 -10.457 12.443 -5.819 570 2HB SER 74 2HB SER 74 -11.303 11.806 -7.218 571 HG SER 74 HG SER 74 -12.734 12.847 -5.787 572 H SER 75 H SER 75 -12.627 9.735 -4.267 573 HA SER 75 HA SER 75 -13.606 7.466 -5.848 574 1HB SER 75 1HB SER 75 -15.051 7.008 -4.015 575 2HB SER 75 2HB SER 75 -13.555 7.576 -3.281 576 HG SER 75 HG SER 75 -14.813 8.991 -2.366 577 H ALA 76 H ALA 76 -13.871 10.677 -6.326 578 HA ALA 76 HA ALA 76 -16.676 11.124 -6.555 579 1HB ALA 76 1HB ALA 76 -14.201 12.446 -7.530 580 2HB ALA 76 2HB ALA 76 -15.687 12.814 -8.405 581 3HB ALA 76 3HB ALA 76 -15.580 13.135 -6.674 582 H GLY 77 H GLY 77 -14.277 10.498 -9.140 583 1HA GLY 77 1HA GLY 77 -16.506 9.339 -10.764 584 2HA GLY 77 2HA GLY 77 -15.103 10.145 -11.464 585 H GLY 78 H GLY 78 -15.402 7.630 -8.937 586 1HA GLY 78 1HA GLY 78 -13.129 6.170 -10.033 587 2HA GLY 78 2HA GLY 78 -14.130 5.657 -8.675 588 H ALA 79 H ALA 79 -14.112 5.898 -12.225 589 HA ALA 79 HA ALA 79 -16.367 4.009 -12.428 590 1HB ALA 79 1HB ALA 79 -14.650 5.297 -14.574 591 2HB ALA 79 2HB ALA 79 -16.108 4.347 -14.864 592 3HB ALA 79 3HB ALA 79 -16.216 5.889 -14.015 593 H GLY 80 H GLY 80 -12.901 4.093 -13.293 594 1HA GLY 80 1HA GLY 80 -12.966 1.103 -13.326 595 2HA GLY 80 2HA GLY 80 -12.053 2.013 -14.530 596 H GLU 81 H GLU 81 -10.523 0.317 -13.224 597 HA GLU 81 HA GLU 81 -9.414 1.498 -10.768 598 1HB GLU 81 1HB GLU 81 -8.918 -0.994 -12.366 599 2HB GLU 81 2HB GLU 81 -7.694 -0.447 -11.221 600 1HG GLU 81 1HG GLU 81 -9.679 -0.252 -9.546 601 2HG GLU 81 2HG GLU 81 -10.529 -1.303 -10.678 602 H GLN 82 H GLN 82 -8.843 1.736 -14.173 603 HA GLN 82 HA GLN 82 -6.057 2.668 -13.773 604 1HB GLN 82 1HB GLN 82 -7.665 2.384 -16.329 605 2HB GLN 82 2HB GLN 82 -5.935 2.706 -16.217 606 1HG GLN 82 1HG GLN 82 -5.643 0.541 -15.016 607 2HG GLN 82 2HG GLN 82 -7.361 0.211 -15.249 608 1HE2 GLN 82 2HE2 GLN 82 -5.017 -1.282 -16.395 609 2HE2 GLN 82 1HE2 GLN 82 -5.223 -1.225 -18.078 610 H ASP 83 H ASP 83 -8.246 4.247 -12.673 611 HA ASP 83 HA ASP 83 -8.063 6.677 -14.408 612 1HB ASP 83 1HB ASP 83 -10.379 5.705 -13.992 613 2HB ASP 83 2HB ASP 83 -10.164 6.139 -12.296 614 H TYR 84 H TYR 84 -6.157 5.681 -12.313 615 HA TYR 84 HA TYR 84 -6.412 7.869 -10.308 616 1HB TYR 84 1HB TYR 84 -5.081 5.163 -10.281 617 2HB TYR 84 2HB TYR 84 -4.503 6.432 -9.208 618 HD1 TYR 84 HD1 TYR 84 -7.968 5.493 -10.345 619 HD2 TYR 84 HD2 TYR 84 -5.257 5.990 -7.050 620 HE1 TYR 84 HE1 TYR 84 -9.807 5.007 -8.759 621 HE2 TYR 84 HE2 TYR 84 -7.099 5.506 -5.464 622 HH TYR 84 HH TYR 84 -10.368 5.453 -6.404 623 H GLU 85 H GLU 85 -3.928 8.288 -9.564 624 HA GLU 85 HA GLU 85 -2.381 8.880 -12.045 625 1HB GLU 85 1HB GLU 85 -1.583 10.703 -9.974 626 2HB GLU 85 2HB GLU 85 -2.309 11.078 -11.529 627 1HG GLU 85 1HG GLU 85 -4.010 10.231 -9.179 628 2HG GLU 85 2HG GLU 85 -3.523 11.909 -9.404 629 H VAL 86 H VAL 86 -0.414 7.945 -12.048 630 HA VAL 86 HA VAL 86 0.440 6.214 -9.961 631 HB VAL 86 HB VAL 86 2.169 7.469 -12.112 632 1HG1 VAL 86 1HG1 VAL 86 2.448 5.176 -10.206 633 2HG1 VAL 86 2HG1 VAL 86 3.152 5.014 -11.816 634 3HG1 VAL 86 3HG1 VAL 86 3.665 6.328 -10.756 635 1HG2 VAL 86 1HG2 VAL 86 0.224 5.158 -12.137 636 2HG2 VAL 86 2HG2 VAL 86 0.351 6.497 -13.279 637 3HG2 VAL 86 3HG2 VAL 86 1.575 5.228 -13.269 638 H LEU 87 H LEU 87 0.378 7.529 -8.025 639 HA LEU 87 HA LEU 87 1.889 9.906 -7.616 640 1HB LEU 87 1HB LEU 87 0.141 8.498 -6.115 641 2HB LEU 87 2HB LEU 87 1.646 7.976 -5.366 642 HG LEU 87 HG LEU 87 2.296 10.400 -5.148 643 1HD1 LEU 87 1HD1 LEU 87 0.286 10.860 -6.942 644 2HD1 LEU 87 2HD1 LEU 87 -0.523 11.259 -5.428 645 3HD1 LEU 87 3HD1 LEU 87 0.959 12.097 -5.884 646 1HD2 LEU 87 1HD2 LEU 87 0.168 8.976 -3.698 647 2HD2 LEU 87 2HD2 LEU 87 1.556 9.861 -3.069 648 3HD2 LEU 87 3HD2 LEU 87 0.084 10.727 -3.503 649 H LEU 88 H LEU 88 2.732 6.588 -6.569 650 HA LEU 88 HA LEU 88 5.599 7.293 -7.005 651 1HB LEU 88 1HB LEU 88 5.231 5.112 -5.138 652 2HB LEU 88 2HB LEU 88 6.259 6.518 -5.014 653 HG LEU 88 HG LEU 88 3.300 6.807 -4.552 654 1HD1 LEU 88 1HD1 LEU 88 4.596 4.896 -3.178 655 2HD1 LEU 88 2HD1 LEU 88 5.097 6.299 -2.233 656 3HD1 LEU 88 3HD1 LEU 88 3.382 5.933 -2.427 657 1HD2 LEU 88 1HD2 LEU 88 5.836 8.186 -3.668 658 2HD2 LEU 88 2HD2 LEU 88 4.533 8.848 -4.655 659 3HD2 LEU 88 3HD2 LEU 88 4.265 8.527 -2.941 660 H VAL 89 H VAL 89 6.650 5.981 -8.387 661 HA VAL 89 HA VAL 89 5.227 3.909 -9.809 662 HB VAL 89 HB VAL 89 7.466 3.455 -10.847 663 1HG1 VAL 89 1HG1 VAL 89 5.830 5.428 -11.416 664 2HG1 VAL 89 2HG1 VAL 89 7.097 6.435 -10.716 665 3HG1 VAL 89 3HG1 VAL 89 7.449 5.419 -12.114 666 1HG2 VAL 89 1HG2 VAL 89 8.663 4.081 -8.640 667 2HG2 VAL 89 2HG2 VAL 89 9.409 4.620 -10.146 668 3HG2 VAL 89 3HG2 VAL 89 8.476 5.754 -9.168 669 H THR 90 H THR 90 6.875 1.741 -10.035 670 HA THR 90 HA THR 90 6.335 0.271 -7.644 671 HB THR 90 HB THR 90 7.244 -0.292 -10.290 672 HG1 THR 90 HG1 THR 90 6.119 -1.996 -9.851 673 1HG2 THR 90 1HG2 THR 90 9.033 -1.536 -8.176 674 2HG2 THR 90 2HG2 THR 90 8.886 -2.127 -9.831 675 3HG2 THR 90 3HG2 THR 90 9.547 -0.522 -9.524 676 H SER 91 H SER 91 7.355 0.512 -5.741 677 HA SER 91 HA SER 91 10.102 1.629 -5.701 678 1HB SER 91 1HB SER 91 9.620 2.426 -3.551 679 2HB SER 91 2HB SER 91 8.048 2.517 -4.332 680 HG SER 91 HG SER 91 9.036 0.548 -2.553 681 H SER 92 H SER 92 11.671 0.125 -5.680 682 HA SER 92 HA SER 92 11.215 -2.588 -4.656 683 1HB SER 92 1HB SER 92 13.414 -3.072 -5.485 684 2HB SER 92 2HB SER 92 12.658 -2.016 -6.675 685 HG SER 92 HG SER 92 14.020 -0.475 -6.170 686 H PHE 93 H PHE 93 11.520 -3.135 -2.561 687 HA PHE 93 HA PHE 93 13.281 -1.388 -0.896 688 1HB PHE 93 1HB PHE 93 10.784 -2.920 -0.211 689 2HB PHE 93 2HB PHE 93 11.882 -2.338 1.029 690 HD1 PHE 93 HD1 PHE 93 12.706 0.305 -0.116 691 HD2 PHE 93 HD2 PHE 93 8.860 -1.611 0.035 692 HE1 PHE 93 HE1 PHE 93 11.599 2.518 -0.215 693 HE2 PHE 93 HE2 PHE 93 7.759 0.605 -0.058 694 HZ PHE 93 HZ PHE 93 9.127 2.669 -0.183 695 H MET 94 H MET 94 12.121 -4.732 -1.292 696 HA MET 94 HA MET 94 14.700 -5.642 -0.065 697 1HB MET 94 1HB MET 94 11.950 -6.274 0.595 698 2HB MET 94 2HB MET 94 12.804 -7.741 0.123 699 1HG MET 94 1HG MET 94 14.349 -7.561 1.860 700 2HG MET 94 2HG MET 94 14.126 -5.819 2.014 701 1HE MET 94 1HE MET 94 12.342 -8.951 1.712 702 2HE MET 94 2HE MET 94 12.392 -9.413 3.417 703 3HE MET 94 3HE MET 94 10.888 -8.841 2.702 704 H SER 95 H SER 95 14.523 -8.323 -0.677 705 HA SER 95 HA SER 95 14.440 -8.367 -3.666 706 1HB SER 95 1HB SER 95 16.492 -9.503 -3.745 707 2HB SER 95 2HB SER 95 16.757 -8.390 -2.412 708 HG SER 95 HG SER 95 17.077 -10.094 -1.242 709 HA PRO 96 HA PRO 96 12.143 -12.168 -3.149 710 1HB PRO 96 1HB PRO 96 13.091 -13.749 -5.159 711 2HB PRO 96 2HB PRO 96 12.107 -12.306 -5.438 712 1HG PRO 96 1HG PRO 96 14.956 -12.744 -5.977 713 2HG PRO 96 2HG PRO 96 13.862 -11.519 -6.633 714 1HD PRO 96 1HD PRO 96 15.814 -11.210 -4.530 715 2HD PRO 96 2HD PRO 96 14.728 -9.975 -5.207 716 H SER 97 H SER 97 15.029 -12.134 -1.820 717 HA SER 97 HA SER 97 15.173 -15.092 -1.412 718 1HB SER 97 1HB SER 97 17.365 -13.010 -1.476 719 2HB SER 97 2HB SER 97 17.604 -14.610 -0.778 720 HG SER 97 HG SER 97 18.044 -14.162 -3.164 721 H GLU 98 H GLU 98 16.016 -11.990 0.189 722 HA GLU 98 HA GLU 98 16.192 -12.979 2.823 723 1HB GLU 98 1HB GLU 98 16.026 -10.402 1.499 724 2HB GLU 98 2HB GLU 98 15.108 -10.378 3.004 725 1HG GLU 98 1HG GLU 98 17.290 -9.792 3.665 726 2HG GLU 98 2HG GLU 98 17.173 -11.508 4.054 727 H SER 99 H SER 99 13.362 -12.227 0.894 728 HA SER 99 HA SER 99 11.375 -11.844 2.818 729 1HB SER 99 1HB SER 99 11.346 -13.259 0.162 730 2HB SER 99 2HB SER 99 9.888 -13.150 1.144 731 HG SER 99 HG SER 99 10.149 -11.398 -0.354 732 H ARG 100 H ARG 100 13.115 -14.800 2.122 733 HA ARG 100 HA ARG 100 11.193 -16.503 3.521 734 1HB ARG 100 1HB ARG 100 14.001 -17.014 2.495 735 2HB ARG 100 2HB ARG 100 12.980 -18.249 3.234 736 1HG ARG 100 1HG ARG 100 11.355 -18.085 1.493 737 2HG ARG 100 2HG ARG 100 12.064 -16.595 0.876 738 1HD ARG 100 1HD ARG 100 13.347 -17.806 -0.517 739 2HD ARG 100 2HD ARG 100 14.128 -18.559 0.873 740 HE ARG 100 HE ARG 100 11.779 -19.980 0.632 741 1HH1 ARG 100 1HH1 ARG 100 14.350 -19.150 -1.590 742 2HH1 ARG 100 2HH1 ARG 100 14.127 -20.578 -2.539 743 1HH2 ARG 100 1HH2 ARG 100 11.527 -21.815 -0.623 744 2HH2 ARG 100 2HH2 ARG 100 12.547 -22.072 -1.998 745 H SER 101 H SER 101 14.667 -16.550 4.300 746 HA SER 101 HA SER 101 14.323 -15.344 6.914 747 1HB SER 101 1HB SER 101 13.364 -17.795 7.005 748 2HB SER 101 2HB SER 101 15.063 -18.261 6.991 749 HG SER 101 HG SER 101 13.652 -16.680 8.864 750 H GLY 102 H GLY 102 16.003 -14.985 4.631 751 1HA GLY 102 1HA GLY 102 18.626 -16.131 5.342 752 2HA GLY 102 2HA GLY 102 18.285 -15.110 3.944 753 H SER 103 H SER 103 16.797 -13.206 5.835 754 HA SER 103 HA SER 103 18.753 -12.185 7.680 755 1HB SER 103 1HB SER 103 18.975 -11.371 4.885 756 2HB SER 103 2HB SER 103 18.834 -10.008 5.993 757 HG SER 103 HG SER 103 20.958 -10.475 6.002 758 H ASN 104 H ASN 104 16.891 -10.115 5.594 759 HA ASN 104 HA ASN 104 15.021 -9.584 7.845 760 1HB ASN 104 1HB ASN 104 14.810 -7.271 6.623 761 2HB ASN 104 2HB ASN 104 16.199 -7.563 7.665 762 1HD2 ASN 104 2HD2 ASN 104 15.329 -8.161 4.193 763 2HD2 ASN 104 1HD2 ASN 104 16.837 -7.673 3.585 764 HA PRO 105 HA PRO 105 12.508 -11.164 4.311 765 1HB PRO 105 1HB PRO 105 10.698 -12.462 5.902 766 2HB PRO 105 2HB PRO 105 12.219 -13.183 5.365 767 1HG PRO 105 1HG PRO 105 11.506 -12.050 8.019 768 2HG PRO 105 2HG PRO 105 12.552 -13.424 7.621 769 1HD PRO 105 1HD PRO 105 13.483 -10.908 8.309 770 2HD PRO 105 2HD PRO 105 14.407 -12.095 7.361 771 H ASN 106 H ASN 106 11.775 -9.417 7.229 772 HA ASN 106 HA ASN 106 9.536 -8.038 5.827 773 1HB ASN 106 1HB ASN 106 9.555 -8.948 8.721 774 2HB ASN 106 2HB ASN 106 8.304 -7.959 7.977 775 1HD2 ASN 106 2HD2 ASN 106 8.191 -9.358 5.423 776 2HD2 ASN 106 1HD2 ASN 106 7.538 -10.892 5.715 777 H ARG 107 H ARG 107 9.494 -5.811 6.171 778 HA ARG 107 HA ARG 107 11.135 -4.612 8.287 779 1HB ARG 107 1HB ARG 107 12.310 -5.097 5.772 780 2HB ARG 107 2HB ARG 107 11.920 -3.378 5.771 781 1HG ARG 107 1HG ARG 107 12.970 -3.836 8.327 782 2HG ARG 107 2HG ARG 107 13.986 -4.808 7.263 783 1HD ARG 107 1HD ARG 107 14.486 -2.880 5.880 784 2HD ARG 107 2HD ARG 107 13.330 -1.891 6.772 785 HE ARG 107 HE ARG 107 15.418 -3.038 8.461 786 1HH1 ARG 107 1HH1 ARG 107 14.530 -0.363 6.389 787 2HH1 ARG 107 2HH1 ARG 107 15.647 0.720 7.143 788 1HH2 ARG 107 1HH2 ARG 107 16.850 -1.604 9.401 789 2HH2 ARG 107 2HH2 ARG 107 16.949 0.027 8.827 790 H VAL 108 H VAL 108 11.268 -2.030 7.254 791 HA VAL 108 HA VAL 108 8.446 -1.302 6.599 792 HB VAL 108 HB VAL 108 10.166 -0.176 8.814 793 1HG1 VAL 108 1HG1 VAL 108 7.671 0.844 7.499 794 2HG1 VAL 108 2HG1 VAL 108 7.905 1.114 9.226 795 3HG1 VAL 108 3HG1 VAL 108 9.077 1.746 8.069 796 1HG2 VAL 108 1HG2 VAL 108 7.650 -1.825 8.702 797 2HG2 VAL 108 2HG2 VAL 108 9.126 -2.132 9.619 798 3HG2 VAL 108 3HG2 VAL 108 8.028 -0.844 10.119 799 H ARG 109 H ARG 109 8.315 0.818 5.535 800 HA ARG 109 HA ARG 109 10.750 2.305 4.956 801 1HB ARG 109 1HB ARG 109 9.801 0.251 3.098 802 2HB ARG 109 2HB ARG 109 9.865 1.843 2.344 803 1HG ARG 109 1HG ARG 109 12.085 1.533 2.083 804 2HG ARG 109 2HG ARG 109 12.244 1.681 3.830 805 1HD ARG 109 1HD ARG 109 11.454 -0.899 3.672 806 2HD ARG 109 2HD ARG 109 12.286 -0.748 2.126 807 HE ARG 109 HE ARG 109 13.554 -0.832 4.716 808 1HH1 ARG 109 1HH1 ARG 109 13.775 0.613 1.538 809 2HH1 ARG 109 2HH1 ARG 109 15.487 0.833 1.648 810 1HH2 ARG 109 1HH2 ARG 109 15.770 -0.527 4.814 811 2HH2 ARG 109 2HH2 ARG 109 16.605 0.194 3.479 812 H MET 110 H MET 110 10.257 4.352 4.003 813 HA MET 110 HA MET 110 7.335 4.938 3.765 814 1HB MET 110 1HB MET 110 9.403 6.747 5.042 815 2HB MET 110 2HB MET 110 7.666 7.034 4.944 816 1HG MET 110 1HG MET 110 7.223 5.081 6.334 817 2HG MET 110 2HG MET 110 8.932 4.673 6.350 818 1HE MET 110 1HE MET 110 10.673 6.360 6.824 819 2HE MET 110 2HE MET 110 10.682 7.290 8.321 820 3HE MET 110 3HE MET 110 10.538 5.535 8.383 821 H PHE 111 H PHE 111 7.021 7.162 2.695 822 HA PHE 111 HA PHE 111 9.070 7.583 0.562 823 1HB PHE 111 1HB PHE 111 6.085 7.786 0.110 824 2HB PHE 111 2HB PHE 111 7.356 7.829 -1.101 825 HD1 PHE 111 HD1 PHE 111 6.096 5.549 1.630 826 HD2 PHE 111 HD2 PHE 111 7.775 5.913 -2.310 827 HE1 PHE 111 HE1 PHE 111 5.900 3.111 1.315 828 HE2 PHE 111 HE2 PHE 111 7.577 3.466 -2.613 829 HZ PHE 111 HZ PHE 111 6.638 2.057 -0.803 830 H GLY 112 H GLY 112 8.658 9.714 -0.553 831 1HA GLY 112 1HA GLY 112 7.373 11.779 1.111 832 2HA GLY 112 2HA GLY 112 9.076 11.969 0.744 833 HA PRO 113 HA PRO 113 6.848 13.863 -2.844 834 1HB PRO 113 1HB PRO 113 8.559 15.981 -3.069 835 2HB PRO 113 2HB PRO 113 7.154 15.971 -1.993 836 1HG PRO 113 1HG PRO 113 10.035 15.661 -1.338 837 2HG PRO 113 2HG PRO 113 8.730 16.381 -0.383 838 1HD PRO 113 1HD PRO 113 9.790 13.826 0.025 839 2HD PRO 113 2HD PRO 113 8.217 14.377 0.619 840 H ASP 114 H ASP 114 10.193 13.067 -2.265 841 HA ASP 114 HA ASP 114 11.361 13.381 -4.795 842 1HB ASP 114 1HB ASP 114 12.237 12.453 -2.453 843 2HB ASP 114 2HB ASP 114 11.970 10.905 -3.255 844 H LYS 115 H LYS 115 9.424 10.646 -3.575 845 HA LYS 115 HA LYS 115 9.457 9.510 -6.336 846 1HB LYS 115 1HB LYS 115 9.332 8.324 -3.613 847 2HB LYS 115 2HB LYS 115 8.374 7.526 -4.861 848 1HG LYS 115 1HG LYS 115 10.403 6.447 -5.156 849 2HG LYS 115 2HG LYS 115 10.604 7.798 -6.274 850 1HD LYS 115 1HD LYS 115 12.554 8.083 -5.103 851 2HD LYS 115 2HD LYS 115 11.492 8.968 -4.009 852 1HE LYS 115 1HE LYS 115 11.101 6.747 -2.809 853 2HE LYS 115 2HE LYS 115 12.446 6.109 -3.755 854 1HZ LYS 115 1HZ LYS 115 12.621 8.540 -2.063 855 2HZ LYS 115 2HZ LYS 115 13.082 6.990 -1.542 856 3HZ LYS 115 3HZ LYS 115 13.900 7.728 -2.831 857 H LEU 116 H LEU 116 7.601 11.673 -4.931 858 HA LEU 116 HA LEU 116 5.081 10.353 -5.841 859 1HB LEU 116 1HB LEU 116 4.220 10.627 -3.801 860 2HB LEU 116 2HB LEU 116 5.748 11.260 -3.258 861 HG LEU 116 HG LEU 116 4.668 13.505 -4.376 862 1HD1 LEU 116 1HD1 LEU 116 2.491 11.612 -3.599 863 2HD1 LEU 116 2HD1 LEU 116 2.279 13.320 -3.233 864 3HD1 LEU 116 3HD1 LEU 116 2.517 12.800 -4.901 865 1HD2 LEU 116 1HD2 LEU 116 5.495 12.734 -1.922 866 2HD2 LEU 116 2HD2 LEU 116 4.673 14.265 -2.211 867 3HD2 LEU 116 3HD2 LEU 116 3.765 12.876 -1.613 868 H VAL 117 H VAL 117 4.336 11.194 -7.602 869 HA VAL 117 HA VAL 117 5.393 13.279 -9.094 870 HB VAL 117 HB VAL 117 3.726 11.696 -9.953 871 1HG1 VAL 117 1HG1 VAL 117 2.389 11.738 -7.823 872 2HG1 VAL 117 2HG1 VAL 117 1.697 13.253 -8.369 873 3HG1 VAL 117 3HG1 VAL 117 1.424 11.781 -9.298 874 1HG2 VAL 117 1HG2 VAL 117 2.888 14.606 -10.134 875 2HG2 VAL 117 2HG2 VAL 117 3.917 13.726 -11.260 876 3HG2 VAL 117 3HG2 VAL 117 2.202 13.334 -11.138 877 H ARG 118 H ARG 118 5.472 15.481 -8.869 878 HA ARG 118 HA ARG 118 4.279 16.834 -6.635 879 1HB ARG 118 1HB ARG 118 5.925 17.548 -8.966 880 2HB ARG 118 2HB ARG 118 4.817 18.831 -8.481 881 1HG ARG 118 1HG ARG 118 5.681 18.823 -6.226 882 2HG ARG 118 2HG ARG 118 6.650 17.385 -6.550 883 1HD ARG 118 1HD ARG 118 7.913 18.676 -8.278 884 2HD ARG 118 2HD ARG 118 7.002 20.115 -7.822 885 HE ARG 118 HE ARG 118 8.292 18.875 -5.536 886 1HH1 ARG 118 1HH1 ARG 118 8.784 21.003 -8.267 887 2HH1 ARG 118 2HH1 ARG 118 10.103 21.829 -7.515 888 1HH2 ARG 118 1HH2 ARG 118 10.002 19.972 -4.599 889 2HH2 ARG 118 2HH2 ARG 118 10.786 21.253 -5.459 890 H ALA 119 H ALA 119 3.335 16.532 -10.044 891 HA ALA 119 HA ALA 119 1.194 18.382 -10.062 892 1HB ALA 119 1HB ALA 119 1.741 15.861 -11.620 893 2HB ALA 119 2HB ALA 119 0.272 16.800 -11.889 894 3HB ALA 119 3HB ALA 119 1.851 17.536 -12.162 895 H ALA 120 H ALA 120 1.156 14.903 -9.240 896 HA ALA 120 HA ALA 120 -1.697 15.079 -8.513 897 1HB ALA 120 1HB ALA 120 -0.212 13.033 -9.542 898 2HB ALA 120 2HB ALA 120 -0.194 12.623 -7.827 899 3HB ALA 120 3HB ALA 120 -1.730 12.802 -8.675 900 H ALA 121 H ALA 121 1.470 14.745 -6.940 901 HA ALA 121 HA ALA 121 0.872 14.134 -4.315 902 1HB ALA 121 1HB ALA 121 2.687 16.366 -5.272 903 2HB ALA 121 2HB ALA 121 2.731 15.653 -3.661 904 3HB ALA 121 3HB ALA 121 3.151 14.682 -5.064 905 H GLU 122 H GLU 122 0.453 17.341 -5.817 906 HA GLU 122 HA GLU 122 -0.744 18.323 -3.294 907 1HB GLU 122 1HB GLU 122 -0.813 20.530 -4.511 908 2HB GLU 122 2HB GLU 122 0.804 19.852 -4.334 909 1HG GLU 122 1HG GLU 122 1.054 19.541 -6.573 910 2HG GLU 122 2HG GLU 122 -0.606 18.984 -6.778 911 H LYS 123 H LYS 123 -2.010 16.472 -5.572 912 HA LYS 123 HA LYS 123 -4.436 18.067 -6.097 913 1HB LYS 123 1HB LYS 123 -3.332 15.484 -7.103 914 2HB LYS 123 2HB LYS 123 -5.072 15.745 -7.196 915 1HG LYS 123 1HG LYS 123 -3.609 18.097 -8.076 916 2HG LYS 123 2HG LYS 123 -3.118 16.672 -8.980 917 1HD LYS 123 1HD LYS 123 -4.973 17.561 -10.182 918 2HD LYS 123 2HD LYS 123 -5.616 16.184 -9.287 919 1HE LYS 123 1HE LYS 123 -7.195 17.832 -8.800 920 2HE LYS 123 2HE LYS 123 -6.100 17.975 -7.425 921 1HZ LYS 123 1HZ LYS 123 -4.911 19.723 -8.677 922 2HZ LYS 123 2HZ LYS 123 -6.111 19.647 -9.878 923 3HZ LYS 123 3HZ LYS 123 -6.516 20.140 -8.306 924 H ARG 124 H ARG 124 -6.248 17.833 -4.847 925 HA ARG 124 HA ARG 124 -6.158 16.295 -2.428 926 1HB ARG 124 1HB ARG 124 -8.379 17.741 -3.876 927 2HB ARG 124 2HB ARG 124 -8.671 16.854 -2.380 928 1HG ARG 124 1HG ARG 124 -6.984 18.197 -1.219 929 2HG ARG 124 2HG ARG 124 -6.610 19.054 -2.715 930 1HD ARG 124 1HD ARG 124 -8.891 19.949 -2.807 931 2HD ARG 124 2HD ARG 124 -9.326 19.037 -1.363 932 HE ARG 124 HE ARG 124 -8.219 20.658 -0.057 933 1HH1 ARG 124 1HH1 ARG 124 -7.310 20.986 -3.419 934 2HH1 ARG 124 2HH1 ARG 124 -6.473 22.473 -3.149 935 1HH2 ARG 124 1HH2 ARG 124 -7.122 22.580 0.246 936 2HH2 ARG 124 2HH2 ARG 124 -6.365 23.368 -1.099 937 H TRP 125 H TRP 125 -6.133 14.122 -2.487 938 HA TRP 125 HA TRP 125 -8.079 12.701 -4.269 939 1HB TRP 125 1HB TRP 125 -5.478 11.647 -3.106 940 2HB TRP 125 2HB TRP 125 -6.540 10.800 -4.227 941 HD1 TRP 125 HD1 TRP 125 -3.505 12.786 -4.207 942 HE1 TRP 125 HE1 TRP 125 -2.975 13.726 -6.549 943 HE3 TRP 125 HE3 TRP 125 -7.988 11.990 -6.503 944 HZ2 TRP 125 HZ2 TRP 125 -4.286 14.082 -9.070 945 HZ3 TRP 125 HZ3 TRP 125 -8.322 12.619 -8.869 946 HH2 TRP 125 HH2 TRP 125 -6.481 13.672 -10.158 947 H ASP 126 H ASP 126 -8.908 10.641 -3.266 948 HA ASP 126 HA ASP 126 -8.777 10.635 -0.302 949 1HB ASP 126 1HB ASP 126 -11.238 10.364 -0.147 950 2HB ASP 126 2HB ASP 126 -10.772 11.930 -0.801 951 H ARG 127 H ARG 127 -8.025 8.909 -2.816 952 HA ARG 127 HA ARG 127 -8.662 6.340 -1.514 953 1HB ARG 127 1HB ARG 127 -9.347 6.969 -4.406 954 2HB ARG 127 2HB ARG 127 -9.310 5.342 -3.733 955 1HG ARG 127 1HG ARG 127 -10.894 6.562 -1.904 956 2HG ARG 127 2HG ARG 127 -11.303 7.505 -3.335 957 1HD ARG 127 1HD ARG 127 -12.035 5.584 -4.522 958 2HD ARG 127 2HD ARG 127 -11.261 4.487 -3.382 959 HE ARG 127 HE ARG 127 -13.049 5.766 -1.773 960 1HH1 ARG 127 1HH1 ARG 127 -13.406 4.267 -4.919 961 2HH1 ARG 127 2HH1 ARG 127 -15.068 3.883 -4.653 962 1HH2 ARG 127 1HH2 ARG 127 -15.197 5.237 -1.478 963 2HH2 ARG 127 2HH2 ARG 127 -16.072 4.421 -2.730 964 H VAL 128 H VAL 128 -7.023 4.742 -2.087 965 HA VAL 128 HA VAL 128 -4.877 5.741 -3.879 966 HB VAL 128 HB VAL 128 -4.421 6.421 -1.500 967 1HG1 VAL 128 1HG1 VAL 128 -5.169 3.756 -0.957 968 2HG1 VAL 128 2HG1 VAL 128 -3.441 3.844 -0.619 969 3HG1 VAL 128 3HG1 VAL 128 -4.555 4.947 0.186 970 1HG2 VAL 128 1HG2 VAL 128 -2.605 4.630 -3.082 971 2HG2 VAL 128 2HG2 VAL 128 -2.520 6.376 -2.849 972 3HG2 VAL 128 3HG2 VAL 128 -2.070 5.288 -1.535 973 H LYS 129 H LYS 129 -3.692 4.138 -4.899 974 HA LYS 129 HA LYS 129 -4.721 1.360 -4.561 975 1HB LYS 129 1HB LYS 129 -4.417 2.948 -6.836 976 2HB LYS 129 2HB LYS 129 -3.028 1.863 -6.900 977 1HG LYS 129 1HG LYS 129 -4.453 -0.081 -6.774 978 2HG LYS 129 2HG LYS 129 -5.871 0.919 -6.459 979 1HD LYS 129 1HD LYS 129 -6.090 1.544 -8.646 980 2HD LYS 129 2HD LYS 129 -4.347 1.570 -8.921 981 1HE LYS 129 1HE LYS 129 -4.330 -0.916 -8.915 982 2HE LYS 129 2HE LYS 129 -6.083 -0.910 -8.719 983 1HZ LYS 129 1HZ LYS 129 -6.030 0.577 -10.800 984 2HZ LYS 129 2HZ LYS 129 -4.472 -0.058 -11.034 985 3HZ LYS 129 3HZ LYS 129 -5.817 -1.094 -10.989 986 H ILE 130 H ILE 130 -3.305 -0.243 -3.933 987 HA ILE 130 HA ILE 130 -0.394 0.448 -3.832 988 HB ILE 130 HB ILE 130 -2.028 -1.001 -1.715 989 1HG1 ILE 130 1HG1 ILE 130 -2.332 1.457 -1.738 990 2HG1 ILE 130 2HG1 ILE 130 -1.452 0.937 -0.304 991 1HG2 ILE 130 1HG2 ILE 130 0.943 -0.390 -1.890 992 2HG2 ILE 130 2HG2 ILE 130 0.132 -0.938 -0.422 993 3HG2 ILE 130 3HG2 ILE 130 0.192 -1.984 -1.840 994 1HD1 ILE 130 1HD1 ILE 130 0.694 1.497 -1.491 995 2HD1 ILE 130 2HD1 ILE 130 -0.263 2.160 -2.814 996 3HD1 ILE 130 3HD1 ILE 130 -0.341 2.897 -1.216 997 H VAL 131 H VAL 131 0.465 -0.897 -5.397 998 HA VAL 131 HA VAL 131 -0.495 -3.708 -5.451 999 HB VAL 131 HB VAL 131 0.889 -2.122 -7.627 1000 1HG1 VAL 131 1HG1 VAL 131 -0.342 -4.882 -7.508 1001 2HG1 VAL 131 2HG1 VAL 131 0.097 -4.070 -9.011 1002 3HG1 VAL 131 3HG1 VAL 131 1.345 -4.481 -7.834 1003 1HG2 VAL 131 1HG2 VAL 131 -1.988 -2.728 -6.982 1004 2HG2 VAL 131 2HG2 VAL 131 -1.266 -1.198 -7.480 1005 3HG2 VAL 131 3HG2 VAL 131 -1.485 -2.495 -8.655 1006 H CYS 132 H CYS 132 0.870 -4.916 -4.275 1007 HA CYS 132 HA CYS 132 3.718 -4.260 -4.045 1008 1HB CYS 132 1HB CYS 132 3.185 -5.225 -2.043 1009 2HB CYS 132 2HB CYS 132 1.772 -6.023 -2.698 1010 HG CYS 132 HG CYS 132 3.639 -7.855 -3.649 1011 H SER 133 H SER 133 5.422 -5.725 -4.859 1012 HA SER 133 HA SER 133 4.638 -7.777 -6.816 1013 1HB SER 133 1HB SER 133 5.137 -5.058 -7.612 1014 2HB SER 133 2HB SER 133 6.405 -6.082 -8.274 1015 HG SER 133 HG SER 133 3.975 -5.785 -9.173 1016 H GLN 134 H GLN 134 6.051 -9.375 -6.534 1017 HA GLN 134 HA GLN 134 8.813 -9.292 -6.875 1018 1HB GLN 134 1HB GLN 134 8.885 -7.921 -4.774 1019 2HB GLN 134 2HB GLN 134 8.132 -9.257 -3.913 1020 1HG GLN 134 1HG GLN 134 10.445 -9.542 -3.511 1021 2HG GLN 134 2HG GLN 134 10.095 -10.682 -4.810 1022 1HE2 GLN 134 2HE2 GLN 134 12.428 -8.561 -3.945 1023 2HE2 GLN 134 1HE2 GLN 134 12.934 -8.018 -5.471 1024 HA PRO 135 HA PRO 135 7.577 -13.618 -6.522 1025 1HB PRO 135 1HB PRO 135 9.845 -14.690 -7.599 1026 2HB PRO 135 2HB PRO 135 8.594 -13.906 -8.576 1027 1HG PRO 135 1HG PRO 135 11.298 -12.966 -7.902 1028 2HG PRO 135 2HG PRO 135 10.239 -12.491 -9.237 1029 1HD PRO 135 1HD PRO 135 10.720 -11.060 -6.800 1030 2HD PRO 135 2HD PRO 135 9.598 -10.628 -8.109 1031 H TYR 136 H TYR 136 7.630 -14.037 -4.261 1032 HA TYR 136 HA TYR 136 10.213 -15.065 -3.223 1033 1HB TYR 136 1HB TYR 136 9.882 -13.750 -1.108 1034 2HB TYR 136 2HB TYR 136 10.253 -12.756 -2.516 1035 HD1 TYR 136 HD1 TYR 136 7.581 -13.839 -0.199 1036 HD2 TYR 136 HD2 TYR 136 8.592 -11.271 -3.490 1037 HE1 TYR 136 HE1 TYR 136 5.471 -12.584 0.131 1038 HE2 TYR 136 HE2 TYR 136 6.475 -10.020 -3.160 1039 HH TYR 136 HH TYR 136 4.290 -10.336 -2.173 1040 H SER 137 H SER 137 7.200 -15.948 -3.796 1041 HA SER 137 HA SER 137 7.102 -17.627 -1.353 1042 1HB SER 137 1HB SER 137 5.345 -15.426 -1.795 1043 2HB SER 137 2HB SER 137 4.403 -16.899 -1.979 1044 HG SER 137 HG SER 137 4.622 -16.081 0.216 1045 H LYS 138 H LYS 138 4.895 -19.058 -1.748 1046 HA LYS 138 HA LYS 138 4.260 -19.837 -4.420 1047 1HB LYS 138 1HB LYS 138 6.667 -20.558 -4.387 1048 2HB LYS 138 2HB LYS 138 6.279 -21.642 -3.050 1049 1HG LYS 138 1HG LYS 138 4.718 -22.882 -4.426 1050 2HG LYS 138 2HG LYS 138 4.896 -21.724 -5.745 1051 1HD LYS 138 1HD LYS 138 7.058 -22.448 -6.266 1052 2HD LYS 138 2HD LYS 138 7.316 -23.143 -4.665 1053 1HE LYS 138 1HE LYS 138 6.982 -24.961 -6.235 1054 2HE LYS 138 2HE LYS 138 5.560 -24.858 -5.197 1055 1HZ LYS 138 1HZ LYS 138 5.796 -23.654 -7.901 1056 2HZ LYS 138 2HZ LYS 138 4.969 -25.092 -7.538 1057 3HZ LYS 138 3HZ LYS 138 4.420 -23.617 -6.906 1058 H ASP 139 H ASP 139 4.751 -20.910 -1.074 1059 HA ASP 139 HA ASP 139 2.196 -22.422 -1.263 1060 1HB ASP 139 1HB ASP 139 3.091 -23.691 0.720 1061 2HB ASP 139 2HB ASP 139 3.997 -23.940 -0.767 1062 H SER 140 H SER 140 4.051 -20.112 0.577 1063 HA SER 140 HA SER 140 1.767 -19.729 2.432 1064 1HB SER 140 1HB SER 140 3.685 -18.257 3.544 1065 2HB SER 140 2HB SER 140 3.593 -19.991 3.808 1066 HG SER 140 HG SER 140 5.111 -18.687 1.791 1067 HA PRO 141 HA PRO 141 1.128 -15.748 0.436 1068 1HB PRO 141 1HB PRO 141 -0.727 -14.779 2.182 1069 2HB PRO 141 2HB PRO 141 -1.082 -16.045 0.999 1070 1HG PRO 141 1HG PRO 141 -0.841 -16.240 3.915 1071 2HG PRO 141 2HG PRO 141 -1.625 -17.340 2.774 1072 1HD PRO 141 1HD PRO 141 0.961 -17.631 4.015 1073 2HD PRO 141 2HD PRO 141 0.163 -18.729 2.869 1074 H PHE 142 H PHE 142 1.102 -13.352 1.104 1075 HA PHE 142 HA PHE 142 2.127 -12.419 3.590 1076 1HB PHE 142 1HB PHE 142 4.110 -13.555 1.795 1077 2HB PHE 142 2HB PHE 142 4.414 -11.833 2.019 1078 HD1 PHE 142 HD1 PHE 142 4.286 -10.957 4.496 1079 HD2 PHE 142 HD2 PHE 142 4.861 -15.070 3.407 1080 HE1 PHE 142 HE1 PHE 142 5.240 -11.418 6.739 1081 HE2 PHE 142 HE2 PHE 142 5.816 -15.532 5.649 1082 HZ PHE 142 HZ PHE 142 6.005 -13.705 7.316 1083 H GLY 143 H GLY 143 3.533 -10.143 2.753 1084 1HA GLY 143 1HA GLY 143 2.893 -8.774 0.476 1085 2HA GLY 143 2HA GLY 143 1.389 -8.679 1.389 1086 H LEU 144 H LEU 144 1.200 -7.100 2.893 1087 HA LEU 144 HA LEU 144 3.685 -5.585 3.598 1088 1HB LEU 144 1HB LEU 144 1.026 -4.711 2.637 1089 2HB LEU 144 2HB LEU 144 1.682 -3.764 3.968 1090 HG LEU 144 HG LEU 144 3.784 -3.463 2.689 1091 1HD1 LEU 144 1HD1 LEU 144 2.316 -5.250 0.793 1092 2HD1 LEU 144 2HD1 LEU 144 3.351 -3.996 0.109 1093 3HD1 LEU 144 3HD1 LEU 144 4.035 -5.211 1.191 1094 1HD2 LEU 144 1HD2 LEU 144 1.163 -2.624 1.443 1095 2HD2 LEU 144 2HD2 LEU 144 2.231 -1.676 2.476 1096 3HD2 LEU 144 3HD2 LEU 144 2.712 -2.052 0.821 1097 H SER 145 H SER 145 3.747 -4.612 5.693 1098 HA SER 145 HA SER 145 2.338 -6.193 7.746 1099 1HB SER 145 1HB SER 145 4.578 -4.166 7.836 1100 2HB SER 145 2HB SER 145 3.818 -4.790 9.298 1101 HG SER 145 HG SER 145 5.517 -6.014 7.490 1102 H PHE 146 H PHE 146 2.319 -2.987 6.336 1103 HA PHE 146 HA PHE 146 -0.258 -2.342 7.388 1104 1HB PHE 146 1HB PHE 146 0.332 -0.598 9.014 1105 2HB PHE 146 2HB PHE 146 1.020 -2.137 9.524 1106 HD1 PHE 146 HD1 PHE 146 1.758 1.149 8.006 1107 HD2 PHE 146 HD2 PHE 146 3.418 -2.503 9.539 1108 HE1 PHE 146 HE1 PHE 146 4.015 2.166 7.961 1109 HE2 PHE 146 HE2 PHE 146 5.682 -1.492 9.492 1110 HZ PHE 146 HZ PHE 146 5.985 0.833 8.695 1111 H VAL 147 H VAL 147 -0.728 0.089 6.966 1112 HA VAL 147 HA VAL 147 1.106 1.310 4.997 1113 HB VAL 147 HB VAL 147 -0.709 1.604 3.337 1114 1HG1 VAL 147 1HG1 VAL 147 0.898 -0.443 3.477 1115 2HG1 VAL 147 2HG1 VAL 147 -0.543 -1.334 3.966 1116 3HG1 VAL 147 3HG1 VAL 147 -0.491 -0.536 2.396 1117 1HG2 VAL 147 1HG2 VAL 147 -2.265 0.373 5.529 1118 2HG2 VAL 147 2HG2 VAL 147 -2.805 1.427 4.222 1119 3HG2 VAL 147 3HG2 VAL 147 -2.601 -0.301 3.934 1120 H ARG 148 H ARG 148 0.935 3.541 4.957 1121 HA ARG 148 HA ARG 148 -1.313 4.880 6.329 1122 1HB ARG 148 1HB ARG 148 1.544 5.385 7.198 1123 2HB ARG 148 2HB ARG 148 0.078 6.003 7.942 1124 1HG ARG 148 1HG ARG 148 -0.560 3.589 8.415 1125 2HG ARG 148 2HG ARG 148 1.077 3.153 7.925 1126 1HD ARG 148 1HD ARG 148 0.827 5.359 9.902 1127 2HD ARG 148 2HD ARG 148 0.436 3.738 10.473 1128 HE ARG 148 HE ARG 148 2.844 3.415 9.137 1129 1HH1 ARG 148 1HH1 ARG 148 1.708 5.456 11.741 1130 2HH1 ARG 148 2HH1 ARG 148 3.265 5.541 12.487 1131 1HH2 ARG 148 1HH2 ARG 148 4.840 3.553 10.136 1132 2HH2 ARG 148 2HH2 ARG 148 5.021 4.476 11.590 1133 H PHE 149 H PHE 149 -1.075 7.301 6.105 1134 HA PHE 149 HA PHE 149 0.703 8.164 3.880 1135 1HB PHE 149 1HB PHE 149 -2.303 8.605 3.963 1136 2HB PHE 149 2HB PHE 149 -1.206 9.333 2.791 1137 HD1 PHE 149 HD1 PHE 149 0.454 7.530 1.647 1138 HD2 PHE 149 HD2 PHE 149 -3.418 6.672 3.294 1139 HE1 PHE 149 HE1 PHE 149 0.301 5.497 0.233 1140 HE2 PHE 149 HE2 PHE 149 -3.568 4.641 1.877 1141 HZ PHE 149 HZ PHE 149 -1.709 4.055 0.350 1142 H HIS 150 H HIS 150 0.926 10.579 3.848 1143 HA HIS 150 HA HIS 150 -0.284 12.045 6.088 1144 1HB HIS 150 1HB HIS 150 2.348 12.763 6.566 1145 2HB HIS 150 2HB HIS 150 1.376 11.702 7.573 1146 HD1 HIS 150 HD1 HIS 150 4.483 11.799 5.760 1147 HD2 HIS 150 HD2 HIS 150 1.733 8.816 6.705 1148 HE1 HIS 150 HE1 HIS 150 5.685 9.591 5.454 1149 H SER 151 H SER 151 -0.638 14.058 5.505 1150 HA SER 151 HA SER 151 0.227 15.062 2.938 1151 1HB SER 151 1HB SER 151 -1.951 15.703 3.647 1152 2HB SER 151 2HB SER 151 -1.363 16.258 5.210 1153 HG SER 151 HG SER 151 -1.769 17.787 3.266 Start of MODEL 4 1 H MET 1 H MET 1 -6.055 17.386 12.654 2 HA MET 1 HA MET 1 -3.906 17.023 13.073 3 1HB MET 1 1HB MET 1 -5.007 14.416 12.077 4 2HB MET 1 2HB MET 1 -3.296 14.515 12.493 5 1HG MET 1 1HG MET 1 -4.321 13.870 14.518 6 2HG MET 1 2HG MET 1 -4.108 15.611 14.697 7 1HE MET 1 1HE MET 1 -6.349 12.682 14.813 8 2HE MET 1 2HE MET 1 -6.129 13.630 16.281 9 3HE MET 1 3HE MET 1 -7.738 13.460 15.585 10 HA PRO 2 HA PRO 2 -1.296 17.444 9.481 11 1HB PRO 2 1HB PRO 2 1.132 16.915 10.608 12 2HB PRO 2 2HB PRO 2 0.211 18.389 10.940 13 1HG PRO 2 1HG PRO 2 0.742 16.099 12.692 14 2HG PRO 2 2HG PRO 2 0.223 17.737 13.109 15 1HD PRO 2 1HD PRO 2 -1.396 15.353 12.933 16 2HD PRO 2 2HD PRO 2 -1.907 16.994 13.382 17 H GLU 3 H GLU 3 -2.536 14.903 9.403 18 HA GLU 3 HA GLU 3 -0.515 13.356 7.961 19 1HB GLU 3 1HB GLU 3 -0.879 11.289 9.330 20 2HB GLU 3 2HB GLU 3 -0.058 12.568 10.224 21 1HG GLU 3 1HG GLU 3 -2.231 13.254 11.208 22 2HG GLU 3 2HG GLU 3 -3.019 11.927 10.356 23 H ILE 4 H ILE 4 -1.801 10.998 7.599 24 HA ILE 4 HA ILE 4 -4.631 11.633 6.932 25 HB ILE 4 HB ILE 4 -2.538 10.580 5.001 26 1HG1 ILE 4 1HG1 ILE 4 -4.335 13.020 4.888 27 2HG1 ILE 4 2HG1 ILE 4 -2.644 13.050 5.385 28 1HG2 ILE 4 1HG2 ILE 4 -5.552 10.708 4.797 29 2HG2 ILE 4 2HG2 ILE 4 -4.518 10.670 3.368 30 3HG2 ILE 4 3HG2 ILE 4 -4.499 9.323 4.507 31 1HD1 ILE 4 1HD1 ILE 4 -2.405 11.727 3.036 32 2HD1 ILE 4 2HD1 ILE 4 -3.816 12.723 2.677 33 3HD1 ILE 4 3HD1 ILE 4 -2.300 13.483 3.165 34 H ARG 5 H ARG 5 -5.935 9.972 7.535 35 HA ARG 5 HA ARG 5 -4.644 7.351 8.166 36 1HB ARG 5 1HB ARG 5 -6.059 8.932 9.853 37 2HB ARG 5 2HB ARG 5 -7.365 7.949 9.195 38 1HG ARG 5 1HG ARG 5 -6.752 6.444 10.785 39 2HG ARG 5 2HG ARG 5 -5.446 6.046 9.671 40 1HD ARG 5 1HD ARG 5 -3.939 6.746 11.186 41 2HD ARG 5 2HD ARG 5 -4.652 8.358 11.163 42 HE ARG 5 HE ARG 5 -6.275 6.666 12.790 43 1HH1 ARG 5 1HH1 ARG 5 -3.125 8.185 12.769 44 2HH1 ARG 5 2HH1 ARG 5 -3.046 8.276 14.493 45 1HH2 ARG 5 1HH2 ARG 5 -6.131 6.803 15.019 46 2HH2 ARG 5 2HH2 ARG 5 -4.728 7.503 15.755 47 H LEU 6 H LEU 6 -6.203 5.451 7.926 48 HA LEU 6 HA LEU 6 -7.592 5.690 5.304 49 1HB LEU 6 1HB LEU 6 -5.906 3.696 6.573 50 2HB LEU 6 2HB LEU 6 -7.435 2.980 6.077 51 HG LEU 6 HG LEU 6 -7.116 3.766 3.792 52 1HD1 LEU 6 1HD1 LEU 6 -4.639 5.084 4.942 53 2HD1 LEU 6 2HD1 LEU 6 -4.883 4.839 3.213 54 3HD1 LEU 6 3HD1 LEU 6 -5.987 5.870 4.121 55 1HD2 LEU 6 1HD2 LEU 6 -4.673 2.437 4.990 56 2HD2 LEU 6 2HD2 LEU 6 -6.105 1.633 4.348 57 3HD2 LEU 6 3HD2 LEU 6 -5.018 2.501 3.262 58 H ARG 7 H ARG 7 -9.676 4.629 5.056 59 HA ARG 7 HA ARG 7 -11.216 4.510 7.614 60 1HB ARG 7 1HB ARG 7 -11.823 6.208 5.745 61 2HB ARG 7 2HB ARG 7 -12.441 4.804 4.876 62 1HG ARG 7 1HG ARG 7 -14.322 5.604 6.061 63 2HG ARG 7 2HG ARG 7 -13.732 4.270 7.053 64 1HD ARG 7 1HD ARG 7 -12.268 6.296 8.096 65 2HD ARG 7 2HD ARG 7 -13.708 7.187 7.601 66 HE ARG 7 HE ARG 7 -13.548 5.334 9.811 67 1HH1 ARG 7 1HH1 ARG 7 -15.662 6.509 7.285 68 2HH1 ARG 7 2HH1 ARG 7 -17.097 6.131 8.172 69 1HH2 ARG 7 1HH2 ARG 7 -15.432 4.858 10.922 70 2HH2 ARG 7 2HH2 ARG 7 -16.972 5.204 10.207 71 H HIS 8 H HIS 8 -11.065 3.040 4.377 72 HA HIS 8 HA HIS 8 -11.285 0.358 5.497 73 1HB HIS 8 1HB HIS 8 -13.377 -0.202 4.247 74 2HB HIS 8 2HB HIS 8 -13.647 0.961 5.543 75 HD1 HIS 8 HD1 HIS 8 -14.942 2.973 4.860 76 HD2 HIS 8 HD2 HIS 8 -12.923 1.292 1.624 77 HE1 HIS 8 HE1 HIS 8 -15.583 4.340 2.827 78 H VAL 9 H VAL 9 -11.314 -1.284 3.623 79 HA VAL 9 HA VAL 9 -9.424 -0.335 1.584 80 HB VAL 9 HB VAL 9 -9.051 -2.512 2.675 81 1HG1 VAL 9 1HG1 VAL 9 -11.791 -2.828 2.463 82 2HG1 VAL 9 2HG1 VAL 9 -11.177 -3.939 1.241 83 3HG1 VAL 9 3HG1 VAL 9 -10.649 -4.093 2.915 84 1HG2 VAL 9 1HG2 VAL 9 -8.394 -2.054 0.249 85 2HG2 VAL 9 2HG2 VAL 9 -8.515 -3.754 0.702 86 3HG2 VAL 9 3HG2 VAL 9 -9.814 -2.991 -0.214 87 H VAL 10 H VAL 10 -10.633 1.001 0.208 88 HA VAL 10 HA VAL 10 -13.223 0.537 -0.780 89 HB VAL 10 HB VAL 10 -12.310 2.680 -1.214 90 1HG1 VAL 10 1HG1 VAL 10 -9.871 1.373 -1.534 91 2HG1 VAL 10 2HG1 VAL 10 -10.203 2.035 -3.130 92 3HG1 VAL 10 3HG1 VAL 10 -10.159 3.097 -1.724 93 1HG2 VAL 10 1HG2 VAL 10 -13.722 1.842 -3.071 94 2HG2 VAL 10 2HG2 VAL 10 -12.482 2.947 -3.658 95 3HG2 VAL 10 3HG2 VAL 10 -12.283 1.213 -3.874 96 H SER 11 H SER 11 -10.192 -0.277 -2.571 97 HA SER 11 HA SER 11 -11.790 -2.416 -3.898 98 1HB SER 11 1HB SER 11 -10.329 -0.257 -5.054 99 2HB SER 11 2HB SER 11 -9.485 -1.748 -5.463 100 HG SER 11 HG SER 11 -11.863 -0.792 -6.350 101 H CYS 12 H CYS 12 -10.629 -4.412 -4.331 102 HA CYS 12 HA CYS 12 -8.001 -4.694 -2.959 103 1HB CYS 12 1HB CYS 12 -8.799 -6.830 -1.932 104 2HB CYS 12 2HB CYS 12 -9.650 -5.416 -1.317 105 HG CYS 12 HG CYS 12 -10.963 -7.056 -3.622 106 H SER 13 H SER 13 -6.591 -5.948 -4.119 107 HA SER 13 HA SER 13 -7.706 -7.710 -6.250 108 1HB SER 13 1HB SER 13 -5.771 -5.449 -6.513 109 2HB SER 13 2HB SER 13 -5.510 -6.877 -7.510 110 HG SER 13 HG SER 13 -6.904 -5.244 -8.447 111 H SER 14 H SER 14 -6.851 -8.552 -3.733 112 HA SER 14 HA SER 14 -5.448 -10.812 -3.962 113 1HB SER 14 1HB SER 14 -3.500 -8.555 -4.122 114 2HB SER 14 2HB SER 14 -3.060 -9.971 -3.176 115 HG SER 14 HG SER 14 -3.414 -9.670 -5.906 116 H GLN 15 H GLN 15 -7.117 -10.540 -2.133 117 HA GLN 15 HA GLN 15 -5.639 -9.924 0.389 118 1HB GLN 15 1HB GLN 15 -7.702 -8.965 1.309 119 2HB GLN 15 2HB GLN 15 -7.218 -8.103 -0.143 120 1HG GLN 15 1HG GLN 15 -9.296 -8.479 -0.936 121 2HG GLN 15 2HG GLN 15 -8.842 -10.172 -1.094 122 1HE2 GLN 15 2HE2 GLN 15 -8.639 -10.522 1.922 123 2HE2 GLN 15 1HE2 GLN 15 -10.247 -10.561 2.455 124 H ASP 16 H ASP 16 -5.760 -11.522 1.909 125 HA ASP 16 HA ASP 16 -7.180 -14.001 1.281 126 1HB ASP 16 1HB ASP 16 -4.962 -13.309 2.854 127 2HB ASP 16 2HB ASP 16 -6.185 -13.793 4.022 128 H SER 17 H SER 17 -8.893 -14.904 2.596 129 HA SER 17 HA SER 17 -10.912 -13.039 3.382 130 1HB SER 17 1HB SER 17 -11.248 -15.473 2.706 131 2HB SER 17 2HB SER 17 -10.706 -15.911 4.323 132 HG SER 17 HG SER 17 -12.403 -14.552 5.122 133 H THR 18 H THR 18 -9.098 -15.302 5.518 134 HA THR 18 HA THR 18 -9.887 -14.006 7.943 135 HB THR 18 HB THR 18 -7.427 -15.132 8.534 136 HG1 THR 18 HG1 THR 18 -6.976 -16.631 7.128 137 1HG2 THR 18 1HG2 THR 18 -9.678 -15.545 9.580 138 2HG2 THR 18 2HG2 THR 18 -10.026 -16.659 8.259 139 3HG2 THR 18 3HG2 THR 18 -8.703 -16.999 9.375 140 H HIS 19 H HIS 19 -6.698 -13.925 6.331 141 HA HIS 19 HA HIS 19 -6.114 -11.348 7.681 142 1HB HIS 19 1HB HIS 19 -4.478 -13.359 6.144 143 2HB HIS 19 2HB HIS 19 -3.874 -11.723 6.396 144 HD1 HIS 19 HD1 HIS 19 -3.239 -11.031 8.804 145 HD2 HIS 19 HD2 HIS 19 -4.670 -14.937 8.523 146 HE1 HIS 19 HE1 HIS 19 -2.738 -12.140 11.025 147 H CYS 20 H CYS 20 -7.664 -10.102 6.449 148 HA CYS 20 HA CYS 20 -7.167 -9.905 3.532 149 1HB CYS 20 1HB CYS 20 -9.277 -8.613 3.490 150 2HB CYS 20 2HB CYS 20 -9.496 -10.179 4.261 151 HG CYS 20 HG CYS 20 -8.874 -8.018 6.311 152 H ALA 21 H ALA 21 -7.226 -7.642 2.617 153 HA ALA 21 HA ALA 21 -5.102 -6.073 3.670 154 1HB ALA 21 1HB ALA 21 -7.091 -5.841 1.485 155 2HB ALA 21 2HB ALA 21 -6.402 -4.321 2.054 156 3HB ALA 21 3HB ALA 21 -5.345 -5.596 1.450 157 H GLU 22 H GLU 22 -8.524 -6.073 4.371 158 HA GLU 22 HA GLU 22 -8.806 -3.416 5.367 159 1HB GLU 22 1HB GLU 22 -10.495 -5.537 5.096 160 2HB GLU 22 2HB GLU 22 -10.237 -5.554 6.841 161 1HG GLU 22 1HG GLU 22 -10.680 -2.988 6.699 162 2HG GLU 22 2HG GLU 22 -11.399 -3.362 5.132 163 H ASN 23 H ASN 23 -7.040 -6.128 6.631 164 HA ASN 23 HA ASN 23 -7.078 -5.421 9.418 165 1HB ASN 23 1HB ASN 23 -5.206 -7.003 7.677 166 2HB ASN 23 2HB ASN 23 -4.811 -6.684 9.366 167 1HD2 ASN 23 2HD2 ASN 23 -6.353 -8.899 7.369 168 2HD2 ASN 23 1HD2 ASN 23 -7.367 -9.631 8.517 169 H LEU 24 H LEU 24 -5.596 -4.002 6.671 170 HA LEU 24 HA LEU 24 -3.318 -2.770 7.873 171 1HB LEU 24 1HB LEU 24 -4.995 -1.771 5.548 172 2HB LEU 24 2HB LEU 24 -3.324 -1.332 5.905 173 HG LEU 24 HG LEU 24 -4.030 -4.231 5.548 174 1HD1 LEU 24 1HD1 LEU 24 -4.919 -2.707 3.622 175 2HD1 LEU 24 2HD1 LEU 24 -3.215 -2.544 3.201 176 3HD1 LEU 24 3HD1 LEU 24 -3.970 -4.137 3.217 177 1HD2 LEU 24 1HD2 LEU 24 -1.641 -2.532 5.694 178 2HD2 LEU 24 2HD2 LEU 24 -1.812 -4.262 5.984 179 3HD2 LEU 24 3HD2 LEU 24 -1.607 -3.662 4.339 180 H LEU 25 H LEU 25 -6.752 -2.085 7.907 181 HA LEU 25 HA LEU 25 -6.743 0.655 8.614 182 1HB LEU 25 1HB LEU 25 -8.558 -1.684 9.066 183 2HB LEU 25 2HB LEU 25 -8.845 -0.228 10.001 184 HG LEU 25 HG LEU 25 -10.165 -0.289 7.889 185 1HD1 LEU 25 1HD1 LEU 25 -8.281 1.837 8.663 186 2HD1 LEU 25 2HD1 LEU 25 -8.872 1.965 7.008 187 3HD1 LEU 25 3HD1 LEU 25 -10.011 1.920 8.352 188 1HD2 LEU 25 1HD2 LEU 25 -8.411 -1.521 6.568 189 2HD2 LEU 25 2HD2 LEU 25 -9.055 -0.103 5.739 190 3HD2 LEU 25 3HD2 LEU 25 -7.472 -0.030 6.513 191 H LYS 26 H LYS 26 -5.775 -2.199 10.370 192 HA LYS 26 HA LYS 26 -5.449 -0.540 12.843 193 1HB LYS 26 1HB LYS 26 -5.572 -3.569 12.721 194 2HB LYS 26 2HB LYS 26 -5.640 -2.549 14.154 195 1HG LYS 26 1HG LYS 26 -7.892 -2.724 13.956 196 2HG LYS 26 2HG LYS 26 -7.725 -1.554 12.648 197 1HD LYS 26 1HD LYS 26 -8.785 -3.189 11.445 198 2HD LYS 26 2HD LYS 26 -7.147 -3.826 11.297 199 1HE LYS 26 1HE LYS 26 -7.768 -4.954 13.634 200 2HE LYS 26 2HE LYS 26 -9.406 -4.780 13.004 201 1HZ LYS 26 1HZ LYS 26 -7.261 -5.933 11.341 202 2HZ LYS 26 2HZ LYS 26 -8.111 -6.897 12.450 203 3HZ LYS 26 3HZ LYS 26 -8.939 -6.117 11.189 204 H ALA 27 H ALA 27 -3.487 0.063 11.374 205 HA ALA 27 HA ALA 27 -1.345 -1.657 10.802 206 1HB ALA 27 1HB ALA 27 -1.476 0.744 10.145 207 2HB ALA 27 2HB ALA 27 -1.117 1.193 11.811 208 3HB ALA 27 3HB ALA 27 0.081 0.320 10.857 209 H ASP 28 H ASP 28 -2.401 -0.464 13.916 210 HA ASP 28 HA ASP 28 -0.033 -1.800 15.169 211 1HB ASP 28 1HB ASP 28 -1.495 0.728 15.862 212 2HB ASP 28 2HB ASP 28 -0.736 -0.208 17.151 213 H THR 29 H THR 29 -1.294 -3.804 15.147 214 HA THR 29 HA THR 29 -2.926 -4.076 17.565 215 HB THR 29 HB THR 29 -4.721 -5.304 16.047 216 HG1 THR 29 HG1 THR 29 -4.542 -4.856 14.023 217 1HG2 THR 29 1HG2 THR 29 -4.937 -3.231 17.553 218 2HG2 THR 29 2HG2 THR 29 -4.723 -2.286 16.079 219 3HG2 THR 29 3HG2 THR 29 -6.096 -3.381 16.232 220 H TYR 30 H TYR 30 -3.050 -6.202 14.715 221 HA TYR 30 HA TYR 30 -0.879 -7.906 15.454 222 1HB TYR 30 1HB TYR 30 -2.185 -9.797 16.428 223 2HB TYR 30 2HB TYR 30 -2.197 -8.363 17.457 224 HD1 TYR 30 HD1 TYR 30 -4.205 -6.938 17.619 225 HD2 TYR 30 HD2 TYR 30 -4.193 -10.550 15.295 226 HE1 TYR 30 HE1 TYR 30 -6.683 -6.889 17.531 227 HE2 TYR 30 HE2 TYR 30 -6.671 -10.501 15.207 228 HH TYR 30 HH TYR 30 -8.484 -8.835 15.409 229 H ARG 31 H ARG 31 -2.206 -6.844 13.063 230 HA ARG 31 HA ARG 31 -2.264 -9.314 11.508 231 1HB ARG 31 1HB ARG 31 -4.766 -7.814 12.168 232 2HB ARG 31 2HB ARG 31 -4.595 -8.464 10.537 233 1HG ARG 31 1HG ARG 31 -3.873 -10.660 11.767 234 2HG ARG 31 2HG ARG 31 -4.690 -9.939 13.155 235 1HD ARG 31 1HD ARG 31 -6.768 -9.780 11.943 236 2HD ARG 31 2HD ARG 31 -5.984 -10.241 10.432 237 HE ARG 31 HE ARG 31 -5.481 -12.382 12.113 238 1HH1 ARG 31 1HH1 ARG 31 -8.361 -10.686 11.084 239 2HH1 ARG 31 2HH1 ARG 31 -9.360 -12.090 11.230 240 1HH2 ARG 31 1HH2 ARG 31 -6.810 -14.173 12.286 241 2HH2 ARG 31 2HH2 ARG 31 -8.494 -14.043 11.903 242 H LYS 32 H LYS 32 -1.775 -8.897 9.351 243 HA LYS 32 HA LYS 32 -1.641 -6.018 8.538 244 1HB LYS 32 1HB LYS 32 0.369 -8.059 7.584 245 2HB LYS 32 2HB LYS 32 0.493 -6.305 7.574 246 1HG LYS 32 1HG LYS 32 1.588 -6.388 9.536 247 2HG LYS 32 2HG LYS 32 0.149 -7.063 10.291 248 1HD LYS 32 1HD LYS 32 1.198 -9.247 8.966 249 2HD LYS 32 2HD LYS 32 2.649 -8.389 9.482 250 1HE LYS 32 1HE LYS 32 0.374 -8.880 11.400 251 2HE LYS 32 2HE LYS 32 1.614 -10.103 11.129 252 1HZ LYS 32 1HZ LYS 32 2.228 -7.296 11.860 253 2HZ LYS 32 2HZ LYS 32 2.058 -8.541 13.004 254 3HZ LYS 32 3HZ LYS 32 3.293 -8.617 11.840 255 H TRP 33 H TRP 33 -0.902 -6.349 5.890 256 HA TRP 33 HA TRP 33 -3.349 -7.497 4.749 257 1HB TRP 33 1HB TRP 33 -2.356 -5.410 3.785 258 2HB TRP 33 2HB TRP 33 -0.924 -6.314 3.365 259 HD1 TRP 33 HD1 TRP 33 -4.419 -7.780 2.894 260 HE1 TRP 33 HE1 TRP 33 -4.847 -8.112 0.357 261 HE3 TRP 33 HE3 TRP 33 -0.267 -5.517 1.044 262 HZ2 TRP 33 HZ2 TRP 33 -3.556 -7.460 -2.129 263 HZ3 TRP 33 HZ3 TRP 33 0.127 -5.396 -1.408 264 HH2 TRP 33 HH2 TRP 33 -1.513 -6.357 -2.981 265 H ARG 34 H ARG 34 -3.485 -9.443 3.694 266 HA ARG 34 HA ARG 34 -0.992 -10.857 3.009 267 1HB ARG 34 1HB ARG 34 -3.184 -12.241 4.562 268 2HB ARG 34 2HB ARG 34 -1.627 -12.911 4.096 269 1HG ARG 34 1HG ARG 34 -0.564 -11.014 5.451 270 2HG ARG 34 2HG ARG 34 -2.171 -10.735 6.122 271 1HD ARG 34 1HD ARG 34 -1.538 -12.277 7.672 272 2HD ARG 34 2HD ARG 34 -1.944 -13.446 6.417 273 HE ARG 34 HE ARG 34 0.793 -12.483 6.196 274 1HH1 ARG 34 1HH1 ARG 34 -1.312 -14.776 7.791 275 2HH1 ARG 34 2HH1 ARG 34 -0.024 -15.882 8.116 276 1HH2 ARG 34 1HH2 ARG 34 2.429 -13.943 6.638 277 2HH2 ARG 34 2HH2 ARG 34 2.071 -15.419 7.473 278 H ALA 35 H ALA 35 -1.207 -11.635 0.986 279 HA ALA 35 HA ALA 35 -3.483 -11.224 -0.606 280 1HB ALA 35 1HB ALA 35 -1.007 -11.843 -1.239 281 2HB ALA 35 2HB ALA 35 -1.602 -13.502 -1.187 282 3HB ALA 35 3HB ALA 35 -2.319 -12.342 -2.305 283 H ALA 36 H ALA 36 -4.669 -12.997 -1.787 284 HA ALA 36 HA ALA 36 -5.749 -14.902 0.216 285 1HB ALA 36 1HB ALA 36 -6.915 -13.153 -1.685 286 2HB ALA 36 2HB ALA 36 -7.265 -14.792 -2.230 287 3HB ALA 36 3HB ALA 36 -7.744 -14.279 -0.612 288 H LYS 37 H LYS 37 -3.995 -14.765 -2.792 289 HA LYS 37 HA LYS 37 -4.450 -17.644 -3.311 290 1HB LYS 37 1HB LYS 37 -3.287 -17.209 -5.442 291 2HB LYS 37 2HB LYS 37 -4.585 -16.044 -5.206 292 1HG LYS 37 1HG LYS 37 -3.036 -14.338 -4.498 293 2HG LYS 37 2HG LYS 37 -1.703 -15.493 -4.452 294 1HD LYS 37 1HD LYS 37 -1.828 -15.802 -6.865 295 2HD LYS 37 2HD LYS 37 -3.250 -14.761 -6.954 296 1HE LYS 37 1HE LYS 37 -1.806 -12.926 -5.923 297 2HE LYS 37 2HE LYS 37 -0.421 -13.974 -6.230 298 1HZ LYS 37 1HZ LYS 37 -2.360 -13.168 -8.323 299 2HZ LYS 37 2HZ LYS 37 -0.909 -12.338 -8.022 300 3HZ LYS 37 3HZ LYS 37 -0.870 -13.952 -8.543 301 H ALA 38 H ALA 38 -1.764 -17.979 -4.527 302 HA ALA 38 HA ALA 38 0.073 -17.638 -2.230 303 1HB ALA 38 1HB ALA 38 -1.049 -20.230 -3.186 304 2HB ALA 38 2HB ALA 38 0.665 -20.200 -2.773 305 3HB ALA 38 3HB ALA 38 -0.542 -19.753 -1.566 306 H GLY 39 H GLY 39 2.237 -18.982 -3.032 307 1HA GLY 39 1HA GLY 39 3.834 -19.301 -4.767 308 2HA GLY 39 2HA GLY 39 2.735 -18.570 -5.918 309 H GLU 40 H GLU 40 2.531 -16.385 -3.603 310 HA GLU 40 HA GLU 40 3.379 -14.233 -3.412 311 1HB GLU 40 1HB GLU 40 5.618 -16.168 -3.041 312 2HB GLU 40 2HB GLU 40 5.955 -14.445 -3.029 313 1HG GLU 40 1HG GLU 40 4.565 -14.054 -1.186 314 2HG GLU 40 2HG GLU 40 3.679 -15.547 -1.414 315 H LYS 41 H LYS 41 2.975 -13.294 -5.459 316 HA LYS 41 HA LYS 41 5.392 -13.088 -7.195 317 1HB LYS 41 1HB LYS 41 3.064 -14.449 -7.927 318 2HB LYS 41 2HB LYS 41 2.877 -12.869 -8.683 319 1HG LYS 41 1HG LYS 41 4.063 -14.154 -10.284 320 2HG LYS 41 2HG LYS 41 5.302 -13.170 -9.504 321 1HD LYS 41 1HD LYS 41 6.034 -14.994 -8.145 322 2HD LYS 41 2HD LYS 41 4.621 -15.963 -8.565 323 1HE LYS 41 1HE LYS 41 5.384 -16.028 -10.924 324 2HE LYS 41 2HE LYS 41 6.819 -15.108 -10.472 325 1HZ LYS 41 1HZ LYS 41 7.121 -16.985 -8.749 326 2HZ LYS 41 2HZ LYS 41 6.088 -17.870 -9.763 327 3HZ LYS 41 3HZ LYS 41 7.558 -17.269 -10.366 328 H THR 42 H THR 42 2.100 -11.721 -7.265 329 HA THR 42 HA THR 42 3.102 -9.071 -6.454 330 HB THR 42 HB THR 42 2.425 -7.924 -8.473 331 HG1 THR 42 HG1 THR 42 0.810 -8.857 -9.430 332 1HG2 THR 42 1HG2 THR 42 4.677 -9.039 -8.489 333 2HG2 THR 42 2HG2 THR 42 3.945 -10.395 -9.344 334 3HG2 THR 42 3HG2 THR 42 3.992 -8.801 -10.096 335 H ILE 43 H ILE 43 1.428 -7.891 -5.512 336 HA ILE 43 HA ILE 43 -1.349 -8.932 -5.868 337 HB ILE 43 HB ILE 43 -1.654 -8.428 -3.371 338 1HG1 ILE 43 1HG1 ILE 43 1.361 -8.734 -3.378 339 2HG1 ILE 43 2HG1 ILE 43 0.513 -7.210 -3.101 340 1HG2 ILE 43 1HG2 ILE 43 -1.295 -10.704 -4.620 341 2HG2 ILE 43 2HG2 ILE 43 0.254 -10.690 -3.785 342 3HG2 ILE 43 3HG2 ILE 43 -1.242 -10.646 -2.861 343 1HD1 ILE 43 1HD1 ILE 43 -0.800 -8.701 -1.308 344 2HD1 ILE 43 2HD1 ILE 43 0.705 -9.619 -1.338 345 3HD1 ILE 43 3HD1 ILE 43 0.723 -7.910 -0.905 346 H SER 44 H SER 44 -3.017 -7.323 -5.615 347 HA SER 44 HA SER 44 -1.948 -4.542 -5.349 348 1HB SER 44 1HB SER 44 -3.910 -5.608 -7.364 349 2HB SER 44 2HB SER 44 -3.787 -3.894 -6.997 350 HG SER 44 HG SER 44 -2.260 -5.379 -8.590 351 H VAL 45 H VAL 45 -3.153 -3.160 -4.108 352 HA VAL 45 HA VAL 45 -5.848 -3.985 -3.217 353 HB VAL 45 HB VAL 45 -4.327 -5.052 -1.580 354 1HG1 VAL 45 1HG1 VAL 45 -2.482 -3.341 -1.875 355 2HG1 VAL 45 2HG1 VAL 45 -3.428 -2.254 -0.862 356 3HG1 VAL 45 3HG1 VAL 45 -2.831 -3.776 -0.205 357 1HG2 VAL 45 1HG2 VAL 45 -6.020 -2.716 -0.707 358 2HG2 VAL 45 2HG2 VAL 45 -6.380 -4.440 -0.606 359 3HG2 VAL 45 3HG2 VAL 45 -5.187 -3.722 0.477 360 H VAL 46 H VAL 46 -7.079 -2.189 -3.382 361 HA VAL 46 HA VAL 46 -5.745 0.467 -3.232 362 HB VAL 46 HB VAL 46 -8.592 -0.018 -4.113 363 1HG1 VAL 46 1HG1 VAL 46 -7.634 2.288 -3.610 364 2HG1 VAL 46 2HG1 VAL 46 -6.577 2.049 -5.001 365 3HG1 VAL 46 3HG1 VAL 46 -8.327 2.081 -5.219 366 1HG2 VAL 46 1HG2 VAL 46 -6.032 -0.507 -5.612 367 2HG2 VAL 46 2HG2 VAL 46 -7.537 -1.422 -5.660 368 3HG2 VAL 46 3HG2 VAL 46 -7.427 0.134 -6.482 369 H LEU 47 H LEU 47 -5.944 1.533 -1.341 370 HA LEU 47 HA LEU 47 -8.071 0.695 0.554 371 1HB LEU 47 1HB LEU 47 -5.804 2.609 1.126 372 2HB LEU 47 2HB LEU 47 -6.760 1.679 2.279 373 HG LEU 47 HG LEU 47 -5.719 -0.298 0.635 374 1HD1 LEU 47 1HD1 LEU 47 -3.921 2.071 0.666 375 2HD1 LEU 47 2HD1 LEU 47 -3.165 0.506 0.961 376 3HD1 LEU 47 3HD1 LEU 47 -4.067 0.782 -0.529 377 1HD2 LEU 47 1HD2 LEU 47 -5.854 0.013 3.224 378 2HD2 LEU 47 2HD2 LEU 47 -4.557 -0.981 2.562 379 3HD2 LEU 47 3HD2 LEU 47 -4.226 0.676 3.065 380 H GLN 48 H GLN 48 -9.034 2.524 1.889 381 HA GLN 48 HA GLN 48 -9.741 4.785 0.066 382 1HB GLN 48 1HB GLN 48 -11.624 3.289 0.669 383 2HB GLN 48 2HB GLN 48 -11.314 3.597 2.377 384 1HG GLN 48 1HG GLN 48 -13.140 5.032 1.595 385 2HG GLN 48 2HG GLN 48 -11.735 6.019 1.994 386 1HE2 GLN 48 2HE2 GLN 48 -12.777 7.628 0.444 387 2HE2 GLN 48 1HE2 GLN 48 -12.487 7.444 -1.218 388 H LEU 49 H LEU 49 -9.618 6.885 0.868 389 HA LEU 49 HA LEU 49 -8.140 7.228 3.413 390 1HB LEU 49 1HB LEU 49 -8.772 9.255 1.240 391 2HB LEU 49 2HB LEU 49 -7.677 9.488 2.604 392 HG LEU 49 HG LEU 49 -7.314 7.335 0.503 393 1HD1 LEU 49 1HD1 LEU 49 -7.102 9.613 -0.464 394 2HD1 LEU 49 2HD1 LEU 49 -5.915 10.014 0.777 395 3HD1 LEU 49 3HD1 LEU 49 -5.552 8.772 -0.422 396 1HD2 LEU 49 1HD2 LEU 49 -5.895 8.191 2.979 397 2HD2 LEU 49 2HD2 LEU 49 -6.026 6.588 2.256 398 3HD2 LEU 49 3HD2 LEU 49 -4.884 7.759 1.600 399 H GLU 50 H GLU 50 -9.145 8.173 5.131 400 HA GLU 50 HA GLU 50 -12.040 8.534 5.037 401 1HB GLU 50 1HB GLU 50 -11.772 9.088 7.464 402 2HB GLU 50 2HB GLU 50 -11.051 7.541 7.015 403 1HG GLU 50 1HG GLU 50 -8.874 8.349 7.192 404 2HG GLU 50 2HG GLU 50 -9.365 10.021 6.921 405 H LYS 51 H LYS 51 -10.644 10.468 3.374 406 HA LYS 51 HA LYS 51 -12.001 12.827 3.778 407 1HB LYS 51 1HB LYS 51 -10.207 14.338 4.736 408 2HB LYS 51 2HB LYS 51 -10.917 13.241 5.909 409 1HG LYS 51 1HG LYS 51 -9.017 11.668 5.544 410 2HG LYS 51 2HG LYS 51 -8.290 12.844 4.448 411 1HD LYS 51 1HD LYS 51 -8.725 14.443 6.578 412 2HD LYS 51 2HD LYS 51 -8.512 12.904 7.412 413 1HE LYS 51 1HE LYS 51 -6.458 12.819 5.599 414 2HE LYS 51 2HE LYS 51 -6.534 14.545 5.957 415 1HZ LYS 51 1HZ LYS 51 -6.529 13.938 8.346 416 2HZ LYS 51 2HZ LYS 51 -6.240 12.324 7.902 417 3HZ LYS 51 3HZ LYS 51 -5.097 13.522 7.532 418 H GLU 52 H GLU 52 -11.753 13.836 1.823 419 HA GLU 52 HA GLU 52 -9.657 12.971 0.004 420 1HB GLU 52 1HB GLU 52 -12.079 13.689 -0.582 421 2HB GLU 52 2HB GLU 52 -11.457 15.331 -0.444 422 1HG GLU 52 1HG GLU 52 -9.778 14.903 -2.147 423 2HG GLU 52 2HG GLU 52 -10.258 13.210 -2.237 424 H GLU 53 H GLU 53 -7.661 13.714 0.384 425 HA GLU 53 HA GLU 53 -7.229 16.635 0.474 426 1HB GLU 53 1HB GLU 53 -5.270 15.512 2.251 427 2HB GLU 53 2HB GLU 53 -6.466 16.751 2.590 428 1HG GLU 53 1HG GLU 53 -7.435 13.925 2.622 429 2HG GLU 53 2HG GLU 53 -6.364 14.420 3.925 430 H GLN 54 H GLN 54 -4.627 16.878 0.531 431 HA GLN 54 HA GLN 54 -3.747 15.456 -1.894 432 1HB GLN 54 1HB GLN 54 -2.369 17.615 -0.263 433 2HB GLN 54 2HB GLN 54 -1.832 17.011 -1.830 434 1HG GLN 54 1HG GLN 54 -3.677 17.933 -2.960 435 2HG GLN 54 2HG GLN 54 -4.607 18.105 -1.482 436 1HE2 GLN 54 2HE2 GLN 54 -1.189 19.088 -1.831 437 2HE2 GLN 54 1HE2 GLN 54 -1.480 20.747 -1.623 438 H ILE 55 H ILE 55 -1.079 15.147 -1.626 439 HA ILE 55 HA ILE 55 -0.621 13.600 0.877 440 HB ILE 55 HB ILE 55 -0.039 12.559 -1.917 441 1HG1 ILE 55 1HG1 ILE 55 -1.724 10.756 -0.761 442 2HG1 ILE 55 2HG1 ILE 55 -2.323 12.250 -0.043 443 1HG2 ILE 55 1HG2 ILE 55 1.579 11.881 -0.121 444 2HG2 ILE 55 2HG2 ILE 55 0.227 11.200 0.784 445 3HG2 ILE 55 3HG2 ILE 55 0.669 10.524 -0.784 446 1HD1 ILE 55 1HD1 ILE 55 -1.778 12.204 -2.987 447 2HD1 ILE 55 2HD1 ILE 55 -3.237 11.415 -2.389 448 3HD1 ILE 55 3HD1 ILE 55 -2.976 13.133 -2.085 449 H HIS 56 H HIS 56 1.248 14.264 1.756 450 HA HIS 56 HA HIS 56 3.298 15.543 -0.002 451 1HB HIS 56 1HB HIS 56 2.288 16.939 1.833 452 2HB HIS 56 2HB HIS 56 2.967 15.806 3.001 453 HD1 HIS 56 HD1 HIS 56 4.682 17.451 3.990 454 HD2 HIS 56 HD2 HIS 56 5.053 16.968 -0.131 455 HE1 HIS 56 HE1 HIS 56 6.864 18.556 3.336 456 H SER 57 H SER 57 2.710 13.110 2.460 457 HA SER 57 HA SER 57 5.284 11.824 1.765 458 1HB SER 57 1HB SER 57 4.565 12.913 4.469 459 2HB SER 57 2HB SER 57 5.504 11.427 4.369 460 HG SER 57 HG SER 57 7.109 12.772 4.128 461 H VAL 58 H VAL 58 5.255 9.561 2.302 462 HA VAL 58 HA VAL 58 2.598 8.495 3.146 463 HB VAL 58 HB VAL 58 4.194 7.764 0.671 464 1HG1 VAL 58 1HG1 VAL 58 1.949 6.352 2.072 465 2HG1 VAL 58 2HG1 VAL 58 2.058 6.278 0.316 466 3HG1 VAL 58 3HG1 VAL 58 3.383 5.678 1.308 467 1HG2 VAL 58 1HG2 VAL 58 1.672 9.256 1.237 468 2HG2 VAL 58 2HG2 VAL 58 2.907 9.560 0.014 469 3HG2 VAL 58 3HG2 VAL 58 1.730 8.268 -0.223 470 H ASP 59 H ASP 59 2.739 6.227 3.888 471 HA ASP 59 HA ASP 59 5.499 5.281 4.510 472 1HB ASP 59 1HB ASP 59 3.358 6.079 6.403 473 2HB ASP 59 2HB ASP 59 4.162 4.553 6.770 474 H ILE 60 H ILE 60 5.688 3.038 4.333 475 HA ILE 60 HA ILE 60 3.349 1.297 4.461 476 HB ILE 60 HB ILE 60 4.564 2.065 1.811 477 1HG1 ILE 60 1HG1 ILE 60 1.922 1.309 1.461 478 2HG1 ILE 60 2HG1 ILE 60 1.921 1.965 3.095 479 1HG2 ILE 60 1HG2 ILE 60 3.820 -0.705 2.623 480 2HG2 ILE 60 2HG2 ILE 60 3.215 -0.154 1.060 481 3HG2 ILE 60 3HG2 ILE 60 4.949 -0.163 1.381 482 1HD1 ILE 60 1HD1 ILE 60 3.488 3.737 1.548 483 2HD1 ILE 60 2HD1 ILE 60 2.056 3.376 0.584 484 3HD1 ILE 60 3HD1 ILE 60 1.880 4.031 2.211 485 H GLY 61 H GLY 61 4.010 -0.771 4.966 486 1HA GLY 61 1HA GLY 61 6.947 -1.274 4.855 487 2HA GLY 61 2HA GLY 61 5.987 -1.760 6.236 488 H ASN 62 H ASN 62 7.551 -3.171 4.008 489 HA ASN 62 HA ASN 62 5.432 -4.868 2.830 490 1HB ASN 62 1HB ASN 62 7.328 -5.944 1.616 491 2HB ASN 62 2HB ASN 62 7.268 -4.199 1.368 492 1HD2 ASN 62 2HD2 ASN 62 9.388 -6.693 2.123 493 2HD2 ASN 62 1HD2 ASN 62 10.597 -5.787 2.897 494 H ASP 63 H ASP 63 5.346 -7.182 3.188 495 HA ASP 63 HA ASP 63 6.448 -7.978 5.838 496 1HB ASP 63 1HB ASP 63 3.952 -8.275 5.005 497 2HB ASP 63 2HB ASP 63 4.608 -9.714 4.223 498 H GLY 64 H GLY 64 8.184 -7.793 3.504 499 1HA GLY 64 1HA GLY 64 10.101 -9.445 3.410 500 2HA GLY 64 2HA GLY 64 8.878 -10.674 3.108 501 H SER 65 H SER 65 7.454 -8.427 1.455 502 HA SER 65 HA SER 65 8.293 -9.294 -1.119 503 1HB SER 65 1HB SER 65 7.054 -6.609 -0.756 504 2HB SER 65 2HB SER 65 6.698 -7.853 -1.951 505 HG SER 65 HG SER 65 5.075 -8.154 -0.602 506 H ALA 66 H ALA 66 8.708 -7.219 -2.729 507 HA ALA 66 HA ALA 66 11.154 -5.864 -1.691 508 1HB ALA 66 1HB ALA 66 11.366 -8.013 -3.275 509 2HB ALA 66 2HB ALA 66 11.103 -6.798 -4.526 510 3HB ALA 66 3HB ALA 66 12.467 -6.645 -3.421 511 H PHE 67 H PHE 67 8.638 -5.944 -4.223 512 HA PHE 67 HA PHE 67 9.228 -3.062 -4.776 513 1HB PHE 67 1HB PHE 67 7.550 -4.954 -6.441 514 2HB PHE 67 2HB PHE 67 8.107 -3.364 -6.905 515 HD1 PHE 67 HD1 PHE 67 10.855 -3.186 -6.214 516 HD2 PHE 67 HD2 PHE 67 8.688 -6.619 -7.619 517 HE1 PHE 67 HE1 PHE 67 12.963 -4.163 -7.076 518 HE2 PHE 67 HE2 PHE 67 10.797 -7.596 -8.481 519 HZ PHE 67 HZ PHE 67 12.935 -6.369 -8.210 520 H VAL 68 H VAL 68 7.679 -1.487 -4.526 521 HA VAL 68 HA VAL 68 4.900 -2.308 -3.860 522 HB VAL 68 HB VAL 68 6.582 -0.504 -2.094 523 1HG1 VAL 68 1HG1 VAL 68 3.676 -1.369 -1.933 524 2HG1 VAL 68 2HG1 VAL 68 4.542 -0.556 -0.630 525 3HG1 VAL 68 3HG1 VAL 68 4.271 0.275 -2.161 526 1HG2 VAL 68 1HG2 VAL 68 5.697 -3.355 -1.983 527 2HG2 VAL 68 2HG2 VAL 68 7.219 -2.638 -1.461 528 3HG2 VAL 68 3HG2 VAL 68 5.770 -2.450 -0.473 529 H GLU 69 H GLU 69 3.747 -1.226 -5.340 530 HA GLU 69 HA GLU 69 4.594 1.518 -6.162 531 1HB GLU 69 1HB GLU 69 4.302 -0.123 -7.982 532 2HB GLU 69 2HB GLU 69 2.652 -0.432 -7.449 533 1HG GLU 69 1HG GLU 69 1.855 1.530 -8.327 534 2HG GLU 69 2HG GLU 69 3.345 2.411 -7.991 535 H VAL 70 H VAL 70 3.103 3.255 -6.050 536 HA VAL 70 HA VAL 70 0.524 2.667 -4.685 537 HB VAL 70 HB VAL 70 2.302 4.983 -3.910 538 1HG1 VAL 70 1HG1 VAL 70 -0.387 3.975 -3.139 539 2HG1 VAL 70 2HG1 VAL 70 0.636 4.584 -1.837 540 3HG1 VAL 70 3HG1 VAL 70 0.220 5.631 -3.196 541 1HG2 VAL 70 1HG2 VAL 70 2.000 2.215 -2.738 542 2HG2 VAL 70 2HG2 VAL 70 3.487 3.071 -3.145 543 3HG2 VAL 70 3HG2 VAL 70 2.531 3.579 -1.754 544 H LEU 71 H LEU 71 -1.166 3.714 -5.585 545 HA LEU 71 HA LEU 71 -0.593 5.930 -7.498 546 1HB LEU 71 1HB LEU 71 -2.143 3.465 -7.763 547 2HB LEU 71 2HB LEU 71 -3.116 4.887 -8.133 548 HG LEU 71 HG LEU 71 -1.285 5.657 -9.673 549 1HD1 LEU 71 1HD1 LEU 71 0.506 4.308 -8.542 550 2HD1 LEU 71 2HD1 LEU 71 -0.212 2.856 -9.239 551 3HD1 LEU 71 3HD1 LEU 71 0.467 4.097 -10.292 552 1HD2 LEU 71 1HD2 LEU 71 -3.326 3.935 -10.156 553 2HD2 LEU 71 2HD2 LEU 71 -2.226 4.500 -11.413 554 3HD2 LEU 71 3HD2 LEU 71 -1.962 2.933 -10.649 555 H VAL 72 H VAL 72 -2.538 7.418 -7.726 556 HA VAL 72 HA VAL 72 -4.026 7.684 -5.153 557 HB VAL 72 HB VAL 72 -3.770 10.175 -5.527 558 1HG1 VAL 72 1HG1 VAL 72 -1.513 8.338 -4.783 559 2HG1 VAL 72 2HG1 VAL 72 -1.312 10.087 -4.690 560 3HG1 VAL 72 3HG1 VAL 72 -2.554 9.291 -3.725 561 1HG2 VAL 72 1HG2 VAL 72 -2.657 9.393 -7.931 562 2HG2 VAL 72 2HG2 VAL 72 -2.483 10.993 -7.213 563 3HG2 VAL 72 3HG2 VAL 72 -1.238 9.774 -6.962 564 H GLY 73 H GLY 73 -6.065 8.919 -5.392 565 1HA GLY 73 1HA GLY 73 -7.114 9.850 -7.830 566 2HA GLY 73 2HA GLY 73 -7.562 8.155 -7.694 567 H SER 74 H SER 74 -9.587 9.805 -7.736 568 HA SER 74 HA SER 74 -10.438 10.177 -4.920 569 1HB SER 74 1HB SER 74 -10.457 12.297 -6.033 570 2HB SER 74 2HB SER 74 -11.240 11.614 -7.449 571 HG SER 74 HG SER 74 -12.280 12.265 -4.937 572 H SER 75 H SER 75 -12.722 9.760 -4.527 573 HA SER 75 HA SER 75 -13.638 7.334 -5.866 574 1HB SER 75 1HB SER 75 -15.309 8.864 -3.902 575 2HB SER 75 2HB SER 75 -15.172 7.123 -4.119 576 HG SER 75 HG SER 75 -13.705 8.829 -2.575 577 H ALA 76 H ALA 76 -13.782 10.479 -6.804 578 HA ALA 76 HA ALA 76 -16.475 11.024 -7.398 579 1HB ALA 76 1HB ALA 76 -13.861 11.804 -8.631 580 2HB ALA 76 2HB ALA 76 -15.352 12.207 -9.482 581 3HB ALA 76 3HB ALA 76 -15.075 12.818 -7.851 582 H GLY 77 H GLY 77 -16.992 11.204 -10.018 583 1HA GLY 77 1HA GLY 77 -17.705 8.570 -10.820 584 2HA GLY 77 2HA GLY 77 -17.713 9.976 -11.882 585 H GLY 78 H GLY 78 -16.139 7.047 -11.156 586 1HA GLY 78 1HA GLY 78 -14.107 7.621 -13.252 587 2HA GLY 78 2HA GLY 78 -13.563 6.965 -11.708 588 H ALA 79 H ALA 79 -14.707 4.889 -11.025 589 HA ALA 79 HA ALA 79 -15.211 2.643 -11.468 590 1HB ALA 79 1HB ALA 79 -17.150 4.005 -12.682 591 2HB ALA 79 2HB ALA 79 -16.371 3.367 -14.130 592 3HB ALA 79 3HB ALA 79 -16.989 2.262 -12.903 593 H GLY 80 H GLY 80 -12.628 3.480 -12.167 594 1HA GLY 80 1HA GLY 80 -12.005 1.522 -14.283 595 2HA GLY 80 2HA GLY 80 -11.508 3.183 -14.607 596 H GLU 81 H GLU 81 -10.342 0.341 -13.497 597 HA GLU 81 HA GLU 81 -8.889 1.030 -11.132 598 1HB GLU 81 1HB GLU 81 -8.375 -0.998 -13.319 599 2HB GLU 81 2HB GLU 81 -7.352 -0.860 -11.889 600 1HG GLU 81 1HG GLU 81 -8.856 -2.414 -11.095 601 2HG GLU 81 2HG GLU 81 -9.729 -0.945 -10.659 602 H GLN 82 H GLN 82 -8.315 1.695 -14.525 603 HA GLN 82 HA GLN 82 -5.583 2.697 -13.928 604 1HB GLN 82 1HB GLN 82 -7.033 2.554 -16.589 605 2HB GLN 82 2HB GLN 82 -5.316 2.872 -16.340 606 1HG GLN 82 1HG GLN 82 -4.905 0.661 -15.576 607 2HG GLN 82 2HG GLN 82 -6.624 0.338 -15.344 608 1HE2 GLN 82 2HE2 GLN 82 -4.491 -0.973 -17.167 609 2HE2 GLN 82 1HE2 GLN 82 -5.218 -0.973 -18.700 610 H ASP 83 H ASP 83 -8.086 4.042 -12.976 611 HA ASP 83 HA ASP 83 -7.924 6.590 -14.520 612 1HB ASP 83 1HB ASP 83 -10.168 5.349 -13.993 613 2HB ASP 83 2HB ASP 83 -9.962 6.029 -12.378 614 H TYR 84 H TYR 84 -5.979 5.570 -12.423 615 HA TYR 84 HA TYR 84 -6.314 7.722 -10.395 616 1HB TYR 84 1HB TYR 84 -4.972 5.031 -10.356 617 2HB TYR 84 2HB TYR 84 -4.395 6.301 -9.280 618 HD1 TYR 84 HD1 TYR 84 -7.842 5.341 -10.446 619 HD2 TYR 84 HD2 TYR 84 -5.176 5.897 -7.124 620 HE1 TYR 84 HE1 TYR 84 -9.701 4.870 -8.876 621 HE2 TYR 84 HE2 TYR 84 -7.037 5.427 -5.554 622 HH TYR 84 HH TYR 84 -9.293 4.074 -5.735 623 H GLU 85 H GLU 85 -3.867 8.188 -9.590 624 HA GLU 85 HA GLU 85 -2.278 8.824 -12.036 625 1HB GLU 85 1HB GLU 85 -1.556 10.658 -9.952 626 2HB GLU 85 2HB GLU 85 -2.274 11.020 -11.514 627 1HG GLU 85 1HG GLU 85 -3.987 10.124 -9.194 628 2HG GLU 85 2HG GLU 85 -3.522 11.811 -9.392 629 H VAL 86 H VAL 86 -0.271 7.979 -11.998 630 HA VAL 86 HA VAL 86 0.585 6.259 -9.897 631 HB VAL 86 HB VAL 86 2.300 7.570 -12.024 632 1HG1 VAL 86 1HG1 VAL 86 2.637 5.236 -10.153 633 2HG1 VAL 86 2HG1 VAL 86 3.457 5.239 -11.715 634 3HG1 VAL 86 3HG1 VAL 86 3.784 6.517 -10.543 635 1HG2 VAL 86 1HG2 VAL 86 0.523 5.118 -12.042 636 2HG2 VAL 86 2HG2 VAL 86 0.478 6.495 -13.143 637 3HG2 VAL 86 3HG2 VAL 86 1.821 5.354 -13.213 638 H LEU 87 H LEU 87 0.440 7.543 -7.960 639 HA LEU 87 HA LEU 87 1.811 9.987 -7.491 640 1HB LEU 87 1HB LEU 87 0.110 8.729 -5.988 641 2HB LEU 87 2HB LEU 87 1.508 7.832 -5.398 642 HG LEU 87 HG LEU 87 2.612 10.037 -4.874 643 1HD1 LEU 87 1HD1 LEU 87 0.031 10.979 -6.019 644 2HD1 LEU 87 2HD1 LEU 87 0.623 11.841 -4.599 645 3HD1 LEU 87 3HD1 LEU 87 1.620 11.741 -6.050 646 1HD2 LEU 87 1HD2 LEU 87 0.181 8.939 -3.562 647 2HD2 LEU 87 2HD2 LEU 87 1.794 9.202 -2.901 648 3HD2 LEU 87 3HD2 LEU 87 0.669 10.553 -3.045 649 H LEU 88 H LEU 88 2.850 6.622 -6.872 650 HA LEU 88 HA LEU 88 5.631 7.450 -7.396 651 1HB LEU 88 1HB LEU 88 6.454 6.296 -5.355 652 2HB LEU 88 2HB LEU 88 5.518 7.745 -5.017 653 HG LEU 88 HG LEU 88 3.715 5.519 -5.173 654 1HD1 LEU 88 1HD1 LEU 88 6.302 5.013 -3.818 655 2HD1 LEU 88 2HD1 LEU 88 4.863 4.618 -2.878 656 3HD1 LEU 88 3HD1 LEU 88 5.120 3.870 -4.454 657 1HD2 LEU 88 1HD2 LEU 88 4.614 7.562 -3.164 658 2HD2 LEU 88 2HD2 LEU 88 3.022 7.338 -3.888 659 3HD2 LEU 88 3HD2 LEU 88 3.580 6.237 -2.629 660 H VAL 89 H VAL 89 6.495 5.983 -8.737 661 HA VAL 89 HA VAL 89 5.160 3.608 -9.571 662 HB VAL 89 HB VAL 89 8.162 3.924 -9.758 663 1HG1 VAL 89 1HG1 VAL 89 5.988 2.539 -11.279 664 2HG1 VAL 89 2HG1 VAL 89 7.420 3.076 -12.158 665 3HG1 VAL 89 3HG1 VAL 89 7.583 1.946 -10.814 666 1HG2 VAL 89 1HG2 VAL 89 6.014 5.548 -11.090 667 2HG2 VAL 89 2HG2 VAL 89 7.599 6.061 -10.511 668 3HG2 VAL 89 3HG2 VAL 89 7.462 5.137 -12.007 669 H THR 90 H THR 90 6.343 1.337 -9.367 670 HA THR 90 HA THR 90 6.199 0.526 -6.676 671 HB THR 90 HB THR 90 6.183 -0.839 -8.957 672 HG1 THR 90 HG1 THR 90 5.590 -1.704 -7.009 673 1HG2 THR 90 1HG2 THR 90 8.653 -0.439 -9.351 674 2HG2 THR 90 2HG2 THR 90 8.971 -1.442 -7.936 675 3HG2 THR 90 3HG2 THR 90 8.173 -2.136 -9.347 676 H SER 91 H SER 91 7.599 0.541 -5.030 677 HA SER 91 HA SER 91 10.312 1.628 -5.513 678 1HB SER 91 1HB SER 91 10.179 1.920 -2.935 679 2HB SER 91 2HB SER 91 9.205 2.991 -3.936 680 HG SER 91 HG SER 91 7.419 1.805 -3.468 681 H SER 92 H SER 92 12.036 0.388 -5.116 682 HA SER 92 HA SER 92 11.629 -2.419 -4.317 683 1HB SER 92 1HB SER 92 13.931 -2.745 -5.059 684 2HB SER 92 2HB SER 92 13.041 -1.848 -6.285 685 HG SER 92 HG SER 92 15.213 -1.124 -4.862 686 H PHE 93 H PHE 93 11.550 -2.700 -2.108 687 HA PHE 93 HA PHE 93 13.258 -1.050 -0.353 688 1HB PHE 93 1HB PHE 93 11.469 -3.329 0.472 689 2HB PHE 93 2HB PHE 93 12.095 -2.045 1.489 690 HD1 PHE 93 HD1 PHE 93 11.523 0.173 -0.733 691 HD2 PHE 93 HD2 PHE 93 9.171 -2.916 1.114 692 HE1 PHE 93 HE1 PHE 93 9.460 1.488 -1.141 693 HE2 PHE 93 HE2 PHE 93 7.121 -1.596 0.707 694 HZ PHE 93 HZ PHE 93 7.262 0.598 -0.421 695 H MET 94 H MET 94 12.734 -4.522 -0.992 696 HA MET 94 HA MET 94 15.521 -5.003 -0.005 697 1HB MET 94 1HB MET 94 12.952 -6.320 0.596 698 2HB MET 94 2HB MET 94 14.260 -7.440 0.221 699 1HG MET 94 1HG MET 94 15.502 -6.829 2.062 700 2HG MET 94 2HG MET 94 14.868 -5.184 2.079 701 1HE MET 94 1HE MET 94 14.094 -8.724 2.112 702 2HE MET 94 2HE MET 94 13.261 -9.064 3.625 703 3HE MET 94 3HE MET 94 12.338 -8.603 2.189 704 H SER 95 H SER 95 16.162 -7.364 -0.831 705 HA SER 95 HA SER 95 15.929 -7.270 -3.794 706 1HB SER 95 1HB SER 95 17.810 -9.229 -3.079 707 2HB SER 95 2HB SER 95 18.163 -7.597 -3.625 708 HG SER 95 HG SER 95 18.960 -8.431 -1.452 709 HA PRO 96 HA PRO 96 13.790 -11.196 -3.784 710 1HB PRO 96 1HB PRO 96 14.929 -12.548 -5.863 711 2HB PRO 96 2HB PRO 96 13.892 -11.131 -6.074 712 1HG PRO 96 1HG PRO 96 16.785 -11.393 -6.477 713 2HG PRO 96 2HG PRO 96 15.671 -10.160 -7.082 714 1HD PRO 96 1HD PRO 96 17.486 -9.968 -4.853 715 2HD PRO 96 2HD PRO 96 16.384 -8.720 -5.474 716 H SER 97 H SER 97 16.588 -11.167 -2.279 717 HA SER 97 HA SER 97 16.825 -14.141 -2.098 718 1HB SER 97 1HB SER 97 19.028 -12.181 -1.433 719 2HB SER 97 2HB SER 97 19.161 -13.921 -1.667 720 HG SER 97 HG SER 97 19.711 -12.321 -3.467 721 H GLU 98 H GLU 98 17.402 -11.133 -0.214 722 HA GLU 98 HA GLU 98 17.443 -12.354 2.334 723 1HB GLU 98 1HB GLU 98 17.204 -9.659 1.238 724 2HB GLU 98 2HB GLU 98 16.283 -9.844 2.730 725 1HG GLU 98 1HG GLU 98 18.539 -9.172 3.290 726 2HG GLU 98 2HG GLU 98 18.307 -10.842 3.799 727 H SER 99 H SER 99 14.754 -11.833 0.199 728 HA SER 99 HA SER 99 12.563 -11.523 1.895 729 1HB SER 99 1HB SER 99 12.408 -11.669 -0.575 730 2HB SER 99 2HB SER 99 12.732 -13.397 -0.483 731 HG SER 99 HG SER 99 10.791 -13.729 0.390 732 H ARG 100 H ARG 100 14.626 -14.335 1.547 733 HA ARG 100 HA ARG 100 12.766 -16.068 3.031 734 1HB ARG 100 1HB ARG 100 15.601 -16.505 2.040 735 2HB ARG 100 2HB ARG 100 14.635 -17.734 2.858 736 1HG ARG 100 1HG ARG 100 12.973 -17.686 1.101 737 2HG ARG 100 2HG ARG 100 13.757 -16.305 0.335 738 1HD ARG 100 1HD ARG 100 15.678 -17.611 -0.258 739 2HD ARG 100 2HD ARG 100 15.150 -18.959 0.750 740 HE ARG 100 HE ARG 100 13.191 -18.321 -1.286 741 1HH1 ARG 100 1HH1 ARG 100 16.222 -19.966 -0.699 742 2HH1 ARG 100 2HH1 ARG 100 15.994 -21.067 -2.012 743 1HH2 ARG 100 1HH2 ARG 100 12.937 -19.769 -2.975 744 2HH2 ARG 100 2HH2 ARG 100 14.155 -20.958 -3.287 745 H SER 101 H SER 101 16.249 -15.800 3.756 746 HA SER 101 HA SER 101 15.854 -14.437 6.276 747 1HB SER 101 1HB SER 101 15.011 -16.788 6.755 748 2HB SER 101 2HB SER 101 16.640 -17.363 6.411 749 HG SER 101 HG SER 101 16.910 -16.928 8.462 750 H GLY 102 H GLY 102 17.465 -14.147 3.929 751 1HA GLY 102 1HA GLY 102 20.157 -15.113 4.529 752 2HA GLY 102 2HA GLY 102 19.715 -14.020 3.217 753 H SER 103 H SER 103 18.237 -12.349 5.375 754 HA SER 103 HA SER 103 20.238 -11.353 7.169 755 1HB SER 103 1HB SER 103 20.374 -10.396 4.430 756 2HB SER 103 2HB SER 103 20.155 -9.080 5.579 757 HG SER 103 HG SER 103 22.282 -9.375 5.658 758 H ASN 104 H ASN 104 18.199 -9.296 5.240 759 HA ASN 104 HA ASN 104 16.515 -8.787 7.636 760 1HB ASN 104 1HB ASN 104 16.052 -6.565 6.597 761 2HB ASN 104 2HB ASN 104 17.769 -6.801 6.914 762 1HD2 ASN 104 2HD2 ASN 104 19.133 -7.471 4.983 763 2HD2 ASN 104 1HD2 ASN 104 18.626 -7.030 3.421 764 HA PRO 105 HA PRO 105 13.824 -10.905 4.519 765 1HB PRO 105 1HB PRO 105 12.426 -12.351 6.371 766 2HB PRO 105 2HB PRO 105 13.955 -12.880 5.664 767 1HG PRO 105 1HG PRO 105 13.431 -11.715 8.348 768 2HG PRO 105 2HG PRO 105 14.586 -12.969 7.868 769 1HD PRO 105 1HD PRO 105 15.273 -10.334 8.336 770 2HD PRO 105 2HD PRO 105 16.201 -11.440 7.297 771 H ASN 106 H ASN 106 13.254 -9.000 7.351 772 HA ASN 106 HA ASN 106 10.589 -8.225 6.246 773 1HB ASN 106 1HB ASN 106 11.051 -9.530 8.715 774 2HB ASN 106 2HB ASN 106 10.690 -7.854 9.120 775 1HD2 ASN 106 2HD2 ASN 106 9.439 -9.840 6.388 776 2HD2 ASN 106 1HD2 ASN 106 7.807 -9.683 6.824 777 H ARG 107 H ARG 107 10.432 -6.083 5.879 778 HA ARG 107 HA ARG 107 11.806 -4.126 7.577 779 1HB ARG 107 1HB ARG 107 13.263 -5.100 5.458 780 2HB ARG 107 2HB ARG 107 12.475 -3.701 4.729 781 1HG ARG 107 1HG ARG 107 13.239 -2.458 6.901 782 2HG ARG 107 2HG ARG 107 14.377 -3.796 7.058 783 1HD ARG 107 1HD ARG 107 15.209 -3.342 4.769 784 2HD ARG 107 2HD ARG 107 14.100 -1.976 4.647 785 HE ARG 107 HE ARG 107 16.626 -1.996 6.076 786 1HH1 ARG 107 1HH1 ARG 107 13.402 -0.640 6.034 787 2HH1 ARG 107 2HH1 ARG 107 13.883 0.787 6.882 788 1HH2 ARG 107 1HH2 ARG 107 17.205 -0.133 7.170 789 2HH2 ARG 107 2HH2 ARG 107 16.013 1.073 7.521 790 H VAL 108 H VAL 108 11.399 -1.830 6.482 791 HA VAL 108 HA VAL 108 8.753 -1.840 5.114 792 HB VAL 108 HB VAL 108 7.937 -0.095 6.577 793 1HG1 VAL 108 1HG1 VAL 108 9.121 -2.458 8.062 794 2HG1 VAL 108 2HG1 VAL 108 7.861 -1.405 8.705 795 3HG1 VAL 108 3HG1 VAL 108 7.541 -2.399 7.283 796 1HG2 VAL 108 1HG2 VAL 108 10.708 -0.301 7.731 797 2HG2 VAL 108 2HG2 VAL 108 9.835 1.143 7.210 798 3HG2 VAL 108 3HG2 VAL 108 9.366 0.314 8.697 799 H ARG 109 H ARG 109 8.348 0.806 4.711 800 HA ARG 109 HA ARG 109 10.796 2.197 3.965 801 1HB ARG 109 1HB ARG 109 10.170 0.422 2.101 802 2HB ARG 109 2HB ARG 109 8.993 1.653 1.637 803 1HG ARG 109 1HG ARG 109 11.012 2.102 0.394 804 2HG ARG 109 2HG ARG 109 10.885 3.334 1.647 805 1HD ARG 109 1HD ARG 109 12.784 2.644 2.657 806 2HD ARG 109 2HD ARG 109 12.305 0.948 2.576 807 HE ARG 109 HE ARG 109 13.003 1.533 -0.028 808 1HH1 ARG 109 1HH1 ARG 109 14.596 1.912 3.064 809 2HH1 ARG 109 2HH1 ARG 109 16.176 1.727 2.386 810 1HH2 ARG 109 1HH2 ARG 109 15.065 1.299 -0.862 811 2HH2 ARG 109 2HH2 ARG 109 16.441 1.383 0.187 812 H MET 110 H MET 110 10.395 4.377 3.461 813 HA MET 110 HA MET 110 7.551 5.264 3.724 814 1HB MET 110 1HB MET 110 9.996 6.637 4.882 815 2HB MET 110 2HB MET 110 8.322 7.166 5.055 816 1HG MET 110 1HG MET 110 7.829 5.561 6.610 817 2HG MET 110 2HG MET 110 8.885 4.365 5.864 818 1HE MET 110 1HE MET 110 10.662 3.586 6.590 819 2HE MET 110 2HE MET 110 11.883 4.781 6.162 820 3HE MET 110 3HE MET 110 11.800 4.148 7.811 821 H PHE 111 H PHE 111 7.028 7.195 2.570 822 HA PHE 111 HA PHE 111 9.033 8.000 0.504 823 1HB PHE 111 1HB PHE 111 6.044 8.106 0.084 824 2HB PHE 111 2HB PHE 111 7.317 8.195 -1.126 825 HD1 PHE 111 HD1 PHE 111 5.884 5.891 1.459 826 HD2 PHE 111 HD2 PHE 111 7.974 6.259 -2.277 827 HE1 PHE 111 HE1 PHE 111 5.732 3.450 1.130 828 HE2 PHE 111 HE2 PHE 111 7.826 3.804 -2.599 829 HZ PHE 111 HZ PHE 111 6.698 2.399 -0.894 830 H GLY 112 H GLY 112 8.571 10.238 -0.337 831 1HA GLY 112 1HA GLY 112 7.209 12.000 1.614 832 2HA GLY 112 2HA GLY 112 8.864 12.334 1.167 833 HA PRO 113 HA PRO 113 6.389 14.665 -1.942 834 1HB PRO 113 1HB PRO 113 8.155 16.740 -2.088 835 2HB PRO 113 2HB PRO 113 6.876 16.630 -0.871 836 1HG PRO 113 1HG PRO 113 9.794 16.145 -0.593 837 2HG PRO 113 2HG PRO 113 8.638 16.788 0.584 838 1HD PRO 113 1HD PRO 113 9.603 14.168 0.573 839 2HD PRO 113 2HD PRO 113 8.120 14.696 1.379 840 H ASP 114 H ASP 114 9.899 14.159 -1.876 841 HA ASP 114 HA ASP 114 10.369 14.557 -4.671 842 1HB ASP 114 1HB ASP 114 11.870 13.243 -2.429 843 2HB ASP 114 2HB ASP 114 12.420 13.004 -4.089 844 H LYS 115 H LYS 115 9.230 11.822 -2.812 845 HA LYS 115 HA LYS 115 9.572 10.007 -5.111 846 1HB LYS 115 1HB LYS 115 8.941 9.706 -2.222 847 2HB LYS 115 2HB LYS 115 8.249 8.504 -3.312 848 1HG LYS 115 1HG LYS 115 10.289 7.618 -3.853 849 2HG LYS 115 2HG LYS 115 11.107 9.179 -3.762 850 1HD LYS 115 1HD LYS 115 10.044 8.043 -1.217 851 2HD LYS 115 2HD LYS 115 11.478 7.282 -1.906 852 1HE LYS 115 1HE LYS 115 11.266 10.276 -1.545 853 2HE LYS 115 2HE LYS 115 11.893 9.219 -0.279 854 1HZ LYS 115 1HZ LYS 115 12.959 9.021 -3.014 855 2HZ LYS 115 2HZ LYS 115 13.508 10.255 -1.988 856 3HZ LYS 115 3HZ LYS 115 13.704 8.629 -1.539 857 H LEU 116 H LEU 116 7.325 12.340 -4.419 858 HA LEU 116 HA LEU 116 5.161 10.667 -5.648 859 1HB LEU 116 1HB LEU 116 3.531 12.280 -4.532 860 2HB LEU 116 2HB LEU 116 4.323 11.109 -3.487 861 HG LEU 116 HG LEU 116 6.080 13.000 -3.112 862 1HD1 LEU 116 1HD1 LEU 116 4.315 14.328 -4.881 863 2HD1 LEU 116 2HD1 LEU 116 4.054 15.047 -3.296 864 3HD1 LEU 116 3HD1 LEU 116 5.666 15.027 -4.000 865 1HD2 LEU 116 1HD2 LEU 116 3.263 13.149 -2.005 866 2HD2 LEU 116 2HD2 LEU 116 4.565 12.132 -1.389 867 3HD2 LEU 116 3HD2 LEU 116 4.682 13.886 -1.265 868 H VAL 117 H VAL 117 4.115 11.460 -7.365 869 HA VAL 117 HA VAL 117 5.330 13.484 -8.971 870 HB VAL 117 HB VAL 117 3.838 11.712 -9.882 871 1HG1 VAL 117 1HG1 VAL 117 2.237 11.822 -7.949 872 2HG1 VAL 117 2HG1 VAL 117 1.592 13.293 -8.658 873 3HG1 VAL 117 3HG1 VAL 117 1.463 11.771 -9.533 874 1HG2 VAL 117 1HG2 VAL 117 4.183 13.879 -11.114 875 2HG2 VAL 117 2HG2 VAL 117 2.643 13.100 -11.478 876 3HG2 VAL 117 3HG2 VAL 117 2.695 14.476 -10.377 877 H ARG 118 H ARG 118 5.139 15.703 -8.878 878 HA ARG 118 HA ARG 118 3.579 16.910 -6.744 879 1HB ARG 118 1HB ARG 118 5.425 17.887 -8.884 880 2HB ARG 118 2HB ARG 118 4.316 19.054 -8.162 881 1HG ARG 118 1HG ARG 118 5.198 17.862 -5.914 882 2HG ARG 118 2HG ARG 118 6.615 17.616 -6.936 883 1HD ARG 118 1HD ARG 118 6.991 19.718 -5.906 884 2HD ARG 118 2HD ARG 118 6.405 20.118 -7.521 885 HE ARG 118 HE ARG 118 4.098 20.049 -6.006 886 1HH1 ARG 118 1HH1 ARG 118 7.165 21.701 -5.702 887 2HH1 ARG 118 2HH1 ARG 118 6.472 23.049 -4.871 888 1HH2 ARG 118 1HH2 ARG 118 3.243 21.812 -4.928 889 2HH2 ARG 118 2HH2 ARG 118 4.276 23.114 -4.435 890 H ALA 119 H ALA 119 3.165 16.473 -10.214 891 HA ALA 119 HA ALA 119 1.006 18.311 -10.573 892 1HB ALA 119 1HB ALA 119 2.109 15.980 -12.068 893 2HB ALA 119 2HB ALA 119 0.472 16.501 -12.473 894 3HB ALA 119 3HB ALA 119 1.819 17.631 -12.616 895 H ALA 120 H ALA 120 1.144 15.148 -9.125 896 HA ALA 120 HA ALA 120 -1.837 15.067 -9.047 897 1HB ALA 120 1HB ALA 120 -0.154 13.136 -10.014 898 2HB ALA 120 2HB ALA 120 -0.350 12.610 -8.343 899 3HB ALA 120 3HB ALA 120 -1.765 12.813 -9.376 900 H ALA 121 H ALA 121 1.098 14.335 -7.089 901 HA ALA 121 HA ALA 121 -0.077 13.705 -4.649 902 1HB ALA 121 1HB ALA 121 2.384 13.784 -5.179 903 2HB ALA 121 2HB ALA 121 2.315 15.529 -4.934 904 3HB ALA 121 3HB ALA 121 1.956 14.436 -3.599 905 H GLU 122 H GLU 122 0.351 16.983 -5.993 906 HA GLU 122 HA GLU 122 -0.702 18.206 -3.546 907 1HB GLU 122 1HB GLU 122 -0.515 20.331 -4.763 908 2HB GLU 122 2HB GLU 122 0.969 19.396 -4.937 909 1HG GLU 122 1HG GLU 122 0.667 19.898 -7.153 910 2HG GLU 122 2HG GLU 122 -0.384 18.483 -7.091 911 H LYS 123 H LYS 123 -2.241 16.466 -5.878 912 HA LYS 123 HA LYS 123 -4.600 18.233 -6.051 913 1HB LYS 123 1HB LYS 123 -4.113 15.487 -7.228 914 2HB LYS 123 2HB LYS 123 -5.493 16.524 -7.580 915 1HG LYS 123 1HG LYS 123 -3.565 18.263 -8.158 916 2HG LYS 123 2HG LYS 123 -2.646 16.785 -8.434 917 1HD LYS 123 1HD LYS 123 -4.125 16.042 -10.126 918 2HD LYS 123 2HD LYS 123 -5.385 17.176 -9.638 919 1HE LYS 123 1HE LYS 123 -3.414 18.932 -10.193 920 2HE LYS 123 2HE LYS 123 -2.965 17.637 -11.303 921 1HZ LYS 123 1HZ LYS 123 -5.467 17.675 -11.885 922 2HZ LYS 123 2HZ LYS 123 -5.434 19.235 -11.219 923 3HZ LYS 123 3HZ LYS 123 -4.442 18.859 -12.547 924 H ARG 124 H ARG 124 -6.428 17.846 -4.827 925 HA ARG 124 HA ARG 124 -6.212 16.189 -2.500 926 1HB ARG 124 1HB ARG 124 -8.487 17.708 -3.763 927 2HB ARG 124 2HB ARG 124 -8.742 16.700 -2.339 928 1HG ARG 124 1HG ARG 124 -7.012 17.942 -1.118 929 2HG ARG 124 2HG ARG 124 -6.699 18.932 -2.544 930 1HD ARG 124 1HD ARG 124 -9.365 18.771 -1.106 931 2HD ARG 124 2HD ARG 124 -8.195 20.076 -0.912 932 HE ARG 124 HE ARG 124 -8.871 19.680 -3.697 933 1HH1 ARG 124 1HH1 ARG 124 -9.999 21.094 -0.701 934 2HH1 ARG 124 2HH1 ARG 124 -10.961 22.282 -1.508 935 1HH2 ARG 124 1HH2 ARG 124 -10.128 21.235 -4.699 936 2HH2 ARG 124 2HH2 ARG 124 -11.035 22.364 -3.747 937 H TRP 125 H TRP 125 -6.266 14.040 -2.549 938 HA TRP 125 HA TRP 125 -8.192 12.657 -4.383 939 1HB TRP 125 1HB TRP 125 -5.600 11.589 -3.210 940 2HB TRP 125 2HB TRP 125 -6.656 10.744 -4.334 941 HD1 TRP 125 HD1 TRP 125 -3.683 12.855 -4.251 942 HE1 TRP 125 HE1 TRP 125 -3.127 13.770 -6.593 943 HE3 TRP 125 HE3 TRP 125 -8.033 11.778 -6.689 944 HZ2 TRP 125 HZ2 TRP 125 -4.336 13.998 -9.158 945 HZ3 TRP 125 HZ3 TRP 125 -8.303 12.333 -9.082 946 HH2 TRP 125 HH2 TRP 125 -6.467 13.453 -10.323 947 H ASP 126 H ASP 126 -9.009 10.562 -3.410 948 HA ASP 126 HA ASP 126 -8.942 10.550 -0.443 949 1HB ASP 126 1HB ASP 126 -11.416 10.221 -0.371 950 2HB ASP 126 2HB ASP 126 -10.936 11.815 -0.938 951 H ARG 127 H ARG 127 -8.113 8.848 -2.947 952 HA ARG 127 HA ARG 127 -8.790 6.251 -1.700 953 1HB ARG 127 1HB ARG 127 -9.152 6.855 -4.659 954 2HB ARG 127 2HB ARG 127 -9.290 5.262 -3.923 955 1HG ARG 127 1HG ARG 127 -11.013 6.773 -2.379 956 2HG ARG 127 2HG ARG 127 -11.230 7.473 -3.981 957 1HD ARG 127 1HD ARG 127 -11.858 5.381 -4.926 958 2HD ARG 127 2HD ARG 127 -11.270 4.491 -3.528 959 HE ARG 127 HE ARG 127 -13.215 6.020 -2.402 960 1HH1 ARG 127 1HH1 ARG 127 -13.209 4.052 -5.300 961 2HH1 ARG 127 2HH1 ARG 127 -14.899 3.713 -5.188 962 1HH2 ARG 127 1HH2 ARG 127 -15.392 5.546 -2.300 963 2HH2 ARG 127 2HH2 ARG 127 -16.122 4.543 -3.510 964 H VAL 128 H VAL 128 -7.049 4.724 -2.075 965 HA VAL 128 HA VAL 128 -4.818 5.764 -3.743 966 HB VAL 128 HB VAL 128 -4.529 6.393 -1.308 967 1HG1 VAL 128 1HG1 VAL 128 -5.245 3.748 -0.843 968 2HG1 VAL 128 2HG1 VAL 128 -3.503 3.756 -0.571 969 3HG1 VAL 128 3HG1 VAL 128 -4.544 4.852 0.338 970 1HG2 VAL 128 1HG2 VAL 128 -2.493 4.600 -2.646 971 2HG2 VAL 128 2HG2 VAL 128 -2.646 6.347 -2.830 972 3HG2 VAL 128 3HG2 VAL 128 -2.141 5.664 -1.284 973 H LYS 129 H LYS 129 -3.634 4.215 -4.783 974 HA LYS 129 HA LYS 129 -4.627 1.420 -4.560 975 1HB LYS 129 1HB LYS 129 -4.016 3.093 -6.754 976 2HB LYS 129 2HB LYS 129 -2.729 1.889 -6.713 977 1HG LYS 129 1HG LYS 129 -4.427 0.090 -6.638 978 2HG LYS 129 2HG LYS 129 -5.704 1.305 -6.717 979 1HD LYS 129 1HD LYS 129 -5.380 1.694 -8.936 980 2HD LYS 129 2HD LYS 129 -3.627 1.542 -8.809 981 1HE LYS 129 1HE LYS 129 -3.690 -0.803 -8.979 982 2HE LYS 129 2HE LYS 129 -5.391 -0.884 -8.523 983 1HZ LYS 129 1HZ LYS 129 -5.731 0.481 -10.667 984 2HZ LYS 129 2HZ LYS 129 -4.195 -0.105 -11.098 985 3HZ LYS 129 3HZ LYS 129 -5.460 -1.191 -10.791 986 H ILE 130 H ILE 130 -3.181 -0.265 -4.076 987 HA ILE 130 HA ILE 130 -0.325 0.461 -3.609 988 HB ILE 130 HB ILE 130 -2.164 -0.928 -1.627 989 1HG1 ILE 130 1HG1 ILE 130 -2.304 1.554 -1.689 990 2HG1 ILE 130 2HG1 ILE 130 -1.621 0.972 -0.175 991 1HG2 ILE 130 1HG2 ILE 130 0.817 -0.805 -1.845 992 2HG2 ILE 130 2HG2 ILE 130 0.109 -0.645 -0.238 993 3HG2 ILE 130 3HG2 ILE 130 -0.210 -2.086 -1.202 994 1HD1 ILE 130 1HD1 ILE 130 0.670 1.385 -1.103 995 2HD1 ILE 130 2HD1 ILE 130 -0.077 2.098 -2.531 996 3HD1 ILE 130 3HD1 ILE 130 -0.292 2.854 -0.954 997 H VAL 131 H VAL 131 0.642 -0.887 -5.108 998 HA VAL 131 HA VAL 131 -0.278 -3.712 -5.177 999 HB VAL 131 HB VAL 131 1.135 -2.138 -7.340 1000 1HG1 VAL 131 1HG1 VAL 131 -0.021 -4.920 -7.170 1001 2HG1 VAL 131 2HG1 VAL 131 0.356 -4.133 -8.701 1002 3HG1 VAL 131 3HG1 VAL 131 1.641 -4.465 -7.539 1003 1HG2 VAL 131 1HG2 VAL 131 -1.753 -2.728 -6.755 1004 2HG2 VAL 131 2HG2 VAL 131 -1.018 -1.224 -7.312 1005 3HG2 VAL 131 3HG2 VAL 131 -1.216 -2.576 -8.427 1006 H CYS 132 H CYS 132 1.110 -5.091 -4.279 1007 HA CYS 132 HA CYS 132 3.941 -4.293 -3.887 1008 1HB CYS 132 1HB CYS 132 2.278 -5.373 -2.115 1009 2HB CYS 132 2HB CYS 132 2.802 -6.878 -2.874 1010 HG CYS 132 HG CYS 132 5.247 -5.285 -2.286 1011 H SER 133 H SER 133 5.685 -5.684 -4.689 1012 HA SER 133 HA SER 133 4.941 -7.905 -6.494 1013 1HB SER 133 1HB SER 133 5.337 -5.221 -7.440 1014 2HB SER 133 2HB SER 133 6.657 -6.214 -8.041 1015 HG SER 133 HG SER 133 3.898 -6.403 -8.487 1016 H GLN 134 H GLN 134 6.531 -9.310 -6.889 1017 HA GLN 134 HA GLN 134 9.155 -9.393 -7.159 1018 1HB GLN 134 1HB GLN 134 9.664 -7.982 -5.240 1019 2HB GLN 134 2HB GLN 134 8.729 -9.012 -4.177 1020 1HG GLN 134 1HG GLN 134 10.800 -9.903 -3.733 1021 2HG GLN 134 2HG GLN 134 10.472 -10.839 -5.189 1022 1HE2 GLN 134 2HE2 GLN 134 12.976 -9.299 -3.879 1023 2HE2 GLN 134 1HE2 GLN 134 13.696 -8.603 -5.249 1024 HA PRO 135 HA PRO 135 7.252 -13.485 -6.631 1025 1HB PRO 135 1HB PRO 135 8.804 -14.774 -8.466 1026 2HB PRO 135 2HB PRO 135 7.419 -13.762 -8.903 1027 1HG PRO 135 1HG PRO 135 10.306 -13.220 -9.195 1028 2HG PRO 135 2HG PRO 135 8.937 -12.566 -10.103 1029 1HD PRO 135 1HD PRO 135 10.378 -11.264 -8.030 1030 2HD PRO 135 2HD PRO 135 8.877 -10.705 -8.797 1031 H TYR 136 H TYR 136 7.822 -14.796 -4.897 1032 HA TYR 136 HA TYR 136 10.619 -15.714 -4.756 1033 1HB TYR 136 1HB TYR 136 10.382 -15.190 -2.141 1034 2HB TYR 136 2HB TYR 136 11.096 -14.065 -3.282 1035 HD1 TYR 136 HD1 TYR 136 7.788 -14.928 -1.674 1036 HD2 TYR 136 HD2 TYR 136 10.209 -11.891 -3.510 1037 HE1 TYR 136 HE1 TYR 136 6.185 -13.178 -0.973 1038 HE2 TYR 136 HE2 TYR 136 8.594 -10.191 -2.812 1039 HH TYR 136 HH TYR 136 6.258 -10.012 -2.201 1040 H SER 137 H SER 137 7.485 -16.755 -4.694 1041 HA SER 137 HA SER 137 8.348 -19.156 -3.184 1042 1HB SER 137 1HB SER 137 6.986 -17.354 -1.767 1043 2HB SER 137 2HB SER 137 5.621 -18.180 -2.515 1044 HG SER 137 HG SER 137 7.763 -19.461 -1.159 1045 H LYS 138 H LYS 138 6.212 -20.701 -3.156 1046 HA LYS 138 HA LYS 138 5.003 -20.629 -5.880 1047 1HB LYS 138 1HB LYS 138 6.529 -22.919 -4.620 1048 2HB LYS 138 2HB LYS 138 5.415 -23.149 -5.969 1049 1HG LYS 138 1HG LYS 138 7.749 -21.215 -6.001 1050 2HG LYS 138 2HG LYS 138 7.794 -22.836 -6.696 1051 1HD LYS 138 1HD LYS 138 5.654 -22.085 -7.985 1052 2HD LYS 138 2HD LYS 138 6.186 -20.451 -7.583 1053 1HE LYS 138 1HE LYS 138 8.317 -20.810 -8.685 1054 2HE LYS 138 2HE LYS 138 7.936 -22.510 -8.956 1055 1HZ LYS 138 1HZ LYS 138 5.878 -21.544 -10.157 1056 2HZ LYS 138 2HZ LYS 138 6.809 -20.126 -10.256 1057 3HZ LYS 138 3HZ LYS 138 7.377 -21.562 -10.957 1058 H ASP 139 H ASP 139 4.779 -21.775 -2.516 1059 HA ASP 139 HA ASP 139 1.927 -22.411 -3.066 1060 1HB ASP 139 1HB ASP 139 2.172 -24.060 -1.151 1061 2HB ASP 139 2HB ASP 139 2.980 -24.504 -2.649 1062 H SER 140 H SER 140 4.024 -20.440 -1.257 1063 HA SER 140 HA SER 140 2.005 -20.086 0.887 1064 1HB SER 140 1HB SER 140 4.066 -18.608 1.736 1065 2HB SER 140 2HB SER 140 3.959 -20.336 2.033 1066 HG SER 140 HG SER 140 5.406 -20.703 0.475 1067 HA PRO 141 HA PRO 141 1.024 -16.031 -0.792 1068 1HB PRO 141 1HB PRO 141 -0.452 -15.139 1.327 1069 2HB PRO 141 2HB PRO 141 -1.028 -16.365 0.193 1070 1HG PRO 141 1HG PRO 141 -0.214 -16.653 2.993 1071 2HG PRO 141 2HG PRO 141 -1.209 -17.718 1.993 1072 1HD PRO 141 1HD PRO 141 1.568 -18.037 2.686 1073 2HD PRO 141 2HD PRO 141 0.557 -19.097 1.684 1074 H PHE 142 H PHE 142 0.683 -13.692 0.746 1075 HA PHE 142 HA PHE 142 2.732 -13.127 2.634 1076 1HB PHE 142 1HB PHE 142 4.380 -11.953 1.305 1077 2HB PHE 142 2HB PHE 142 4.196 -13.563 0.619 1078 HD1 PHE 142 HD1 PHE 142 2.236 -13.728 -1.203 1079 HD2 PHE 142 HD2 PHE 142 4.331 -10.134 -0.159 1080 HE1 PHE 142 HE1 PHE 142 1.591 -12.724 -3.383 1081 HE2 PHE 142 HE2 PHE 142 3.701 -9.130 -2.338 1082 HZ PHE 142 HZ PHE 142 2.329 -10.424 -3.949 1083 H GLY 143 H GLY 143 3.255 -10.404 1.857 1084 1HA GLY 143 1HA GLY 143 1.312 -8.840 0.801 1085 2HA GLY 143 2HA GLY 143 0.600 -9.273 2.353 1086 H LEU 144 H LEU 144 0.743 -6.921 2.638 1087 HA LEU 144 HA LEU 144 3.445 -5.906 3.297 1088 1HB LEU 144 1HB LEU 144 0.880 -4.707 2.467 1089 2HB LEU 144 2HB LEU 144 1.679 -3.825 3.767 1090 HG LEU 144 HG LEU 144 3.774 -3.820 2.409 1091 1HD1 LEU 144 1HD1 LEU 144 1.975 -5.369 0.604 1092 2HD1 LEU 144 2HD1 LEU 144 3.098 -4.239 -0.151 1093 3HD1 LEU 144 3HD1 LEU 144 3.710 -5.538 0.873 1094 1HD2 LEU 144 1HD2 LEU 144 1.324 -2.643 1.060 1095 2HD2 LEU 144 2HD2 LEU 144 2.234 -1.893 2.372 1096 3HD2 LEU 144 3HD2 LEU 144 2.987 -2.119 0.792 1097 H SER 145 H SER 145 3.883 -5.030 5.383 1098 HA SER 145 HA SER 145 2.513 -6.371 7.590 1099 1HB SER 145 1HB SER 145 4.113 -4.910 8.962 1100 2HB SER 145 2HB SER 145 4.862 -6.049 7.859 1101 HG SER 145 HG SER 145 5.497 -4.452 6.605 1102 H PHE 146 H PHE 146 2.526 -3.184 6.121 1103 HA PHE 146 HA PHE 146 0.018 -2.451 7.327 1104 1HB PHE 146 1HB PHE 146 0.867 -0.630 8.805 1105 2HB PHE 146 2HB PHE 146 1.396 -2.222 9.357 1106 HD1 PHE 146 HD1 PHE 146 3.725 -2.971 9.023 1107 HD2 PHE 146 HD2 PHE 146 2.423 0.946 7.827 1108 HE1 PHE 146 HE1 PHE 146 6.075 -2.274 8.745 1109 HE2 PHE 146 HE2 PHE 146 4.776 1.652 7.544 1110 HZ PHE 146 HZ PHE 146 6.622 0.032 7.979 1111 H VAL 147 H VAL 147 -0.450 -0.077 6.885 1112 HA VAL 147 HA VAL 147 1.221 1.057 4.712 1113 HB VAL 147 HB VAL 147 -0.801 1.546 3.370 1114 1HG1 VAL 147 1HG1 VAL 147 0.597 -0.646 3.236 1115 2HG1 VAL 147 2HG1 VAL 147 -0.818 -1.407 3.961 1116 3HG1 VAL 147 3HG1 VAL 147 -0.957 -0.591 2.404 1117 1HG2 VAL 147 1HG2 VAL 147 -2.095 0.323 5.757 1118 2HG2 VAL 147 2HG2 VAL 147 -2.695 1.579 4.675 1119 3HG2 VAL 147 3HG2 VAL 147 -2.781 -0.114 4.192 1120 H ARG 148 H ARG 148 0.820 3.384 4.437 1121 HA ARG 148 HA ARG 148 -0.844 4.765 6.418 1122 1HB ARG 148 1HB ARG 148 2.082 4.371 6.744 1123 2HB ARG 148 2HB ARG 148 1.488 6.002 7.040 1124 1HG ARG 148 1HG ARG 148 -0.293 4.924 8.522 1125 2HG ARG 148 2HG ARG 148 0.667 3.448 8.414 1126 1HD ARG 148 1HD ARG 148 2.418 4.328 9.633 1127 2HD ARG 148 2HD ARG 148 2.073 5.983 9.134 1128 HE ARG 148 HE ARG 148 -0.020 4.864 10.819 1129 1HH1 ARG 148 1HH1 ARG 148 3.093 6.457 10.798 1130 2HH1 ARG 148 2HH1 ARG 148 2.879 7.117 12.382 1131 1HH2 ARG 148 1HH2 ARG 148 -0.256 5.738 12.865 1132 2HH2 ARG 148 2HH2 ARG 148 1.004 6.716 13.541 1133 H PHE 149 H PHE 149 -0.789 7.094 6.094 1134 HA PHE 149 HA PHE 149 0.608 8.154 3.723 1135 1HB PHE 149 1HB PHE 149 -2.421 8.205 3.972 1136 2HB PHE 149 2HB PHE 149 -1.484 9.039 2.735 1137 HD1 PHE 149 HD1 PHE 149 0.330 7.390 1.538 1138 HD2 PHE 149 HD2 PHE 149 -3.370 6.195 3.351 1139 HE1 PHE 149 HE1 PHE 149 0.314 5.331 0.153 1140 HE2 PHE 149 HE2 PHE 149 -3.393 4.141 1.962 1141 HZ PHE 149 HZ PHE 149 -1.547 3.708 0.364 1142 H HIS 150 H HIS 150 0.626 10.526 3.775 1143 HA HIS 150 HA HIS 150 -0.762 11.867 5.981 1144 1HB HIS 150 1HB HIS 150 1.981 12.667 6.327 1145 2HB HIS 150 2HB HIS 150 0.877 11.984 7.510 1146 HD1 HIS 150 HD1 HIS 150 0.993 9.413 7.916 1147 HD2 HIS 150 HD2 HIS 150 3.810 10.809 5.188 1148 HE1 HIS 150 HE1 HIS 150 2.656 7.533 7.579 1149 H SER 151 H SER 151 -0.949 14.058 5.681 1150 HA SER 151 HA SER 151 0.077 15.086 3.079 1151 1HB SER 151 1HB SER 151 -1.818 16.900 4.002 1152 2HB SER 151 2HB SER 151 -2.101 15.634 2.814 1153 HG SER 151 HG SER 151 -2.504 15.556 5.620 Start of MODEL 5 1 H MET 1 H MET 1 -3.865 19.974 7.851 2 HA MET 1 HA MET 1 -4.277 17.636 9.633 3 1HB MET 1 1HB MET 1 -5.094 18.355 6.823 4 2HB MET 1 2HB MET 1 -4.907 16.666 7.296 5 1HG MET 1 1HG MET 1 -6.691 16.733 8.767 6 2HG MET 1 2HG MET 1 -6.501 18.458 9.082 7 1HE MET 1 1HE MET 1 -6.988 20.228 7.758 8 2HE MET 1 2HE MET 1 -8.286 20.342 6.574 9 3HE MET 1 3HE MET 1 -8.653 19.940 8.257 10 HA PRO 2 HA PRO 2 -0.016 17.220 7.935 11 1HB PRO 2 1HB PRO 2 1.179 16.684 10.328 12 2HB PRO 2 2HB PRO 2 0.874 18.327 9.743 13 1HG PRO 2 1HG PRO 2 -0.400 16.881 11.946 14 2HG PRO 2 2HG PRO 2 -0.399 18.613 11.593 15 1HD PRO 2 1HD PRO 2 -2.488 16.673 11.056 16 2HD PRO 2 2HD PRO 2 -2.524 18.434 10.803 17 H GLU 3 H GLU 3 -2.301 15.135 8.564 18 HA GLU 3 HA GLU 3 -0.576 12.783 8.225 19 1HB GLU 3 1HB GLU 3 -1.166 13.383 10.800 20 2HB GLU 3 2HB GLU 3 -2.593 12.435 10.381 21 1HG GLU 3 1HG GLU 3 -1.004 10.852 11.185 22 2HG GLU 3 2HG GLU 3 -0.969 10.695 9.428 23 H ILE 4 H ILE 4 -1.866 10.869 7.631 24 HA ILE 4 HA ILE 4 -4.677 11.459 6.850 25 HB ILE 4 HB ILE 4 -2.480 10.454 5.009 26 1HG1 ILE 4 1HG1 ILE 4 -4.335 12.842 4.785 27 2HG1 ILE 4 2HG1 ILE 4 -2.695 12.931 5.424 28 1HG2 ILE 4 1HG2 ILE 4 -5.461 10.298 4.825 29 2HG2 ILE 4 2HG2 ILE 4 -4.567 10.696 3.358 30 3HG2 ILE 4 3HG2 ILE 4 -4.240 9.185 4.207 31 1HD1 ILE 4 1HD1 ILE 4 -3.255 11.746 2.709 32 2HD1 ILE 4 2HD1 ILE 4 -3.023 13.481 2.925 33 3HD1 ILE 4 3HD1 ILE 4 -1.729 12.360 3.344 34 H ARG 5 H ARG 5 -5.987 9.765 7.347 35 HA ARG 5 HA ARG 5 -4.683 7.148 7.977 36 1HB ARG 5 1HB ARG 5 -6.362 8.805 9.553 37 2HB ARG 5 2HB ARG 5 -7.339 7.411 9.104 38 1HG ARG 5 1HG ARG 5 -6.309 6.283 10.764 39 2HG ARG 5 2HG ARG 5 -4.855 6.303 9.770 40 1HD ARG 5 1HD ARG 5 -5.023 8.854 11.019 41 2HD ARG 5 2HD ARG 5 -5.342 7.651 12.267 42 HE ARG 5 HE ARG 5 -2.799 8.091 10.928 43 1HH1 ARG 5 1HH1 ARG 5 -4.818 5.719 12.517 44 2HH1 ARG 5 2HH1 ARG 5 -3.473 4.734 12.974 45 1HH2 ARG 5 1HH2 ARG 5 -1.089 6.788 11.540 46 2HH2 ARG 5 2HH2 ARG 5 -1.383 5.330 12.428 47 H LEU 6 H LEU 6 -6.216 5.247 7.672 48 HA LEU 6 HA LEU 6 -7.605 5.554 5.063 49 1HB LEU 6 1HB LEU 6 -6.054 3.461 6.381 50 2HB LEU 6 2HB LEU 6 -7.590 2.843 5.785 51 HG LEU 6 HG LEU 6 -7.105 3.716 3.543 52 1HD1 LEU 6 1HD1 LEU 6 -5.756 5.683 4.307 53 2HD1 LEU 6 2HD1 LEU 6 -4.438 4.582 4.708 54 3HD1 LEU 6 3HD1 LEU 6 -4.958 4.762 3.032 55 1HD2 LEU 6 1HD2 LEU 6 -4.851 2.114 4.784 56 2HD2 LEU 6 2HD2 LEU 6 -6.323 1.470 4.056 57 3HD2 LEU 6 3HD2 LEU 6 -5.121 2.276 3.048 58 H ARG 7 H ARG 7 -9.704 4.425 4.802 59 HA ARG 7 HA ARG 7 -11.278 4.422 7.347 60 1HB ARG 7 1HB ARG 7 -11.813 6.230 5.623 61 2HB ARG 7 2HB ARG 7 -12.393 4.929 4.582 62 1HG ARG 7 1HG ARG 7 -14.336 5.647 5.721 63 2HG ARG 7 2HG ARG 7 -13.828 4.213 6.613 64 1HD ARG 7 1HD ARG 7 -12.985 5.466 8.406 65 2HD ARG 7 2HD ARG 7 -12.829 6.929 7.434 66 HE ARG 7 HE ARG 7 -15.222 6.059 8.838 67 1HH1 ARG 7 1HH1 ARG 7 -14.017 7.846 6.085 68 2HH1 ARG 7 2HH1 ARG 7 -15.434 8.830 5.976 69 1HH2 ARG 7 1HH2 ARG 7 -17.037 7.355 8.662 70 2HH2 ARG 7 2HH2 ARG 7 -17.127 8.557 7.418 71 H HIS 8 H HIS 8 -11.026 2.963 4.121 72 HA HIS 8 HA HIS 8 -11.588 0.316 5.204 73 1HB HIS 8 1HB HIS 8 -13.593 -0.061 3.763 74 2HB HIS 8 2HB HIS 8 -13.879 1.128 5.030 75 HD1 HIS 8 HD1 HIS 8 -14.594 3.430 4.301 76 HD2 HIS 8 HD2 HIS 8 -13.087 1.184 1.129 77 HE1 HIS 8 HE1 HIS 8 -14.995 4.792 2.204 78 H VAL 9 H VAL 9 -12.101 -1.104 2.950 79 HA VAL 9 HA VAL 9 -9.788 -0.411 1.204 80 HB VAL 9 HB VAL 9 -9.595 -2.580 2.365 81 1HG1 VAL 9 1HG1 VAL 9 -12.357 -2.755 1.877 82 2HG1 VAL 9 2HG1 VAL 9 -11.638 -4.015 0.877 83 3HG1 VAL 9 3HG1 VAL 9 -11.333 -3.985 2.612 84 1HG2 VAL 9 1HG2 VAL 9 -8.659 -2.301 0.078 85 2HG2 VAL 9 2HG2 VAL 9 -9.153 -3.964 0.395 86 3HG2 VAL 9 3HG2 VAL 9 -10.168 -2.918 -0.596 87 H VAL 10 H VAL 10 -10.921 1.000 -0.213 88 HA VAL 10 HA VAL 10 -13.439 0.584 -1.383 89 HB VAL 10 HB VAL 10 -12.508 2.715 -1.760 90 1HG1 VAL 10 1HG1 VAL 10 -10.037 1.364 -1.911 91 2HG1 VAL 10 2HG1 VAL 10 -10.221 2.189 -3.451 92 3HG1 VAL 10 3HG1 VAL 10 -10.309 3.100 -1.946 93 1HG2 VAL 10 1HG2 VAL 10 -13.711 1.856 -3.760 94 2HG2 VAL 10 2HG2 VAL 10 -12.444 3.000 -4.201 95 3HG2 VAL 10 3HG2 VAL 10 -12.182 1.269 -4.414 96 H SER 11 H SER 11 -10.335 -0.211 -3.054 97 HA SER 11 HA SER 11 -11.874 -2.374 -4.433 98 1HB SER 11 1HB SER 11 -10.284 -0.238 -5.546 99 2HB SER 11 2HB SER 11 -9.557 -1.787 -5.961 100 HG SER 11 HG SER 11 -12.069 -0.732 -6.602 101 H CYS 12 H CYS 12 -10.604 -4.374 -4.818 102 HA CYS 12 HA CYS 12 -7.987 -4.588 -3.500 103 1HB CYS 12 1HB CYS 12 -8.804 -6.212 -1.820 104 2HB CYS 12 2HB CYS 12 -9.465 -4.611 -1.576 105 HG CYS 12 HG CYS 12 -11.068 -7.052 -2.666 106 H SER 13 H SER 13 -6.841 -6.094 -4.593 107 HA SER 13 HA SER 13 -8.251 -8.501 -5.622 108 1HB SER 13 1HB SER 13 -7.483 -6.427 -7.308 109 2HB SER 13 2HB SER 13 -6.159 -7.577 -7.453 110 HG SER 13 HG SER 13 -7.979 -7.938 -8.889 111 H SER 14 H SER 14 -7.113 -9.071 -3.502 112 HA SER 14 HA SER 14 -5.185 -10.962 -3.634 113 1HB SER 14 1HB SER 14 -3.100 -9.545 -2.853 114 2HB SER 14 2HB SER 14 -3.423 -9.795 -4.562 115 HG SER 14 HG SER 14 -4.601 -7.599 -3.260 116 H GLN 15 H GLN 15 -7.178 -10.529 -1.887 117 HA GLN 15 HA GLN 15 -5.772 -9.816 0.665 118 1HB GLN 15 1HB GLN 15 -8.730 -9.725 0.755 119 2HB GLN 15 2HB GLN 15 -7.556 -8.597 1.405 120 1HG GLN 15 1HG GLN 15 -8.450 -8.774 -1.483 121 2HG GLN 15 2HG GLN 15 -8.906 -7.523 -0.330 122 1HE2 GLN 15 2HE2 GLN 15 -6.179 -7.341 0.868 123 2HE2 GLN 15 1HE2 GLN 15 -5.220 -6.558 -0.295 124 H ASP 16 H ASP 16 -6.053 -11.139 2.412 125 HA ASP 16 HA ASP 16 -7.149 -13.834 1.840 126 1HB ASP 16 1HB ASP 16 -4.850 -13.015 3.062 127 2HB ASP 16 2HB ASP 16 -5.899 -13.257 4.451 128 H SER 17 H SER 17 -7.907 -14.669 4.353 129 HA SER 17 HA SER 17 -10.351 -13.054 4.774 130 1HB SER 17 1HB SER 17 -10.035 -15.745 4.554 131 2HB SER 17 2HB SER 17 -9.970 -15.564 6.304 132 HG SER 17 HG SER 17 -12.031 -15.193 6.279 133 H THR 18 H THR 18 -8.239 -14.887 7.022 134 HA THR 18 HA THR 18 -8.883 -13.258 9.280 135 HB THR 18 HB THR 18 -6.425 -14.258 9.921 136 HG1 THR 18 HG1 THR 18 -6.373 -16.325 8.877 137 1HG2 THR 18 1HG2 THR 18 -9.187 -15.429 9.952 138 2HG2 THR 18 2HG2 THR 18 -7.827 -16.391 10.532 139 3HG2 THR 18 3HG2 THR 18 -8.207 -14.850 11.300 140 H HIS 19 H HIS 19 -5.980 -13.281 7.191 141 HA HIS 19 HA HIS 19 -5.265 -10.596 8.266 142 1HB HIS 19 1HB HIS 19 -3.633 -12.436 6.487 143 2HB HIS 19 2HB HIS 19 -3.059 -10.986 7.311 144 HD1 HIS 19 HD1 HIS 19 -2.931 -14.490 7.694 145 HD2 HIS 19 HD2 HIS 19 -3.717 -11.369 10.343 146 HE1 HIS 19 HE1 HIS 19 -2.536 -15.409 10.021 147 H CYS 20 H CYS 20 -7.208 -9.850 6.941 148 HA CYS 20 HA CYS 20 -6.759 -9.762 4.028 149 1HB CYS 20 1HB CYS 20 -8.967 -8.634 3.968 150 2HB CYS 20 2HB CYS 20 -9.040 -10.159 4.842 151 HG CYS 20 HG CYS 20 -9.240 -7.342 6.143 152 H ALA 21 H ALA 21 -7.103 -7.539 2.978 153 HA ALA 21 HA ALA 21 -5.045 -5.758 3.822 154 1HB ALA 21 1HB ALA 21 -7.213 -5.751 1.778 155 2HB ALA 21 2HB ALA 21 -6.503 -4.192 2.196 156 3HB ALA 21 3HB ALA 21 -5.481 -5.493 1.582 157 H GLU 22 H GLU 22 -8.443 -5.979 4.654 158 HA GLU 22 HA GLU 22 -8.874 -3.306 5.531 159 1HB GLU 22 1HB GLU 22 -10.397 -5.598 5.446 160 2HB GLU 22 2HB GLU 22 -10.161 -5.384 7.181 161 1HG GLU 22 1HG GLU 22 -10.871 -2.967 6.879 162 2HG GLU 22 2HG GLU 22 -11.324 -3.379 5.226 163 H ASN 23 H ASN 23 -6.907 -5.831 6.885 164 HA ASN 23 HA ASN 23 -6.929 -4.984 9.634 165 1HB ASN 23 1HB ASN 23 -4.999 -6.512 7.913 166 2HB ASN 23 2HB ASN 23 -4.555 -6.055 9.557 167 1HD2 ASN 23 2HD2 ASN 23 -5.818 -8.597 7.874 168 2HD2 ASN 23 1HD2 ASN 23 -6.793 -9.291 9.076 169 H LEU 24 H LEU 24 -5.575 -3.647 6.772 170 HA LEU 24 HA LEU 24 -3.396 -2.169 7.876 171 1HB LEU 24 1HB LEU 24 -5.109 -1.478 5.468 172 2HB LEU 24 2HB LEU 24 -3.470 -0.916 5.791 173 HG LEU 24 HG LEU 24 -3.986 -3.873 5.691 174 1HD1 LEU 24 1HD1 LEU 24 -4.999 -2.610 3.649 175 2HD1 LEU 24 2HD1 LEU 24 -3.317 -2.348 3.193 176 3HD1 LEU 24 3HD1 LEU 24 -3.940 -3.989 3.359 177 1HD2 LEU 24 1HD2 LEU 24 -1.779 -2.427 6.220 178 2HD2 LEU 24 2HD2 LEU 24 -1.718 -4.003 5.431 179 3HD2 LEU 24 3HD2 LEU 24 -1.639 -2.530 4.465 180 H LEU 25 H LEU 25 -6.871 -1.702 7.832 181 HA LEU 25 HA LEU 25 -7.005 1.088 8.327 182 1HB LEU 25 1HB LEU 25 -8.735 -1.291 8.885 183 2HB LEU 25 2HB LEU 25 -9.109 0.206 9.716 184 HG LEU 25 HG LEU 25 -10.359 -0.069 7.569 185 1HD1 LEU 25 1HD1 LEU 25 -8.579 2.211 8.215 186 2HD1 LEU 25 2HD1 LEU 25 -9.284 2.212 6.600 187 3HD1 LEU 25 3HD1 LEU 25 -10.327 2.161 8.019 188 1HD2 LEU 25 1HD2 LEU 25 -8.452 -1.239 6.382 189 2HD2 LEU 25 2HD2 LEU 25 -9.208 0.054 5.452 190 3HD2 LEU 25 3HD2 LEU 25 -7.658 0.330 6.249 191 H LYS 26 H LYS 26 -5.902 -1.564 10.297 192 HA LYS 26 HA LYS 26 -5.618 0.330 12.595 193 1HB LYS 26 1HB LYS 26 -5.989 -2.645 12.999 194 2HB LYS 26 2HB LYS 26 -6.184 -1.341 14.168 195 1HG LYS 26 1HG LYS 26 -8.404 -1.722 13.709 196 2HG LYS 26 2HG LYS 26 -8.059 -0.573 12.416 197 1HD LYS 26 1HD LYS 26 -7.879 -2.271 10.788 198 2HD LYS 26 2HD LYS 26 -7.664 -3.533 12.002 199 1HE LYS 26 1HE LYS 26 -10.090 -2.606 12.750 200 2HE LYS 26 2HE LYS 26 -10.162 -2.255 11.023 201 1HZ LYS 26 1HZ LYS 26 -9.374 -4.611 10.694 202 2HZ LYS 26 2HZ LYS 26 -9.723 -4.870 12.337 203 3HZ LYS 26 3HZ LYS 26 -10.963 -4.429 11.267 204 H ALA 27 H ALA 27 -3.528 0.619 11.383 205 HA ALA 27 HA ALA 27 -1.567 -1.318 10.920 206 1HB ALA 27 1HB ALA 27 -1.376 1.559 11.798 207 2HB ALA 27 2HB ALA 27 0.073 0.593 11.526 208 3HB ALA 27 3HB ALA 27 -1.062 0.870 10.206 209 H ASP 28 H ASP 28 -2.117 0.452 13.987 210 HA ASP 28 HA ASP 28 -0.127 -1.229 15.365 211 1HB ASP 28 1HB ASP 28 -0.778 0.133 17.362 212 2HB ASP 28 2HB ASP 28 -0.257 1.121 15.998 213 H THR 29 H THR 29 -1.398 -3.238 14.857 214 HA THR 29 HA THR 29 -3.093 -3.958 17.128 215 HB THR 29 HB THR 29 -4.375 -4.548 14.536 216 HG1 THR 29 HG1 THR 29 -4.587 -1.994 15.742 217 1HG2 THR 29 1HG2 THR 29 -5.122 -5.081 16.980 218 2HG2 THR 29 2HG2 THR 29 -5.675 -3.406 16.984 219 3HG2 THR 29 3HG2 THR 29 -6.328 -4.546 15.809 220 H TYR 30 H TYR 30 -0.583 -4.804 15.843 221 HA TYR 30 HA TYR 30 0.524 -6.709 15.096 222 1HB TYR 30 1HB TYR 30 0.132 -8.610 16.463 223 2HB TYR 30 2HB TYR 30 -0.296 -7.207 17.429 224 HD1 TYR 30 HD1 TYR 30 -1.686 -10.082 15.526 225 HD2 TYR 30 HD2 TYR 30 -2.524 -6.825 18.205 226 HE1 TYR 30 HE1 TYR 30 -3.933 -11.023 15.971 227 HE2 TYR 30 HE2 TYR 30 -4.764 -7.782 18.662 228 HH TYR 30 HH TYR 30 -6.382 -9.276 17.559 229 H ARG 31 H ARG 31 -1.757 -5.784 13.379 230 HA ARG 31 HA ARG 31 -2.269 -8.385 11.989 231 1HB ARG 31 1HB ARG 31 -3.996 -5.891 12.058 232 2HB ARG 31 2HB ARG 31 -4.323 -7.317 11.075 233 1HG ARG 31 1HG ARG 31 -3.839 -7.861 13.943 234 2HG ARG 31 2HG ARG 31 -5.310 -6.954 13.592 235 1HD ARG 31 1HD ARG 31 -5.562 -8.820 11.698 236 2HD ARG 31 2HD ARG 31 -4.574 -9.746 12.827 237 HE ARG 31 HE ARG 31 -6.634 -8.585 14.352 238 1HH1 ARG 31 1HH1 ARG 31 -6.333 -10.835 11.690 239 2HH1 ARG 31 2HH1 ARG 31 -7.774 -11.690 12.119 240 1HH2 ARG 31 1HH2 ARG 31 -8.491 -9.721 14.870 241 2HH2 ARG 31 2HH2 ARG 31 -8.984 -11.067 13.899 242 H LYS 32 H LYS 32 -1.599 -8.485 9.875 243 HA LYS 32 HA LYS 32 -0.663 -5.941 8.599 244 1HB LYS 32 1HB LYS 32 0.622 -8.681 8.418 245 2HB LYS 32 2HB LYS 32 1.199 -7.211 7.639 246 1HG LYS 32 1HG LYS 32 1.848 -6.235 9.675 247 2HG LYS 32 2HG LYS 32 0.785 -7.278 10.618 248 1HD LYS 32 1HD LYS 32 2.318 -9.186 9.576 249 2HD LYS 32 2HD LYS 32 3.480 -7.863 9.468 250 1HE LYS 32 1HE LYS 32 3.505 -7.526 11.794 251 2HE LYS 32 2HE LYS 32 1.967 -8.358 12.025 252 1HZ LYS 32 1HZ LYS 32 3.233 -10.380 11.115 253 2HZ LYS 32 2HZ LYS 32 4.635 -9.502 11.504 254 3HZ LYS 32 3HZ LYS 32 3.517 -9.905 12.718 255 H TRP 33 H TRP 33 -0.184 -6.585 6.093 256 HA TRP 33 HA TRP 33 -2.763 -7.674 5.108 257 1HB TRP 33 1HB TRP 33 -1.990 -5.502 4.137 258 2HB TRP 33 2HB TRP 33 -0.526 -6.288 3.597 259 HD1 TRP 33 HD1 TRP 33 -3.923 -8.009 3.319 260 HE1 TRP 33 HE1 TRP 33 -4.465 -8.345 0.811 261 HE3 TRP 33 HE3 TRP 33 -0.105 -5.386 1.250 262 HZ2 TRP 33 HZ2 TRP 33 -3.414 -7.577 -1.710 263 HZ3 TRP 33 HZ3 TRP 33 0.117 -5.217 -1.227 264 HH2 TRP 33 HH2 TRP 33 -1.540 -6.297 -2.701 265 H ARG 34 H ARG 34 -2.877 -9.561 3.979 266 HA ARG 34 HA ARG 34 -0.359 -10.861 3.100 267 1HB ARG 34 1HB ARG 34 -2.502 -12.170 4.819 268 2HB ARG 34 2HB ARG 34 -1.214 -13.052 4.001 269 1HG ARG 34 1HG ARG 34 0.482 -11.882 5.276 270 2HG ARG 34 2HG ARG 34 -0.732 -10.820 5.993 271 1HD ARG 34 1HD ARG 34 -0.627 -12.358 7.694 272 2HD ARG 34 2HD ARG 34 -1.790 -13.204 6.675 273 HE ARG 34 HE ARG 34 -0.132 -14.806 6.174 274 1HH1 ARG 34 1HH1 ARG 34 1.311 -11.990 7.671 275 2HH1 ARG 34 2HH1 ARG 34 2.848 -12.758 7.862 276 1HH2 ARG 34 1HH2 ARG 34 1.875 -15.753 6.434 277 2HH2 ARG 34 2HH2 ARG 34 3.166 -14.864 7.170 278 H ALA 35 H ALA 35 -0.665 -11.584 1.030 279 HA ALA 35 HA ALA 35 -2.971 -11.058 -0.478 280 1HB ALA 35 1HB ALA 35 -0.604 -11.772 -1.265 281 2HB ALA 35 2HB ALA 35 -1.182 -13.427 -1.076 282 3HB ALA 35 3HB ALA 35 -1.978 -12.340 -2.214 283 H ALA 36 H ALA 36 -4.439 -12.676 -1.521 284 HA ALA 36 HA ALA 36 -5.795 -14.220 0.507 285 1HB ALA 36 1HB ALA 36 -6.630 -13.021 -1.734 286 2HB ALA 36 2HB ALA 36 -6.394 -14.644 -2.384 287 3HB ALA 36 3HB ALA 36 -7.499 -14.386 -1.033 288 H LYS 37 H LYS 37 -3.351 -14.987 -1.850 289 HA LYS 37 HA LYS 37 -3.467 -17.808 -0.961 290 1HB LYS 37 1HB LYS 37 -2.972 -18.526 -3.299 291 2HB LYS 37 2HB LYS 37 -4.563 -17.790 -3.138 292 1HG LYS 37 1HG LYS 37 -3.046 -15.592 -3.692 293 2HG LYS 37 2HG LYS 37 -2.175 -16.828 -4.598 294 1HD LYS 37 1HD LYS 37 -3.773 -16.112 -6.151 295 2HD LYS 37 2HD LYS 37 -4.552 -17.525 -5.438 296 1HE LYS 37 1HE LYS 37 -6.223 -15.838 -5.409 297 2HE LYS 37 2HE LYS 37 -5.605 -15.887 -3.758 298 1HZ LYS 37 1HZ LYS 37 -4.730 -13.991 -5.869 299 2HZ LYS 37 2HZ LYS 37 -5.779 -13.620 -4.589 300 3HZ LYS 37 3HZ LYS 37 -4.161 -14.030 -4.269 301 H ALA 38 H ALA 38 -1.372 -18.895 -1.875 302 HA ALA 38 HA ALA 38 0.875 -17.242 -0.942 303 1HB ALA 38 1HB ALA 38 0.592 -19.639 -0.245 304 2HB ALA 38 2HB ALA 38 0.902 -20.114 -1.916 305 3HB ALA 38 3HB ALA 38 2.158 -19.301 -0.982 306 H GLY 39 H GLY 39 3.020 -17.907 -2.362 307 1HA GLY 39 1HA GLY 39 4.012 -17.970 -4.555 308 2HA GLY 39 2HA GLY 39 2.423 -17.667 -5.255 309 H GLU 40 H GLU 40 1.589 -15.434 -3.922 310 HA GLU 40 HA GLU 40 1.674 -13.118 -4.255 311 1HB GLU 40 1HB GLU 40 4.356 -13.557 -2.945 312 2HB GLU 40 2HB GLU 40 3.375 -12.092 -2.911 313 1HG GLU 40 1HG GLU 40 2.515 -12.914 -0.993 314 2HG GLU 40 2HG GLU 40 1.595 -14.001 -2.020 315 H LYS 41 H LYS 41 1.875 -13.070 -6.579 316 HA LYS 41 HA LYS 41 4.643 -12.574 -7.575 317 1HB LYS 41 1HB LYS 41 3.751 -12.927 -9.820 318 2HB LYS 41 2HB LYS 41 3.285 -14.283 -8.799 319 1HG LYS 41 1HG LYS 41 1.091 -13.044 -8.392 320 2HG LYS 41 2HG LYS 41 1.571 -11.959 -9.694 321 1HD LYS 41 1HD LYS 41 0.420 -13.510 -10.950 322 2HD LYS 41 2HD LYS 41 2.000 -14.295 -10.944 323 1HE LYS 41 1HE LYS 41 1.365 -15.850 -9.306 324 2HE LYS 41 2HE LYS 41 0.029 -14.848 -8.737 325 1HZ LYS 41 1HZ LYS 41 -0.989 -15.209 -10.986 326 2HZ LYS 41 2HZ LYS 41 0.195 -16.397 -11.257 327 3HZ LYS 41 3HZ LYS 41 -0.922 -16.579 -9.990 328 H THR 42 H THR 42 1.369 -11.254 -7.533 329 HA THR 42 HA THR 42 2.371 -8.522 -7.405 330 HB THR 42 HB THR 42 0.872 -7.900 -9.447 331 HG1 THR 42 HG1 THR 42 0.475 -9.499 -10.853 332 1HG2 THR 42 1HG2 THR 42 3.571 -8.290 -9.170 333 2HG2 THR 42 2HG2 THR 42 3.200 -9.336 -10.534 334 3HG2 THR 42 3HG2 THR 42 2.801 -7.620 -10.604 335 H ILE 43 H ILE 43 1.105 -8.040 -5.643 336 HA ILE 43 HA ILE 43 -1.767 -8.853 -5.744 337 HB ILE 43 HB ILE 43 -1.665 -8.214 -3.247 338 1HG1 ILE 43 1HG1 ILE 43 1.298 -8.603 -3.749 339 2HG1 ILE 43 2HG1 ILE 43 0.544 -7.049 -3.390 340 1HG2 ILE 43 1HG2 ILE 43 -1.516 -10.546 -4.489 341 2HG2 ILE 43 2HG2 ILE 43 0.104 -10.540 -3.790 342 3HG2 ILE 43 3HG2 ILE 43 -1.309 -10.416 -2.743 343 1HD1 ILE 43 1HD1 ILE 43 -0.464 -8.567 -1.361 344 2HD1 ILE 43 2HD1 ILE 43 1.108 -9.335 -1.589 345 3HD1 ILE 43 3HD1 ILE 43 1.013 -7.612 -1.224 346 H SER 44 H SER 44 -3.382 -7.332 -5.712 347 HA SER 44 HA SER 44 -2.474 -4.482 -5.505 348 1HB SER 44 1HB SER 44 -4.170 -3.860 -7.065 349 2HB SER 44 2HB SER 44 -3.370 -5.265 -7.757 350 HG SER 44 HG SER 44 -5.886 -5.018 -7.379 351 H VAL 45 H VAL 45 -3.478 -3.234 -4.021 352 HA VAL 45 HA VAL 45 -6.029 -4.144 -2.813 353 HB VAL 45 HB VAL 45 -4.293 -5.060 -1.349 354 1HG1 VAL 45 1HG1 VAL 45 -2.659 -3.114 -2.006 355 2HG1 VAL 45 2HG1 VAL 45 -3.407 -2.275 -0.649 356 3HG1 VAL 45 3HG1 VAL 45 -2.569 -3.805 -0.389 357 1HG2 VAL 45 1HG2 VAL 45 -5.879 -2.704 -0.321 358 2HG2 VAL 45 2HG2 VAL 45 -6.276 -4.418 -0.211 359 3HG2 VAL 45 3HG2 VAL 45 -4.957 -3.754 0.755 360 H VAL 46 H VAL 46 -7.181 -2.348 -3.559 361 HA VAL 46 HA VAL 46 -5.981 0.336 -3.310 362 HB VAL 46 HB VAL 46 -8.770 -0.272 -4.256 363 1HG1 VAL 46 1HG1 VAL 46 -8.052 2.085 -3.774 364 2HG1 VAL 46 2HG1 VAL 46 -6.825 1.909 -5.028 365 3HG1 VAL 46 3HG1 VAL 46 -8.534 1.814 -5.448 366 1HG2 VAL 46 1HG2 VAL 46 -6.143 -0.621 -5.674 367 2HG2 VAL 46 2HG2 VAL 46 -7.577 -1.647 -5.732 368 3HG2 VAL 46 3HG2 VAL 46 -7.561 -0.104 -6.588 369 H LEU 47 H LEU 47 -6.193 1.419 -1.470 370 HA LEU 47 HA LEU 47 -8.445 0.732 0.349 371 1HB LEU 47 1HB LEU 47 -6.151 2.501 1.149 372 2HB LEU 47 2HB LEU 47 -7.126 1.427 2.148 373 HG LEU 47 HG LEU 47 -5.955 -0.328 0.339 374 1HD1 LEU 47 1HD1 LEU 47 -4.510 1.593 -0.419 375 2HD1 LEU 47 2HD1 LEU 47 -3.839 1.661 1.210 376 3HD1 LEU 47 3HD1 LEU 47 -3.605 0.220 0.219 377 1HD2 LEU 47 1HD2 LEU 47 -6.192 -0.210 2.985 378 2HD2 LEU 47 2HD2 LEU 47 -4.978 -1.242 2.231 379 3HD2 LEU 47 3HD2 LEU 47 -4.516 0.327 2.884 380 H GLN 48 H GLN 48 -9.354 2.623 1.599 381 HA GLN 48 HA GLN 48 -9.734 4.933 -0.255 382 1HB GLN 48 1HB GLN 48 -11.667 3.357 0.691 383 2HB GLN 48 2HB GLN 48 -11.542 4.443 2.076 384 1HG GLN 48 1HG GLN 48 -11.635 5.668 -0.648 385 2HG GLN 48 2HG GLN 48 -13.134 5.010 0.011 386 1HE2 GLN 48 2HE2 GLN 48 -11.985 7.914 -0.347 387 2HE2 GLN 48 1HE2 GLN 48 -12.284 8.625 1.164 388 H LEU 49 H LEU 49 -9.877 7.074 0.751 389 HA LEU 49 HA LEU 49 -8.200 7.273 3.204 390 1HB LEU 49 1HB LEU 49 -8.773 9.330 1.044 391 2HB LEU 49 2HB LEU 49 -7.725 9.576 2.440 392 HG LEU 49 HG LEU 49 -7.304 7.402 0.371 393 1HD1 LEU 49 1HD1 LEU 49 -7.028 9.691 -0.576 394 2HD1 LEU 49 2HD1 LEU 49 -5.861 10.050 0.696 395 3HD1 LEU 49 3HD1 LEU 49 -5.503 8.807 -0.501 396 1HD2 LEU 49 1HD2 LEU 49 -5.641 8.470 2.672 397 2HD2 LEU 49 2HD2 LEU 49 -6.327 6.852 2.523 398 3HD2 LEU 49 3HD2 LEU 49 -5.025 7.360 1.447 399 H GLU 50 H GLU 50 -9.261 7.884 4.998 400 HA GLU 50 HA GLU 50 -12.021 8.329 5.204 401 1HB GLU 50 1HB GLU 50 -11.531 9.269 7.449 402 2HB GLU 50 2HB GLU 50 -10.650 7.775 7.134 403 1HG GLU 50 1HG GLU 50 -8.611 8.839 6.998 404 2HG GLU 50 2HG GLU 50 -9.314 10.333 6.377 405 H LYS 51 H LYS 51 -9.838 10.538 3.796 406 HA LYS 51 HA LYS 51 -11.907 12.574 3.639 407 1HB LYS 51 1HB LYS 51 -10.426 14.376 4.612 408 2HB LYS 51 2HB LYS 51 -11.037 13.222 5.796 409 1HG LYS 51 1HG LYS 51 -8.969 12.290 6.162 410 2HG LYS 51 2HG LYS 51 -8.438 12.560 4.502 411 1HD LYS 51 1HD LYS 51 -8.132 14.941 4.946 412 2HD LYS 51 2HD LYS 51 -8.770 14.745 6.578 413 1HE LYS 51 1HE LYS 51 -6.473 13.014 5.776 414 2HE LYS 51 2HE LYS 51 -6.142 14.716 6.097 415 1HZ LYS 51 1HZ LYS 51 -7.319 14.441 8.237 416 2HZ LYS 51 2HZ LYS 51 -7.437 12.776 7.932 417 3HZ LYS 51 3HZ LYS 51 -5.910 13.498 8.118 418 H GLU 52 H GLU 52 -11.569 13.869 1.829 419 HA GLU 52 HA GLU 52 -9.511 13.030 -0.042 420 1HB GLU 52 1HB GLU 52 -11.927 13.942 -0.518 421 2HB GLU 52 2HB GLU 52 -11.147 15.515 -0.380 422 1HG GLU 52 1HG GLU 52 -9.664 15.068 -2.184 423 2HG GLU 52 2HG GLU 52 -10.058 13.349 -2.175 424 H GLU 53 H GLU 53 -7.489 13.658 0.350 425 HA GLU 53 HA GLU 53 -6.916 16.536 0.716 426 1HB GLU 53 1HB GLU 53 -4.999 15.519 2.362 427 2HB GLU 53 2HB GLU 53 -6.532 16.154 2.945 428 1HG GLU 53 1HG GLU 53 -5.999 13.933 3.929 429 2HG GLU 53 2HG GLU 53 -7.486 13.894 2.982 430 H GLN 54 H GLN 54 -4.388 16.768 0.616 431 HA GLN 54 HA GLN 54 -3.544 15.423 -1.859 432 1HB GLN 54 1HB GLN 54 -2.147 17.503 -0.141 433 2HB GLN 54 2HB GLN 54 -1.588 16.942 -1.715 434 1HG GLN 54 1HG GLN 54 -3.423 17.899 -2.844 435 2HG GLN 54 2HG GLN 54 -4.348 18.078 -1.364 436 1HE2 GLN 54 2HE2 GLN 54 -0.906 18.974 -1.711 437 2HE2 GLN 54 1HE2 GLN 54 -1.151 20.638 -1.484 438 H ILE 55 H ILE 55 -0.867 15.035 -1.606 439 HA ILE 55 HA ILE 55 -0.466 13.393 0.846 440 HB ILE 55 HB ILE 55 0.057 12.396 -1.974 441 1HG1 ILE 55 1HG1 ILE 55 -1.703 10.645 -0.876 442 2HG1 ILE 55 2HG1 ILE 55 -2.224 12.133 -0.085 443 1HG2 ILE 55 1HG2 ILE 55 0.703 11.392 0.771 444 2HG2 ILE 55 2HG2 ILE 55 0.250 10.210 -0.457 445 3HG2 ILE 55 3HG2 ILE 55 1.640 11.263 -0.718 446 1HD1 ILE 55 1HD1 ILE 55 -1.730 12.101 -3.052 447 2HD1 ILE 55 2HD1 ILE 55 -3.258 11.504 -2.404 448 3HD1 ILE 55 3HD1 ILE 55 -2.769 13.173 -2.112 449 H HIS 56 H HIS 56 1.419 13.983 1.741 450 HA HIS 56 HA HIS 56 3.545 15.141 -0.010 451 1HB HIS 56 1HB HIS 56 2.604 16.621 1.793 452 2HB HIS 56 2HB HIS 56 3.200 15.467 2.986 453 HD1 HIS 56 HD1 HIS 56 4.408 17.923 0.386 454 HD2 HIS 56 HD2 HIS 56 5.984 15.557 3.435 455 HE1 HIS 56 HE1 HIS 56 6.817 18.647 0.683 456 H SER 57 H SER 57 2.794 12.729 2.434 457 HA SER 57 HA SER 57 5.345 11.357 1.800 458 1HB SER 57 1HB SER 57 4.561 12.423 4.494 459 2HB SER 57 2HB SER 57 5.440 10.900 4.405 460 HG SER 57 HG SER 57 6.201 13.444 3.411 461 H VAL 58 H VAL 58 5.228 9.085 2.332 462 HA VAL 58 HA VAL 58 2.516 8.085 3.060 463 HB VAL 58 HB VAL 58 4.165 7.366 0.620 464 1HG1 VAL 58 1HG1 VAL 58 1.904 5.914 1.959 465 2HG1 VAL 58 2HG1 VAL 58 2.042 5.871 0.201 466 3HG1 VAL 58 3HG1 VAL 58 3.358 5.266 1.204 467 1HG2 VAL 58 1HG2 VAL 58 1.563 8.763 1.135 468 2HG2 VAL 58 2HG2 VAL 58 2.873 9.213 0.044 469 3HG2 VAL 58 3HG2 VAL 58 1.788 7.888 -0.380 470 H ASP 59 H ASP 59 2.588 5.803 3.807 471 HA ASP 59 HA ASP 59 5.322 4.899 4.613 472 1HB ASP 59 1HB ASP 59 3.802 6.057 6.429 473 2HB ASP 59 2HB ASP 59 2.976 4.502 6.434 474 H ILE 60 H ILE 60 5.679 2.758 4.324 475 HA ILE 60 HA ILE 60 3.435 0.852 4.232 476 HB ILE 60 HB ILE 60 5.057 1.621 1.816 477 1HG1 ILE 60 1HG1 ILE 60 2.665 0.822 0.907 478 2HG1 ILE 60 2HG1 ILE 60 2.212 1.169 2.574 479 1HG2 ILE 60 1HG2 ILE 60 4.272 -1.165 2.562 480 2HG2 ILE 60 2HG2 ILE 60 4.037 -0.665 0.888 481 3HG2 ILE 60 3HG2 ILE 60 5.646 -0.605 1.607 482 1HD1 ILE 60 1HD1 ILE 60 3.800 3.346 1.830 483 2HD1 ILE 60 2HD1 ILE 60 2.811 3.015 0.407 484 3HD1 ILE 60 3HD1 ILE 60 2.041 3.329 1.961 485 H GLY 61 H GLY 61 4.104 -0.921 5.341 486 1HA GLY 61 1HA GLY 61 6.989 -1.177 5.899 487 2HA GLY 61 2HA GLY 61 5.723 -1.984 6.791 488 H ASN 62 H ASN 62 8.128 -2.494 4.636 489 HA ASN 62 HA ASN 62 6.885 -4.365 2.812 490 1HB ASN 62 1HB ASN 62 9.568 -3.374 3.364 491 2HB ASN 62 2HB ASN 62 9.591 -5.112 3.069 492 1HD2 ASN 62 2HD2 ASN 62 10.390 -5.118 0.912 493 2HD2 ASN 62 1HD2 ASN 62 9.583 -4.376 -0.385 494 H ASP 63 H ASP 63 6.226 -6.428 3.215 495 HA ASP 63 HA ASP 63 7.392 -7.835 5.591 496 1HB ASP 63 1HB ASP 63 4.975 -7.102 5.873 497 2HB ASP 63 2HB ASP 63 4.568 -8.176 4.536 498 H GLY 64 H GLY 64 8.934 -8.716 4.053 499 1HA GLY 64 1HA GLY 64 9.667 -10.553 2.763 500 2HA GLY 64 2HA GLY 64 8.020 -11.186 2.807 501 H SER 65 H SER 65 8.100 -7.922 1.813 502 HA SER 65 HA SER 65 7.571 -8.733 -0.987 503 1HB SER 65 1HB SER 65 6.813 -6.272 -1.107 504 2HB SER 65 2HB SER 65 5.825 -7.379 -0.158 505 HG SER 65 HG SER 65 6.552 -5.254 0.793 506 H ALA 66 H ALA 66 8.263 -6.837 -2.556 507 HA ALA 66 HA ALA 66 10.994 -5.896 -1.867 508 1HB ALA 66 1HB ALA 66 10.800 -8.143 -3.282 509 2HB ALA 66 2HB ALA 66 10.540 -7.007 -4.604 510 3HB ALA 66 3HB ALA 66 12.025 -6.935 -3.657 511 H PHE 67 H PHE 67 8.392 -5.861 -4.321 512 HA PHE 67 HA PHE 67 9.147 -3.025 -4.908 513 1HB PHE 67 1HB PHE 67 7.452 -4.886 -6.596 514 2HB PHE 67 2HB PHE 67 8.058 -3.304 -7.059 515 HD1 PHE 67 HD1 PHE 67 10.772 -3.144 -6.382 516 HD2 PHE 67 HD2 PHE 67 8.591 -6.617 -7.657 517 HE1 PHE 67 HE1 PHE 67 12.879 -4.171 -7.183 518 HE2 PHE 67 HE2 PHE 67 10.696 -7.646 -8.457 519 HZ PHE 67 HZ PHE 67 12.844 -6.425 -8.221 520 H VAL 68 H VAL 68 7.733 -1.430 -4.404 521 HA VAL 68 HA VAL 68 4.902 -2.195 -3.812 522 HB VAL 68 HB VAL 68 6.584 -0.304 -2.141 523 1HG1 VAL 68 1HG1 VAL 68 3.948 -0.092 -2.442 524 2HG1 VAL 68 2HG1 VAL 68 3.940 -1.452 -1.319 525 3HG1 VAL 68 3HG1 VAL 68 4.688 0.074 -0.851 526 1HG2 VAL 68 1HG2 VAL 68 7.199 -2.715 -1.925 527 2HG2 VAL 68 2HG2 VAL 68 6.497 -2.057 -0.445 528 3HG2 VAL 68 3HG2 VAL 68 5.523 -3.072 -1.509 529 H GLU 69 H GLU 69 3.697 -1.130 -5.246 530 HA GLU 69 HA GLU 69 4.539 1.598 -6.137 531 1HB GLU 69 1HB GLU 69 4.294 -0.071 -7.940 532 2HB GLU 69 2HB GLU 69 2.640 -0.393 -7.425 533 1HG GLU 69 1HG GLU 69 1.903 1.777 -8.075 534 2HG GLU 69 2HG GLU 69 3.553 2.377 -8.229 535 H VAL 70 H VAL 70 2.955 3.287 -6.171 536 HA VAL 70 HA VAL 70 0.376 2.703 -4.807 537 HB VAL 70 HB VAL 70 2.207 4.969 -3.990 538 1HG1 VAL 70 1HG1 VAL 70 -0.586 4.200 -3.395 539 2HG1 VAL 70 2HG1 VAL 70 0.389 4.629 -1.989 540 3HG1 VAL 70 3HG1 VAL 70 0.190 5.780 -3.309 541 1HG2 VAL 70 1HG2 VAL 70 1.858 2.179 -2.996 542 2HG2 VAL 70 2HG2 VAL 70 3.297 3.199 -2.990 543 3HG2 VAL 70 3HG2 VAL 70 2.033 3.449 -1.786 544 H LEU 71 H LEU 71 -1.253 3.653 -5.859 545 HA LEU 71 HA LEU 71 -0.668 5.955 -7.675 546 1HB LEU 71 1HB LEU 71 -2.197 3.471 -8.022 547 2HB LEU 71 2HB LEU 71 -3.123 4.905 -8.453 548 HG LEU 71 HG LEU 71 -1.253 5.638 -9.916 549 1HD1 LEU 71 1HD1 LEU 71 -0.075 3.008 -8.990 550 2HD1 LEU 71 2HD1 LEU 71 0.472 3.831 -10.451 551 3HD1 LEU 71 3HD1 LEU 71 0.649 4.613 -8.881 552 1HD2 LEU 71 1HD2 LEU 71 -3.191 4.009 -10.589 553 2HD2 LEU 71 2HD2 LEU 71 -1.838 4.232 -11.698 554 3HD2 LEU 71 3HD2 LEU 71 -1.909 2.801 -10.670 555 H VAL 72 H VAL 72 -2.480 7.528 -7.821 556 HA VAL 72 HA VAL 72 -4.097 7.605 -5.312 557 HB VAL 72 HB VAL 72 -3.865 10.142 -5.604 558 1HG1 VAL 72 1HG1 VAL 72 -2.859 8.783 -3.786 559 2HG1 VAL 72 2HG1 VAL 72 -1.439 8.530 -4.799 560 3HG1 VAL 72 3HG1 VAL 72 -1.846 10.152 -4.241 561 1HG2 VAL 72 1HG2 VAL 72 -1.514 9.170 -7.246 562 2HG2 VAL 72 2HG2 VAL 72 -2.834 10.190 -7.808 563 3HG2 VAL 72 3HG2 VAL 72 -1.679 10.813 -6.633 564 H GLY 73 H GLY 73 -6.138 8.734 -5.488 565 1HA GLY 73 1HA GLY 73 -7.140 9.754 -7.968 566 2HA GLY 73 2HA GLY 73 -7.700 8.104 -7.719 567 H SER 74 H SER 74 -9.559 10.021 -7.781 568 HA SER 74 HA SER 74 -10.323 10.431 -4.943 569 1HB SER 74 1HB SER 74 -9.973 12.572 -5.993 570 2HB SER 74 2HB SER 74 -10.938 12.100 -7.380 571 HG SER 74 HG SER 74 -11.761 13.271 -5.190 572 H SER 75 H SER 75 -12.680 10.507 -4.616 573 HA SER 75 HA SER 75 -13.976 8.213 -5.781 574 1HB SER 75 1HB SER 75 -14.347 9.431 -3.449 575 2HB SER 75 2HB SER 75 -15.529 10.348 -4.374 576 HG SER 75 HG SER 75 -16.720 8.596 -4.619 577 H ALA 76 H ALA 76 -13.536 11.375 -6.887 578 HA ALA 76 HA ALA 76 -15.985 12.035 -8.101 579 1HB ALA 76 1HB ALA 76 -13.586 13.238 -7.995 580 2HB ALA 76 2HB ALA 76 -13.498 12.594 -9.635 581 3HB ALA 76 3HB ALA 76 -14.809 13.684 -9.184 582 H GLY 77 H GLY 77 -16.890 11.559 -10.134 583 1HA GLY 77 1HA GLY 77 -15.857 9.068 -11.394 584 2HA GLY 77 2HA GLY 77 -17.496 9.696 -11.571 585 H GLY 78 H GLY 78 -14.524 11.589 -11.891 586 1HA GLY 78 1HA GLY 78 -15.352 12.826 -14.330 587 2HA GLY 78 2HA GLY 78 -13.706 12.844 -13.697 588 H ALA 79 H ALA 79 -12.189 11.517 -14.640 589 HA ALA 79 HA ALA 79 -12.809 10.275 -17.170 590 1HB ALA 79 1HB ALA 79 -10.560 11.248 -16.443 591 2HB ALA 79 2HB ALA 79 -10.336 9.772 -15.502 592 3HB ALA 79 3HB ALA 79 -10.494 9.684 -17.256 593 H GLY 80 H GLY 80 -12.433 9.088 -13.870 594 1HA GLY 80 1HA GLY 80 -14.011 6.982 -13.675 595 2HA GLY 80 2HA GLY 80 -12.843 6.293 -14.804 596 H GLU 81 H GLU 81 -13.582 6.034 -11.729 597 HA GLU 81 HA GLU 81 -10.977 6.516 -10.467 598 1HB GLU 81 1HB GLU 81 -13.366 4.975 -9.400 599 2HB GLU 81 2HB GLU 81 -12.014 5.607 -8.460 600 1HG GLU 81 1HG GLU 81 -13.424 7.376 -8.132 601 2HG GLU 81 2HG GLU 81 -12.819 7.878 -9.711 602 H GLN 82 H GLN 82 -9.858 5.136 -12.122 603 HA GLN 82 HA GLN 82 -9.516 2.415 -11.055 604 1HB GLN 82 1HB GLN 82 -10.394 2.942 -13.911 605 2HB GLN 82 2HB GLN 82 -9.748 1.401 -13.345 606 1HG GLN 82 1HG GLN 82 -11.593 1.580 -11.508 607 2HG GLN 82 2HG GLN 82 -12.336 2.745 -12.606 608 1HE2 GLN 82 2HE2 GLN 82 -11.696 1.574 -15.111 609 2HE2 GLN 82 1HE2 GLN 82 -12.478 0.073 -15.234 610 H ASP 83 H ASP 83 -8.658 4.702 -13.647 611 HA ASP 83 HA ASP 83 -6.040 3.584 -14.104 612 1HB ASP 83 1HB ASP 83 -7.528 5.282 -15.523 613 2HB ASP 83 2HB ASP 83 -6.589 6.477 -14.628 614 H TYR 84 H TYR 84 -7.175 6.411 -12.221 615 HA TYR 84 HA TYR 84 -6.189 7.598 -10.493 616 1HB TYR 84 1HB TYR 84 -4.957 4.868 -10.239 617 2HB TYR 84 2HB TYR 84 -4.384 6.191 -9.237 618 HD1 TYR 84 HD1 TYR 84 -7.869 5.486 -10.437 619 HD2 TYR 84 HD2 TYR 84 -5.190 5.715 -7.084 620 HE1 TYR 84 HE1 TYR 84 -9.772 5.144 -8.890 621 HE2 TYR 84 HE2 TYR 84 -7.100 5.378 -5.540 622 HH TYR 84 HH TYR 84 -9.435 4.269 -5.727 623 H GLU 85 H GLU 85 -4.073 8.541 -9.832 624 HA GLU 85 HA GLU 85 -2.300 8.793 -12.209 625 1HB GLU 85 1HB GLU 85 -1.588 10.738 -10.217 626 2HB GLU 85 2HB GLU 85 -2.230 11.008 -11.829 627 1HG GLU 85 1HG GLU 85 -3.945 10.434 -9.392 628 2HG GLU 85 2HG GLU 85 -3.610 12.043 -10.020 629 H VAL 86 H VAL 86 -0.277 8.025 -12.134 630 HA VAL 86 HA VAL 86 0.587 6.325 -10.030 631 HB VAL 86 HB VAL 86 2.308 7.694 -12.117 632 1HG1 VAL 86 1HG1 VAL 86 2.713 5.474 -10.161 633 2HG1 VAL 86 2HG1 VAL 86 3.434 5.292 -11.760 634 3HG1 VAL 86 3HG1 VAL 86 3.862 6.673 -10.751 635 1HG2 VAL 86 1HG2 VAL 86 0.137 6.149 -12.666 636 2HG2 VAL 86 2HG2 VAL 86 1.583 6.178 -13.674 637 3HG2 VAL 86 3HG2 VAL 86 1.366 4.900 -12.479 638 H LEU 87 H LEU 87 0.411 7.577 -8.063 639 HA LEU 87 HA LEU 87 1.774 10.041 -7.587 640 1HB LEU 87 1HB LEU 87 0.048 8.726 -6.106 641 2HB LEU 87 2HB LEU 87 1.484 7.945 -5.447 642 HG LEU 87 HG LEU 87 2.419 10.310 -5.099 643 1HD1 LEU 87 1HD1 LEU 87 0.314 11.102 -6.602 644 2HD1 LEU 87 2HD1 LEU 87 -0.389 11.282 -4.995 645 3HD1 LEU 87 3HD1 LEU 87 1.088 12.150 -5.413 646 1HD2 LEU 87 1HD2 LEU 87 1.060 8.662 -3.445 647 2HD2 LEU 87 2HD2 LEU 87 1.650 10.244 -2.933 648 3HD2 LEU 87 3HD2 LEU 87 -0.031 10.047 -3.427 649 H LEU 88 H LEU 88 2.773 6.678 -6.871 650 HA LEU 88 HA LEU 88 5.567 7.487 -7.376 651 1HB LEU 88 1HB LEU 88 6.393 6.465 -5.317 652 2HB LEU 88 2HB LEU 88 5.293 7.795 -4.972 653 HG LEU 88 HG LEU 88 3.662 5.502 -5.175 654 1HD1 LEU 88 1HD1 LEU 88 6.336 4.968 -3.974 655 2HD1 LEU 88 2HD1 LEU 88 4.932 4.343 -3.109 656 3HD1 LEU 88 3HD1 LEU 88 5.225 3.861 -4.779 657 1HD2 LEU 88 1HD2 LEU 88 4.645 7.332 -3.005 658 2HD2 LEU 88 2HD2 LEU 88 3.016 7.151 -3.655 659 3HD2 LEU 88 3HD2 LEU 88 3.672 5.929 -2.566 660 H VAL 89 H VAL 89 6.382 6.047 -8.763 661 HA VAL 89 HA VAL 89 5.071 3.664 -9.588 662 HB VAL 89 HB VAL 89 8.071 3.991 -9.788 663 1HG1 VAL 89 1HG1 VAL 89 5.895 2.598 -11.295 664 2HG1 VAL 89 2HG1 VAL 89 7.311 3.153 -12.188 665 3HG1 VAL 89 3HG1 VAL 89 7.501 2.018 -10.852 666 1HG2 VAL 89 1HG2 VAL 89 5.911 5.621 -11.091 667 2HG2 VAL 89 2HG2 VAL 89 7.508 6.127 -10.538 668 3HG2 VAL 89 3HG2 VAL 89 7.343 5.205 -12.032 669 H THR 90 H THR 90 6.241 1.398 -9.404 670 HA THR 90 HA THR 90 6.147 0.597 -6.703 671 HB THR 90 HB THR 90 5.979 -0.790 -8.936 672 HG1 THR 90 HG1 THR 90 5.510 -1.874 -7.178 673 1HG2 THR 90 1HG2 THR 90 8.541 -0.304 -9.323 674 2HG2 THR 90 2HG2 THR 90 8.761 -1.633 -8.185 675 3HG2 THR 90 3HG2 THR 90 7.884 -1.899 -9.691 676 H SER 91 H SER 91 7.647 0.466 -5.116 677 HA SER 91 HA SER 91 10.355 1.530 -5.726 678 1HB SER 91 1HB SER 91 10.355 1.914 -3.176 679 2HB SER 91 2HB SER 91 9.305 2.945 -4.142 680 HG SER 91 HG SER 91 7.570 1.825 -3.470 681 H SER 92 H SER 92 12.052 0.237 -5.430 682 HA SER 92 HA SER 92 11.652 -2.527 -4.521 683 1HB SER 92 1HB SER 92 14.380 -1.601 -5.118 684 2HB SER 92 2HB SER 92 13.537 -3.034 -5.682 685 HG SER 92 HG SER 92 13.291 -1.943 -7.457 686 H PHE 93 H PHE 93 11.970 -3.125 -2.435 687 HA PHE 93 HA PHE 93 13.795 -1.445 -0.762 688 1HB PHE 93 1HB PHE 93 11.285 -2.885 0.098 689 2HB PHE 93 2HB PHE 93 12.356 -1.993 1.167 690 HD1 PHE 93 HD1 PHE 93 13.006 0.409 -0.408 691 HD2 PHE 93 HD2 PHE 93 9.276 -1.688 0.008 692 HE1 PHE 93 HE1 PHE 93 11.774 2.494 -0.936 693 HE2 PHE 93 HE2 PHE 93 8.047 0.401 -0.519 694 HZ PHE 93 HZ PHE 93 9.296 2.490 -0.990 695 H MET 94 H MET 94 12.362 -4.681 -1.134 696 HA MET 94 HA MET 94 14.846 -5.803 0.107 697 1HB MET 94 1HB MET 94 12.060 -6.192 0.773 698 2HB MET 94 2HB MET 94 12.757 -7.727 0.265 699 1HG MET 94 1HG MET 94 14.400 -7.679 1.957 700 2HG MET 94 2HG MET 94 14.198 -5.948 2.228 701 1HE MET 94 1HE MET 94 12.315 -9.024 1.719 702 2HE MET 94 2HE MET 94 12.547 -9.611 3.362 703 3HE MET 94 3HE MET 94 10.960 -9.032 2.843 704 H SER 95 H SER 95 14.434 -8.464 -0.524 705 HA SER 95 HA SER 95 14.324 -8.486 -3.512 706 1HB SER 95 1HB SER 95 16.286 -9.795 -3.624 707 2HB SER 95 2HB SER 95 16.664 -8.630 -2.363 708 HG SER 95 HG SER 95 16.750 -10.208 -0.983 709 HA PRO 96 HA PRO 96 11.808 -12.137 -2.956 710 1HB PRO 96 1HB PRO 96 12.535 -13.682 -5.084 711 2HB PRO 96 2HB PRO 96 11.619 -12.176 -5.242 712 1HG PRO 96 1HG PRO 96 14.396 -12.748 -5.989 713 2HG PRO 96 2HG PRO 96 13.338 -11.432 -6.516 714 1HD PRO 96 1HD PRO 96 15.435 -11.339 -4.534 715 2HD PRO 96 2HD PRO 96 14.395 -10.010 -5.091 716 H SER 97 H SER 97 14.840 -12.322 -1.912 717 HA SER 97 HA SER 97 14.782 -15.288 -1.537 718 1HB SER 97 1HB SER 97 16.726 -14.304 -2.893 719 2HB SER 97 2HB SER 97 17.260 -13.561 -1.388 720 HG SER 97 HG SER 97 18.251 -15.486 -1.370 721 H GLU 98 H GLU 98 15.614 -12.157 -0.059 722 HA GLU 98 HA GLU 98 16.259 -13.076 2.537 723 1HB GLU 98 1HB GLU 98 15.404 -10.529 1.304 724 2HB GLU 98 2HB GLU 98 15.062 -10.668 3.029 725 1HG GLU 98 1HG GLU 98 17.255 -9.743 2.862 726 2HG GLU 98 2HG GLU 98 17.466 -11.432 3.320 727 H SER 99 H SER 99 13.169 -12.938 0.946 728 HA SER 99 HA SER 99 11.347 -12.616 3.038 729 1HB SER 99 1HB SER 99 11.121 -14.666 0.819 730 2HB SER 99 2HB SER 99 9.792 -13.958 1.732 731 HG SER 99 HG SER 99 9.892 -12.692 -0.013 732 H ARG 100 H ARG 100 13.480 -15.332 2.460 733 HA ARG 100 HA ARG 100 12.044 -17.065 4.343 734 1HB ARG 100 1HB ARG 100 14.706 -17.423 2.930 735 2HB ARG 100 2HB ARG 100 13.881 -18.664 3.875 736 1HG ARG 100 1HG ARG 100 12.163 -18.891 2.316 737 2HG ARG 100 2HG ARG 100 12.413 -17.276 1.655 738 1HD ARG 100 1HD ARG 100 14.832 -18.448 1.125 739 2HD ARG 100 2HD ARG 100 13.735 -19.817 0.952 740 HE ARG 100 HE ARG 100 12.667 -17.546 -0.435 741 1HH1 ARG 100 1HH1 ARG 100 15.198 -19.951 -0.644 742 2HH1 ARG 100 2HH1 ARG 100 15.264 -19.877 -2.370 743 1HH2 ARG 100 1HH2 ARG 100 12.787 -17.483 -2.667 744 2HH2 ARG 100 2HH2 ARG 100 13.914 -18.496 -3.505 745 H SER 101 H SER 101 15.579 -16.636 4.458 746 HA SER 101 HA SER 101 15.541 -15.125 6.926 747 1HB SER 101 1HB SER 101 14.912 -17.591 7.524 748 2HB SER 101 2HB SER 101 16.604 -17.937 7.177 749 HG SER 101 HG SER 101 16.979 -17.208 9.104 750 H GLY 102 H GLY 102 16.740 -14.928 4.337 751 1HA GLY 102 1HA GLY 102 19.553 -15.727 4.612 752 2HA GLY 102 2HA GLY 102 18.853 -14.841 3.256 753 H SER 103 H SER 103 17.567 -12.965 5.338 754 HA SER 103 HA SER 103 19.716 -11.639 6.701 755 1HB SER 103 1HB SER 103 19.344 -11.015 3.875 756 2HB SER 103 2HB SER 103 19.275 -9.593 4.912 757 HG SER 103 HG SER 103 21.419 -10.657 4.087 758 H ASN 104 H ASN 104 17.281 -9.966 4.863 759 HA ASN 104 HA ASN 104 15.785 -9.422 7.375 760 1HB ASN 104 1HB ASN 104 15.211 -7.185 6.111 761 2HB ASN 104 2HB ASN 104 16.742 -7.328 6.966 762 1HD2 ASN 104 2HD2 ASN 104 15.485 -8.156 3.665 763 2HD2 ASN 104 1HD2 ASN 104 16.854 -7.580 2.844 764 HA PRO 105 HA PRO 105 12.822 -11.294 4.392 765 1HB PRO 105 1HB PRO 105 11.257 -12.438 6.325 766 2HB PRO 105 2HB PRO 105 12.711 -13.198 5.674 767 1HG PRO 105 1HG PRO 105 12.313 -11.813 8.271 768 2HG PRO 105 2HG PRO 105 13.339 -13.203 7.878 769 1HD PRO 105 1HD PRO 105 14.268 -10.609 8.191 770 2HD PRO 105 2HD PRO 105 15.111 -11.877 7.275 771 H ASN 106 H ASN 106 12.441 -9.259 7.186 772 HA ASN 106 HA ASN 106 9.916 -8.152 6.021 773 1HB ASN 106 1HB ASN 106 10.499 -9.110 8.748 774 2HB ASN 106 2HB ASN 106 9.789 -7.497 8.703 775 1HD2 ASN 106 2HD2 ASN 106 9.177 -10.173 6.393 776 2HD2 ASN 106 1HD2 ASN 106 7.522 -10.304 6.744 777 H ARG 107 H ARG 107 9.807 -5.875 5.973 778 HA ARG 107 HA ARG 107 11.998 -4.341 7.242 779 1HB ARG 107 1HB ARG 107 11.697 -4.813 4.322 780 2HB ARG 107 2HB ARG 107 12.078 -3.163 4.814 781 1HG ARG 107 1HG ARG 107 13.618 -5.547 5.853 782 2HG ARG 107 2HG ARG 107 14.080 -4.697 4.378 783 1HD ARG 107 1HD ARG 107 14.240 -2.584 5.647 784 2HD ARG 107 2HD ARG 107 13.789 -3.439 7.123 785 HE ARG 107 HE ARG 107 16.101 -4.630 5.829 786 1HH1 ARG 107 1HH1 ARG 107 15.035 -2.062 7.951 787 2HH1 ARG 107 2HH1 ARG 107 16.574 -1.931 8.728 788 1HH2 ARG 107 1HH2 ARG 107 18.074 -4.427 6.863 789 2HH2 ARG 107 2HH2 ARG 107 18.276 -3.254 8.122 790 H VAL 108 H VAL 108 11.637 -1.907 6.304 791 HA VAL 108 HA VAL 108 8.758 -1.224 6.190 792 HB VAL 108 HB VAL 108 10.648 -0.318 8.368 793 1HG1 VAL 108 1HG1 VAL 108 8.062 0.806 7.378 794 2HG1 VAL 108 2HG1 VAL 108 8.363 0.814 9.115 795 3HG1 VAL 108 3HG1 VAL 108 9.471 1.646 8.025 796 1HG2 VAL 108 1HG2 VAL 108 8.101 -1.939 8.331 797 2HG2 VAL 108 2HG2 VAL 108 9.688 -2.437 8.917 798 3HG2 VAL 108 3HG2 VAL 108 8.757 -1.233 9.808 799 H ARG 109 H ARG 109 8.479 0.774 5.057 800 HA ARG 109 HA ARG 109 10.814 2.502 4.618 801 1HB ARG 109 1HB ARG 109 9.961 0.517 2.662 802 2HB ARG 109 2HB ARG 109 9.865 2.147 1.998 803 1HG ARG 109 1HG ARG 109 12.085 1.878 1.588 804 2HG ARG 109 2HG ARG 109 12.276 2.245 3.300 805 1HD ARG 109 1HD ARG 109 11.640 -0.511 3.160 806 2HD ARG 109 2HD ARG 109 12.846 -0.216 1.907 807 HE ARG 109 HE ARG 109 13.310 -0.126 4.767 808 1HH1 ARG 109 1HH1 ARG 109 14.282 1.235 1.695 809 2HH1 ARG 109 2HH1 ARG 109 15.859 1.655 2.266 810 1HH2 ARG 109 1HH2 ARG 109 15.361 0.434 5.463 811 2HH2 ARG 109 2HH2 ARG 109 16.467 1.207 4.376 812 H MET 110 H MET 110 10.235 4.569 3.977 813 HA MET 110 HA MET 110 7.306 5.109 3.718 814 1HB MET 110 1HB MET 110 9.360 6.831 5.135 815 2HB MET 110 2HB MET 110 7.629 7.150 5.023 816 1HG MET 110 1HG MET 110 7.112 5.636 6.637 817 2HG MET 110 2HG MET 110 8.316 4.477 6.079 818 1HE MET 110 1HE MET 110 10.388 4.191 6.629 819 2HE MET 110 2HE MET 110 11.294 4.835 7.996 820 3HE MET 110 3HE MET 110 9.892 3.807 8.283 821 H PHE 111 H PHE 111 6.764 6.921 2.396 822 HA PHE 111 HA PHE 111 8.927 7.768 0.522 823 1HB PHE 111 1HB PHE 111 5.954 7.832 -0.047 824 2HB PHE 111 2HB PHE 111 7.275 7.988 -1.198 825 HD1 PHE 111 HD1 PHE 111 5.807 5.586 1.277 826 HD2 PHE 111 HD2 PHE 111 8.073 6.098 -2.337 827 HE1 PHE 111 HE1 PHE 111 5.781 3.144 0.910 828 HE2 PHE 111 HE2 PHE 111 8.048 3.644 -2.697 829 HZ PHE 111 HZ PHE 111 6.899 2.161 -1.068 830 H GLY 112 H GLY 112 8.721 10.024 -0.230 831 1HA GLY 112 1HA GLY 112 7.237 11.779 1.662 832 2HA GLY 112 2HA GLY 112 8.887 12.116 1.201 833 HA PRO 113 HA PRO 113 6.356 14.476 -1.841 834 1HB PRO 113 1HB PRO 113 8.089 16.582 -1.955 835 2HB PRO 113 2HB PRO 113 6.820 16.427 -0.731 836 1HG PRO 113 1HG PRO 113 9.747 15.982 -0.482 837 2HG PRO 113 2HG PRO 113 8.589 16.584 0.714 838 1HD PRO 113 1HD PRO 113 9.592 13.981 0.646 839 2HD PRO 113 2HD PRO 113 8.107 14.469 1.471 840 H ASP 114 H ASP 114 9.867 13.981 -1.798 841 HA ASP 114 HA ASP 114 10.318 14.430 -4.593 842 1HB ASP 114 1HB ASP 114 11.981 14.157 -2.517 843 2HB ASP 114 2HB ASP 114 12.028 12.491 -3.096 844 H LYS 115 H LYS 115 9.222 11.667 -2.744 845 HA LYS 115 HA LYS 115 9.546 9.855 -5.039 846 1HB LYS 115 1HB LYS 115 8.305 9.383 -2.315 847 2HB LYS 115 2HB LYS 115 8.653 8.140 -3.519 848 1HG LYS 115 1HG LYS 115 11.083 8.963 -3.438 849 2HG LYS 115 2HG LYS 115 10.619 9.844 -1.981 850 1HD LYS 115 1HD LYS 115 9.589 7.440 -1.355 851 2HD LYS 115 2HD LYS 115 10.898 6.910 -2.413 852 1HE LYS 115 1HE LYS 115 12.491 8.284 -1.071 853 2HE LYS 115 2HE LYS 115 11.172 8.690 0.027 854 1HZ LYS 115 1HZ LYS 115 11.985 5.905 -0.590 855 2HZ LYS 115 2HZ LYS 115 12.582 6.778 0.736 856 3HZ LYS 115 3HZ LYS 115 10.923 6.428 0.629 857 H LEU 116 H LEU 116 7.330 12.227 -4.405 858 HA LEU 116 HA LEU 116 5.170 10.596 -5.688 859 1HB LEU 116 1HB LEU 116 3.542 12.229 -4.561 860 2HB LEU 116 2HB LEU 116 4.261 10.977 -3.559 861 HG LEU 116 HG LEU 116 6.075 12.810 -3.059 862 1HD1 LEU 116 1HD1 LEU 116 4.432 14.268 -4.781 863 2HD1 LEU 116 2HD1 LEU 116 3.986 14.838 -3.177 864 3HD1 LEU 116 3HD1 LEU 116 5.663 14.930 -3.710 865 1HD2 LEU 116 1HD2 LEU 116 3.256 12.873 -1.959 866 2HD2 LEU 116 2HD2 LEU 116 4.580 11.861 -1.383 867 3HD2 LEU 116 3HD2 LEU 116 4.652 13.611 -1.175 868 H VAL 117 H VAL 117 4.145 11.447 -7.393 869 HA VAL 117 HA VAL 117 5.415 13.477 -8.947 870 HB VAL 117 HB VAL 117 3.920 11.731 -9.901 871 1HG1 VAL 117 1HG1 VAL 117 2.293 11.844 -7.991 872 2HG1 VAL 117 2HG1 VAL 117 1.675 13.325 -8.698 873 3HG1 VAL 117 3HG1 VAL 117 1.543 11.810 -9.587 874 1HG2 VAL 117 1HG2 VAL 117 4.288 14.082 -10.958 875 2HG2 VAL 117 2HG2 VAL 117 2.972 13.088 -11.583 876 3HG2 VAL 117 3HG2 VAL 117 2.628 14.398 -10.452 877 H ARG 118 H ARG 118 5.190 15.702 -8.909 878 HA ARG 118 HA ARG 118 3.637 16.916 -6.769 879 1HB ARG 118 1HB ARG 118 5.565 17.823 -8.831 880 2HB ARG 118 2HB ARG 118 4.363 19.022 -8.351 881 1HG ARG 118 1HG ARG 118 5.004 18.880 -6.050 882 2HG ARG 118 2HG ARG 118 5.983 17.444 -6.343 883 1HD ARG 118 1HD ARG 118 7.733 18.645 -7.201 884 2HD ARG 118 2HD ARG 118 6.677 19.844 -7.949 885 HE ARG 118 HE ARG 118 6.383 20.333 -5.249 886 1HH1 ARG 118 1HH1 ARG 118 9.134 20.061 -7.392 887 2HH1 ARG 118 2HH1 ARG 118 10.092 21.159 -6.463 888 1HH2 ARG 118 1HH2 ARG 118 7.659 21.749 -4.078 889 2HH2 ARG 118 2HH2 ARG 118 9.269 22.106 -4.606 890 H ALA 119 H ALA 119 3.246 16.500 -10.254 891 HA ALA 119 HA ALA 119 1.060 18.293 -10.619 892 1HB ALA 119 1HB ALA 119 1.695 15.724 -12.096 893 2HB ALA 119 2HB ALA 119 0.594 16.980 -12.659 894 3HB ALA 119 3HB ALA 119 2.316 17.325 -12.501 895 H ALA 120 H ALA 120 1.219 15.183 -9.090 896 HA ALA 120 HA ALA 120 -1.764 15.070 -9.029 897 1HB ALA 120 1HB ALA 120 -0.090 13.139 -9.999 898 2HB ALA 120 2HB ALA 120 -0.262 12.623 -8.321 899 3HB ALA 120 3HB ALA 120 -1.692 12.813 -9.337 900 H ALA 121 H ALA 121 1.174 14.324 -7.083 901 HA ALA 121 HA ALA 121 0.010 13.725 -4.631 902 1HB ALA 121 1HB ALA 121 2.466 13.784 -5.173 903 2HB ALA 121 2HB ALA 121 2.411 15.532 -4.944 904 3HB ALA 121 3HB ALA 121 2.052 14.453 -3.596 905 H GLU 122 H GLU 122 0.539 17.011 -5.947 906 HA GLU 122 HA GLU 122 -0.509 18.267 -3.528 907 1HB GLU 122 1HB GLU 122 -0.332 20.369 -4.772 908 2HB GLU 122 2HB GLU 122 1.135 19.419 -4.991 909 1HG GLU 122 1HG GLU 122 0.784 19.843 -7.204 910 2HG GLU 122 2HG GLU 122 -0.362 18.509 -7.079 911 H LYS 123 H LYS 123 -2.073 16.557 -5.926 912 HA LYS 123 HA LYS 123 -4.449 18.297 -5.995 913 1HB LYS 123 1HB LYS 123 -4.057 15.547 -7.199 914 2HB LYS 123 2HB LYS 123 -5.355 16.679 -7.567 915 1HG LYS 123 1HG LYS 123 -3.394 18.306 -8.174 916 2HG LYS 123 2HG LYS 123 -2.450 16.823 -8.310 917 1HD LYS 123 1HD LYS 123 -3.639 16.066 -10.138 918 2HD LYS 123 2HD LYS 123 -5.117 16.900 -9.652 919 1HE LYS 123 1HE LYS 123 -2.699 18.496 -10.452 920 2HE LYS 123 2HE LYS 123 -3.748 17.813 -11.694 921 1HZ LYS 123 1HZ LYS 123 -4.649 19.552 -9.460 922 2HZ LYS 123 2HZ LYS 123 -4.412 20.062 -11.064 923 3HZ LYS 123 3HZ LYS 123 -5.626 18.933 -10.706 924 H ARG 124 H ARG 124 -6.202 17.933 -4.697 925 HA ARG 124 HA ARG 124 -5.983 16.220 -2.419 926 1HB ARG 124 1HB ARG 124 -8.221 17.830 -3.622 927 2HB ARG 124 2HB ARG 124 -8.527 16.760 -2.254 928 1HG ARG 124 1HG ARG 124 -6.852 17.901 -0.915 929 2HG ARG 124 2HG ARG 124 -6.376 18.895 -2.292 930 1HD ARG 124 1HD ARG 124 -8.858 19.645 -2.344 931 2HD ARG 124 2HD ARG 124 -8.942 18.984 -0.710 932 HE ARG 124 HE ARG 124 -6.692 20.796 -1.068 933 1HH1 ARG 124 1HH1 ARG 124 -10.115 20.583 -0.374 934 2HH1 ARG 124 2HH1 ARG 124 -10.139 22.093 0.468 935 1HH2 ARG 124 1HH2 ARG 124 -6.772 22.744 0.029 936 2HH2 ARG 124 2HH2 ARG 124 -8.269 23.305 0.695 937 H TRP 125 H TRP 125 -6.067 14.056 -2.523 938 HA TRP 125 HA TRP 125 -8.050 12.770 -4.371 939 1HB TRP 125 1HB TRP 125 -5.478 11.604 -3.252 940 2HB TRP 125 2HB TRP 125 -6.577 10.804 -4.370 941 HD1 TRP 125 HD1 TRP 125 -3.571 12.898 -4.292 942 HE1 TRP 125 HE1 TRP 125 -3.023 13.800 -6.637 943 HE3 TRP 125 HE3 TRP 125 -7.926 11.815 -6.709 944 HZ2 TRP 125 HZ2 TRP 125 -4.239 14.012 -9.203 945 HZ3 TRP 125 HZ3 TRP 125 -8.204 12.344 -9.103 946 HH2 TRP 125 HH2 TRP 125 -6.372 13.459 -10.359 947 H ASP 126 H ASP 126 -8.953 10.684 -3.448 948 HA ASP 126 HA ASP 126 -8.848 10.617 -0.476 949 1HB ASP 126 1HB ASP 126 -11.290 10.374 -0.321 950 2HB ASP 126 2HB ASP 126 -10.843 11.920 -1.036 951 H ARG 127 H ARG 127 -8.253 8.892 -3.149 952 HA ARG 127 HA ARG 127 -8.921 6.323 -1.817 953 1HB ARG 127 1HB ARG 127 -9.228 6.680 -4.809 954 2HB ARG 127 2HB ARG 127 -9.780 5.334 -3.818 955 1HG ARG 127 1HG ARG 127 -11.055 7.596 -2.737 956 2HG ARG 127 2HG ARG 127 -11.153 7.814 -4.478 957 1HD ARG 127 1HD ARG 127 -12.277 5.716 -4.760 958 2HD ARG 127 2HD ARG 127 -11.895 5.227 -3.111 959 HE ARG 127 HE ARG 127 -13.491 7.670 -3.284 960 1HH1 ARG 127 1HH1 ARG 127 -13.551 4.188 -3.048 961 2HH1 ARG 127 2HH1 ARG 127 -15.135 4.159 -2.364 962 1HH2 ARG 127 1HH2 ARG 127 -15.539 7.587 -2.393 963 2HH2 ARG 127 2HH2 ARG 127 -16.252 6.059 -1.999 964 H VAL 128 H VAL 128 -7.161 4.895 -1.975 965 HA VAL 128 HA VAL 128 -4.971 5.746 -3.818 966 HB VAL 128 HB VAL 128 -4.652 6.340 -1.357 967 1HG1 VAL 128 1HG1 VAL 128 -5.336 3.666 -0.953 968 2HG1 VAL 128 2HG1 VAL 128 -3.591 3.702 -0.697 969 3HG1 VAL 128 3HG1 VAL 128 -4.644 4.757 0.246 970 1HG2 VAL 128 1HG2 VAL 128 -2.663 4.614 -2.839 971 2HG2 VAL 128 2HG2 VAL 128 -2.803 6.372 -2.888 972 3HG2 VAL 128 3HG2 VAL 128 -2.260 5.571 -1.414 973 H LYS 129 H LYS 129 -3.806 4.117 -4.820 974 HA LYS 129 HA LYS 129 -4.920 1.366 -4.505 975 1HB LYS 129 1HB LYS 129 -5.279 2.441 -6.721 976 2HB LYS 129 2HB LYS 129 -3.533 2.584 -6.900 977 1HG LYS 129 1HG LYS 129 -3.841 -0.085 -6.246 978 2HG LYS 129 2HG LYS 129 -5.260 0.230 -7.244 979 1HD LYS 129 1HD LYS 129 -3.507 1.446 -8.804 980 2HD LYS 129 2HD LYS 129 -2.358 0.397 -7.972 981 1HE LYS 129 1HE LYS 129 -3.220 -1.518 -8.902 982 2HE LYS 129 2HE LYS 129 -4.863 -0.877 -8.956 983 1HZ LYS 129 1HZ LYS 129 -2.672 0.072 -10.714 984 2HZ LYS 129 2HZ LYS 129 -3.776 -1.135 -11.162 985 3HZ LYS 129 3HZ LYS 129 -4.327 0.439 -10.837 986 H ILE 130 H ILE 130 -3.540 0.156 -3.279 987 HA ILE 130 HA ILE 130 -0.607 0.635 -3.549 988 HB ILE 130 HB ILE 130 -2.159 -0.965 -1.486 989 1HG1 ILE 130 1HG1 ILE 130 -2.585 1.462 -1.337 990 2HG1 ILE 130 2HG1 ILE 130 -1.625 0.908 0.032 991 1HG2 ILE 130 1HG2 ILE 130 0.155 -1.774 -1.830 992 2HG2 ILE 130 2HG2 ILE 130 0.760 -0.140 -1.560 993 3HG2 ILE 130 3HG2 ILE 130 -0.032 -1.015 -0.250 994 1HD1 ILE 130 1HD1 ILE 130 0.218 1.608 -2.014 995 2HD1 ILE 130 2HD1 ILE 130 -0.967 2.910 -1.929 996 3HD1 ILE 130 3HD1 ILE 130 -0.064 2.445 -0.488 997 H VAL 131 H VAL 131 0.607 -0.847 -4.670 998 HA VAL 131 HA VAL 131 -0.547 -3.553 -5.086 999 HB VAL 131 HB VAL 131 0.921 -1.863 -7.130 1000 1HG1 VAL 131 1HG1 VAL 131 -0.275 -4.627 -7.131 1001 2HG1 VAL 131 2HG1 VAL 131 0.013 -3.733 -8.624 1002 3HG1 VAL 131 3HG1 VAL 131 1.364 -4.145 -7.569 1003 1HG2 VAL 131 1HG2 VAL 131 -1.999 -2.526 -6.702 1004 2HG2 VAL 131 2HG2 VAL 131 -1.262 -0.933 -6.873 1005 3HG2 VAL 131 3HG2 VAL 131 -1.374 -2.006 -8.268 1006 H CYS 132 H CYS 132 0.805 -4.994 -4.186 1007 HA CYS 132 HA CYS 132 3.674 -4.317 -3.834 1008 1HB CYS 132 1HB CYS 132 1.900 -5.529 -2.144 1009 2HB CYS 132 2HB CYS 132 2.646 -6.941 -2.890 1010 HG CYS 132 HG CYS 132 4.310 -4.735 -1.418 1011 H SER 133 H SER 133 5.325 -5.509 -4.877 1012 HA SER 133 HA SER 133 4.466 -7.660 -6.761 1013 1HB SER 133 1HB SER 133 5.222 -4.982 -7.460 1014 2HB SER 133 2HB SER 133 6.464 -6.074 -8.056 1015 HG SER 133 HG SER 133 4.523 -5.662 -9.414 1016 H GLN 134 H GLN 134 5.787 -9.377 -6.664 1017 HA GLN 134 HA GLN 134 8.401 -9.813 -6.936 1018 1HB GLN 134 1HB GLN 134 9.128 -8.201 -5.265 1019 2HB GLN 134 2HB GLN 134 8.108 -8.934 -4.040 1020 1HG GLN 134 1HG GLN 134 10.051 -9.994 -3.461 1021 2HG GLN 134 2HG GLN 134 9.629 -11.086 -4.771 1022 1HE2 GLN 134 2HE2 GLN 134 10.349 -9.887 -7.077 1023 2HE2 GLN 134 1HE2 GLN 134 11.965 -9.377 -7.063 1024 HA PRO 135 HA PRO 135 6.650 -13.758 -5.675 1025 1HB PRO 135 1HB PRO 135 8.679 -15.339 -6.565 1026 2HB PRO 135 2HB PRO 135 7.497 -14.582 -7.643 1027 1HG PRO 135 1HG PRO 135 10.339 -13.939 -7.240 1028 2HG PRO 135 2HG PRO 135 9.287 -13.584 -8.617 1029 1HD PRO 135 1HD PRO 135 10.097 -11.789 -6.541 1030 2HD PRO 135 2HD PRO 135 8.965 -11.464 -7.869 1031 H TYR 136 H TYR 136 6.722 -13.797 -3.389 1032 HA TYR 136 HA TYR 136 9.276 -13.993 -1.984 1033 1HB TYR 136 1HB TYR 136 6.777 -14.707 -0.541 1034 2HB TYR 136 2HB TYR 136 8.122 -13.708 -0.014 1035 HD1 TYR 136 HD1 TYR 136 8.189 -11.729 -2.337 1036 HD2 TYR 136 HD2 TYR 136 4.936 -13.347 -0.048 1037 HE1 TYR 136 HE1 TYR 136 6.828 -9.710 -2.816 1038 HE2 TYR 136 HE2 TYR 136 3.583 -11.337 -0.540 1039 HH TYR 136 HH TYR 136 4.915 -8.496 -1.804 1040 H SER 137 H SER 137 6.450 -16.094 -2.129 1041 HA SER 137 HA SER 137 8.071 -18.472 -2.599 1042 1HB SER 137 1HB SER 137 8.086 -17.792 -0.005 1043 2HB SER 137 2HB SER 137 6.548 -18.649 -0.039 1044 HG SER 137 HG SER 137 7.697 -20.401 -1.036 1045 H LYS 138 H LYS 138 6.677 -20.418 -2.811 1046 HA LYS 138 HA LYS 138 3.894 -19.638 -3.559 1047 1HB LYS 138 1HB LYS 138 5.565 -22.014 -4.427 1048 2HB LYS 138 2HB LYS 138 3.929 -21.663 -4.982 1049 1HG LYS 138 1HG LYS 138 5.257 -19.265 -5.424 1050 2HG LYS 138 2HG LYS 138 6.479 -20.473 -5.820 1051 1HD LYS 138 1HD LYS 138 5.035 -21.527 -7.425 1052 2HD LYS 138 2HD LYS 138 3.652 -20.566 -6.898 1053 1HE LYS 138 1HE LYS 138 4.910 -18.503 -7.611 1054 2HE LYS 138 2HE LYS 138 6.140 -19.559 -8.304 1055 1HZ LYS 138 1HZ LYS 138 3.317 -19.956 -9.021 1056 2HZ LYS 138 2HZ LYS 138 4.200 -18.711 -9.769 1057 3HZ LYS 138 3HZ LYS 138 4.716 -20.321 -9.914 1058 H ASP 139 H ASP 139 4.879 -20.399 -0.808 1059 HA ASP 139 HA ASP 139 3.173 -22.802 -0.413 1060 1HB ASP 139 1HB ASP 139 4.463 -22.885 1.845 1061 2HB ASP 139 2HB ASP 139 5.270 -23.465 0.395 1062 H SER 140 H SER 140 4.194 -19.855 1.240 1063 HA SER 140 HA SER 140 1.492 -19.694 2.478 1064 1HB SER 140 1HB SER 140 2.905 -18.128 4.069 1065 2HB SER 140 2HB SER 140 2.926 -19.871 4.287 1066 HG SER 140 HG SER 140 5.015 -19.507 4.123 1067 HA PRO 141 HA PRO 141 1.087 -15.739 0.426 1068 1HB PRO 141 1HB PRO 141 -0.890 -14.677 1.975 1069 2HB PRO 141 2HB PRO 141 -1.168 -15.981 0.813 1070 1HG PRO 141 1HG PRO 141 -1.126 -16.076 3.753 1071 2HG PRO 141 2HG PRO 141 -1.906 -17.166 2.599 1072 1HD PRO 141 1HD PRO 141 0.542 -17.606 4.006 1073 2HD PRO 141 2HD PRO 141 -0.178 -18.632 2.747 1074 H PHE 142 H PHE 142 1.236 -13.334 0.929 1075 HA PHE 142 HA PHE 142 2.105 -12.447 3.537 1076 1HB PHE 142 1HB PHE 142 4.088 -13.557 1.714 1077 2HB PHE 142 2HB PHE 142 4.463 -11.885 2.116 1078 HD1 PHE 142 HD1 PHE 142 4.251 -11.261 4.682 1079 HD2 PHE 142 HD2 PHE 142 4.704 -15.252 3.173 1080 HE1 PHE 142 HE1 PHE 142 5.073 -12.008 6.902 1081 HE2 PHE 142 HE2 PHE 142 5.529 -16.001 5.388 1082 HZ PHE 142 HZ PHE 142 5.714 -14.377 7.254 1083 H GLY 143 H GLY 143 3.682 -10.242 2.723 1084 1HA GLY 143 1HA GLY 143 3.023 -8.745 0.514 1085 2HA GLY 143 2HA GLY 143 1.617 -8.542 1.556 1086 H LEU 144 H LEU 144 1.728 -7.011 3.156 1087 HA LEU 144 HA LEU 144 4.428 -6.020 3.911 1088 1HB LEU 144 1HB LEU 144 3.023 -3.709 4.136 1089 2HB LEU 144 2HB LEU 144 4.052 -4.130 2.775 1090 HG LEU 144 HG LEU 144 1.135 -4.854 2.871 1091 1HD1 LEU 144 1HD1 LEU 144 1.773 -2.340 3.097 1092 2HD1 LEU 144 2HD1 LEU 144 2.270 -2.486 1.410 1093 3HD1 LEU 144 3HD1 LEU 144 0.595 -2.805 1.866 1094 1HD2 LEU 144 1HD2 LEU 144 3.398 -5.028 0.944 1095 2HD2 LEU 144 2HD2 LEU 144 1.954 -6.033 1.065 1096 3HD2 LEU 144 3HD2 LEU 144 1.873 -4.467 0.260 1097 H SER 145 H SER 145 4.446 -4.796 5.954 1098 HA SER 145 HA SER 145 2.801 -6.174 7.937 1099 1HB SER 145 1HB SER 145 5.068 -4.196 8.100 1100 2HB SER 145 2HB SER 145 4.185 -4.720 9.530 1101 HG SER 145 HG SER 145 5.505 -6.355 9.464 1102 H PHE 146 H PHE 146 2.637 -3.132 6.256 1103 HA PHE 146 HA PHE 146 0.117 -2.414 7.342 1104 1HB PHE 146 1HB PHE 146 0.710 -0.540 8.846 1105 2HB PHE 146 2HB PHE 146 1.335 -2.055 9.482 1106 HD1 PHE 146 HD1 PHE 146 3.772 -2.598 9.271 1107 HD2 PHE 146 HD2 PHE 146 2.161 1.191 8.059 1108 HE1 PHE 146 HE1 PHE 146 6.064 -1.647 9.192 1109 HE2 PHE 146 HE2 PHE 146 4.442 2.149 7.991 1110 HZ PHE 146 HZ PHE 146 6.402 0.721 8.548 1111 H VAL 147 H VAL 147 -0.213 0.119 7.069 1112 HA VAL 147 HA VAL 147 1.474 1.343 4.999 1113 HB VAL 147 HB VAL 147 -0.406 1.626 3.400 1114 1HG1 VAL 147 1HG1 VAL 147 1.227 -0.361 3.362 1115 2HG1 VAL 147 2HG1 VAL 147 -0.099 -1.314 4.026 1116 3HG1 VAL 147 3HG1 VAL 147 -0.270 -0.545 2.448 1117 1HG2 VAL 147 1HG2 VAL 147 -1.846 0.224 5.596 1118 2HG2 VAL 147 2HG2 VAL 147 -2.439 1.433 4.457 1119 3HG2 VAL 147 3HG2 VAL 147 -2.278 -0.249 3.952 1120 H ARG 148 H ARG 148 1.499 3.533 5.446 1121 HA ARG 148 HA ARG 148 -0.906 4.745 6.726 1122 1HB ARG 148 1HB ARG 148 1.846 5.404 7.770 1123 2HB ARG 148 2HB ARG 148 0.288 5.675 8.534 1124 1HG ARG 148 1HG ARG 148 0.108 3.055 8.467 1125 2HG ARG 148 2HG ARG 148 1.863 3.133 8.313 1126 1HD ARG 148 1HD ARG 148 0.579 4.809 10.426 1127 2HD ARG 148 2HD ARG 148 0.690 3.071 10.708 1128 HE ARG 148 HE ARG 148 3.223 4.110 9.810 1129 1HH1 ARG 148 1HH1 ARG 148 1.117 3.948 12.598 1130 2HH1 ARG 148 2HH1 ARG 148 2.426 4.094 13.719 1131 1HH2 ARG 148 1HH2 ARG 148 4.884 4.295 11.294 1132 2HH2 ARG 148 2HH2 ARG 148 4.535 4.287 12.992 1133 H PHE 149 H PHE 149 -1.443 6.328 5.279 1134 HA PHE 149 HA PHE 149 0.659 7.780 3.791 1135 1HB PHE 149 1HB PHE 149 -2.355 8.143 3.747 1136 2HB PHE 149 2HB PHE 149 -1.206 8.840 2.607 1137 HD1 PHE 149 HD1 PHE 149 0.362 7.124 1.375 1138 HD2 PHE 149 HD2 PHE 149 -3.361 6.101 3.250 1139 HE1 PHE 149 HE1 PHE 149 0.226 5.076 -0.016 1140 HE2 PHE 149 HE2 PHE 149 -3.500 4.056 1.854 1141 HZ PHE 149 HZ PHE 149 -1.708 3.543 0.225 1142 H HIS 150 H HIS 150 0.716 10.177 3.863 1143 HA HIS 150 HA HIS 150 -0.692 11.521 6.053 1144 1HB HIS 150 1HB HIS 150 2.049 12.250 6.504 1145 2HB HIS 150 2HB HIS 150 0.900 11.555 7.636 1146 HD1 HIS 150 HD1 HIS 150 1.179 9.107 8.242 1147 HD2 HIS 150 HD2 HIS 150 3.701 10.282 5.142 1148 HE1 HIS 150 HE1 HIS 150 2.799 7.196 7.875 1149 H SER 151 H SER 151 -0.875 13.693 5.693 1150 HA SER 151 HA SER 151 0.168 14.678 3.106 1151 1HB SER 151 1HB SER 151 -2.259 14.978 4.444 1152 2HB SER 151 2HB SER 151 -1.474 16.540 4.655 1153 HG SER 151 HG SER 151 -2.706 16.316 2.686 Start of MODEL 6 1 H MET 1 H MET 1 -2.614 15.929 13.048 2 HA MET 1 HA MET 1 -4.615 17.129 12.712 3 1HB MET 1 1HB MET 1 -3.040 19.343 13.310 4 2HB MET 1 2HB MET 1 -3.408 19.559 11.599 5 1HG MET 1 1HG MET 1 -5.842 19.093 12.189 6 2HG MET 1 2HG MET 1 -5.367 19.228 13.882 7 1HE MET 1 1HE MET 1 -5.979 21.003 15.007 8 2HE MET 1 2HE MET 1 -4.295 21.543 14.956 9 3HE MET 1 3HE MET 1 -5.602 22.696 14.698 10 HA PRO 2 HA PRO 2 -3.093 17.427 8.179 11 1HB PRO 2 1HB PRO 2 -0.425 17.703 7.679 12 2HB PRO 2 2HB PRO 2 -1.502 19.076 7.976 13 1HG PRO 2 1HG PRO 2 0.583 17.925 9.707 14 2HG PRO 2 2HG PRO 2 -0.118 19.549 9.711 15 1HD PRO 2 1HD PRO 2 -0.730 17.397 11.490 16 2HD PRO 2 2HD PRO 2 -1.512 18.989 11.410 17 H GLU 3 H GLU 3 -3.620 15.086 8.872 18 HA GLU 3 HA GLU 3 -1.364 13.310 8.048 19 1HB GLU 3 1HB GLU 3 -3.170 13.063 10.449 20 2HB GLU 3 2HB GLU 3 -2.446 11.630 9.718 21 1HG GLU 3 1HG GLU 3 -0.731 14.009 10.383 22 2HG GLU 3 2HG GLU 3 -1.163 12.853 11.642 23 H ILE 4 H ILE 4 -2.420 10.985 7.683 24 HA ILE 4 HA ILE 4 -4.971 11.371 6.160 25 HB ILE 4 HB ILE 4 -2.683 9.547 5.430 26 1HG1 ILE 4 1HG1 ILE 4 -1.999 11.900 5.204 27 2HG1 ILE 4 2HG1 ILE 4 -2.173 11.146 3.625 28 1HG2 ILE 4 1HG2 ILE 4 -5.226 10.343 4.010 29 2HG2 ILE 4 2HG2 ILE 4 -3.900 9.484 3.226 30 3HG2 ILE 4 3HG2 ILE 4 -4.770 8.732 4.563 31 1HD1 ILE 4 1HD1 ILE 4 -4.644 12.093 3.830 32 2HD1 ILE 4 2HD1 ILE 4 -3.872 13.221 4.941 33 3HD1 ILE 4 3HD1 ILE 4 -3.323 13.117 3.271 34 H ARG 5 H ARG 5 -6.443 9.622 6.278 35 HA ARG 5 HA ARG 5 -5.655 7.271 7.922 36 1HB ARG 5 1HB ARG 5 -7.917 9.189 8.481 37 2HB ARG 5 2HB ARG 5 -7.974 7.519 9.045 38 1HG ARG 5 1HG ARG 5 -6.320 7.842 10.596 39 2HG ARG 5 2HG ARG 5 -5.451 8.993 9.580 40 1HD ARG 5 1HD ARG 5 -8.110 9.893 10.531 41 2HD ARG 5 2HD ARG 5 -6.874 9.718 11.777 42 HE ARG 5 HE ARG 5 -5.916 11.174 9.446 43 1HH1 ARG 5 1HH1 ARG 5 -7.651 11.433 12.472 44 2HH1 ARG 5 2HH1 ARG 5 -7.282 13.112 12.655 45 1HH2 ARG 5 1HH2 ARG 5 -5.464 13.348 9.722 46 2HH2 ARG 5 2HH2 ARG 5 -6.058 14.186 11.117 47 H LEU 6 H LEU 6 -6.532 5.384 7.116 48 HA LEU 6 HA LEU 6 -8.175 5.589 4.683 49 1HB LEU 6 1HB LEU 6 -6.694 3.385 6.079 50 2HB LEU 6 2HB LEU 6 -8.006 2.953 4.987 51 HG LEU 6 HG LEU 6 -5.852 2.961 3.799 52 1HD1 LEU 6 1HD1 LEU 6 -7.997 3.722 2.678 53 2HD1 LEU 6 2HD1 LEU 6 -7.440 5.377 2.920 54 3HD1 LEU 6 3HD1 LEU 6 -6.506 4.272 1.921 55 1HD2 LEU 6 1HD2 LEU 6 -5.169 5.016 5.439 56 2HD2 LEU 6 2HD2 LEU 6 -4.339 4.672 3.922 57 3HD2 LEU 6 3HD2 LEU 6 -5.590 5.913 3.981 58 H ARG 7 H ARG 7 -10.277 4.831 4.499 59 HA ARG 7 HA ARG 7 -11.749 4.555 7.062 60 1HB ARG 7 1HB ARG 7 -12.479 6.124 5.144 61 2HB ARG 7 2HB ARG 7 -12.971 4.655 4.302 62 1HG ARG 7 1HG ARG 7 -14.714 4.244 5.741 63 2HG ARG 7 2HG ARG 7 -13.873 4.944 7.125 64 1HD ARG 7 1HD ARG 7 -14.167 7.208 5.906 65 2HD ARG 7 2HD ARG 7 -15.363 6.366 4.921 66 HE ARG 7 HE ARG 7 -15.709 7.192 7.683 67 1HH1 ARG 7 1HH1 ARG 7 -16.608 4.793 5.302 68 2HH1 ARG 7 2HH1 ARG 7 -18.092 4.411 6.102 69 1HH2 ARG 7 1HH2 ARG 7 -17.640 6.666 8.684 70 2HH2 ARG 7 2HH2 ARG 7 -18.673 5.459 7.995 71 H HIS 8 H HIS 8 -11.492 2.941 3.916 72 HA HIS 8 HA HIS 8 -11.572 0.305 5.159 73 1HB HIS 8 1HB HIS 8 -13.603 -0.426 3.884 74 2HB HIS 8 2HB HIS 8 -13.967 0.758 5.139 75 HD1 HIS 8 HD1 HIS 8 -15.560 2.477 4.311 76 HD2 HIS 8 HD2 HIS 8 -12.992 1.203 1.283 77 HE1 HIS 8 HE1 HIS 8 -16.184 3.794 2.240 78 H VAL 9 H VAL 9 -11.443 -1.406 3.367 79 HA VAL 9 HA VAL 9 -9.550 -0.480 1.346 80 HB VAL 9 HB VAL 9 -9.224 -2.657 2.451 81 1HG1 VAL 9 1HG1 VAL 9 -11.964 -2.934 2.204 82 2HG1 VAL 9 2HG1 VAL 9 -11.352 -4.063 0.997 83 3HG1 VAL 9 3HG1 VAL 9 -10.849 -4.213 2.681 84 1HG2 VAL 9 1HG2 VAL 9 -8.407 -2.325 0.121 85 2HG2 VAL 9 2HG2 VAL 9 -8.820 -4.008 0.448 86 3HG2 VAL 9 3HG2 VAL 9 -9.921 -2.994 -0.484 87 H VAL 10 H VAL 10 -10.810 0.910 0.028 88 HA VAL 10 HA VAL 10 -13.351 0.450 -1.039 89 HB VAL 10 HB VAL 10 -12.433 2.596 -1.434 90 1HG1 VAL 10 1HG1 VAL 10 -9.986 1.293 -1.708 91 2HG1 VAL 10 2HG1 VAL 10 -10.279 1.967 -3.306 92 3HG1 VAL 10 3HG1 VAL 10 -10.269 3.017 -1.891 93 1HG2 VAL 10 1HG2 VAL 10 -13.793 1.741 -3.337 94 2HG2 VAL 10 2HG2 VAL 10 -12.570 2.896 -3.866 95 3HG2 VAL 10 3HG2 VAL 10 -12.316 1.170 -4.113 96 H SER 11 H SER 11 -10.285 -0.358 -2.762 97 HA SER 11 HA SER 11 -11.847 -2.521 -4.094 98 1HB SER 11 1HB SER 11 -9.565 -1.643 -5.671 99 2HB SER 11 2HB SER 11 -11.251 -1.799 -6.145 100 HG SER 11 HG SER 11 -10.065 0.400 -5.978 101 H CYS 12 H CYS 12 -10.461 -4.421 -4.697 102 HA CYS 12 HA CYS 12 -7.806 -4.533 -3.422 103 1HB CYS 12 1HB CYS 12 -8.425 -6.539 -2.073 104 2HB CYS 12 2HB CYS 12 -9.228 -5.067 -1.531 105 HG CYS 12 HG CYS 12 -11.443 -5.987 -2.240 106 H SER 13 H SER 13 -6.491 -5.942 -4.439 107 HA SER 13 HA SER 13 -7.703 -7.963 -6.269 108 1HB SER 13 1HB SER 13 -6.496 -5.692 -7.195 109 2HB SER 13 2HB SER 13 -5.116 -6.782 -7.103 110 HG SER 13 HG SER 13 -5.864 -7.641 -8.858 111 H SER 14 H SER 14 -6.940 -8.562 -3.700 112 HA SER 14 HA SER 14 -5.448 -10.825 -3.669 113 1HB SER 14 1HB SER 14 -3.163 -9.797 -2.754 114 2HB SER 14 2HB SER 14 -3.405 -10.102 -4.470 115 HG SER 14 HG SER 14 -4.248 -7.634 -3.438 116 H GLN 15 H GLN 15 -6.798 -11.138 -1.830 117 HA GLN 15 HA GLN 15 -5.638 -10.259 0.687 118 1HB GLN 15 1HB GLN 15 -8.191 -9.484 1.328 119 2HB GLN 15 2HB GLN 15 -6.867 -8.392 0.963 120 1HG GLN 15 1HG GLN 15 -8.537 -7.577 -0.421 121 2HG GLN 15 2HG GLN 15 -7.703 -8.657 -1.527 122 1HE2 GLN 15 2HE2 GLN 15 -8.642 -11.068 -1.288 123 2HE2 GLN 15 1HE2 GLN 15 -10.339 -11.166 -1.290 124 H ASP 16 H ASP 16 -6.304 -11.566 2.431 125 HA ASP 16 HA ASP 16 -7.833 -13.976 1.591 126 1HB ASP 16 1HB ASP 16 -5.516 -13.515 3.244 127 2HB ASP 16 2HB ASP 16 -6.759 -14.306 4.210 128 H SER 17 H SER 17 -8.736 -14.913 4.015 129 HA SER 17 HA SER 17 -10.931 -13.025 4.578 130 1HB SER 17 1HB SER 17 -11.319 -15.493 4.137 131 2HB SER 17 2HB SER 17 -10.538 -15.818 5.683 132 HG SER 17 HG SER 17 -12.954 -14.475 5.127 133 H THR 18 H THR 18 -8.767 -15.070 6.587 134 HA THR 18 HA THR 18 -9.271 -13.637 9.013 135 HB THR 18 HB THR 18 -6.787 -14.666 9.420 136 HG1 THR 18 HG1 THR 18 -6.387 -16.284 8.074 137 1HG2 THR 18 1HG2 THR 18 -9.513 -15.936 9.443 138 2HG2 THR 18 2HG2 THR 18 -8.091 -16.853 9.944 139 3HG2 THR 18 3HG2 THR 18 -8.540 -15.381 10.806 140 H HIS 19 H HIS 19 -6.331 -13.597 6.969 141 HA HIS 19 HA HIS 19 -5.688 -10.900 8.046 142 1HB HIS 19 1HB HIS 19 -4.087 -12.911 6.438 143 2HB HIS 19 2HB HIS 19 -3.505 -11.287 6.804 144 HD1 HIS 19 HD1 HIS 19 -2.716 -10.810 9.190 145 HD2 HIS 19 HD2 HIS 19 -4.353 -14.620 8.755 146 HE1 HIS 19 HE1 HIS 19 -2.198 -12.061 11.330 147 H CYS 20 H CYS 20 -7.526 -10.000 6.775 148 HA CYS 20 HA CYS 20 -7.199 -10.005 3.842 149 1HB CYS 20 1HB CYS 20 -9.315 -8.706 3.852 150 2HB CYS 20 2HB CYS 20 -9.469 -10.211 4.751 151 HG CYS 20 HG CYS 20 -10.347 -8.647 6.501 152 H ALA 21 H ALA 21 -7.406 -7.832 2.738 153 HA ALA 21 HA ALA 21 -5.232 -6.135 3.487 154 1HB ALA 21 1HB ALA 21 -7.376 -6.128 1.427 155 2HB ALA 21 2HB ALA 21 -6.637 -4.568 1.791 156 3HB ALA 21 3HB ALA 21 -5.636 -5.912 1.240 157 H GLU 22 H GLU 22 -8.603 -6.162 4.382 158 HA GLU 22 HA GLU 22 -8.888 -3.428 5.154 159 1HB GLU 22 1HB GLU 22 -10.563 -5.572 5.097 160 2HB GLU 22 2HB GLU 22 -10.254 -5.458 6.829 161 1HG GLU 22 1HG GLU 22 -10.845 -3.028 6.728 162 2HG GLU 22 2HG GLU 22 -11.277 -3.240 5.032 163 H ASN 23 H ASN 23 -7.021 -5.999 6.548 164 HA ASN 23 HA ASN 23 -7.019 -5.127 9.287 165 1HB ASN 23 1HB ASN 23 -5.132 -6.738 7.595 166 2HB ASN 23 2HB ASN 23 -4.698 -6.296 9.245 167 1HD2 ASN 23 2HD2 ASN 23 -5.968 -8.814 7.578 168 2HD2 ASN 23 1HD2 ASN 23 -7.017 -9.457 8.749 169 H LEU 24 H LEU 24 -5.589 -3.867 6.421 170 HA LEU 24 HA LEU 24 -3.373 -2.463 7.559 171 1HB LEU 24 1HB LEU 24 -5.006 -1.733 5.107 172 2HB LEU 24 2HB LEU 24 -3.356 -1.221 5.465 173 HG LEU 24 HG LEU 24 -4.018 -4.157 5.340 174 1HD1 LEU 24 1HD1 LEU 24 -4.111 -2.259 3.116 175 2HD1 LEU 24 2HD1 LEU 24 -2.932 -3.545 2.863 176 3HD1 LEU 24 3HD1 LEU 24 -4.618 -3.946 3.180 177 1HD2 LEU 24 1HD2 LEU 24 -1.710 -2.624 5.854 178 2HD2 LEU 24 2HD2 LEU 24 -1.794 -4.363 5.587 179 3HD2 LEU 24 3HD2 LEU 24 -1.488 -3.278 4.231 180 H LEU 25 H LEU 25 -6.825 -1.869 7.437 181 HA LEU 25 HA LEU 25 -6.830 0.937 7.937 182 1HB LEU 25 1HB LEU 25 -8.719 -1.346 8.418 183 2HB LEU 25 2HB LEU 25 -9.052 0.194 9.184 184 HG LEU 25 HG LEU 25 -10.197 -0.033 6.990 185 1HD1 LEU 25 1HD1 LEU 25 -9.457 2.191 7.893 186 2HD1 LEU 25 2HD1 LEU 25 -8.007 2.053 6.905 187 3HD1 LEU 25 3HD1 LEU 25 -9.587 2.140 6.136 188 1HD2 LEU 25 1HD2 LEU 25 -8.222 -1.412 6.034 189 2HD2 LEU 25 2HD2 LEU 25 -9.015 -0.262 4.956 190 3HD2 LEU 25 3HD2 LEU 25 -7.472 0.149 5.704 191 H LYS 26 H LYS 26 -5.947 -1.790 9.908 192 HA LYS 26 HA LYS 26 -5.986 -0.066 12.350 193 1HB LYS 26 1HB LYS 26 -5.647 -3.081 12.267 194 2HB LYS 26 2HB LYS 26 -6.011 -2.075 13.667 195 1HG LYS 26 1HG LYS 26 -7.854 -2.260 11.274 196 2HG LYS 26 2HG LYS 26 -7.998 -3.323 12.675 197 1HD LYS 26 1HD LYS 26 -7.882 -0.967 13.960 198 2HD LYS 26 2HD LYS 26 -8.578 -0.410 12.439 199 1HE LYS 26 1HE LYS 26 -10.477 -0.981 13.698 200 2HE LYS 26 2HE LYS 26 -10.209 -2.423 12.718 201 1HZ LYS 26 1HZ LYS 26 -9.183 -2.051 15.480 202 2HZ LYS 26 2HZ LYS 26 -10.595 -2.911 15.087 203 3HZ LYS 26 3HZ LYS 26 -9.088 -3.465 14.542 204 H ALA 27 H ALA 27 -4.016 0.790 10.998 205 HA ALA 27 HA ALA 27 -1.611 -0.613 10.662 206 1HB ALA 27 1HB ALA 27 -2.177 1.815 10.025 207 2HB ALA 27 2HB ALA 27 -1.684 2.232 11.667 208 3HB ALA 27 3HB ALA 27 -0.527 1.493 10.560 209 H ASP 28 H ASP 28 -3.083 0.471 13.642 210 HA ASP 28 HA ASP 28 -0.644 -0.439 15.118 211 1HB ASP 28 1HB ASP 28 -1.395 2.033 15.306 212 2HB ASP 28 2HB ASP 28 -2.736 1.408 16.267 213 H THR 29 H THR 29 -1.576 -2.639 14.970 214 HA THR 29 HA THR 29 -3.308 -3.187 17.276 215 HB THR 29 HB THR 29 -4.744 -4.708 15.658 216 HG1 THR 29 HG1 THR 29 -4.632 -4.190 13.633 217 1HG2 THR 29 1HG2 THR 29 -5.420 -2.680 17.086 218 2HG2 THR 29 2HG2 THR 29 -5.253 -1.735 15.606 219 3HG2 THR 29 3HG2 THR 29 -6.432 -3.046 15.688 220 H TYR 30 H TYR 30 -2.807 -5.291 14.445 221 HA TYR 30 HA TYR 30 -0.461 -6.610 15.388 222 1HB TYR 30 1HB TYR 30 -1.519 -8.698 16.282 223 2HB TYR 30 2HB TYR 30 -1.815 -7.285 17.297 224 HD1 TYR 30 HD1 TYR 30 -3.312 -9.639 14.877 225 HD2 TYR 30 HD2 TYR 30 -4.021 -6.288 17.470 226 HE1 TYR 30 HE1 TYR 30 -5.758 -9.965 14.632 227 HE2 TYR 30 HE2 TYR 30 -6.467 -6.615 17.225 228 HH TYR 30 HH TYR 30 -7.897 -9.201 16.369 229 H ARG 31 H ARG 31 -3.566 -6.961 13.707 230 HA ARG 31 HA ARG 31 -2.588 -9.105 11.980 231 1HB ARG 31 1HB ARG 31 -5.077 -8.287 12.707 232 2HB ARG 31 2HB ARG 31 -4.942 -7.515 11.128 233 1HG ARG 31 1HG ARG 31 -4.917 -9.508 10.002 234 2HG ARG 31 2HG ARG 31 -4.027 -10.336 11.279 235 1HD ARG 31 1HD ARG 31 -6.239 -10.030 12.654 236 2HD ARG 31 2HD ARG 31 -6.980 -9.820 11.066 237 HE ARG 31 HE ARG 31 -6.685 -12.123 10.688 238 1HH1 ARG 31 1HH1 ARG 31 -4.630 -11.070 13.315 239 2HH1 ARG 31 2HH1 ARG 31 -4.126 -12.679 13.697 240 1HH2 ARG 31 1HH2 ARG 31 -6.006 -14.187 11.219 241 2HH2 ARG 31 2HH2 ARG 31 -4.895 -14.427 12.525 242 H LYS 32 H LYS 32 -2.070 -8.908 9.755 243 HA LYS 32 HA LYS 32 -1.571 -6.118 8.792 244 1HB LYS 32 1HB LYS 32 0.194 -8.525 8.268 245 2HB LYS 32 2HB LYS 32 0.501 -6.862 7.791 246 1HG LYS 32 1HG LYS 32 0.997 -6.181 9.962 247 2HG LYS 32 2HG LYS 32 0.088 -7.497 10.685 248 1HD LYS 32 1HD LYS 32 1.877 -9.003 9.462 249 2HD LYS 32 2HD LYS 32 2.842 -7.527 9.518 250 1HE LYS 32 1HE LYS 32 3.426 -8.372 11.573 251 2HE LYS 32 2HE LYS 32 1.949 -7.538 12.055 252 1HZ LYS 32 1HZ LYS 32 0.725 -9.596 11.731 253 2HZ LYS 32 2HZ LYS 32 2.154 -10.397 11.278 254 3HZ LYS 32 3HZ LYS 32 1.971 -9.810 12.861 255 H TRP 33 H TRP 33 -0.699 -6.759 6.218 256 HA TRP 33 HA TRP 33 -3.212 -7.759 5.012 257 1HB TRP 33 1HB TRP 33 -2.192 -5.653 4.124 258 2HB TRP 33 2HB TRP 33 -0.753 -6.551 3.716 259 HD1 TRP 33 HD1 TRP 33 -4.280 -7.911 3.130 260 HE1 TRP 33 HE1 TRP 33 -4.614 -8.233 0.573 261 HE3 TRP 33 HE3 TRP 33 0.017 -5.819 1.474 262 HZ2 TRP 33 HZ2 TRP 33 -3.180 -7.634 -1.829 263 HZ3 TRP 33 HZ3 TRP 33 0.533 -5.725 -0.967 264 HH2 TRP 33 HH2 TRP 33 -1.071 -6.617 -2.610 265 H ARG 34 H ARG 34 -3.293 -9.617 3.767 266 HA ARG 34 HA ARG 34 -0.793 -11.091 3.223 267 1HB ARG 34 1HB ARG 34 -1.546 -11.948 5.404 268 2HB ARG 34 2HB ARG 34 -3.152 -12.249 4.746 269 1HG ARG 34 1HG ARG 34 -1.397 -13.549 2.982 270 2HG ARG 34 2HG ARG 34 -0.759 -13.897 4.588 271 1HD ARG 34 1HD ARG 34 -3.648 -14.142 4.589 272 2HD ARG 34 2HD ARG 34 -2.947 -15.146 3.324 273 HE ARG 34 HE ARG 34 -1.493 -15.451 5.797 274 1HH1 ARG 34 1HH1 ARG 34 -4.437 -16.380 4.154 275 2HH1 ARG 34 2HH1 ARG 34 -4.585 -17.857 5.042 276 1HH2 ARG 34 1HH2 ARG 34 -1.722 -17.369 6.922 277 2HH2 ARG 34 2HH2 ARG 34 -3.066 -18.413 6.592 278 H ALA 35 H ALA 35 -0.915 -11.831 1.153 279 HA ALA 35 HA ALA 35 -3.056 -11.315 -0.598 280 1HB ALA 35 1HB ALA 35 -0.693 -11.949 -1.241 281 2HB ALA 35 2HB ALA 35 -1.108 -13.624 -0.876 282 3HB ALA 35 3HB ALA 35 -1.943 -12.771 -2.174 283 H ALA 36 H ALA 36 -4.660 -12.645 -1.516 284 HA ALA 36 HA ALA 36 -6.094 -14.296 0.305 285 1HB ALA 36 1HB ALA 36 -6.613 -13.064 -2.102 286 2HB ALA 36 2HB ALA 36 -6.650 -14.768 -2.539 287 3HB ALA 36 3HB ALA 36 -7.713 -14.160 -1.270 288 H LYS 37 H LYS 37 -3.556 -15.051 -1.972 289 HA LYS 37 HA LYS 37 -3.733 -17.890 -1.135 290 1HB LYS 37 1HB LYS 37 -3.167 -18.548 -3.490 291 2HB LYS 37 2HB LYS 37 -4.766 -17.825 -3.335 292 1HG LYS 37 1HG LYS 37 -3.730 -15.609 -3.964 293 2HG LYS 37 2HG LYS 37 -2.238 -16.481 -4.323 294 1HD LYS 37 1HD LYS 37 -3.211 -17.658 -6.115 295 2HD LYS 37 2HD LYS 37 -4.853 -17.335 -5.555 296 1HE LYS 37 1HE LYS 37 -4.797 -15.101 -6.290 297 2HE LYS 37 2HE LYS 37 -3.035 -15.071 -6.358 298 1HZ LYS 37 1HZ LYS 37 -4.656 -16.838 -8.093 299 2HZ LYS 37 2HZ LYS 37 -4.245 -15.257 -8.548 300 3HZ LYS 37 3HZ LYS 37 -3.023 -16.404 -8.268 301 H ALA 38 H ALA 38 -1.590 -18.913 -2.342 302 HA ALA 38 HA ALA 38 0.659 -17.331 -1.214 303 1HB ALA 38 1HB ALA 38 0.297 -19.744 -0.549 304 2HB ALA 38 2HB ALA 38 0.680 -20.195 -2.211 305 3HB ALA 38 3HB ALA 38 1.897 -19.405 -1.208 306 H GLY 39 H GLY 39 2.759 -18.418 -2.717 307 1HA GLY 39 1HA GLY 39 3.936 -18.051 -4.716 308 2HA GLY 39 2HA GLY 39 2.399 -18.271 -5.555 309 H GLU 40 H GLU 40 3.379 -15.881 -3.163 310 HA GLU 40 HA GLU 40 2.059 -13.657 -4.112 311 1HB GLU 40 1HB GLU 40 4.657 -13.984 -2.644 312 2HB GLU 40 2HB GLU 40 4.091 -12.380 -3.111 313 1HG GLU 40 1HG GLU 40 3.135 -12.617 -1.007 314 2HG GLU 40 2HG GLU 40 1.830 -13.169 -2.054 315 H LYS 41 H LYS 41 2.113 -13.626 -6.377 316 HA LYS 41 HA LYS 41 4.699 -13.068 -7.726 317 1HB LYS 41 1HB LYS 41 3.044 -14.634 -8.777 318 2HB LYS 41 2HB LYS 41 1.912 -13.287 -8.913 319 1HG LYS 41 1HG LYS 41 4.048 -12.139 -10.065 320 2HG LYS 41 2HG LYS 41 4.414 -13.824 -10.441 321 1HD LYS 41 1HD LYS 41 2.146 -14.083 -11.414 322 2HD LYS 41 2HD LYS 41 1.826 -12.379 -11.086 323 1HE LYS 41 1HE LYS 41 3.405 -11.648 -12.667 324 2HE LYS 41 2HE LYS 41 4.238 -13.202 -12.691 325 1HZ LYS 41 1HZ LYS 41 1.425 -12.995 -13.547 326 2HZ LYS 41 2HZ LYS 41 2.678 -12.609 -14.622 327 3HZ LYS 41 3HZ LYS 41 2.585 -14.169 -13.956 328 H THR 42 H THR 42 1.437 -11.635 -7.577 329 HA THR 42 HA THR 42 2.555 -8.956 -7.189 330 HB THR 42 HB THR 42 1.291 -8.045 -9.194 331 HG1 THR 42 HG1 THR 42 0.234 -9.398 -10.381 332 1HG2 THR 42 1HG2 THR 42 3.831 -8.717 -9.036 333 2HG2 THR 42 2HG2 THR 42 3.362 -9.984 -10.169 334 3HG2 THR 42 3HG2 THR 42 3.131 -8.288 -10.597 335 H ILE 43 H ILE 43 1.256 -8.297 -5.549 336 HA ILE 43 HA ILE 43 -1.651 -9.007 -5.691 337 HB ILE 43 HB ILE 43 -1.524 -8.493 -3.149 338 1HG1 ILE 43 1HG1 ILE 43 1.392 -9.121 -3.670 339 2HG1 ILE 43 2HG1 ILE 43 0.779 -7.520 -3.265 340 1HG2 ILE 43 1HG2 ILE 43 -1.532 -10.774 -4.519 341 2HG2 ILE 43 2HG2 ILE 43 0.044 -10.930 -3.745 342 3HG2 ILE 43 3HG2 ILE 43 -1.404 -10.727 -2.760 343 1HD1 ILE 43 1HD1 ILE 43 -0.362 -8.968 -1.274 344 2HD1 ILE 43 2HD1 ILE 43 1.106 -9.909 -1.535 345 3HD1 ILE 43 3HD1 ILE 43 1.217 -8.199 -1.120 346 H SER 44 H SER 44 -3.109 -7.336 -5.757 347 HA SER 44 HA SER 44 -1.997 -4.595 -5.275 348 1HB SER 44 1HB SER 44 -4.489 -4.886 -6.853 349 2HB SER 44 2HB SER 44 -3.146 -3.779 -7.076 350 HG SER 44 HG SER 44 -3.571 -5.793 -8.533 351 H VAL 45 H VAL 45 -3.255 -3.151 -4.043 352 HA VAL 45 HA VAL 45 -5.831 -4.090 -2.943 353 HB VAL 45 HB VAL 45 -4.145 -4.985 -1.364 354 1HG1 VAL 45 1HG1 VAL 45 -2.486 -3.076 -1.877 355 2HG1 VAL 45 2HG1 VAL 45 -3.406 -2.132 -0.709 356 3HG1 VAL 45 3HG1 VAL 45 -2.600 -3.616 -0.206 357 1HG2 VAL 45 1HG2 VAL 45 -5.832 -2.659 -0.414 358 2HG2 VAL 45 2HG2 VAL 45 -6.253 -4.371 -0.398 359 3HG2 VAL 45 3HG2 VAL 45 -5.006 -3.760 0.690 360 H VAL 46 H VAL 46 -7.105 -2.357 -3.398 361 HA VAL 46 HA VAL 46 -5.937 0.369 -3.323 362 HB VAL 46 HB VAL 46 -8.756 -0.348 -4.128 363 1HG1 VAL 46 1HG1 VAL 46 -8.148 2.035 -3.753 364 2HG1 VAL 46 2HG1 VAL 46 -6.883 1.878 -4.972 365 3HG1 VAL 46 3HG1 VAL 46 -8.577 1.706 -5.431 366 1HG2 VAL 46 1HG2 VAL 46 -6.180 -0.665 -5.645 367 2HG2 VAL 46 2HG2 VAL 46 -7.586 -1.726 -5.621 368 3HG2 VAL 46 3HG2 VAL 46 -7.644 -0.205 -6.514 369 H LEU 47 H LEU 47 -6.135 1.507 -1.480 370 HA LEU 47 HA LEU 47 -8.239 0.734 0.480 371 1HB LEU 47 1HB LEU 47 -5.970 2.669 0.932 372 2HB LEU 47 2HB LEU 47 -6.927 1.816 2.143 373 HG LEU 47 HG LEU 47 -5.883 -0.249 0.579 374 1HD1 LEU 47 1HD1 LEU 47 -4.405 1.686 -0.361 375 2HD1 LEU 47 2HD1 LEU 47 -3.570 1.580 1.190 376 3HD1 LEU 47 3HD1 LEU 47 -3.624 0.179 0.121 377 1HD2 LEU 47 1HD2 LEU 47 -5.250 0.980 3.239 378 2HD2 LEU 47 2HD2 LEU 47 -5.884 -0.624 2.870 379 3HD2 LEU 47 3HD2 LEU 47 -4.173 -0.274 2.623 380 H GLN 48 H GLN 48 -9.430 2.499 1.579 381 HA GLN 48 HA GLN 48 -9.937 4.778 -0.293 382 1HB GLN 48 1HB GLN 48 -11.756 2.973 0.401 383 2HB GLN 48 2HB GLN 48 -11.890 3.989 1.835 384 1HG GLN 48 1HG GLN 48 -11.890 5.302 -0.858 385 2HG GLN 48 2HG GLN 48 -13.361 4.500 -0.306 386 1HE2 GLN 48 2HE2 GLN 48 -12.525 7.496 -0.561 387 2HE2 GLN 48 1HE2 GLN 48 -12.952 8.148 0.947 388 H LEU 49 H LEU 49 -9.407 6.769 0.458 389 HA LEU 49 HA LEU 49 -8.457 7.142 3.183 390 1HB LEU 49 1HB LEU 49 -8.921 9.240 1.040 391 2HB LEU 49 2HB LEU 49 -7.878 9.373 2.455 392 HG LEU 49 HG LEU 49 -7.432 7.218 0.392 393 1HD1 LEU 49 1HD1 LEU 49 -6.979 10.113 0.131 394 2HD1 LEU 49 2HD1 LEU 49 -5.533 9.142 -0.150 395 3HD1 LEU 49 3HD1 LEU 49 -6.988 8.858 -1.106 396 1HD2 LEU 49 1HD2 LEU 49 -6.008 8.388 2.733 397 2HD2 LEU 49 2HD2 LEU 49 -6.043 6.721 2.158 398 3HD2 LEU 49 3HD2 LEU 49 -5.010 7.908 1.359 399 H GLU 50 H GLU 50 -9.628 8.085 4.790 400 HA GLU 50 HA GLU 50 -12.504 8.480 4.383 401 1HB GLU 50 1HB GLU 50 -12.541 8.935 6.825 402 2HB GLU 50 2HB GLU 50 -11.725 7.420 6.446 403 1HG GLU 50 1HG GLU 50 -9.770 8.150 7.307 404 2HG GLU 50 2HG GLU 50 -9.863 9.668 6.414 405 H LYS 51 H LYS 51 -10.986 10.368 2.878 406 HA LYS 51 HA LYS 51 -12.267 12.781 3.233 407 1HB LYS 51 1HB LYS 51 -10.420 14.199 4.292 408 2HB LYS 51 2HB LYS 51 -11.328 13.187 5.410 409 1HG LYS 51 1HG LYS 51 -9.523 11.885 5.891 410 2HG LYS 51 2HG LYS 51 -8.977 11.860 4.215 411 1HD LYS 51 1HD LYS 51 -8.072 14.136 4.460 412 2HD LYS 51 2HD LYS 51 -8.637 14.188 6.131 413 1HE LYS 51 1HE LYS 51 -6.805 11.989 5.184 414 2HE LYS 51 2HE LYS 51 -6.161 13.544 5.709 415 1HZ LYS 51 1HZ LYS 51 -8.116 12.154 7.406 416 2HZ LYS 51 2HZ LYS 51 -6.501 11.629 7.411 417 3HZ LYS 51 3HZ LYS 51 -6.873 13.225 7.847 418 H GLU 52 H GLU 52 -11.844 13.844 1.340 419 HA GLU 52 HA GLU 52 -9.682 12.924 -0.370 420 1HB GLU 52 1HB GLU 52 -12.072 13.920 -0.982 421 2HB GLU 52 2HB GLU 52 -11.180 15.437 -0.940 422 1HG GLU 52 1HG GLU 52 -9.614 14.657 -2.599 423 2HG GLU 52 2HG GLU 52 -10.297 13.034 -2.547 424 H GLU 53 H GLU 53 -7.670 13.532 0.216 425 HA GLU 53 HA GLU 53 -7.149 16.428 0.646 426 1HB GLU 53 1HB GLU 53 -5.310 15.542 2.320 427 2HB GLU 53 2HB GLU 53 -6.963 15.775 2.875 428 1HG GLU 53 1HG GLU 53 -6.015 13.593 3.620 429 2HG GLU 53 2HG GLU 53 -7.429 13.384 2.591 430 H GLN 54 H GLN 54 -4.573 16.632 0.716 431 HA GLN 54 HA GLN 54 -3.642 15.376 -1.805 432 1HB GLN 54 1HB GLN 54 -2.445 17.626 -0.151 433 2HB GLN 54 2HB GLN 54 -1.821 17.057 -1.700 434 1HG GLN 54 1HG GLN 54 -3.734 17.800 -2.875 435 2HG GLN 54 2HG GLN 54 -4.669 17.973 -1.402 436 1HE2 GLN 54 2HE2 GLN 54 -1.312 19.136 -1.749 437 2HE2 GLN 54 1HE2 GLN 54 -1.700 20.783 -1.622 438 H ILE 55 H ILE 55 -1.334 14.563 -1.830 439 HA ILE 55 HA ILE 55 -0.648 13.319 0.809 440 HB ILE 55 HB ILE 55 -0.040 12.220 -1.950 441 1HG1 ILE 55 1HG1 ILE 55 -1.821 10.482 -0.870 442 2HG1 ILE 55 2HG1 ILE 55 -2.409 11.988 -0.164 443 1HG2 ILE 55 1HG2 ILE 55 0.535 11.401 0.856 444 2HG2 ILE 55 2HG2 ILE 55 0.086 10.122 -0.272 445 3HG2 ILE 55 3HG2 ILE 55 1.484 11.143 -0.607 446 1HD1 ILE 55 1HD1 ILE 55 -2.237 12.937 -2.575 447 2HD1 ILE 55 2HD1 ILE 55 -2.163 11.248 -3.078 448 3HD1 ILE 55 3HD1 ILE 55 -3.576 11.849 -2.210 449 H HIS 56 H HIS 56 1.295 13.906 1.626 450 HA HIS 56 HA HIS 56 3.303 15.096 -0.247 451 1HB HIS 56 1HB HIS 56 2.262 16.634 1.496 452 2HB HIS 56 2HB HIS 56 3.090 15.665 2.716 453 HD1 HIS 56 HD1 HIS 56 3.707 18.148 -0.018 454 HD2 HIS 56 HD2 HIS 56 5.941 15.930 2.715 455 HE1 HIS 56 HE1 HIS 56 6.049 19.107 -0.063 456 H SER 57 H SER 57 2.756 12.846 2.411 457 HA SER 57 HA SER 57 5.367 11.582 1.810 458 1HB SER 57 1HB SER 57 4.696 12.986 4.360 459 2HB SER 57 2HB SER 57 5.544 11.448 4.485 460 HG SER 57 HG SER 57 7.088 13.013 4.267 461 H VAL 58 H VAL 58 5.481 9.405 2.733 462 HA VAL 58 HA VAL 58 2.919 8.322 3.754 463 HB VAL 58 HB VAL 58 4.290 7.356 1.227 464 1HG1 VAL 58 1HG1 VAL 58 1.894 6.336 2.782 465 2HG1 VAL 58 2HG1 VAL 58 2.204 5.892 1.102 466 3HG1 VAL 58 3HG1 VAL 58 3.359 5.451 2.360 467 1HG2 VAL 58 1HG2 VAL 58 1.747 8.896 1.771 468 2HG2 VAL 58 2HG2 VAL 58 3.074 9.326 0.693 469 3HG2 VAL 58 3HG2 VAL 58 1.990 8.000 0.270 470 H ASP 59 H ASP 59 3.152 6.089 4.493 471 HA ASP 59 HA ASP 59 5.945 5.186 5.006 472 1HB ASP 59 1HB ASP 59 3.882 6.034 6.954 473 2HB ASP 59 2HB ASP 59 4.611 4.468 7.310 474 H ILE 60 H ILE 60 6.118 2.958 4.683 475 HA ILE 60 HA ILE 60 3.722 1.259 4.883 476 HB ILE 60 HB ILE 60 4.924 2.103 2.278 477 1HG1 ILE 60 1HG1 ILE 60 2.269 1.054 2.082 478 2HG1 ILE 60 2HG1 ILE 60 2.350 2.016 3.553 479 1HG2 ILE 60 1HG2 ILE 60 4.051 -0.737 2.837 480 2HG2 ILE 60 2HG2 ILE 60 3.983 -0.038 1.219 481 3HG2 ILE 60 3HG2 ILE 60 5.531 -0.187 2.050 482 1HD1 ILE 60 1HD1 ILE 60 3.715 3.593 1.742 483 2HD1 ILE 60 2HD1 ILE 60 2.448 2.875 0.747 484 3HD1 ILE 60 3HD1 ILE 60 2.022 3.794 2.190 485 H GLY 61 H GLY 61 4.328 -0.705 5.646 486 1HA GLY 61 1HA GLY 61 7.238 -1.298 5.648 487 2HA GLY 61 2HA GLY 61 6.110 -1.953 6.809 488 H ASN 62 H ASN 62 7.949 -2.867 4.415 489 HA ASN 62 HA ASN 62 6.081 -4.501 2.848 490 1HB ASN 62 1HB ASN 62 8.173 -5.356 1.772 491 2HB ASN 62 2HB ASN 62 8.032 -3.599 1.720 492 1HD2 ASN 62 2HD2 ASN 62 9.610 -2.356 2.850 493 2HD2 ASN 62 1HD2 ASN 62 10.902 -3.049 3.705 494 H ASP 63 H ASP 63 5.467 -6.549 3.369 495 HA ASP 63 HA ASP 63 6.841 -7.896 5.638 496 1HB ASP 63 1HB ASP 63 4.163 -7.609 5.041 497 2HB ASP 63 2HB ASP 63 4.501 -9.218 4.405 498 H GLY 64 H GLY 64 8.429 -7.820 3.457 499 1HA GLY 64 1HA GLY 64 9.793 -9.692 2.611 500 2HA GLY 64 2HA GLY 64 8.301 -10.608 2.390 501 H SER 65 H SER 65 6.967 -8.072 1.357 502 HA SER 65 HA SER 65 7.245 -8.505 -1.431 503 1HB SER 65 1HB SER 65 5.308 -7.343 -0.554 504 2HB SER 65 2HB SER 65 6.319 -6.059 0.102 505 HG SER 65 HG SER 65 6.201 -6.739 -2.654 506 H ALA 66 H ALA 66 8.139 -7.000 -3.040 507 HA ALA 66 HA ALA 66 10.605 -5.636 -2.041 508 1HB ALA 66 1HB ALA 66 10.872 -7.806 -3.419 509 2HB ALA 66 2HB ALA 66 10.321 -6.845 -4.791 510 3HB ALA 66 3HB ALA 66 11.796 -6.398 -3.939 511 H PHE 67 H PHE 67 8.307 -5.742 -4.788 512 HA PHE 67 HA PHE 67 8.916 -2.883 -5.312 513 1HB PHE 67 1HB PHE 67 7.156 -4.772 -6.903 514 2HB PHE 67 2HB PHE 67 7.708 -3.189 -7.412 515 HD1 PHE 67 HD1 PHE 67 10.517 -3.118 -6.647 516 HD2 PHE 67 HD2 PHE 67 8.208 -6.363 -8.258 517 HE1 PHE 67 HE1 PHE 67 12.580 -4.130 -7.567 518 HE2 PHE 67 HE2 PHE 67 10.269 -7.377 -9.172 519 HZ PHE 67 HZ PHE 67 12.461 -6.263 -8.832 520 H VAL 68 H VAL 68 7.590 -1.308 -4.617 521 HA VAL 68 HA VAL 68 4.745 -2.018 -4.007 522 HB VAL 68 HB VAL 68 6.516 -0.218 -2.326 523 1HG1 VAL 68 1HG1 VAL 68 3.618 -1.070 -2.170 524 2HG1 VAL 68 2HG1 VAL 68 4.495 -0.505 -0.748 525 3HG1 VAL 68 3HG1 VAL 68 4.276 0.565 -2.131 526 1HG2 VAL 68 1HG2 VAL 68 5.420 -3.004 -1.843 527 2HG2 VAL 68 2HG2 VAL 68 7.114 -2.587 -2.101 528 3HG2 VAL 68 3HG2 VAL 68 6.282 -2.035 -0.648 529 H GLU 69 H GLU 69 3.569 -0.907 -5.443 530 HA GLU 69 HA GLU 69 4.453 1.832 -6.250 531 1HB GLU 69 1HB GLU 69 4.152 0.199 -8.086 532 2HB GLU 69 2HB GLU 69 2.486 -0.063 -7.579 533 1HG GLU 69 1HG GLU 69 1.760 1.893 -8.499 534 2HG GLU 69 2HG GLU 69 3.216 2.772 -8.033 535 H VAL 70 H VAL 70 2.979 3.577 -6.110 536 HA VAL 70 HA VAL 70 0.398 2.991 -4.720 537 HB VAL 70 HB VAL 70 2.079 5.419 -4.085 538 1HG1 VAL 70 1HG1 VAL 70 -0.578 4.625 -3.474 539 2HG1 VAL 70 2HG1 VAL 70 0.350 4.480 -1.982 540 3HG1 VAL 70 3HG1 VAL 70 0.304 6.015 -2.846 541 1HG2 VAL 70 1HG2 VAL 70 1.984 2.753 -2.635 542 2HG2 VAL 70 2HG2 VAL 70 3.389 3.450 -3.441 543 3HG2 VAL 70 3HG2 VAL 70 2.732 4.216 -1.994 544 H LEU 71 H LEU 71 -1.278 3.831 -5.809 545 HA LEU 71 HA LEU 71 -0.771 6.033 -7.752 546 1HB LEU 71 1HB LEU 71 -2.533 3.621 -7.785 547 2HB LEU 71 2HB LEU 71 -3.150 5.083 -8.549 548 HG LEU 71 HG LEU 71 -0.568 4.993 -9.503 549 1HD1 LEU 71 1HD1 LEU 71 -0.449 2.677 -8.406 550 2HD1 LEU 71 2HD1 LEU 71 -1.594 2.157 -9.642 551 3HD1 LEU 71 3HD1 LEU 71 -0.006 2.765 -10.111 552 1HD2 LEU 71 1HD2 LEU 71 -3.174 3.937 -10.604 553 2HD2 LEU 71 2HD2 LEU 71 -2.386 5.477 -10.952 554 3HD2 LEU 71 3HD2 LEU 71 -1.702 3.977 -11.576 555 H VAL 72 H VAL 72 -2.476 7.643 -7.900 556 HA VAL 72 HA VAL 72 -4.080 7.896 -5.392 557 HB VAL 72 HB VAL 72 -3.833 10.384 -5.829 558 1HG1 VAL 72 1HG1 VAL 72 -1.589 8.568 -4.999 559 2HG1 VAL 72 2HG1 VAL 72 -1.394 10.320 -4.941 560 3HG1 VAL 72 3HG1 VAL 72 -2.653 9.539 -3.984 561 1HG2 VAL 72 1HG2 VAL 72 -2.726 9.588 -8.199 562 2HG2 VAL 72 2HG2 VAL 72 -2.453 11.168 -7.471 563 3HG2 VAL 72 3HG2 VAL 72 -1.283 9.874 -7.232 564 H GLY 73 H GLY 73 -6.151 8.981 -5.635 565 1HA GLY 73 1HA GLY 73 -7.210 9.924 -8.079 566 2HA GLY 73 2HA GLY 73 -7.622 8.221 -7.939 567 H SER 74 H SER 74 -9.654 9.916 -7.977 568 HA SER 74 HA SER 74 -10.507 10.283 -5.166 569 1HB SER 74 1HB SER 74 -10.678 12.361 -6.321 570 2HB SER 74 2HB SER 74 -11.377 11.595 -7.738 571 HG SER 74 HG SER 74 -12.921 12.659 -6.367 572 H SER 75 H SER 75 -12.772 9.780 -4.737 573 HA SER 75 HA SER 75 -13.569 7.271 -6.037 574 1HB SER 75 1HB SER 75 -15.389 7.308 -4.277 575 2HB SER 75 2HB SER 75 -13.749 7.295 -3.635 576 HG SER 75 HG SER 75 -15.599 9.015 -3.084 577 H ALA 76 H ALA 76 -13.925 10.371 -6.946 578 HA ALA 76 HA ALA 76 -16.698 10.773 -7.326 579 1HB ALA 76 1HB ALA 76 -14.610 12.326 -7.789 580 2HB ALA 76 2HB ALA 76 -14.745 11.659 -9.416 581 3HB ALA 76 3HB ALA 76 -16.099 12.540 -8.710 582 H GLY 77 H GLY 77 -18.055 9.404 -8.377 583 1HA GLY 77 1HA GLY 77 -18.884 8.439 -10.439 584 2HA GLY 77 2HA GLY 77 -17.222 8.340 -11.025 585 H GLY 78 H GLY 78 -15.781 6.832 -9.660 586 1HA GLY 78 1HA GLY 78 -15.378 4.735 -8.666 587 2HA GLY 78 2HA GLY 78 -17.073 4.694 -8.175 588 H ALA 79 H ALA 79 -14.962 4.264 -11.012 589 HA ALA 79 HA ALA 79 -16.208 1.823 -11.816 590 1HB ALA 79 1HB ALA 79 -17.062 4.282 -13.376 591 2HB ALA 79 2HB ALA 79 -17.382 2.614 -13.852 592 3HB ALA 79 3HB ALA 79 -18.115 3.270 -12.388 593 H GLY 80 H GLY 80 -13.562 2.927 -11.536 594 1HA GLY 80 1HA GLY 80 -12.430 2.063 -14.069 595 2HA GLY 80 2HA GLY 80 -12.237 3.797 -13.814 596 H GLU 81 H GLU 81 -10.772 0.851 -13.311 597 HA GLU 81 HA GLU 81 -9.456 1.550 -10.765 598 1HB GLU 81 1HB GLU 81 -9.440 -0.819 -12.609 599 2HB GLU 81 2HB GLU 81 -8.108 -0.608 -11.471 600 1HG GLU 81 1HG GLU 81 -10.931 -0.345 -10.485 601 2HG GLU 81 2HG GLU 81 -10.253 -1.953 -10.738 602 H GLN 82 H GLN 82 -8.814 1.671 -14.211 603 HA GLN 82 HA GLN 82 -5.979 2.408 -13.712 604 1HB GLN 82 1HB GLN 82 -5.815 2.352 -16.215 605 2HB GLN 82 2HB GLN 82 -6.331 0.818 -15.516 606 1HG GLN 82 1HG GLN 82 -8.554 1.102 -16.208 607 2HG GLN 82 2HG GLN 82 -8.375 2.849 -16.382 608 1HE2 GLN 82 2HE2 GLN 82 -9.305 0.934 -18.468 609 2HE2 GLN 82 1HE2 GLN 82 -8.212 1.079 -19.757 610 H ASP 83 H ASP 83 -8.297 4.161 -13.000 611 HA ASP 83 HA ASP 83 -7.740 6.456 -14.831 612 1HB ASP 83 1HB ASP 83 -10.140 5.667 -14.604 613 2HB ASP 83 2HB ASP 83 -10.069 6.169 -12.914 614 H TYR 84 H TYR 84 -5.993 5.622 -12.653 615 HA TYR 84 HA TYR 84 -6.375 7.829 -10.692 616 1HB TYR 84 1HB TYR 84 -5.012 5.151 -10.586 617 2HB TYR 84 2HB TYR 84 -4.449 6.444 -9.530 618 HD1 TYR 84 HD1 TYR 84 -7.887 5.467 -10.704 619 HD2 TYR 84 HD2 TYR 84 -5.237 6.061 -7.374 620 HE1 TYR 84 HE1 TYR 84 -9.752 5.009 -9.136 621 HE2 TYR 84 HE2 TYR 84 -7.105 5.606 -5.809 622 HH TYR 84 HH TYR 84 -10.293 5.644 -6.695 623 H GLU 85 H GLU 85 -3.920 8.317 -9.863 624 HA GLU 85 HA GLU 85 -2.317 8.930 -12.306 625 1HB GLU 85 1HB GLU 85 -1.634 10.808 -10.248 626 2HB GLU 85 2HB GLU 85 -2.338 11.134 -11.825 627 1HG GLU 85 1HG GLU 85 -4.058 10.265 -9.497 628 2HG GLU 85 2HG GLU 85 -3.624 11.955 -9.742 629 H VAL 86 H VAL 86 -0.293 8.116 -12.234 630 HA VAL 86 HA VAL 86 0.563 6.425 -10.119 631 HB VAL 86 HB VAL 86 2.246 7.761 -12.255 632 1HG1 VAL 86 1HG1 VAL 86 2.712 5.412 -10.403 633 2HG1 VAL 86 2HG1 VAL 86 3.629 5.633 -11.893 634 3HG1 VAL 86 3HG1 VAL 86 3.722 6.843 -10.613 635 1HG2 VAL 86 1HG2 VAL 86 0.133 6.244 -12.789 636 2HG2 VAL 86 2HG2 VAL 86 1.634 6.038 -13.691 637 3HG2 VAL 86 3HG2 VAL 86 1.241 4.939 -12.368 638 H LEU 87 H LEU 87 0.394 7.638 -8.163 639 HA LEU 87 HA LEU 87 1.691 10.125 -7.649 640 1HB LEU 87 1HB LEU 87 -0.001 8.843 -6.174 641 2HB LEU 87 2HB LEU 87 1.385 7.916 -5.607 642 HG LEU 87 HG LEU 87 2.506 10.087 -5.006 643 1HD1 LEU 87 1HD1 LEU 87 -0.028 11.096 -6.178 644 2HD1 LEU 87 2HD1 LEU 87 0.507 11.894 -4.701 645 3HD1 LEU 87 3HD1 LEU 87 1.563 11.854 -6.112 646 1HD2 LEU 87 1HD2 LEU 87 0.039 8.996 -3.753 647 2HD2 LEU 87 2HD2 LEU 87 1.654 9.190 -3.072 648 3HD2 LEU 87 3HD2 LEU 87 0.569 10.577 -3.176 649 H LEU 88 H LEU 88 2.779 6.841 -6.709 650 HA LEU 88 HA LEU 88 5.554 7.719 -7.286 651 1HB LEU 88 1HB LEU 88 6.411 6.823 -5.224 652 2HB LEU 88 2HB LEU 88 5.124 7.964 -4.849 653 HG LEU 88 HG LEU 88 3.744 5.589 -5.097 654 1HD1 LEU 88 1HD1 LEU 88 6.553 5.082 -4.242 655 2HD1 LEU 88 2HD1 LEU 88 5.280 4.253 -3.347 656 3HD1 LEU 88 3HD1 LEU 88 5.429 4.021 -5.089 657 1HD2 LEU 88 1HD2 LEU 88 4.849 7.196 -2.819 658 2HD2 LEU 88 2HD2 LEU 88 3.171 6.965 -3.309 659 3HD2 LEU 88 3HD2 LEU 88 4.028 5.676 -2.463 660 H VAL 89 H VAL 89 6.404 6.333 -8.716 661 HA VAL 89 HA VAL 89 5.215 3.986 -9.672 662 HB VAL 89 HB VAL 89 7.494 3.395 -10.536 663 1HG1 VAL 89 1HG1 VAL 89 6.301 6.138 -10.800 664 2HG1 VAL 89 2HG1 VAL 89 7.823 5.781 -11.618 665 3HG1 VAL 89 3HG1 VAL 89 6.379 4.837 -11.988 666 1HG2 VAL 89 1HG2 VAL 89 8.568 4.396 -8.381 667 2HG2 VAL 89 2HG2 VAL 89 9.406 4.625 -9.915 668 3HG2 VAL 89 3HG2 VAL 89 8.450 5.938 -9.227 669 H THR 90 H THR 90 6.388 1.724 -9.523 670 HA THR 90 HA THR 90 6.061 0.813 -6.838 671 HB THR 90 HB THR 90 5.898 -0.466 -9.147 672 HG1 THR 90 HG1 THR 90 5.766 -2.241 -7.945 673 1HG2 THR 90 1HG2 THR 90 8.292 -0.257 -9.742 674 2HG2 THR 90 2HG2 THR 90 8.727 -1.134 -8.274 675 3HG2 THR 90 3HG2 THR 90 7.821 -1.946 -9.552 676 H SER 91 H SER 91 7.496 0.586 -5.216 677 HA SER 91 HA SER 91 10.258 1.559 -5.672 678 1HB SER 91 1HB SER 91 10.272 1.961 -3.236 679 2HB SER 91 2HB SER 91 8.895 2.748 -3.990 680 HG SER 91 HG SER 91 7.672 1.572 -2.769 681 H SER 92 H SER 92 11.819 0.082 -5.725 682 HA SER 92 HA SER 92 11.323 -2.691 -4.854 683 1HB SER 92 1HB SER 92 13.453 -3.185 -5.918 684 2HB SER 92 2HB SER 92 12.509 -2.163 -6.999 685 HG SER 92 HG SER 92 14.312 -1.039 -6.947 686 H PHE 93 H PHE 93 11.523 -3.004 -2.684 687 HA PHE 93 HA PHE 93 13.573 -1.508 -1.165 688 1HB PHE 93 1HB PHE 93 11.452 -3.449 -0.245 689 2HB PHE 93 2HB PHE 93 12.522 -2.551 0.819 690 HD1 PHE 93 HD1 PHE 93 12.558 0.109 -0.589 691 HD2 PHE 93 HD2 PHE 93 9.320 -2.587 0.278 692 HE1 PHE 93 HE1 PHE 93 10.969 2.009 -0.604 693 HE2 PHE 93 HE2 PHE 93 7.736 -0.681 0.263 694 HZ PHE 93 HZ PHE 93 8.563 1.611 -0.175 695 H MET 94 H MET 94 12.572 -4.902 -1.637 696 HA MET 94 HA MET 94 15.393 -5.692 -0.978 697 1HB MET 94 1HB MET 94 12.918 -7.377 -0.529 698 2HB MET 94 2HB MET 94 14.553 -7.713 0.033 699 1HG MET 94 1HG MET 94 14.414 -6.218 1.770 700 2HG MET 94 2HG MET 94 13.353 -5.122 0.890 701 1HE MET 94 1HE MET 94 13.721 -8.654 1.833 702 2HE MET 94 2HE MET 94 12.360 -9.087 2.864 703 3HE MET 94 3HE MET 94 12.174 -9.121 1.113 704 H SER 95 H SER 95 15.317 -8.318 -1.683 705 HA SER 95 HA SER 95 14.779 -8.233 -4.620 706 1HB SER 95 1HB SER 95 16.631 -9.676 -4.928 707 2HB SER 95 2HB SER 95 17.184 -8.579 -3.670 708 HG SER 95 HG SER 95 17.487 -10.905 -3.289 709 HA PRO 96 HA PRO 96 12.036 -11.691 -3.991 710 1HB PRO 96 1HB PRO 96 12.512 -13.271 -6.166 711 2HB PRO 96 2HB PRO 96 11.707 -11.698 -6.259 712 1HG PRO 96 1HG PRO 96 14.392 -12.473 -7.160 713 2HG PRO 96 2HG PRO 96 13.397 -11.093 -7.643 714 1HD PRO 96 1HD PRO 96 15.608 -11.111 -5.806 715 2HD PRO 96 2HD PRO 96 14.592 -9.729 -6.273 716 H SER 97 H SER 97 15.180 -12.161 -3.258 717 HA SER 97 HA SER 97 14.808 -15.085 -2.762 718 1HB SER 97 1HB SER 97 17.518 -13.795 -2.940 719 2HB SER 97 2HB SER 97 17.078 -15.483 -3.179 720 HG SER 97 HG SER 97 16.025 -14.861 -5.096 721 H GLU 98 H GLU 98 16.025 -12.008 -1.471 722 HA GLU 98 HA GLU 98 16.714 -13.249 1.091 723 1HB GLU 98 1HB GLU 98 17.500 -11.066 1.727 724 2HB GLU 98 2HB GLU 98 17.992 -11.333 0.061 725 1HG GLU 98 1HG GLU 98 15.679 -10.150 -0.477 726 2HG GLU 98 2HG GLU 98 15.898 -9.479 1.140 727 H SER 99 H SER 99 13.789 -12.429 -0.258 728 HA SER 99 HA SER 99 12.544 -11.082 1.985 729 1HB SER 99 1HB SER 99 11.313 -12.628 -0.312 730 2HB SER 99 2HB SER 99 10.428 -11.598 0.810 731 HG SER 99 HG SER 99 11.137 -10.635 -1.253 732 H ARG 100 H ARG 100 13.050 -14.428 1.039 733 HA ARG 100 HA ARG 100 11.140 -15.577 2.868 734 1HB ARG 100 1HB ARG 100 13.623 -16.701 1.547 735 2HB ARG 100 2HB ARG 100 12.545 -17.668 2.554 736 1HG ARG 100 1HG ARG 100 11.688 -16.126 0.085 737 2HG ARG 100 2HG ARG 100 11.993 -17.862 0.134 738 1HD ARG 100 1HD ARG 100 10.261 -17.551 2.242 739 2HD ARG 100 2HD ARG 100 9.666 -16.337 1.112 740 HE ARG 100 HE ARG 100 8.881 -18.087 -0.237 741 1HH1 ARG 100 1HH1 ARG 100 11.396 -19.274 1.883 742 2HH1 ARG 100 2HH1 ARG 100 11.201 -20.911 1.364 743 1HH2 ARG 100 1HH2 ARG 100 8.657 -20.221 -0.877 744 2HH2 ARG 100 2HH2 ARG 100 9.667 -21.445 -0.182 745 H SER 101 H SER 101 14.664 -16.059 3.160 746 HA SER 101 HA SER 101 14.766 -14.881 5.823 747 1HB SER 101 1HB SER 101 13.674 -17.054 6.318 748 2HB SER 101 2HB SER 101 15.009 -17.894 5.535 749 HG SER 101 HG SER 101 15.947 -17.772 7.404 750 H GLY 102 H GLY 102 16.171 -14.514 3.372 751 1HA GLY 102 1HA GLY 102 18.852 -15.681 3.968 752 2HA GLY 102 2HA GLY 102 18.357 -15.060 2.392 753 H SER 103 H SER 103 17.031 -12.698 3.791 754 HA SER 103 HA SER 103 18.979 -11.214 5.243 755 1HB SER 103 1HB SER 103 19.507 -11.411 2.410 756 2HB SER 103 2HB SER 103 19.154 -9.737 2.829 757 HG SER 103 HG SER 103 20.696 -10.017 4.566 758 H ASN 104 H ASN 104 17.717 -9.792 6.254 759 HA ASN 104 HA ASN 104 15.815 -8.521 6.794 760 1HB ASN 104 1HB ASN 104 15.545 -6.577 5.149 761 2HB ASN 104 2HB ASN 104 17.135 -6.776 5.878 762 1HD2 ASN 104 2HD2 ASN 104 15.304 -7.601 2.884 763 2HD2 ASN 104 1HD2 ASN 104 16.667 -7.614 1.872 764 HA PRO 105 HA PRO 105 12.878 -10.736 3.915 765 1HB PRO 105 1HB PRO 105 11.698 -12.295 5.824 766 2HB PRO 105 2HB PRO 105 13.138 -12.782 4.923 767 1HG PRO 105 1HG PRO 105 12.896 -11.858 7.726 768 2HG PRO 105 2HG PRO 105 14.065 -12.972 7.000 769 1HD PRO 105 1HD PRO 105 14.549 -10.283 7.643 770 2HD PRO 105 2HD PRO 105 15.547 -11.290 6.573 771 H ASN 106 H ASN 106 12.524 -9.295 7.105 772 HA ASN 106 HA ASN 106 9.887 -8.183 6.242 773 1HB ASN 106 1HB ASN 106 10.526 -9.812 8.583 774 2HB ASN 106 2HB ASN 106 9.817 -8.266 9.044 775 1HD2 ASN 106 2HD2 ASN 106 9.102 -10.028 6.009 776 2HD2 ASN 106 1HD2 ASN 106 7.469 -10.316 6.374 777 H ARG 107 H ARG 107 10.626 -6.134 5.718 778 HA ARG 107 HA ARG 107 11.886 -4.591 7.947 779 1HB ARG 107 1HB ARG 107 12.978 -5.158 5.360 780 2HB ARG 107 2HB ARG 107 12.600 -3.438 5.415 781 1HG ARG 107 1HG ARG 107 13.749 -3.566 7.787 782 2HG ARG 107 2HG ARG 107 14.503 -5.013 7.118 783 1HD ARG 107 1HD ARG 107 15.671 -3.828 5.501 784 2HD ARG 107 2HD ARG 107 14.493 -2.516 5.466 785 HE ARG 107 HE ARG 107 15.726 -1.456 7.162 786 1HH1 ARG 107 1HH1 ARG 107 16.504 -4.865 7.088 787 2HH1 ARG 107 2HH1 ARG 107 17.743 -4.711 8.283 788 1HH2 ARG 107 1HH2 ARG 107 17.340 -1.302 8.703 789 2HH2 ARG 107 2HH2 ARG 107 18.215 -2.716 9.188 790 H VAL 108 H VAL 108 11.803 -2.084 6.696 791 HA VAL 108 HA VAL 108 9.044 -1.650 5.774 792 HB VAL 108 HB VAL 108 8.219 -1.125 7.798 793 1HG1 VAL 108 1HG1 VAL 108 10.081 -2.371 8.855 794 2HG1 VAL 108 2HG1 VAL 108 11.004 -0.871 8.940 795 3HG1 VAL 108 3HG1 VAL 108 9.499 -1.034 9.846 796 1HG2 VAL 108 1HG2 VAL 108 8.617 1.189 7.015 797 2HG2 VAL 108 2HG2 VAL 108 8.728 1.075 8.772 798 3HG2 VAL 108 3HG2 VAL 108 10.197 1.178 7.799 799 H ARG 109 H ARG 109 8.777 0.432 4.767 800 HA ARG 109 HA ARG 109 11.177 2.129 4.492 801 1HB ARG 109 1HB ARG 109 9.840 0.569 2.294 802 2HB ARG 109 2HB ARG 109 10.561 2.136 1.931 803 1HG ARG 109 1HG ARG 109 12.329 0.470 3.565 804 2HG ARG 109 2HG ARG 109 11.912 -0.308 2.042 805 1HD ARG 109 1HD ARG 109 12.468 1.972 0.954 806 2HD ARG 109 2HD ARG 109 13.269 2.348 2.479 807 HE ARG 109 HE ARG 109 14.166 -0.206 1.549 808 1HH1 ARG 109 1HH1 ARG 109 14.437 3.206 0.834 809 2HH1 ARG 109 2HH1 ARG 109 16.005 3.037 0.128 810 1HH2 ARG 109 1HH2 ARG 109 16.196 -0.380 0.627 811 2HH2 ARG 109 2HH2 ARG 109 16.993 1.028 0.010 812 H MET 110 H MET 110 10.525 4.195 3.323 813 HA MET 110 HA MET 110 7.613 4.770 3.548 814 1HB MET 110 1HB MET 110 9.757 6.557 4.728 815 2HB MET 110 2HB MET 110 8.011 6.796 4.817 816 1HG MET 110 1HG MET 110 7.744 4.798 6.157 817 2HG MET 110 2HG MET 110 9.439 4.379 5.939 818 1HE MET 110 1HE MET 110 11.176 4.895 7.247 819 2HE MET 110 2HE MET 110 11.375 6.517 6.588 820 3HE MET 110 3HE MET 110 11.414 6.258 8.337 821 H PHE 111 H PHE 111 7.223 7.112 2.730 822 HA PHE 111 HA PHE 111 9.019 7.738 0.431 823 1HB PHE 111 1HB PHE 111 5.993 7.805 0.277 824 2HB PHE 111 2HB PHE 111 7.137 8.026 -1.044 825 HD1 PHE 111 HD1 PHE 111 6.140 5.517 1.564 826 HD2 PHE 111 HD2 PHE 111 7.728 6.191 -2.374 827 HE1 PHE 111 HE1 PHE 111 6.083 3.092 1.118 828 HE2 PHE 111 HE2 PHE 111 7.680 3.746 -2.806 829 HZ PHE 111 HZ PHE 111 6.850 2.195 -1.055 830 H GLY 112 H GLY 112 8.445 9.994 -0.432 831 1HA GLY 112 1HA GLY 112 7.293 11.781 1.625 832 2HA GLY 112 2HA GLY 112 8.919 12.087 1.060 833 HA PRO 113 HA PRO 113 6.227 14.415 -1.863 834 1HB PRO 113 1HB PRO 113 7.882 16.580 -1.998 835 2HB PRO 113 2HB PRO 113 6.650 16.372 -0.745 836 1HG PRO 113 1HG PRO 113 9.595 16.048 -0.570 837 2HG PRO 113 2HG PRO 113 8.440 16.565 0.667 838 1HD PRO 113 1HD PRO 113 9.567 14.005 0.487 839 2HD PRO 113 2HD PRO 113 8.113 14.418 1.405 840 H ASP 114 H ASP 114 9.736 13.966 -1.883 841 HA ASP 114 HA ASP 114 10.149 14.479 -4.676 842 1HB ASP 114 1HB ASP 114 11.738 12.862 -2.664 843 2HB ASP 114 2HB ASP 114 12.288 13.187 -4.308 844 H LYS 115 H LYS 115 9.100 11.674 -2.864 845 HA LYS 115 HA LYS 115 9.412 9.900 -5.185 846 1HB LYS 115 1HB LYS 115 8.384 9.506 -2.373 847 2HB LYS 115 2HB LYS 115 8.269 8.244 -3.601 848 1HG LYS 115 1HG LYS 115 10.766 8.517 -3.964 849 2HG LYS 115 2HG LYS 115 10.785 9.541 -2.529 850 1HD LYS 115 1HD LYS 115 9.438 7.450 -1.516 851 2HD LYS 115 2HD LYS 115 10.370 6.600 -2.750 852 1HE LYS 115 1HE LYS 115 12.368 8.036 -1.769 853 2HE LYS 115 2HE LYS 115 11.336 8.095 -0.340 854 1HZ LYS 115 1HZ LYS 115 11.202 5.675 -0.394 855 2HZ LYS 115 2HZ LYS 115 12.233 5.636 -1.744 856 3HZ LYS 115 3HZ LYS 115 12.812 6.198 -0.252 857 H LEU 116 H LEU 116 7.172 12.248 -4.459 858 HA LEU 116 HA LEU 116 5.034 10.657 -5.820 859 1HB LEU 116 1HB LEU 116 3.393 12.246 -4.643 860 2HB LEU 116 2HB LEU 116 4.103 10.950 -3.690 861 HG LEU 116 HG LEU 116 5.913 12.757 -3.092 862 1HD1 LEU 116 1HD1 LEU 116 4.283 14.287 -4.769 863 2HD1 LEU 116 2HD1 LEU 116 3.825 14.791 -3.146 864 3HD1 LEU 116 3HD1 LEU 116 5.505 14.904 -3.662 865 1HD2 LEU 116 1HD2 LEU 116 3.083 12.643 -2.041 866 2HD2 LEU 116 2HD2 LEU 116 4.500 11.802 -1.412 867 3HD2 LEU 116 3HD2 LEU 116 4.363 13.553 -1.241 868 H VAL 117 H VAL 117 4.016 11.562 -7.494 869 HA VAL 117 HA VAL 117 5.275 13.638 -8.980 870 HB VAL 117 HB VAL 117 3.768 11.932 -9.979 871 1HG1 VAL 117 1HG1 VAL 117 2.150 11.969 -8.067 872 2HG1 VAL 117 2HG1 VAL 117 1.537 13.487 -8.699 873 3HG1 VAL 117 3HG1 VAL 117 1.389 12.018 -9.657 874 1HG2 VAL 117 1HG2 VAL 117 4.096 14.424 -10.861 875 2HG2 VAL 117 2HG2 VAL 117 2.963 13.326 -11.649 876 3HG2 VAL 117 3HG2 VAL 117 2.373 14.527 -10.501 877 H ARG 118 H ARG 118 5.109 15.856 -8.810 878 HA ARG 118 HA ARG 118 3.550 17.002 -6.640 879 1HB ARG 118 1HB ARG 118 5.473 18.002 -8.683 880 2HB ARG 118 2HB ARG 118 4.328 19.177 -8.036 881 1HG ARG 118 1HG ARG 118 5.203 17.778 -5.778 882 2HG ARG 118 2HG ARG 118 6.659 17.961 -6.756 883 1HD ARG 118 1HD ARG 118 6.602 19.935 -5.459 884 2HD ARG 118 2HD ARG 118 5.930 20.435 -7.011 885 HE ARG 118 HE ARG 118 3.872 19.536 -5.172 886 1HH1 ARG 118 1HH1 ARG 118 5.901 22.241 -6.066 887 2HH1 ARG 118 2HH1 ARG 118 4.794 23.408 -5.434 888 1HH2 ARG 118 1HH2 ARG 118 2.469 21.080 -4.365 889 2HH2 ARG 118 2HH2 ARG 118 2.870 22.761 -4.481 890 H ALA 119 H ALA 119 3.159 16.681 -10.121 891 HA ALA 119 HA ALA 119 1.027 18.564 -10.434 892 1HB ALA 119 1HB ALA 119 2.492 17.198 -12.192 893 2HB ALA 119 2HB ALA 119 1.113 16.102 -12.121 894 3HB ALA 119 3HB ALA 119 0.879 17.783 -12.601 895 H ALA 120 H ALA 120 1.124 15.370 -9.069 896 HA ALA 120 HA ALA 120 -1.861 15.309 -9.040 897 1HB ALA 120 1HB ALA 120 -0.200 13.396 -10.074 898 2HB ALA 120 2HB ALA 120 -0.420 12.803 -8.427 899 3HB ALA 120 3HB ALA 120 -1.822 13.072 -9.462 900 H ALA 121 H ALA 121 1.051 14.475 -7.093 901 HA ALA 121 HA ALA 121 -0.144 13.754 -4.687 902 1HB ALA 121 1HB ALA 121 2.321 13.834 -5.202 903 2HB ALA 121 2HB ALA 121 2.265 15.569 -4.891 904 3HB ALA 121 3HB ALA 121 1.891 14.429 -3.599 905 H GLU 122 H GLU 122 0.328 17.079 -5.891 906 HA GLU 122 HA GLU 122 -0.732 18.229 -3.416 907 1HB GLU 122 1HB GLU 122 -0.568 20.387 -4.586 908 2HB GLU 122 2HB GLU 122 0.923 19.467 -4.778 909 1HG GLU 122 1HG GLU 122 0.627 19.996 -6.985 910 2HG GLU 122 2HG GLU 122 -0.435 18.589 -6.951 911 H LYS 123 H LYS 123 -2.255 16.584 -5.855 912 HA LYS 123 HA LYS 123 -4.647 18.312 -5.910 913 1HB LYS 123 1HB LYS 123 -4.196 15.612 -7.205 914 2HB LYS 123 2HB LYS 123 -5.513 16.731 -7.549 915 1HG LYS 123 1HG LYS 123 -3.592 18.417 -8.088 916 2HG LYS 123 2HG LYS 123 -2.598 16.969 -8.240 917 1HD LYS 123 1HD LYS 123 -3.397 17.289 -10.430 918 2HD LYS 123 2HD LYS 123 -4.512 16.092 -9.771 919 1HE LYS 123 1HE LYS 123 -6.038 17.998 -9.122 920 2HE LYS 123 2HE LYS 123 -4.973 19.074 -10.028 921 1HZ LYS 123 1HZ LYS 123 -6.295 16.674 -11.168 922 2HZ LYS 123 2HZ LYS 123 -6.885 18.259 -11.327 923 3HZ LYS 123 3HZ LYS 123 -5.390 17.833 -12.013 924 H ARG 124 H ARG 124 -6.435 17.849 -4.674 925 HA ARG 124 HA ARG 124 -6.163 16.057 -2.451 926 1HB ARG 124 1HB ARG 124 -8.478 17.637 -3.568 927 2HB ARG 124 2HB ARG 124 -8.671 16.578 -2.171 928 1HG ARG 124 1HG ARG 124 -7.109 17.819 -0.879 929 2HG ARG 124 2HG ARG 124 -6.498 18.672 -2.296 930 1HD ARG 124 1HD ARG 124 -9.403 18.959 -1.738 931 2HD ARG 124 2HD ARG 124 -8.307 19.760 -0.613 932 HE ARG 124 HE ARG 124 -7.353 20.472 -3.124 933 1HH1 ARG 124 1HH1 ARG 124 -10.422 20.716 -1.465 934 2HH1 ARG 124 2HH1 ARG 124 -10.881 22.150 -2.315 935 1HH2 ARG 124 1HH2 ARG 124 -7.987 22.326 -4.200 936 2HH2 ARG 124 2HH2 ARG 124 -9.519 23.053 -3.848 937 H TRP 125 H TRP 125 -6.193 13.909 -2.673 938 HA TRP 125 HA TRP 125 -8.187 12.642 -4.521 939 1HB TRP 125 1HB TRP 125 -5.609 11.477 -3.410 940 2HB TRP 125 2HB TRP 125 -6.677 10.714 -4.583 941 HD1 TRP 125 HD1 TRP 125 -3.703 12.850 -4.354 942 HE1 TRP 125 HE1 TRP 125 -3.128 13.866 -6.651 943 HE3 TRP 125 HE3 TRP 125 -7.997 11.799 -6.900 944 HZ2 TRP 125 HZ2 TRP 125 -4.307 14.173 -9.227 945 HZ3 TRP 125 HZ3 TRP 125 -8.243 12.441 -9.273 946 HH2 TRP 125 HH2 TRP 125 -6.409 13.638 -10.443 947 H ASP 126 H ASP 126 -9.103 10.554 -3.613 948 HA ASP 126 HA ASP 126 -8.992 10.479 -0.638 949 1HB ASP 126 1HB ASP 126 -11.427 10.189 -0.497 950 2HB ASP 126 2HB ASP 126 -11.010 11.737 -1.223 951 H ARG 127 H ARG 127 -8.293 8.772 -3.267 952 HA ARG 127 HA ARG 127 -8.880 6.188 -1.934 953 1HB ARG 127 1HB ARG 127 -9.296 6.655 -4.908 954 2HB ARG 127 2HB ARG 127 -9.572 5.152 -4.033 955 1HG ARG 127 1HG ARG 127 -11.101 7.090 -2.671 956 2HG ARG 127 2HG ARG 127 -11.355 7.418 -4.382 957 1HD ARG 127 1HD ARG 127 -11.455 4.567 -3.531 958 2HD ARG 127 2HD ARG 127 -12.794 5.597 -3.031 959 HE ARG 127 HE ARG 127 -12.097 5.792 -5.873 960 1HH1 ARG 127 1HH1 ARG 127 -14.079 4.212 -3.453 961 2HH1 ARG 127 2HH1 ARG 127 -15.289 3.766 -4.600 962 1HH2 ARG 127 1HH2 ARG 127 -13.688 5.176 -7.315 963 2HH2 ARG 127 2HH2 ARG 127 -15.072 4.297 -6.756 964 H VAL 128 H VAL 128 -7.119 4.734 -2.226 965 HA VAL 128 HA VAL 128 -4.953 5.708 -4.024 966 HB VAL 128 HB VAL 128 -4.613 6.376 -1.604 967 1HG1 VAL 128 1HG1 VAL 128 -5.259 3.700 -1.107 968 2HG1 VAL 128 2HG1 VAL 128 -3.521 3.791 -0.825 969 3HG1 VAL 128 3HG1 VAL 128 -4.617 4.856 0.056 970 1HG2 VAL 128 1HG2 VAL 128 -2.687 4.743 -3.221 971 2HG2 VAL 128 2HG2 VAL 128 -2.699 6.481 -2.921 972 3HG2 VAL 128 3HG2 VAL 128 -2.201 5.369 -1.645 973 H LYS 129 H LYS 129 -3.746 4.140 -5.033 974 HA LYS 129 HA LYS 129 -4.738 1.344 -4.718 975 1HB LYS 129 1HB LYS 129 -4.316 2.999 -6.985 976 2HB LYS 129 2HB LYS 129 -3.077 1.748 -7.054 977 1HG LYS 129 1HG LYS 129 -4.766 0.003 -6.881 978 2HG LYS 129 2HG LYS 129 -6.034 1.212 -6.664 979 1HD LYS 129 1HD LYS 129 -6.076 1.765 -8.880 980 2HD LYS 129 2HD LYS 129 -4.336 1.550 -9.072 981 1HE LYS 129 1HE LYS 129 -4.667 -0.921 -8.968 982 2HE LYS 129 2HE LYS 129 -6.409 -0.658 -8.899 983 1HZ LYS 129 1HZ LYS 129 -6.248 0.528 -11.022 984 2HZ LYS 129 2HZ LYS 129 -4.592 0.171 -11.096 985 3HZ LYS 129 3HZ LYS 129 -5.733 -1.086 -11.152 986 H ILE 130 H ILE 130 -3.391 0.156 -3.453 987 HA ILE 130 HA ILE 130 -0.455 0.702 -3.564 988 HB ILE 130 HB ILE 130 -2.069 -0.895 -1.540 989 1HG1 ILE 130 1HG1 ILE 130 -2.593 1.521 -1.475 990 2HG1 ILE 130 2HG1 ILE 130 -1.687 1.033 -0.044 991 1HG2 ILE 130 1HG2 ILE 130 0.848 -0.239 -1.853 992 2HG2 ILE 130 2HG2 ILE 130 0.170 -0.405 -0.233 993 3HG2 ILE 130 3HG2 ILE 130 0.091 -1.755 -1.365 994 1HD1 ILE 130 1HD1 ILE 130 0.288 1.737 -1.902 995 2HD1 ILE 130 2HD1 ILE 130 -0.968 2.958 -2.112 996 3HD1 ILE 130 3HD1 ILE 130 -0.243 2.703 -0.524 997 H VAL 131 H VAL 131 0.638 -0.693 -4.927 998 HA VAL 131 HA VAL 131 -0.439 -3.453 -5.185 999 HB VAL 131 HB VAL 131 1.077 -1.838 -7.247 1000 1HG1 VAL 131 1HG1 VAL 131 -0.139 -4.591 -7.176 1001 2HG1 VAL 131 2HG1 VAL 131 0.117 -3.741 -8.699 1002 3HG1 VAL 131 3HG1 VAL 131 1.491 -4.120 -7.660 1003 1HG2 VAL 131 1HG2 VAL 131 -1.564 -1.502 -6.467 1004 2HG2 VAL 131 2HG2 VAL 131 -0.911 -1.083 -8.050 1005 3HG2 VAL 131 3HG2 VAL 131 -1.700 -2.639 -7.807 1006 H CYS 132 H CYS 132 0.867 -4.942 -4.343 1007 HA CYS 132 HA CYS 132 3.755 -4.340 -3.965 1008 1HB CYS 132 1HB CYS 132 3.152 -5.205 -1.933 1009 2HB CYS 132 2HB CYS 132 1.720 -5.979 -2.576 1010 HG CYS 132 HG CYS 132 3.005 -8.085 -2.252 1011 H SER 133 H SER 133 5.302 -5.443 -5.175 1012 HA SER 133 HA SER 133 4.375 -7.677 -6.914 1013 1HB SER 133 1HB SER 133 4.928 -5.016 -7.777 1014 2HB SER 133 2HB SER 133 6.228 -6.035 -8.381 1015 HG SER 133 HG SER 133 3.625 -5.896 -9.136 1016 H GLN 134 H GLN 134 5.722 -9.350 -6.730 1017 HA GLN 134 HA GLN 134 8.433 -9.494 -7.157 1018 1HB GLN 134 1HB GLN 134 8.754 -8.013 -5.143 1019 2HB GLN 134 2HB GLN 134 8.007 -9.263 -4.158 1020 1HG GLN 134 1HG GLN 134 10.337 -9.652 -3.958 1021 2HG GLN 134 2HG GLN 134 9.791 -10.842 -5.141 1022 1HE2 GLN 134 2HE2 GLN 134 12.243 -8.663 -4.631 1023 2HE2 GLN 134 1HE2 GLN 134 12.652 -8.312 -6.238 1024 HA PRO 135 HA PRO 135 6.837 -13.664 -6.445 1025 1HB PRO 135 1HB PRO 135 8.817 -14.984 -7.780 1026 2HB PRO 135 2HB PRO 135 7.497 -14.138 -8.603 1027 1HG PRO 135 1HG PRO 135 10.340 -13.406 -8.389 1028 2HG PRO 135 2HG PRO 135 9.136 -12.918 -9.589 1029 1HD PRO 135 1HD PRO 135 10.081 -11.390 -7.365 1030 2HD PRO 135 2HD PRO 135 8.789 -10.952 -8.502 1031 H TYR 136 H TYR 136 7.283 -13.656 -4.126 1032 HA TYR 136 HA TYR 136 9.966 -14.756 -3.431 1033 1HB TYR 136 1HB TYR 136 9.438 -13.736 -1.102 1034 2HB TYR 136 2HB TYR 136 9.964 -12.661 -2.392 1035 HD1 TYR 136 HD1 TYR 136 7.046 -13.821 -0.426 1036 HD2 TYR 136 HD2 TYR 136 8.463 -11.040 -3.375 1037 HE1 TYR 136 HE1 TYR 136 4.960 -12.500 -0.185 1038 HE2 TYR 136 HE2 TYR 136 6.375 -9.720 -3.133 1039 HH TYR 136 HH TYR 136 3.762 -10.578 -2.186 1040 H SER 137 H SER 137 6.617 -15.442 -3.379 1041 HA SER 137 HA SER 137 7.165 -17.616 -1.393 1042 1HB SER 137 1HB SER 137 5.153 -15.606 -1.335 1043 2HB SER 137 2HB SER 137 4.348 -17.143 -1.615 1044 HG SER 137 HG SER 137 6.062 -16.372 0.497 1045 H LYS 138 H LYS 138 5.399 -19.399 -1.696 1046 HA LYS 138 HA LYS 138 4.630 -19.871 -4.498 1047 1HB LYS 138 1HB LYS 138 5.816 -22.080 -4.544 1048 2HB LYS 138 2HB LYS 138 6.917 -20.703 -4.520 1049 1HG LYS 138 1HG LYS 138 6.966 -20.970 -1.976 1050 2HG LYS 138 2HG LYS 138 6.177 -22.527 -2.227 1051 1HD LYS 138 1HD LYS 138 8.599 -21.931 -3.866 1052 2HD LYS 138 2HD LYS 138 8.840 -22.306 -2.160 1053 1HE LYS 138 1HE LYS 138 7.111 -24.270 -2.771 1054 2HE LYS 138 2HE LYS 138 7.843 -24.047 -4.359 1055 1HZ LYS 138 1HZ LYS 138 9.319 -24.527 -1.827 1056 2HZ LYS 138 2HZ LYS 138 9.053 -25.675 -3.050 1057 3HZ LYS 138 3HZ LYS 138 10.022 -24.314 -3.356 1058 H ASP 139 H ASP 139 4.899 -21.194 -1.201 1059 HA ASP 139 HA ASP 139 2.279 -22.537 -1.617 1060 1HB ASP 139 1HB ASP 139 3.003 -23.974 0.325 1061 2HB ASP 139 2HB ASP 139 3.970 -24.181 -1.130 1062 H SER 140 H SER 140 4.129 -20.398 0.411 1063 HA SER 140 HA SER 140 1.823 -20.068 2.243 1064 1HB SER 140 1HB SER 140 3.729 -18.593 3.390 1065 2HB SER 140 2HB SER 140 3.641 -20.333 3.628 1066 HG SER 140 HG SER 140 5.452 -18.797 2.214 1067 HA PRO 141 HA PRO 141 1.141 -16.049 0.344 1068 1HB PRO 141 1HB PRO 141 -0.745 -15.159 2.092 1069 2HB PRO 141 2HB PRO 141 -1.066 -16.402 0.878 1070 1HG PRO 141 1HG PRO 141 -0.847 -16.662 3.789 1071 2HG PRO 141 2HG PRO 141 -1.600 -17.748 2.617 1072 1HD PRO 141 1HD PRO 141 0.980 -18.017 3.874 1073 2HD PRO 141 2HD PRO 141 0.210 -19.105 2.699 1074 H PHE 142 H PHE 142 0.759 -13.644 1.372 1075 HA PHE 142 HA PHE 142 1.878 -12.788 3.782 1076 1HB PHE 142 1HB PHE 142 3.920 -13.773 1.978 1077 2HB PHE 142 2HB PHE 142 4.135 -12.040 2.212 1078 HD1 PHE 142 HD1 PHE 142 3.893 -11.208 4.722 1079 HD2 PHE 142 HD2 PHE 142 4.815 -15.235 3.555 1080 HE1 PHE 142 HE1 PHE 142 4.863 -11.635 6.964 1081 HE2 PHE 142 HE2 PHE 142 5.788 -15.664 5.796 1082 HZ PHE 142 HZ PHE 142 5.812 -13.863 7.501 1083 H GLY 143 H GLY 143 3.219 -10.429 3.012 1084 1HA GLY 143 1HA GLY 143 2.385 -9.033 0.769 1085 2HA GLY 143 2HA GLY 143 1.010 -8.921 1.864 1086 H LEU 144 H LEU 144 1.011 -7.148 3.101 1087 HA LEU 144 HA LEU 144 3.634 -5.853 3.723 1088 1HB LEU 144 1HB LEU 144 1.036 -4.794 2.809 1089 2HB LEU 144 2HB LEU 144 1.745 -3.894 4.147 1090 HG LEU 144 HG LEU 144 3.867 -3.714 2.870 1091 1HD1 LEU 144 1HD1 LEU 144 2.246 -5.267 0.859 1092 2HD1 LEU 144 2HD1 LEU 144 3.559 -4.215 0.332 1093 3HD1 LEU 144 3HD1 LEU 144 3.891 -5.567 1.415 1094 1HD2 LEU 144 1HD2 LEU 144 1.914 -2.040 2.728 1095 2HD2 LEU 144 2HD2 LEU 144 3.122 -1.963 1.445 1096 3HD2 LEU 144 3HD2 LEU 144 1.575 -2.755 1.152 1097 H SER 145 H SER 145 3.780 -4.760 5.808 1098 HA SER 145 HA SER 145 2.318 -6.249 7.926 1099 1HB SER 145 1HB SER 145 4.688 -4.375 8.148 1100 2HB SER 145 2HB SER 145 4.042 -5.397 9.430 1101 HG SER 145 HG SER 145 5.164 -6.238 6.957 1102 H PHE 146 H PHE 146 2.599 -3.035 6.541 1103 HA PHE 146 HA PHE 146 0.218 -2.112 7.847 1104 1HB PHE 146 1HB PHE 146 1.186 -0.479 9.419 1105 2HB PHE 146 2HB PHE 146 1.704 -2.107 9.848 1106 HD1 PHE 146 HD1 PHE 146 2.727 1.090 8.325 1107 HD2 PHE 146 HD2 PHE 146 4.023 -2.812 9.566 1108 HE1 PHE 146 HE1 PHE 146 5.086 1.783 8.026 1109 HE2 PHE 146 HE2 PHE 146 6.388 -2.123 9.250 1110 HZ PHE 146 HZ PHE 146 6.913 0.173 8.480 1111 H VAL 147 H VAL 147 -0.125 0.261 7.460 1112 HA VAL 147 HA VAL 147 1.637 1.421 5.373 1113 HB VAL 147 HB VAL 147 -0.287 2.011 3.974 1114 1HG1 VAL 147 1HG1 VAL 147 0.925 -0.228 3.772 1115 2HG1 VAL 147 2HG1 VAL 147 -0.459 -0.938 4.605 1116 3HG1 VAL 147 3HG1 VAL 147 -0.680 -0.148 3.044 1117 1HG2 VAL 147 1HG2 VAL 147 -1.774 0.839 6.285 1118 2HG2 VAL 147 2HG2 VAL 147 -2.204 2.204 5.254 1119 3HG2 VAL 147 3HG2 VAL 147 -2.436 0.554 4.676 1120 H ARG 148 H ARG 148 1.283 3.809 5.190 1121 HA ARG 148 HA ARG 148 -0.345 5.103 7.267 1122 1HB ARG 148 1HB ARG 148 2.517 4.520 7.621 1123 2HB ARG 148 2HB ARG 148 2.120 6.218 7.861 1124 1HG ARG 148 1HG ARG 148 1.499 5.644 9.938 1125 2HG ARG 148 2HG ARG 148 0.081 4.905 9.199 1126 1HD ARG 148 1HD ARG 148 0.819 2.811 9.651 1127 2HD ARG 148 2HD ARG 148 2.446 3.175 9.077 1128 HE ARG 148 HE ARG 148 2.284 4.490 11.513 1129 1HH1 ARG 148 1HH1 ARG 148 1.772 1.200 10.440 1130 2HH1 ARG 148 2HH1 ARG 148 2.243 0.525 11.960 1131 1HH2 ARG 148 1HH2 ARG 148 2.884 3.572 13.464 1132 2HH2 ARG 148 2HH2 ARG 148 2.865 1.851 13.655 1133 H PHE 149 H PHE 149 -1.236 6.535 5.725 1134 HA PHE 149 HA PHE 149 0.597 8.015 3.926 1135 1HB PHE 149 1HB PHE 149 -2.413 8.102 4.258 1136 2HB PHE 149 2HB PHE 149 -1.519 9.065 3.087 1137 HD1 PHE 149 HD1 PHE 149 0.434 7.367 1.920 1138 HD2 PHE 149 HD2 PHE 149 -3.519 6.350 3.246 1139 HE1 PHE 149 HE1 PHE 149 0.404 5.447 0.349 1140 HE2 PHE 149 HE2 PHE 149 -3.552 4.426 1.678 1141 HZ PHE 149 HZ PHE 149 -1.590 3.977 0.228 1142 H HIS 150 H HIS 150 0.842 10.325 4.072 1143 HA HIS 150 HA HIS 150 -0.444 11.715 6.316 1144 1HB HIS 150 1HB HIS 150 2.138 12.536 6.831 1145 2HB HIS 150 2HB HIS 150 1.225 11.388 7.797 1146 HD1 HIS 150 HD1 HIS 150 4.335 11.716 6.040 1147 HD2 HIS 150 HD2 HIS 150 1.714 8.567 6.785 1148 HE1 HIS 150 HE1 HIS 150 5.653 9.585 5.662 1149 H SER 151 H SER 151 -1.028 13.619 5.534 1150 HA SER 151 HA SER 151 0.099 14.691 3.074 1151 1HB SER 151 1HB SER 151 -1.701 16.180 3.129 1152 2HB SER 151 2HB SER 151 -2.344 14.852 4.083 1153 HG SER 151 HG SER 151 -2.674 16.619 5.315 Start of MODEL 7 1 H MET 1 H MET 1 0.420 18.525 14.130 2 HA MET 1 HA MET 1 0.267 16.317 14.069 3 1HB MET 1 1HB MET 1 -2.581 16.846 14.920 4 2HB MET 1 2HB MET 1 -2.036 15.220 14.509 5 1HG MET 1 1HG MET 1 -1.690 15.362 16.844 6 2HG MET 1 2HG MET 1 -0.094 15.664 16.156 7 1HE MET 1 1HE MET 1 1.213 16.891 17.044 8 2HE MET 1 2HE MET 1 1.099 18.548 17.629 9 3HE MET 1 3HE MET 1 0.649 17.215 18.689 10 HA PRO 2 HA PRO 2 -1.437 16.779 9.785 11 1HB PRO 2 1HB PRO 2 0.966 16.740 8.493 12 2HB PRO 2 2HB PRO 2 0.237 18.218 9.136 13 1HG PRO 2 1HG PRO 2 2.582 16.735 10.088 14 2HG PRO 2 2HG PRO 2 2.104 18.408 10.404 15 1HD PRO 2 1HD PRO 2 1.788 16.124 12.134 16 2HD PRO 2 2HD PRO 2 1.313 17.808 12.448 17 H GLU 3 H GLU 3 -2.284 14.701 9.544 18 HA GLU 3 HA GLU 3 -0.472 12.617 8.530 19 1HB GLU 3 1HB GLU 3 -2.062 12.284 11.089 20 2HB GLU 3 2HB GLU 3 -1.407 10.926 10.172 21 1HG GLU 3 1HG GLU 3 0.867 11.993 10.356 22 2HG GLU 3 2HG GLU 3 0.158 13.187 11.445 23 H ILE 4 H ILE 4 -1.981 10.532 8.168 24 HA ILE 4 HA ILE 4 -4.719 11.347 7.388 25 HB ILE 4 HB ILE 4 -2.533 10.484 5.486 26 1HG1 ILE 4 1HG1 ILE 4 -4.675 12.620 5.343 27 2HG1 ILE 4 2HG1 ILE 4 -3.025 12.893 5.900 28 1HG2 ILE 4 1HG2 ILE 4 -5.525 10.270 5.025 29 2HG2 ILE 4 2HG2 ILE 4 -4.310 10.186 3.749 30 3HG2 ILE 4 3HG2 ILE 4 -4.362 8.945 5.002 31 1HD1 ILE 4 1HD1 ILE 4 -3.543 11.647 3.209 32 2HD1 ILE 4 2HD1 ILE 4 -3.585 13.396 3.417 33 3HD1 ILE 4 3HD1 ILE 4 -2.108 12.502 3.774 34 H ARG 5 H ARG 5 -6.023 9.802 8.172 35 HA ARG 5 HA ARG 5 -4.941 7.085 8.678 36 1HB ARG 5 1HB ARG 5 -7.339 8.626 9.650 37 2HB ARG 5 2HB ARG 5 -7.280 6.869 9.810 38 1HG ARG 5 1HG ARG 5 -5.118 7.063 11.004 39 2HG ARG 5 2HG ARG 5 -5.227 8.819 10.884 40 1HD ARG 5 1HD ARG 5 -7.511 7.282 12.072 41 2HD ARG 5 2HD ARG 5 -6.085 7.611 13.055 42 HE ARG 5 HE ARG 5 -8.075 9.565 12.214 43 1HH1 ARG 5 1HH1 ARG 5 -4.738 9.085 13.145 44 2HH1 ARG 5 2HH1 ARG 5 -4.549 10.717 13.680 45 1HH2 ARG 5 1HH2 ARG 5 -7.785 11.667 12.915 46 2HH2 ARG 5 2HH2 ARG 5 -6.254 12.166 13.553 47 H LEU 6 H LEU 6 -6.459 5.246 8.185 48 HA LEU 6 HA LEU 6 -7.668 5.654 5.495 49 1HB LEU 6 1HB LEU 6 -6.059 3.583 6.725 50 2HB LEU 6 2HB LEU 6 -7.565 2.897 6.123 51 HG LEU 6 HG LEU 6 -7.145 3.819 3.901 52 1HD1 LEU 6 1HD1 LEU 6 -4.740 5.069 5.257 53 2HD1 LEU 6 2HD1 LEU 6 -4.850 4.886 3.506 54 3HD1 LEU 6 3HD1 LEU 6 -6.022 5.887 4.364 55 1HD2 LEU 6 1HD2 LEU 6 -4.709 2.449 5.074 56 2HD2 LEU 6 2HD2 LEU 6 -6.154 1.642 4.465 57 3HD2 LEU 6 3HD2 LEU 6 -5.106 2.530 3.357 58 H ARG 7 H ARG 7 -9.757 4.738 5.056 59 HA ARG 7 HA ARG 7 -11.466 4.537 7.489 60 1HB ARG 7 1HB ARG 7 -12.032 6.239 5.718 61 2HB ARG 7 2HB ARG 7 -12.335 4.900 4.611 62 1HG ARG 7 1HG ARG 7 -13.971 3.993 6.329 63 2HG ARG 7 2HG ARG 7 -13.799 5.526 7.185 64 1HD ARG 7 1HD ARG 7 -14.684 6.764 5.345 65 2HD ARG 7 2HD ARG 7 -14.556 5.379 4.261 66 HE ARG 7 HE ARG 7 -16.613 4.608 5.100 67 1HH1 ARG 7 1HH1 ARG 7 -15.224 6.940 7.307 68 2HH1 ARG 7 2HH1 ARG 7 -16.624 6.961 8.323 69 1HH2 ARG 7 1HH2 ARG 7 -18.403 4.669 6.441 70 2HH2 ARG 7 2HH2 ARG 7 -18.405 5.690 7.839 71 H HIS 8 H HIS 8 -11.219 3.046 4.263 72 HA HIS 8 HA HIS 8 -11.417 0.365 5.394 73 1HB HIS 8 1HB HIS 8 -13.502 -0.208 4.133 74 2HB HIS 8 2HB HIS 8 -13.780 0.946 5.437 75 HD1 HIS 8 HD1 HIS 8 -15.316 2.753 4.693 76 HD2 HIS 8 HD2 HIS 8 -12.821 1.509 1.593 77 HE1 HIS 8 HE1 HIS 8 -15.897 4.187 2.687 78 H VAL 9 H VAL 9 -11.227 -1.291 3.649 79 HA VAL 9 HA VAL 9 -9.454 -0.332 1.529 80 HB VAL 9 HB VAL 9 -8.975 -2.454 2.679 81 1HG1 VAL 9 1HG1 VAL 9 -11.714 -2.865 2.545 82 2HG1 VAL 9 2HG1 VAL 9 -11.083 -4.017 1.369 83 3HG1 VAL 9 3HG1 VAL 9 -10.519 -4.063 3.039 84 1HG2 VAL 9 1HG2 VAL 9 -8.579 -2.016 0.105 85 2HG2 VAL 9 2HG2 VAL 9 -8.288 -3.618 0.781 86 3HG2 VAL 9 3HG2 VAL 9 -9.785 -3.287 -0.091 87 H VAL 10 H VAL 10 -10.749 0.911 0.132 88 HA VAL 10 HA VAL 10 -13.328 0.268 -0.802 89 HB VAL 10 HB VAL 10 -12.504 2.467 -1.259 90 1HG1 VAL 10 1HG1 VAL 10 -10.047 1.322 -1.633 91 2HG1 VAL 10 2HG1 VAL 10 -10.490 1.721 -3.287 92 3HG1 VAL 10 3HG1 VAL 10 -10.442 2.983 -2.058 93 1HG2 VAL 10 1HG2 VAL 10 -13.861 1.124 -3.099 94 2HG2 VAL 10 2HG2 VAL 10 -13.234 2.734 -3.456 95 3HG2 VAL 10 3HG2 VAL 10 -12.371 1.305 -4.025 96 H SER 11 H SER 11 -10.231 -0.448 -2.521 97 HA SER 11 HA SER 11 -11.734 -2.642 -3.874 98 1HB SER 11 1HB SER 11 -9.309 -1.602 -5.219 99 2HB SER 11 2HB SER 11 -10.851 -2.098 -5.906 100 HG SER 11 HG SER 11 -10.912 0.050 -6.110 101 H CYS 12 H CYS 12 -10.513 -4.623 -4.215 102 HA CYS 12 HA CYS 12 -7.856 -4.764 -2.900 103 1HB CYS 12 1HB CYS 12 -8.584 -6.828 -1.657 104 2HB CYS 12 2HB CYS 12 -9.347 -5.344 -1.091 105 HG CYS 12 HG CYS 12 -10.896 -7.665 -1.946 106 H SER 13 H SER 13 -6.601 -5.587 -4.477 107 HA SER 13 HA SER 13 -7.726 -7.722 -6.234 108 1HB SER 13 1HB SER 13 -6.373 -5.412 -6.922 109 2HB SER 13 2HB SER 13 -5.097 -6.624 -6.958 110 HG SER 13 HG SER 13 -5.963 -6.905 -8.892 111 H SER 14 H SER 14 -7.027 -8.411 -3.661 112 HA SER 14 HA SER 14 -5.715 -10.745 -3.637 113 1HB SER 14 1HB SER 14 -3.641 -10.152 -4.487 114 2HB SER 14 2HB SER 14 -3.684 -8.549 -3.771 115 HG SER 14 HG SER 14 -3.110 -11.039 -2.576 116 H GLN 15 H GLN 15 -6.930 -11.090 -1.782 117 HA GLN 15 HA GLN 15 -5.830 -10.091 0.707 118 1HB GLN 15 1HB GLN 15 -7.136 -8.271 0.952 119 2HB GLN 15 2HB GLN 15 -7.914 -8.600 -0.573 120 1HG GLN 15 1HG GLN 15 -8.866 -10.068 1.875 121 2HG GLN 15 2HG GLN 15 -9.340 -8.395 1.628 122 1HE2 GLN 15 2HE2 GLN 15 -8.814 -10.580 -1.144 123 2HE2 GLN 15 1HE2 GLN 15 -10.449 -10.650 -1.596 124 H ASP 16 H ASP 16 -6.218 -11.544 2.336 125 HA ASP 16 HA ASP 16 -7.683 -13.994 1.641 126 1HB ASP 16 1HB ASP 16 -5.462 -13.521 3.159 127 2HB ASP 16 2HB ASP 16 -6.697 -13.640 4.411 128 H SER 17 H SER 17 -8.714 -14.710 4.167 129 HA SER 17 HA SER 17 -11.076 -12.929 4.267 130 1HB SER 17 1HB SER 17 -10.555 -15.706 5.355 131 2HB SER 17 2HB SER 17 -12.033 -14.806 5.681 132 HG SER 17 HG SER 17 -11.610 -16.311 3.646 133 H THR 18 H THR 18 -9.356 -14.788 6.795 134 HA THR 18 HA THR 18 -10.038 -12.929 8.876 135 HB THR 18 HB THR 18 -7.699 -14.212 9.727 136 HG1 THR 18 HG1 THR 18 -9.232 -16.087 8.274 137 1HG2 THR 18 1HG2 THR 18 -10.641 -14.736 9.982 138 2HG2 THR 18 2HG2 THR 18 -9.496 -15.884 10.675 139 3HG2 THR 18 3HG2 THR 18 -9.491 -14.202 11.207 140 H HIS 19 H HIS 19 -6.922 -13.503 7.209 141 HA HIS 19 HA HIS 19 -5.954 -10.869 8.173 142 1HB HIS 19 1HB HIS 19 -4.463 -12.900 6.484 143 2HB HIS 19 2HB HIS 19 -3.774 -11.570 7.412 144 HD1 HIS 19 HD1 HIS 19 -2.925 -14.524 7.939 145 HD2 HIS 19 HD2 HIS 19 -5.898 -12.527 10.071 146 HE1 HIS 19 HE1 HIS 19 -3.145 -15.726 10.157 147 H CYS 20 H CYS 20 -7.774 -9.992 6.704 148 HA CYS 20 HA CYS 20 -7.100 -10.010 3.827 149 1HB CYS 20 1HB CYS 20 -9.187 -8.685 3.574 150 2HB CYS 20 2HB CYS 20 -9.459 -10.205 4.411 151 HG CYS 20 HG CYS 20 -10.624 -8.488 5.913 152 H ALA 21 H ALA 21 -7.413 -7.737 2.769 153 HA ALA 21 HA ALA 21 -5.222 -6.090 3.573 154 1HB ALA 21 1HB ALA 21 -7.406 -5.957 1.548 155 2HB ALA 21 2HB ALA 21 -6.596 -4.444 1.949 156 3HB ALA 21 3HB ALA 21 -5.663 -5.807 1.332 157 H GLU 22 H GLU 22 -8.607 -6.104 4.453 158 HA GLU 22 HA GLU 22 -8.836 -3.408 5.376 159 1HB GLU 22 1HB GLU 22 -10.566 -5.494 5.173 160 2HB GLU 22 2HB GLU 22 -10.267 -5.506 6.911 161 1HG GLU 22 1HG GLU 22 -10.653 -2.918 6.727 162 2HG GLU 22 2HG GLU 22 -11.466 -3.331 5.216 163 H ASN 23 H ASN 23 -7.009 -6.072 6.632 164 HA ASN 23 HA ASN 23 -7.039 -5.375 9.420 165 1HB ASN 23 1HB ASN 23 -5.186 -6.919 7.639 166 2HB ASN 23 2HB ASN 23 -4.682 -6.524 9.282 167 1HD2 ASN 23 2HD2 ASN 23 -7.296 -8.141 7.435 168 2HD2 ASN 23 1HD2 ASN 23 -7.774 -9.164 8.703 169 H LEU 24 H LEU 24 -5.628 -3.897 6.666 170 HA LEU 24 HA LEU 24 -3.393 -2.583 7.867 171 1HB LEU 24 1HB LEU 24 -5.085 -1.656 5.524 172 2HB LEU 24 2HB LEU 24 -3.427 -1.174 5.882 173 HG LEU 24 HG LEU 24 -4.050 -4.096 5.560 174 1HD1 LEU 24 1HD1 LEU 24 -4.987 -2.601 3.619 175 2HD1 LEU 24 2HD1 LEU 24 -3.287 -2.446 3.177 176 3HD1 LEU 24 3HD1 LEU 24 -4.041 -4.039 3.238 177 1HD2 LEU 24 1HD2 LEU 24 -1.781 -2.709 6.163 178 2HD2 LEU 24 2HD2 LEU 24 -1.792 -4.291 5.388 179 3HD2 LEU 24 3HD2 LEU 24 -1.639 -2.832 4.410 180 H LEU 25 H LEU 25 -6.844 -2.027 7.916 181 HA LEU 25 HA LEU 25 -6.924 0.724 8.582 182 1HB LEU 25 1HB LEU 25 -8.666 -1.664 9.044 183 2HB LEU 25 2HB LEU 25 -8.998 -0.219 9.980 184 HG LEU 25 HG LEU 25 -10.316 -0.318 7.869 185 1HD1 LEU 25 1HD1 LEU 25 -8.489 1.863 8.637 186 2HD1 LEU 25 2HD1 LEU 25 -9.100 1.974 6.986 187 3HD1 LEU 25 3HD1 LEU 25 -10.224 1.893 8.340 188 1HD2 LEU 25 1HD2 LEU 25 -8.408 -1.481 6.601 189 2HD2 LEU 25 2HD2 LEU 25 -9.273 -0.216 5.727 190 3HD2 LEU 25 3HD2 LEU 25 -7.690 0.120 6.430 191 H LYS 26 H LYS 26 -5.800 -2.051 10.362 192 HA LYS 26 HA LYS 26 -5.481 -0.315 12.775 193 1HB LYS 26 1HB LYS 26 -5.806 -3.334 12.813 194 2HB LYS 26 2HB LYS 26 -5.761 -2.246 14.198 195 1HG LYS 26 1HG LYS 26 -8.038 -2.384 14.019 196 2HG LYS 26 2HG LYS 26 -7.793 -1.119 12.816 197 1HD LYS 26 1HD LYS 26 -8.104 -2.565 11.029 198 2HD LYS 26 2HD LYS 26 -7.578 -3.977 11.946 199 1HE LYS 26 1HE LYS 26 -9.663 -4.374 12.775 200 2HE LYS 26 2HE LYS 26 -10.011 -2.659 12.991 201 1HZ LYS 26 1HZ LYS 26 -10.234 -2.525 10.528 202 2HZ LYS 26 2HZ LYS 26 -10.143 -4.221 10.475 203 3HZ LYS 26 3HZ LYS 26 -11.425 -3.467 11.291 204 H ALA 27 H ALA 27 -3.464 0.197 11.532 205 HA ALA 27 HA ALA 27 -1.424 -1.656 10.923 206 1HB ALA 27 1HB ALA 27 -1.235 1.213 11.877 207 2HB ALA 27 2HB ALA 27 0.142 0.292 11.271 208 3HB ALA 27 3HB ALA 27 -1.222 0.639 10.208 209 H ASP 28 H ASP 28 -2.536 -0.549 14.039 210 HA ASP 28 HA ASP 28 -0.176 -1.857 15.329 211 1HB ASP 28 1HB ASP 28 -2.098 0.153 16.536 212 2HB ASP 28 2HB ASP 28 -0.630 -0.478 17.283 213 H THR 29 H THR 29 -0.851 -3.965 15.589 214 HA THR 29 HA THR 29 -2.693 -4.573 17.669 215 HB THR 29 HB THR 29 -4.587 -4.253 16.399 216 HG1 THR 29 HG1 THR 29 -4.905 -6.287 16.946 217 1HG2 THR 29 1HG2 THR 29 -2.761 -4.590 14.174 218 2HG2 THR 29 2HG2 THR 29 -4.285 -5.434 13.906 219 3HG2 THR 29 3HG2 THR 29 -4.288 -3.712 14.266 220 H TYR 30 H TYR 30 -2.642 -6.778 14.918 221 HA TYR 30 HA TYR 30 -0.172 -8.072 15.670 222 1HB TYR 30 1HB TYR 30 -1.084 -10.106 16.654 223 2HB TYR 30 2HB TYR 30 -1.628 -8.714 17.588 224 HD1 TYR 30 HD1 TYR 30 -3.957 -7.964 17.506 225 HD2 TYR 30 HD2 TYR 30 -2.648 -11.398 15.283 226 HE1 TYR 30 HE1 TYR 30 -6.318 -8.634 17.150 227 HE2 TYR 30 HE2 TYR 30 -5.008 -12.065 14.923 228 HH TYR 30 HH TYR 30 -7.265 -10.882 14.872 229 H ARG 31 H ARG 31 -1.646 -7.145 13.266 230 HA ARG 31 HA ARG 31 -1.122 -9.487 11.602 231 1HB ARG 31 1HB ARG 31 -3.688 -9.309 12.588 232 2HB ARG 31 2HB ARG 31 -3.835 -8.463 11.048 233 1HG ARG 31 1HG ARG 31 -4.233 -10.701 10.452 234 2HG ARG 31 2HG ARG 31 -2.523 -10.496 10.075 235 1HD ARG 31 1HD ARG 31 -3.149 -11.341 12.852 236 2HD ARG 31 2HD ARG 31 -3.458 -12.533 11.591 237 HE ARG 31 HE ARG 31 -0.886 -11.448 11.115 238 1HH1 ARG 31 1HH1 ARG 31 -2.542 -13.367 13.524 239 2HH1 ARG 31 2HH1 ARG 31 -1.102 -14.193 14.002 240 1HH2 ARG 31 1HH2 ARG 31 0.955 -12.543 11.764 241 2HH2 ARG 31 2HH2 ARG 31 0.858 -13.734 13.017 242 H LYS 32 H LYS 32 -1.836 -8.838 9.213 243 HA LYS 32 HA LYS 32 -1.824 -5.970 8.663 244 1HB LYS 32 1HB LYS 32 0.338 -5.979 7.464 245 2HB LYS 32 2HB LYS 32 0.554 -6.349 9.167 246 1HG LYS 32 1HG LYS 32 0.074 -8.745 7.537 247 2HG LYS 32 2HG LYS 32 1.528 -7.870 7.061 248 1HD LYS 32 1HD LYS 32 2.599 -8.290 9.043 249 2HD LYS 32 2HD LYS 32 1.107 -8.225 9.982 250 1HE LYS 32 1HE LYS 32 1.939 -10.516 9.965 251 2HE LYS 32 2HE LYS 32 0.451 -10.434 9.021 252 1HZ LYS 32 1HZ LYS 32 3.062 -10.075 7.707 253 2HZ LYS 32 2HZ LYS 32 2.492 -11.636 8.045 254 3HZ LYS 32 3HZ LYS 32 1.590 -10.603 7.042 255 H TRP 33 H TRP 33 -0.836 -6.225 5.939 256 HA TRP 33 HA TRP 33 -3.201 -7.458 4.751 257 1HB TRP 33 1HB TRP 33 -2.152 -5.393 3.775 258 2HB TRP 33 2HB TRP 33 -0.745 -6.346 3.370 259 HD1 TRP 33 HD1 TRP 33 -4.284 -7.725 2.957 260 HE1 TRP 33 HE1 TRP 33 -4.720 -8.135 0.441 261 HE3 TRP 33 HE3 TRP 33 -0.080 -5.631 1.030 262 HZ2 TRP 33 HZ2 TRP 33 -3.420 -7.601 -2.067 263 HZ3 TRP 33 HZ3 TRP 33 0.314 -5.608 -1.430 264 HH2 TRP 33 HH2 TRP 33 -1.356 -6.580 -2.969 265 H ARG 34 H ARG 34 -3.318 -9.376 3.661 266 HA ARG 34 HA ARG 34 -0.839 -10.902 3.121 267 1HB ARG 34 1HB ARG 34 -3.095 -11.787 4.924 268 2HB ARG 34 2HB ARG 34 -2.125 -12.969 4.052 269 1HG ARG 34 1HG ARG 34 -0.071 -11.844 5.050 270 2HG ARG 34 2HG ARG 34 -1.176 -10.952 6.097 271 1HD ARG 34 1HD ARG 34 -1.975 -12.947 7.127 272 2HD ARG 34 2HD ARG 34 -1.240 -13.965 5.891 273 HE ARG 34 HE ARG 34 0.716 -12.376 7.352 274 1HH1 ARG 34 1HH1 ARG 34 -1.153 -15.333 7.341 275 2HH1 ARG 34 2HH1 ARG 34 -0.044 -16.156 8.381 276 1HH2 ARG 34 1HH2 ARG 34 2.124 -13.481 8.695 277 2HH2 ARG 34 2HH2 ARG 34 1.791 -15.121 9.143 278 H ALA 35 H ALA 35 -1.028 -11.696 1.070 279 HA ALA 35 HA ALA 35 -3.266 -11.259 -0.597 280 1HB ALA 35 1HB ALA 35 -0.947 -11.821 -1.377 281 2HB ALA 35 2HB ALA 35 -1.222 -13.490 -0.883 282 3HB ALA 35 3HB ALA 35 -2.192 -12.781 -2.174 283 H ALA 36 H ALA 36 -4.872 -12.665 -1.408 284 HA ALA 36 HA ALA 36 -6.068 -14.389 0.561 285 1HB ALA 36 1HB ALA 36 -6.920 -13.056 -1.711 286 2HB ALA 36 2HB ALA 36 -7.020 -14.749 -2.187 287 3HB ALA 36 3HB ALA 36 -7.889 -14.178 -0.762 288 H LYS 37 H LYS 37 -3.984 -14.935 -2.204 289 HA LYS 37 HA LYS 37 -4.136 -17.865 -1.695 290 1HB LYS 37 1HB LYS 37 -4.608 -16.600 -4.059 291 2HB LYS 37 2HB LYS 37 -2.872 -16.878 -4.192 292 1HG LYS 37 1HG LYS 37 -3.504 -18.926 -4.952 293 2HG LYS 37 2HG LYS 37 -3.698 -19.294 -3.239 294 1HD LYS 37 1HD LYS 37 -5.986 -19.241 -3.345 295 2HD LYS 37 2HD LYS 37 -6.003 -17.967 -4.566 296 1HE LYS 37 1HE LYS 37 -5.388 -19.556 -6.303 297 2HE LYS 37 2HE LYS 37 -5.201 -20.840 -5.108 298 1HZ LYS 37 1HZ LYS 37 -7.750 -19.380 -5.450 299 2HZ LYS 37 2HZ LYS 37 -7.377 -20.754 -6.373 300 3HZ LYS 37 3HZ LYS 37 -7.483 -20.872 -4.680 301 H ALA 38 H ALA 38 -1.792 -18.580 -2.962 302 HA ALA 38 HA ALA 38 0.294 -17.248 -1.269 303 1HB ALA 38 1HB ALA 38 -0.250 -19.660 -0.729 304 2HB ALA 38 2HB ALA 38 0.331 -20.089 -2.339 305 3HB ALA 38 3HB ALA 38 1.437 -19.379 -1.163 306 H GLY 39 H GLY 39 2.525 -18.439 -2.550 307 1HA GLY 39 1HA GLY 39 3.960 -18.073 -4.373 308 2HA GLY 39 2HA GLY 39 2.530 -18.216 -5.396 309 H GLU 40 H GLU 40 3.270 -15.866 -2.869 310 HA GLU 40 HA GLU 40 2.183 -13.585 -3.902 311 1HB GLU 40 1HB GLU 40 4.735 -13.937 -2.340 312 2HB GLU 40 2HB GLU 40 4.062 -12.348 -2.705 313 1HG GLU 40 1HG GLU 40 1.979 -14.092 -1.706 314 2HG GLU 40 2HG GLU 40 3.338 -14.073 -0.592 315 H LYS 41 H LYS 41 2.358 -13.460 -6.107 316 HA LYS 41 HA LYS 41 5.051 -12.923 -7.280 317 1HB LYS 41 1HB LYS 41 3.481 -14.608 -8.369 318 2HB LYS 41 2HB LYS 41 2.424 -13.250 -8.757 319 1HG LYS 41 1HG LYS 41 4.411 -12.156 -9.888 320 2HG LYS 41 2HG LYS 41 5.273 -13.682 -9.685 321 1HD LYS 41 1HD LYS 41 2.608 -13.409 -11.104 322 2HD LYS 41 2HD LYS 41 4.167 -13.463 -11.925 323 1HE LYS 41 1HE LYS 41 4.617 -15.680 -10.976 324 2HE LYS 41 2HE LYS 41 3.091 -15.627 -10.095 325 1HZ LYS 41 1HZ LYS 41 1.999 -15.332 -12.318 326 2HZ LYS 41 2HZ LYS 41 3.494 -15.722 -13.029 327 3HZ LYS 41 3HZ LYS 41 2.695 -16.856 -12.047 328 H THR 42 H THR 42 1.719 -11.653 -7.498 329 HA THR 42 HA THR 42 2.690 -8.907 -7.130 330 HB THR 42 HB THR 42 1.667 -8.078 -9.229 331 HG1 THR 42 HG1 THR 42 1.087 -9.654 -10.789 332 1HG2 THR 42 1HG2 THR 42 4.112 -8.840 -9.042 333 2HG2 THR 42 2HG2 THR 42 3.608 -10.289 -9.912 334 3HG2 THR 42 3HG2 THR 42 3.449 -8.705 -10.669 335 H ILE 43 H ILE 43 1.219 -8.031 -5.767 336 HA ILE 43 HA ILE 43 -1.637 -8.893 -6.037 337 HB ILE 43 HB ILE 43 -1.733 -8.467 -3.505 338 1HG1 ILE 43 1HG1 ILE 43 1.263 -8.817 -3.825 339 2HG1 ILE 43 2HG1 ILE 43 0.453 -7.330 -3.335 340 1HG2 ILE 43 1HG2 ILE 43 -1.779 -10.693 -4.659 341 2HG2 ILE 43 2HG2 ILE 43 -0.036 -10.781 -4.429 342 3HG2 ILE 43 3HG2 ILE 43 -1.107 -10.734 -3.031 343 1HD1 ILE 43 1HD1 ILE 43 -0.628 -9.075 -1.552 344 2HD1 ILE 43 2HD1 ILE 43 0.963 -9.800 -1.778 345 3HD1 ILE 43 3HD1 ILE 43 0.826 -8.131 -1.226 346 H SER 44 H SER 44 -3.223 -7.273 -5.498 347 HA SER 44 HA SER 44 -2.087 -4.522 -5.226 348 1HB SER 44 1HB SER 44 -4.577 -4.572 -6.742 349 2HB SER 44 2HB SER 44 -3.059 -3.772 -7.114 350 HG SER 44 HG SER 44 -3.307 -5.311 -8.654 351 H VAL 45 H VAL 45 -3.403 -3.045 -4.078 352 HA VAL 45 HA VAL 45 -5.952 -3.957 -2.941 353 HB VAL 45 HB VAL 45 -4.308 -4.988 -1.407 354 1HG1 VAL 45 1HG1 VAL 45 -2.582 -3.100 -1.923 355 2HG1 VAL 45 2HG1 VAL 45 -3.392 -2.232 -0.619 356 3HG1 VAL 45 3HG1 VAL 45 -2.625 -3.786 -0.300 357 1HG2 VAL 45 1HG2 VAL 45 -5.811 -2.590 -0.328 358 2HG2 VAL 45 2HG2 VAL 45 -6.370 -4.262 -0.393 359 3HG2 VAL 45 3HG2 VAL 45 -5.063 -3.811 0.702 360 H VAL 46 H VAL 46 -7.116 -2.143 -3.441 361 HA VAL 46 HA VAL 46 -5.827 0.505 -3.185 362 HB VAL 46 HB VAL 46 -8.646 -0.098 -4.096 363 1HG1 VAL 46 1HG1 VAL 46 -7.724 2.260 -3.368 364 2HG1 VAL 46 2HG1 VAL 46 -6.953 2.218 -4.954 365 3HG1 VAL 46 3HG1 VAL 46 -8.708 2.107 -4.824 366 1HG2 VAL 46 1HG2 VAL 46 -6.411 -1.040 -5.376 367 2HG2 VAL 46 2HG2 VAL 46 -7.902 -0.597 -6.203 368 3HG2 VAL 46 3HG2 VAL 46 -6.572 0.555 -6.108 369 H LEU 47 H LEU 47 -5.995 1.594 -1.332 370 HA LEU 47 HA LEU 47 -8.097 0.799 0.612 371 1HB LEU 47 1HB LEU 47 -5.808 2.708 1.117 372 2HB LEU 47 2HB LEU 47 -6.750 1.804 2.299 373 HG LEU 47 HG LEU 47 -5.725 -0.195 0.642 374 1HD1 LEU 47 1HD1 LEU 47 -4.253 1.607 -0.353 375 2HD1 LEU 47 2HD1 LEU 47 -3.502 1.774 1.235 376 3HD1 LEU 47 3HD1 LEU 47 -3.382 0.249 0.358 377 1HD2 LEU 47 1HD2 LEU 47 -5.892 0.101 3.233 378 2HD2 LEU 47 2HD2 LEU 47 -4.598 -0.901 2.579 379 3HD2 LEU 47 3HD2 LEU 47 -4.258 0.749 3.100 380 H GLN 48 H GLN 48 -9.218 2.563 1.792 381 HA GLN 48 HA GLN 48 -9.748 4.868 -0.034 382 1HB GLN 48 1HB GLN 48 -11.556 3.063 0.758 383 2HB GLN 48 2HB GLN 48 -11.645 4.140 2.152 384 1HG GLN 48 1HG GLN 48 -11.671 5.385 -0.560 385 2HG GLN 48 2HG GLN 48 -13.134 4.559 -0.024 386 1HE2 GLN 48 2HE2 GLN 48 -12.340 7.568 -0.289 387 2HE2 GLN 48 1HE2 GLN 48 -12.803 8.224 1.205 388 H LEU 49 H LEU 49 -9.277 6.873 0.721 389 HA LEU 49 HA LEU 49 -8.230 7.192 3.437 390 1HB LEU 49 1HB LEU 49 -8.643 9.314 1.304 391 2HB LEU 49 2HB LEU 49 -7.594 9.413 2.718 392 HG LEU 49 HG LEU 49 -7.252 7.403 0.474 393 1HD1 LEU 49 1HD1 LEU 49 -6.828 10.002 0.108 394 2HD1 LEU 49 2HD1 LEU 49 -5.346 9.650 0.998 395 3HD1 LEU 49 3HD1 LEU 49 -5.690 8.805 -0.510 396 1HD2 LEU 49 1HD2 LEU 49 -5.645 8.117 2.938 397 2HD2 LEU 49 2HD2 LEU 49 -6.312 6.545 2.503 398 3HD2 LEU 49 3HD2 LEU 49 -4.961 7.212 1.588 399 H GLU 50 H GLU 50 -9.292 8.364 5.008 400 HA GLU 50 HA GLU 50 -12.190 8.586 4.754 401 1HB GLU 50 1HB GLU 50 -12.065 9.373 7.127 402 2HB GLU 50 2HB GLU 50 -11.254 7.828 6.859 403 1HG GLU 50 1HG GLU 50 -9.155 8.716 7.171 404 2HG GLU 50 2HG GLU 50 -9.613 10.292 6.524 405 H LYS 51 H LYS 51 -10.762 10.435 2.985 406 HA LYS 51 HA LYS 51 -12.247 12.743 3.066 407 1HB LYS 51 1HB LYS 51 -10.554 14.419 4.030 408 2HB LYS 51 2HB LYS 51 -11.451 13.465 5.207 409 1HG LYS 51 1HG LYS 51 -9.597 12.300 5.873 410 2HG LYS 51 2HG LYS 51 -8.917 12.256 4.246 411 1HD LYS 51 1HD LYS 51 -8.194 14.572 4.434 412 2HD LYS 51 2HD LYS 51 -8.983 14.725 6.003 413 1HE LYS 51 1HE LYS 51 -6.948 12.558 5.602 414 2HE LYS 51 2HE LYS 51 -6.399 14.212 5.874 415 1HZ LYS 51 1HZ LYS 51 -7.935 14.219 7.847 416 2HZ LYS 51 2HZ LYS 51 -8.086 12.538 7.642 417 3HZ LYS 51 3HZ LYS 51 -6.569 13.223 7.983 418 H GLU 52 H GLU 52 -11.744 13.941 1.235 419 HA GLU 52 HA GLU 52 -9.589 12.971 -0.481 420 1HB GLU 52 1HB GLU 52 -11.952 14.050 -1.085 421 2HB GLU 52 2HB GLU 52 -11.012 15.539 -1.017 422 1HG GLU 52 1HG GLU 52 -9.391 14.601 -2.622 423 2HG GLU 52 2HG GLU 52 -10.344 13.120 -2.711 424 H GLU 53 H GLU 53 -7.580 13.519 0.280 425 HA GLU 53 HA GLU 53 -7.000 16.407 0.670 426 1HB GLU 53 1HB GLU 53 -5.263 15.455 2.448 427 2HB GLU 53 2HB GLU 53 -6.911 15.853 2.914 428 1HG GLU 53 1HG GLU 53 -6.134 13.624 3.775 429 2HG GLU 53 2HG GLU 53 -7.577 13.521 2.773 430 H GLN 54 H GLN 54 -4.538 16.712 0.718 431 HA GLN 54 HA GLN 54 -3.436 15.385 -1.663 432 1HB GLN 54 1HB GLN 54 -2.276 17.552 0.121 433 2HB GLN 54 2HB GLN 54 -1.589 17.011 -1.408 434 1HG GLN 54 1HG GLN 54 -3.426 17.835 -2.657 435 2HG GLN 54 2HG GLN 54 -4.412 18.031 -1.219 436 1HE2 GLN 54 2HE2 GLN 54 -0.991 19.037 -1.433 437 2HE2 GLN 54 1HE2 GLN 54 -1.305 20.699 -1.286 438 H ILE 55 H ILE 55 -0.877 14.929 -1.361 439 HA ILE 55 HA ILE 55 -0.423 13.537 1.234 440 HB ILE 55 HB ILE 55 0.051 12.234 -1.463 441 1HG1 ILE 55 1HG1 ILE 55 -1.823 10.692 -0.291 442 2HG1 ILE 55 2HG1 ILE 55 -2.281 12.252 0.392 443 1HG2 ILE 55 1HG2 ILE 55 1.376 11.714 0.802 444 2HG2 ILE 55 2HG2 ILE 55 -0.071 10.763 1.133 445 3HG2 ILE 55 3HG2 ILE 55 0.895 10.426 -0.303 446 1HD1 ILE 55 1HD1 ILE 55 -1.997 13.060 -2.120 447 2HD1 ILE 55 2HD1 ILE 55 -2.293 11.356 -2.465 448 3HD1 ILE 55 3HD1 ILE 55 -3.495 12.299 -1.584 449 H HIS 56 H HIS 56 1.544 14.095 1.992 450 HA HIS 56 HA HIS 56 3.615 15.002 0.032 451 1HB HIS 56 1HB HIS 56 2.899 16.782 1.561 452 2HB HIS 56 2HB HIS 56 3.233 15.753 2.952 453 HD1 HIS 56 HD1 HIS 56 4.872 17.936 0.413 454 HD2 HIS 56 HD2 HIS 56 6.049 15.344 3.458 455 HE1 HIS 56 HE1 HIS 56 7.332 18.379 0.819 456 H SER 57 H SER 57 2.909 12.880 2.762 457 HA SER 57 HA SER 57 5.469 11.465 2.205 458 1HB SER 57 1HB SER 57 4.704 12.814 4.755 459 2HB SER 57 2HB SER 57 5.468 11.232 4.879 460 HG SER 57 HG SER 57 6.662 13.504 4.519 461 H VAL 58 H VAL 58 5.435 9.270 2.990 462 HA VAL 58 HA VAL 58 2.760 8.231 3.769 463 HB VAL 58 HB VAL 58 4.413 7.277 1.416 464 1HG1 VAL 58 1HG1 VAL 58 1.868 6.261 2.698 465 2HG1 VAL 58 2HG1 VAL 58 2.276 5.888 1.022 466 3HG1 VAL 58 3HG1 VAL 58 3.336 5.357 2.328 467 1HG2 VAL 58 1HG2 VAL 58 1.860 8.869 1.663 468 2HG2 VAL 58 2HG2 VAL 58 3.312 9.267 0.746 469 3HG2 VAL 58 3HG2 VAL 58 2.249 7.971 0.196 470 H ASP 59 H ASP 59 2.909 5.941 4.478 471 HA ASP 59 HA ASP 59 5.634 5.009 5.201 472 1HB ASP 59 1HB ASP 59 3.452 5.822 7.081 473 2HB ASP 59 2HB ASP 59 4.403 4.398 7.502 474 H ILE 60 H ILE 60 5.482 3.146 3.942 475 HA ILE 60 HA ILE 60 3.223 1.303 4.569 476 HB ILE 60 HB ILE 60 4.502 2.019 1.937 477 1HG1 ILE 60 1HG1 ILE 60 1.695 1.308 1.899 478 2HG1 ILE 60 2HG1 ILE 60 2.005 2.464 3.191 479 1HG2 ILE 60 1HG2 ILE 60 3.599 -0.690 2.743 480 2HG2 ILE 60 2HG2 ILE 60 2.999 -0.104 1.190 481 3HG2 ILE 60 3HG2 ILE 60 4.735 -0.210 1.482 482 1HD1 ILE 60 1HD1 ILE 60 3.435 3.665 1.294 483 2HD1 ILE 60 2HD1 ILE 60 2.325 2.790 0.238 484 3HD1 ILE 60 3HD1 ILE 60 1.695 3.924 1.432 485 H GLY 61 H GLY 61 3.919 -0.512 5.510 486 1HA GLY 61 1HA GLY 61 6.803 -1.042 5.584 487 2HA GLY 61 2HA GLY 61 5.615 -1.806 6.619 488 H ASN 62 H ASN 62 7.723 -2.575 4.423 489 HA ASN 62 HA ASN 62 6.119 -4.228 2.606 490 1HB ASN 62 1HB ASN 62 9.093 -3.881 3.015 491 2HB ASN 62 2HB ASN 62 8.411 -5.014 1.848 492 1HD2 ASN 62 2HD2 ASN 62 8.108 -1.530 2.764 493 2HD2 ASN 62 1HD2 ASN 62 7.904 -0.983 1.170 494 H ASP 63 H ASP 63 5.388 -6.226 3.182 495 HA ASP 63 HA ASP 63 6.681 -7.633 5.461 496 1HB ASP 63 1HB ASP 63 4.064 -7.330 4.947 497 2HB ASP 63 2HB ASP 63 4.344 -8.787 3.991 498 H GLY 64 H GLY 64 8.578 -7.821 3.881 499 1HA GLY 64 1HA GLY 64 9.928 -9.416 2.760 500 2HA GLY 64 2HA GLY 64 8.526 -10.478 2.639 501 H SER 65 H SER 65 7.557 -7.440 1.619 502 HA SER 65 HA SER 65 7.224 -8.198 -1.122 503 1HB SER 65 1HB SER 65 7.154 -5.478 0.215 504 2HB SER 65 2HB SER 65 6.609 -5.800 -1.424 505 HG SER 65 HG SER 65 5.484 -6.489 1.029 506 H ALA 66 H ALA 66 8.017 -6.322 -2.744 507 HA ALA 66 HA ALA 66 10.861 -5.686 -2.312 508 1HB ALA 66 1HB ALA 66 9.846 -7.786 -4.109 509 2HB ALA 66 2HB ALA 66 10.982 -6.669 -4.859 510 3HB ALA 66 3HB ALA 66 11.453 -7.588 -3.431 511 H PHE 67 H PHE 67 8.287 -5.776 -4.811 512 HA PHE 67 HA PHE 67 9.060 -2.969 -5.525 513 1HB PHE 67 1HB PHE 67 7.377 -4.948 -7.095 514 2HB PHE 67 2HB PHE 67 7.844 -3.342 -7.629 515 HD1 PHE 67 HD1 PHE 67 10.614 -3.055 -6.919 516 HD2 PHE 67 HD2 PHE 67 8.533 -6.528 -8.343 517 HE1 PHE 67 HE1 PHE 67 12.739 -3.955 -7.814 518 HE2 PHE 67 HE2 PHE 67 10.651 -7.435 -9.235 519 HZ PHE 67 HZ PHE 67 12.763 -6.151 -8.976 520 H VAL 68 H VAL 68 7.797 -1.461 -4.579 521 HA VAL 68 HA VAL 68 4.909 -2.158 -4.140 522 HB VAL 68 HB VAL 68 6.643 -0.337 -2.443 523 1HG1 VAL 68 1HG1 VAL 68 4.235 0.304 -2.539 524 2HG1 VAL 68 2HG1 VAL 68 3.801 -1.332 -2.043 525 3HG1 VAL 68 3HG1 VAL 68 4.701 -0.286 -0.943 526 1HG2 VAL 68 1HG2 VAL 68 5.762 -3.201 -2.239 527 2HG2 VAL 68 2HG2 VAL 68 7.343 -2.499 -1.899 528 3HG2 VAL 68 3HG2 VAL 68 6.011 -2.259 -0.769 529 H GLU 69 H GLU 69 3.780 -1.105 -5.650 530 HA GLU 69 HA GLU 69 4.598 1.660 -6.431 531 1HB GLU 69 1HB GLU 69 4.394 0.010 -8.270 532 2HB GLU 69 2HB GLU 69 2.719 -0.287 -7.811 533 1HG GLU 69 1HG GLU 69 1.980 1.691 -8.703 534 2HG GLU 69 2HG GLU 69 3.458 2.555 -8.283 535 H VAL 70 H VAL 70 3.140 3.369 -6.199 536 HA VAL 70 HA VAL 70 0.499 2.698 -4.982 537 HB VAL 70 HB VAL 70 2.243 5.007 -4.116 538 1HG1 VAL 70 1HG1 VAL 70 -0.509 4.094 -3.532 539 2HG1 VAL 70 2HG1 VAL 70 0.447 4.578 -2.132 540 3HG1 VAL 70 3HG1 VAL 70 0.181 5.715 -3.453 541 1HG2 VAL 70 1HG2 VAL 70 1.924 2.207 -3.085 542 2HG2 VAL 70 2HG2 VAL 70 3.391 3.176 -3.228 543 3HG2 VAL 70 3HG2 VAL 70 2.230 3.517 -1.944 544 H LEU 71 H LEU 71 -1.140 3.624 -6.024 545 HA LEU 71 HA LEU 71 -0.581 5.926 -7.836 546 1HB LEU 71 1HB LEU 71 -2.074 3.429 -8.179 547 2HB LEU 71 2HB LEU 71 -3.051 4.842 -8.572 548 HG LEU 71 HG LEU 71 -1.155 5.649 -10.019 549 1HD1 LEU 71 1HD1 LEU 71 -0.089 2.927 -9.251 550 2HD1 LEU 71 2HD1 LEU 71 0.444 3.768 -10.706 551 3HD1 LEU 71 3HD1 LEU 71 0.722 4.488 -9.121 552 1HD2 LEU 71 1HD2 LEU 71 -2.583 3.046 -10.544 553 2HD2 LEU 71 2HD2 LEU 71 -2.937 4.645 -11.199 554 3HD2 LEU 71 3HD2 LEU 71 -1.520 3.757 -11.759 555 H VAL 72 H VAL 72 -2.437 7.469 -7.994 556 HA VAL 72 HA VAL 72 -3.957 7.600 -5.424 557 HB VAL 72 HB VAL 72 -3.837 10.118 -5.841 558 1HG1 VAL 72 1HG1 VAL 72 -1.736 8.275 -4.850 559 2HG1 VAL 72 2HG1 VAL 72 -1.259 9.959 -5.066 560 3HG1 VAL 72 3HG1 VAL 72 -2.602 9.553 -3.999 561 1HG2 VAL 72 1HG2 VAL 72 -2.987 9.985 -8.163 562 2HG2 VAL 72 2HG2 VAL 72 -1.866 10.870 -7.128 563 3HG2 VAL 72 3HG2 VAL 72 -1.525 9.196 -7.573 564 H GLY 73 H GLY 73 -6.036 8.699 -5.547 565 1HA GLY 73 1HA GLY 73 -7.231 9.529 -8.002 566 2HA GLY 73 2HA GLY 73 -7.701 7.866 -7.648 567 H SER 74 H SER 74 -9.620 9.801 -7.675 568 HA SER 74 HA SER 74 -10.179 10.368 -4.831 569 1HB SER 74 1HB SER 74 -10.250 12.402 -6.061 570 2HB SER 74 2HB SER 74 -11.137 11.657 -7.380 571 HG SER 74 HG SER 74 -12.005 12.432 -4.822 572 H SER 75 H SER 75 -12.261 9.942 -4.032 573 HA SER 75 HA SER 75 -13.524 7.587 -5.229 574 1HB SER 75 1HB SER 75 -13.216 7.691 -2.786 575 2HB SER 75 2HB SER 75 -14.208 9.145 -2.722 576 HG SER 75 HG SER 75 -15.888 7.900 -2.730 577 H ALA 76 H ALA 76 -13.727 10.711 -6.071 578 HA ALA 76 HA ALA 76 -16.482 11.373 -5.918 579 1HB ALA 76 1HB ALA 76 -14.574 12.915 -6.562 580 2HB ALA 76 2HB ALA 76 -14.598 12.154 -8.152 581 3HB ALA 76 3HB ALA 76 -16.008 13.044 -7.578 582 H GLY 77 H GLY 77 -18.158 10.312 -6.843 583 1HA GLY 77 1HA GLY 77 -19.414 9.112 -8.424 584 2HA GLY 77 2HA GLY 77 -18.201 9.567 -9.620 585 H GLY 78 H GLY 78 -16.247 8.238 -9.754 586 1HA GLY 78 1HA GLY 78 -15.056 6.199 -8.903 587 2HA GLY 78 2HA GLY 78 -16.649 5.476 -8.672 588 H ALA 79 H ALA 79 -14.563 6.844 -11.227 589 HA ALA 79 HA ALA 79 -16.058 5.720 -13.412 590 1HB ALA 79 1HB ALA 79 -13.296 6.855 -13.087 591 2HB ALA 79 2HB ALA 79 -13.717 6.013 -14.578 592 3HB ALA 79 3HB ALA 79 -14.628 7.439 -14.084 593 H GLY 80 H GLY 80 -13.241 4.585 -11.562 594 1HA GLY 80 1HA GLY 80 -13.840 1.838 -11.785 595 2HA GLY 80 2HA GLY 80 -12.767 2.227 -13.130 596 H GLU 81 H GLU 81 -11.280 0.712 -11.961 597 HA GLU 81 HA GLU 81 -9.961 1.976 -9.602 598 1HB GLU 81 1HB GLU 81 -8.887 -0.278 -9.324 599 2HB GLU 81 2HB GLU 81 -10.645 -0.311 -9.191 600 1HG GLU 81 1HG GLU 81 -9.562 -0.683 -11.928 601 2HG GLU 81 2HG GLU 81 -9.236 -1.994 -10.794 602 H GLN 82 H GLN 82 -9.499 1.208 -12.964 603 HA GLN 82 HA GLN 82 -6.565 1.602 -12.752 604 1HB GLN 82 1HB GLN 82 -8.390 0.738 -15.002 605 2HB GLN 82 2HB GLN 82 -6.687 1.118 -15.262 606 1HG GLN 82 1HG GLN 82 -5.964 -0.647 -13.847 607 2HG GLN 82 2HG GLN 82 -7.570 -0.847 -13.144 608 1HE2 GLN 82 2HE2 GLN 82 -7.623 -3.130 -13.816 609 2HE2 GLN 82 1HE2 GLN 82 -7.861 -3.551 -15.443 610 H ASP 83 H ASP 83 -8.564 3.800 -12.317 611 HA ASP 83 HA ASP 83 -7.694 5.606 -14.539 612 1HB ASP 83 1HB ASP 83 -10.249 5.064 -14.078 613 2HB ASP 83 2HB ASP 83 -10.044 6.257 -12.795 614 H TYR 84 H TYR 84 -6.070 5.056 -12.282 615 HA TYR 84 HA TYR 84 -6.335 7.461 -10.556 616 1HB TYR 84 1HB TYR 84 -4.909 4.815 -10.323 617 2HB TYR 84 2HB TYR 84 -4.373 6.187 -9.362 618 HD1 TYR 84 HD1 TYR 84 -7.882 5.264 -10.347 619 HD2 TYR 84 HD2 TYR 84 -5.007 5.626 -7.174 620 HE1 TYR 84 HE1 TYR 84 -9.650 4.778 -8.692 621 HE2 TYR 84 HE2 TYR 84 -6.786 5.145 -5.517 622 HH TYR 84 HH TYR 84 -9.276 3.717 -5.873 623 H GLU 85 H GLU 85 -3.808 7.994 -9.895 624 HA GLU 85 HA GLU 85 -2.313 8.293 -12.452 625 1HB GLU 85 1HB GLU 85 -2.551 10.534 -12.371 626 2HB GLU 85 2HB GLU 85 -3.529 10.382 -10.922 627 1HG GLU 85 1HG GLU 85 -1.736 11.875 -10.399 628 2HG GLU 85 2HG GLU 85 -1.353 10.351 -9.596 629 H VAL 86 H VAL 86 -0.167 7.779 -12.292 630 HA VAL 86 HA VAL 86 0.737 6.260 -10.065 631 HB VAL 86 HB VAL 86 2.461 7.582 -12.173 632 1HG1 VAL 86 1HG1 VAL 86 2.811 5.149 -10.397 633 2HG1 VAL 86 2HG1 VAL 86 3.871 5.537 -11.752 634 3HG1 VAL 86 3HG1 VAL 86 3.770 6.629 -10.371 635 1HG2 VAL 86 1HG2 VAL 86 0.664 5.173 -12.222 636 2HG2 VAL 86 2HG2 VAL 86 0.927 6.391 -13.471 637 3HG2 VAL 86 3HG2 VAL 86 2.152 5.159 -13.168 638 H LEU 87 H LEU 87 0.521 7.562 -8.158 639 HA LEU 87 HA LEU 87 1.824 10.118 -7.813 640 1HB LEU 87 1HB LEU 87 0.022 9.072 -6.312 641 2HB LEU 87 2HB LEU 87 1.308 8.070 -5.639 642 HG LEU 87 HG LEU 87 2.555 10.351 -5.313 643 1HD1 LEU 87 1HD1 LEU 87 0.311 11.332 -6.557 644 2HD1 LEU 87 2HD1 LEU 87 -0.103 11.559 -4.858 645 3HD1 LEU 87 3HD1 LEU 87 1.366 12.282 -5.512 646 1HD2 LEU 87 1HD2 LEU 87 1.670 8.822 -3.523 647 2HD2 LEU 87 2HD2 LEU 87 1.602 10.528 -3.081 648 3HD2 LEU 87 3HD2 LEU 87 0.138 9.692 -3.600 649 H LEU 88 H LEU 88 2.807 6.752 -7.199 650 HA LEU 88 HA LEU 88 5.602 7.600 -7.485 651 1HB LEU 88 1HB LEU 88 6.377 6.739 -5.382 652 2HB LEU 88 2HB LEU 88 5.094 7.904 -5.074 653 HG LEU 88 HG LEU 88 3.670 5.576 -5.298 654 1HD1 LEU 88 1HD1 LEU 88 6.460 4.964 -4.466 655 2HD1 LEU 88 2HD1 LEU 88 5.178 4.214 -3.516 656 3HD1 LEU 88 3HD1 LEU 88 5.269 3.929 -5.255 657 1HD2 LEU 88 1HD2 LEU 88 4.910 6.965 -2.910 658 2HD2 LEU 88 2HD2 LEU 88 3.280 7.167 -3.550 659 3HD2 LEU 88 3HD2 LEU 88 3.728 5.669 -2.736 660 H VAL 89 H VAL 89 6.492 6.180 -8.838 661 HA VAL 89 HA VAL 89 5.281 3.826 -9.783 662 HB VAL 89 HB VAL 89 7.563 3.225 -10.627 663 1HG1 VAL 89 1HG1 VAL 89 5.918 5.170 -11.481 664 2HG1 VAL 89 2HG1 VAL 89 7.318 6.163 -11.075 665 3HG1 VAL 89 3HG1 VAL 89 7.475 4.856 -12.249 666 1HG2 VAL 89 1HG2 VAL 89 8.702 4.171 -8.542 667 2HG2 VAL 89 2HG2 VAL 89 9.457 4.585 -10.081 668 3HG2 VAL 89 3HG2 VAL 89 8.451 5.768 -9.245 669 H THR 90 H THR 90 6.686 1.617 -9.622 670 HA THR 90 HA THR 90 6.247 0.700 -6.935 671 HB THR 90 HB THR 90 6.161 -0.582 -9.248 672 HG1 THR 90 HG1 THR 90 5.490 -1.640 -7.520 673 1HG2 THR 90 1HG2 THR 90 8.664 -0.280 -9.615 674 2HG2 THR 90 2HG2 THR 90 8.909 -1.405 -8.279 675 3HG2 THR 90 3HG2 THR 90 8.074 -1.938 -9.738 676 H SER 91 H SER 91 7.636 0.502 -5.278 677 HA SER 91 HA SER 91 10.369 1.572 -5.631 678 1HB SER 91 1HB SER 91 10.280 1.531 -3.059 679 2HB SER 91 2HB SER 91 9.226 2.684 -3.873 680 HG SER 91 HG SER 91 8.598 0.202 -2.681 681 H SER 92 H SER 92 11.941 0.124 -5.885 682 HA SER 92 HA SER 92 11.604 -2.697 -5.232 683 1HB SER 92 1HB SER 92 13.944 -2.906 -5.996 684 2HB SER 92 2HB SER 92 13.005 -1.960 -7.148 685 HG SER 92 HG SER 92 14.011 -0.161 -6.510 686 H PHE 93 H PHE 93 11.033 -1.969 -2.945 687 HA PHE 93 HA PHE 93 12.918 -0.915 -1.121 688 1HB PHE 93 1HB PHE 93 10.484 -1.182 -0.685 689 2HB PHE 93 2HB PHE 93 10.730 -2.920 -0.568 690 HD1 PHE 93 HD1 PHE 93 12.683 0.018 0.702 691 HD2 PHE 93 HD2 PHE 93 10.560 -3.594 1.653 692 HE1 PHE 93 HE1 PHE 93 13.350 0.252 3.079 693 HE2 PHE 93 HE2 PHE 93 11.227 -3.358 4.033 694 HZ PHE 93 HZ PHE 93 12.623 -1.433 4.744 695 H MET 94 H MET 94 12.017 -4.352 -1.533 696 HA MET 94 HA MET 94 14.760 -5.050 -0.574 697 1HB MET 94 1HB MET 94 12.119 -6.441 -0.093 698 2HB MET 94 2HB MET 94 13.677 -7.186 0.258 699 1HG MET 94 1HG MET 94 14.197 -5.587 1.921 700 2HG MET 94 2HG MET 94 12.951 -4.472 1.358 701 1HE MET 94 1HE MET 94 13.721 -7.944 2.667 702 2HE MET 94 2HE MET 94 12.210 -8.537 3.369 703 3HE MET 94 3HE MET 94 12.377 -8.395 1.622 704 H SER 95 H SER 95 15.027 -7.597 -1.142 705 HA SER 95 HA SER 95 14.503 -7.834 -4.077 706 1HB SER 95 1HB SER 95 16.632 -8.787 -4.349 707 2HB SER 95 2HB SER 95 16.937 -7.605 -3.087 708 HG SER 95 HG SER 95 17.778 -9.662 -2.556 709 HA PRO 96 HA PRO 96 12.623 -11.786 -3.173 710 1HB PRO 96 1HB PRO 96 13.529 -13.406 -5.175 711 2HB PRO 96 2HB PRO 96 12.394 -12.076 -5.439 712 1HG PRO 96 1HG PRO 96 15.212 -12.297 -6.218 713 2HG PRO 96 2HG PRO 96 13.956 -11.216 -6.837 714 1HD PRO 96 1HD PRO 96 16.051 -10.602 -4.953 715 2HD PRO 96 2HD PRO 96 14.794 -9.516 -5.583 716 H SER 97 H SER 97 15.755 -11.452 -2.340 717 HA SER 97 HA SER 97 16.055 -14.333 -1.592 718 1HB SER 97 1HB SER 97 18.557 -13.725 -1.492 719 2HB SER 97 2HB SER 97 17.835 -13.876 -3.091 720 HG SER 97 HG SER 97 17.938 -11.753 -3.352 721 H GLU 98 H GLU 98 16.576 -10.964 -0.581 722 HA GLU 98 HA GLU 98 17.324 -11.781 2.131 723 1HB GLU 98 1HB GLU 98 17.593 -9.418 2.556 724 2HB GLU 98 2HB GLU 98 18.271 -9.761 0.971 725 1HG GLU 98 1HG GLU 98 15.683 -9.186 0.303 726 2HG GLU 98 2HG GLU 98 15.910 -8.129 1.697 727 H SER 99 H SER 99 14.379 -11.718 0.597 728 HA SER 99 HA SER 99 12.788 -10.431 2.669 729 1HB SER 99 1HB SER 99 11.898 -10.441 0.433 730 2HB SER 99 2HB SER 99 12.078 -12.189 0.310 731 HG SER 99 HG SER 99 10.122 -12.240 1.067 732 H ARG 100 H ARG 100 13.812 -13.720 1.929 733 HA ARG 100 HA ARG 100 11.986 -15.056 3.682 734 1HB ARG 100 1HB ARG 100 13.995 -16.798 3.823 735 2HB ARG 100 2HB ARG 100 13.014 -16.648 2.372 736 1HG ARG 100 1HG ARG 100 15.352 -14.830 2.495 737 2HG ARG 100 2HG ARG 100 15.743 -16.545 2.392 738 1HD ARG 100 1HD ARG 100 13.680 -16.229 0.540 739 2HD ARG 100 2HD ARG 100 14.651 -14.770 0.344 740 HE ARG 100 HE ARG 100 16.340 -16.102 -0.597 741 1HH1 ARG 100 1HH1 ARG 100 14.169 -18.097 1.288 742 2HH1 ARG 100 2HH1 ARG 100 14.944 -19.566 0.810 743 1HH2 ARG 100 1HH2 ARG 100 17.313 -18.027 -1.188 744 2HH2 ARG 100 2HH2 ARG 100 16.706 -19.531 -0.576 745 H SER 101 H SER 101 15.463 -15.019 4.468 746 HA SER 101 HA SER 101 15.045 -13.585 6.963 747 1HB SER 101 1HB SER 101 14.274 -16.128 7.204 748 2HB SER 101 2HB SER 101 16.009 -16.396 7.350 749 HG SER 101 HG SER 101 14.236 -15.198 9.077 750 H GLY 102 H GLY 102 16.709 -13.298 4.666 751 1HA GLY 102 1HA GLY 102 19.405 -14.049 5.705 752 2HA GLY 102 2HA GLY 102 19.051 -13.657 4.023 753 H SER 103 H SER 103 17.304 -11.337 5.035 754 HA SER 103 HA SER 103 18.955 -9.505 6.475 755 1HB SER 103 1HB SER 103 19.676 -9.882 3.696 756 2HB SER 103 2HB SER 103 19.148 -8.225 3.967 757 HG SER 103 HG SER 103 20.734 -7.946 5.419 758 H ASN 104 H ASN 104 17.459 -8.185 7.274 759 HA ASN 104 HA ASN 104 15.393 -7.107 7.574 760 1HB ASN 104 1HB ASN 104 15.050 -5.324 5.780 761 2HB ASN 104 2HB ASN 104 16.605 -5.304 6.607 762 1HD2 ASN 104 2HD2 ASN 104 15.051 -6.530 3.596 763 2HD2 ASN 104 1HD2 ASN 104 16.467 -6.469 2.660 764 HA PRO 105 HA PRO 105 13.001 -9.858 4.616 765 1HB PRO 105 1HB PRO 105 11.922 -11.497 6.520 766 2HB PRO 105 2HB PRO 105 13.466 -11.816 5.721 767 1HG PRO 105 1HG PRO 105 12.934 -10.816 8.462 768 2HG PRO 105 2HG PRO 105 14.265 -11.814 7.862 769 1HD PRO 105 1HD PRO 105 14.423 -9.077 8.401 770 2HD PRO 105 2HD PRO 105 15.563 -9.992 7.389 771 H ASN 106 H ASN 106 12.250 -8.377 7.725 772 HA ASN 106 HA ASN 106 9.576 -7.617 6.638 773 1HB ASN 106 1HB ASN 106 10.160 -9.220 8.993 774 2HB ASN 106 2HB ASN 106 9.295 -7.752 9.444 775 1HD2 ASN 106 2HD2 ASN 106 8.962 -9.491 6.331 776 2HD2 ASN 106 1HD2 ASN 106 7.331 -9.903 6.555 777 H ARG 107 H ARG 107 10.888 -5.662 6.083 778 HA ARG 107 HA ARG 107 11.309 -3.887 8.454 779 1HB ARG 107 1HB ARG 107 12.786 -4.286 5.926 780 2HB ARG 107 2HB ARG 107 12.514 -2.595 6.345 781 1HG ARG 107 1HG ARG 107 13.431 -3.059 8.624 782 2HG ARG 107 2HG ARG 107 13.814 -4.698 8.099 783 1HD ARG 107 1HD ARG 107 15.830 -3.699 7.606 784 2HD ARG 107 2HD ARG 107 14.987 -3.357 6.095 785 HE ARG 107 HE ARG 107 15.013 -1.079 6.672 786 1HH1 ARG 107 1HH1 ARG 107 15.530 -3.030 9.528 787 2HH1 ARG 107 2HH1 ARG 107 15.821 -1.657 10.535 788 1HH2 ARG 107 1HH2 ARG 107 15.401 0.669 8.012 789 2HH2 ARG 107 2HH2 ARG 107 15.749 0.415 9.689 790 H VAL 108 H VAL 108 11.195 -1.414 7.241 791 HA VAL 108 HA VAL 108 8.556 -1.384 5.877 792 HB VAL 108 HB VAL 108 7.546 -0.422 7.618 793 1HG1 VAL 108 1HG1 VAL 108 9.235 -1.560 9.037 794 2HG1 VAL 108 2HG1 VAL 108 10.204 -0.086 9.011 795 3HG1 VAL 108 3HG1 VAL 108 8.606 -0.079 9.758 796 1HG2 VAL 108 1HG2 VAL 108 9.620 1.770 7.341 797 2HG2 VAL 108 2HG2 VAL 108 8.007 1.736 6.629 798 3HG2 VAL 108 3HG2 VAL 108 8.198 1.882 8.377 799 H ARG 109 H ARG 109 8.144 0.763 4.764 800 HA ARG 109 HA ARG 109 10.623 2.192 3.983 801 1HB ARG 109 1HB ARG 109 10.328 0.348 2.344 802 2HB ARG 109 2HB ARG 109 8.704 0.933 1.995 803 1HG ARG 109 1HG ARG 109 10.279 1.745 0.295 804 2HG ARG 109 2HG ARG 109 9.657 3.092 1.239 805 1HD ARG 109 1HD ARG 109 11.692 3.125 2.596 806 2HD ARG 109 2HD ARG 109 12.311 1.718 1.739 807 HE ARG 109 HE ARG 109 11.669 3.914 -0.053 808 1HH1 ARG 109 1HH1 ARG 109 14.093 2.592 2.094 809 2HH1 ARG 109 2HH1 ARG 109 15.393 3.388 1.278 810 1HH2 ARG 109 1HH2 ARG 109 13.380 4.926 -1.077 811 2HH2 ARG 109 2HH2 ARG 109 14.997 4.698 -0.496 812 H MET 110 H MET 110 10.226 4.349 3.716 813 HA MET 110 HA MET 110 7.370 5.229 3.804 814 1HB MET 110 1HB MET 110 9.848 6.782 4.608 815 2HB MET 110 2HB MET 110 8.173 7.277 4.850 816 1HG MET 110 1HG MET 110 7.841 5.801 6.590 817 2HG MET 110 2HG MET 110 8.992 4.627 5.960 818 1HE MET 110 1HE MET 110 10.938 4.100 7.123 819 2HE MET 110 2HE MET 110 11.632 5.121 5.866 820 3HE MET 110 3HE MET 110 12.208 5.264 7.523 821 H PHE 111 H PHE 111 6.836 7.188 2.578 822 HA PHE 111 HA PHE 111 8.698 7.748 0.301 823 1HB PHE 111 1HB PHE 111 5.697 7.528 -0.043 824 2HB PHE 111 2HB PHE 111 6.916 7.680 -1.303 825 HD1 PHE 111 HD1 PHE 111 5.868 5.431 1.500 826 HD2 PHE 111 HD2 PHE 111 7.784 5.755 -2.329 827 HE1 PHE 111 HE1 PHE 111 6.045 2.972 1.379 828 HE2 PHE 111 HE2 PHE 111 7.959 3.282 -2.448 829 HZ PHE 111 HZ PHE 111 7.083 1.885 -0.591 830 H GLY 112 H GLY 112 9.254 9.840 0.790 831 1HA GLY 112 1HA GLY 112 7.345 11.713 1.953 832 2HA GLY 112 2HA GLY 112 9.015 12.036 1.563 833 HA PRO 113 HA PRO 113 6.678 14.273 -1.700 834 1HB PRO 113 1HB PRO 113 8.476 16.316 -1.873 835 2HB PRO 113 2HB PRO 113 7.165 16.268 -0.684 836 1HG PRO 113 1HG PRO 113 10.069 15.733 -0.319 837 2HG PRO 113 2HG PRO 113 8.904 16.458 0.800 838 1HD PRO 113 1HD PRO 113 9.794 13.824 0.945 839 2HD PRO 113 2HD PRO 113 8.291 14.419 1.664 840 H ASP 114 H ASP 114 10.127 13.559 -1.477 841 HA ASP 114 HA ASP 114 10.772 13.920 -4.245 842 1HB ASP 114 1HB ASP 114 12.060 12.308 -2.033 843 2HB ASP 114 2HB ASP 114 12.737 12.399 -3.660 844 H LYS 115 H LYS 115 9.335 11.293 -2.441 845 HA LYS 115 HA LYS 115 9.642 9.444 -4.719 846 1HB LYS 115 1HB LYS 115 8.630 9.179 -1.898 847 2HB LYS 115 2HB LYS 115 8.281 7.932 -3.096 848 1HG LYS 115 1HG LYS 115 10.287 7.103 -2.350 849 2HG LYS 115 2HG LYS 115 10.919 8.231 -3.550 850 1HD LYS 115 1HD LYS 115 10.740 9.938 -1.512 851 2HD LYS 115 2HD LYS 115 10.890 8.454 -0.571 852 1HE LYS 115 1HE LYS 115 12.848 8.017 -2.366 853 2HE LYS 115 2HE LYS 115 12.875 9.780 -2.348 854 1HZ LYS 115 1HZ LYS 115 13.017 9.669 0.095 855 2HZ LYS 115 2HZ LYS 115 13.137 7.977 -0.005 856 3HZ LYS 115 3HZ LYS 115 14.352 8.952 -0.674 857 H LEU 116 H LEU 116 7.559 11.951 -4.155 858 HA LEU 116 HA LEU 116 5.347 10.464 -5.526 859 1HB LEU 116 1HB LEU 116 3.756 12.074 -4.359 860 2HB LEU 116 2HB LEU 116 4.461 10.810 -3.359 861 HG LEU 116 HG LEU 116 6.287 12.579 -2.814 862 1HD1 LEU 116 1HD1 LEU 116 4.624 14.098 -4.562 863 2HD1 LEU 116 2HD1 LEU 116 4.459 14.778 -2.948 864 3HD1 LEU 116 3HD1 LEU 116 6.050 14.635 -3.685 865 1HD2 LEU 116 1HD2 LEU 116 3.434 12.706 -1.824 866 2HD2 LEU 116 2HD2 LEU 116 4.770 11.787 -1.129 867 3HD2 LEU 116 3HD2 LEU 116 4.767 13.549 -1.035 868 H VAL 117 H VAL 117 4.310 11.511 -7.164 869 HA VAL 117 HA VAL 117 5.767 13.559 -8.565 870 HB VAL 117 HB VAL 117 4.250 11.959 -9.704 871 1HG1 VAL 117 1HG1 VAL 117 2.559 11.859 -7.925 872 2HG1 VAL 117 2HG1 VAL 117 2.059 13.491 -8.319 873 3HG1 VAL 117 3HG1 VAL 117 1.833 12.199 -9.493 874 1HG2 VAL 117 1HG2 VAL 117 4.681 14.462 -10.470 875 2HG2 VAL 117 2HG2 VAL 117 3.513 13.456 -11.326 876 3HG2 VAL 117 3HG2 VAL 117 2.959 14.630 -10.133 877 H ARG 118 H ARG 118 5.453 15.803 -8.595 878 HA ARG 118 HA ARG 118 4.027 16.948 -6.314 879 1HB ARG 118 1HB ARG 118 6.051 17.810 -8.211 880 2HB ARG 118 2HB ARG 118 4.783 19.027 -8.080 881 1HG ARG 118 1HG ARG 118 5.868 17.791 -5.572 882 2HG ARG 118 2HG ARG 118 6.809 19.041 -6.386 883 1HD ARG 118 1HD ARG 118 4.418 20.251 -6.435 884 2HD ARG 118 2HD ARG 118 4.175 19.249 -5.004 885 HE ARG 118 HE ARG 118 5.648 20.671 -3.859 886 1HH1 ARG 118 1HH1 ARG 118 6.220 20.915 -7.302 887 2HH1 ARG 118 2HH1 ARG 118 7.392 22.172 -7.119 888 1HH2 ARG 118 1HH2 ARG 118 7.173 22.299 -3.671 889 2HH2 ARG 118 2HH2 ARG 118 7.927 22.948 -5.088 890 H ALA 119 H ALA 119 3.544 16.694 -9.802 891 HA ALA 119 HA ALA 119 1.361 18.514 -10.023 892 1HB ALA 119 1HB ALA 119 2.054 16.052 -11.644 893 2HB ALA 119 2HB ALA 119 0.812 17.218 -12.100 894 3HB ALA 119 3HB ALA 119 2.501 17.719 -12.010 895 H ALA 120 H ALA 120 1.542 15.313 -8.684 896 HA ALA 120 HA ALA 120 -1.443 15.188 -8.603 897 1HB ALA 120 1HB ALA 120 0.165 13.282 -9.627 898 2HB ALA 120 2HB ALA 120 0.147 12.770 -7.938 899 3HB ALA 120 3HB ALA 120 -1.365 12.918 -8.826 900 H ALA 121 H ALA 121 1.492 14.469 -6.651 901 HA ALA 121 HA ALA 121 0.299 13.814 -4.217 902 1HB ALA 121 1HB ALA 121 2.764 15.478 -4.752 903 2HB ALA 121 2HB ALA 121 2.316 14.894 -3.150 904 3HB ALA 121 3HB ALA 121 2.684 13.745 -4.436 905 H GLU 122 H GLU 122 0.556 17.035 -5.660 906 HA GLU 122 HA GLU 122 -0.461 18.307 -3.203 907 1HB GLU 122 1HB GLU 122 -0.298 20.411 -4.461 908 2HB GLU 122 2HB GLU 122 1.202 19.497 -4.599 909 1HG GLU 122 1HG GLU 122 0.947 19.881 -6.832 910 2HG GLU 122 2HG GLU 122 -0.179 18.526 -6.744 911 H LYS 123 H LYS 123 -1.924 16.569 -5.635 912 HA LYS 123 HA LYS 123 -4.340 18.260 -5.760 913 1HB LYS 123 1HB LYS 123 -3.847 15.530 -6.987 914 2HB LYS 123 2HB LYS 123 -5.168 16.632 -7.370 915 1HG LYS 123 1HG LYS 123 -3.280 18.324 -7.949 916 2HG LYS 123 2HG LYS 123 -2.243 16.902 -8.020 917 1HD LYS 123 1HD LYS 123 -2.961 16.924 -10.211 918 2HD LYS 123 2HD LYS 123 -4.271 15.977 -9.505 919 1HE LYS 123 1HE LYS 123 -5.560 17.566 -10.545 920 2HE LYS 123 2HE LYS 123 -5.237 18.454 -9.055 921 1HZ LYS 123 1HZ LYS 123 -3.260 19.404 -10.184 922 2HZ LYS 123 2HZ LYS 123 -3.778 18.677 -11.629 923 3HZ LYS 123 3HZ LYS 123 -4.734 19.866 -10.882 924 H ARG 124 H ARG 124 -6.138 17.805 -4.545 925 HA ARG 124 HA ARG 124 -5.898 16.064 -2.282 926 1HB ARG 124 1HB ARG 124 -8.174 17.629 -3.477 927 2HB ARG 124 2HB ARG 124 -8.439 16.547 -2.109 928 1HG ARG 124 1HG ARG 124 -6.483 17.744 -0.971 929 2HG ARG 124 2HG ARG 124 -6.625 18.960 -2.241 930 1HD ARG 124 1HD ARG 124 -9.042 18.117 -0.653 931 2HD ARG 124 2HD ARG 124 -7.936 19.339 -0.023 932 HE ARG 124 HE ARG 124 -9.829 19.710 -2.194 933 1HH1 ARG 124 1HH1 ARG 124 -6.729 20.713 -0.921 934 2HH1 ARG 124 2HH1 ARG 124 -6.792 22.251 -1.708 935 1HH2 ARG 124 1HH2 ARG 124 -9.867 21.710 -3.193 936 2HH2 ARG 124 2HH2 ARG 124 -8.547 22.812 -2.981 937 H TRP 125 H TRP 125 -5.846 13.898 -2.517 938 HA TRP 125 HA TRP 125 -7.776 12.608 -4.408 939 1HB TRP 125 1HB TRP 125 -5.251 11.456 -3.162 940 2HB TRP 125 2HB TRP 125 -6.286 10.656 -4.342 941 HD1 TRP 125 HD1 TRP 125 -3.370 12.915 -4.072 942 HE1 TRP 125 HE1 TRP 125 -2.725 13.837 -6.392 943 HE3 TRP 125 HE3 TRP 125 -7.470 11.507 -6.761 944 HZ2 TRP 125 HZ2 TRP 125 -3.791 13.941 -9.040 945 HZ3 TRP 125 HZ3 TRP 125 -7.630 12.014 -9.177 946 HH2 TRP 125 HH2 TRP 125 -5.798 13.234 -10.322 947 H ASP 126 H ASP 126 -8.794 10.603 -3.545 948 HA ASP 126 HA ASP 126 -8.955 10.557 -0.577 949 1HB ASP 126 1HB ASP 126 -10.856 11.807 -1.227 950 2HB ASP 126 2HB ASP 126 -11.213 10.704 -2.516 951 H ARG 127 H ARG 127 -8.182 8.787 -3.239 952 HA ARG 127 HA ARG 127 -8.740 6.239 -1.835 953 1HB ARG 127 1HB ARG 127 -9.233 6.665 -4.803 954 2HB ARG 127 2HB ARG 127 -9.417 5.152 -3.925 955 1HG ARG 127 1HG ARG 127 -10.986 7.084 -2.546 956 2HG ARG 127 2HG ARG 127 -11.336 7.281 -4.261 957 1HD ARG 127 1HD ARG 127 -11.271 4.491 -3.804 958 2HD ARG 127 2HD ARG 127 -12.180 5.175 -2.469 959 HE ARG 127 HE ARG 127 -13.867 5.844 -3.987 960 1HH1 ARG 127 1HH1 ARG 127 -11.046 4.680 -5.705 961 2HH1 ARG 127 2HH1 ARG 127 -11.892 4.561 -7.205 962 1HH2 ARG 127 1HH2 ARG 127 -14.906 5.690 -5.953 963 2HH2 ARG 127 2HH2 ARG 127 -14.048 5.128 -7.349 964 H VAL 128 H VAL 128 -6.994 4.764 -2.138 965 HA VAL 128 HA VAL 128 -4.860 5.688 -4.000 966 HB VAL 128 HB VAL 128 -4.480 6.403 -1.593 967 1HG1 VAL 128 1HG1 VAL 128 -5.082 3.722 -1.048 968 2HG1 VAL 128 2HG1 VAL 128 -3.344 3.852 -0.784 969 3HG1 VAL 128 3HG1 VAL 128 -4.452 4.911 0.087 970 1HG2 VAL 128 1HG2 VAL 128 -2.577 4.780 -3.242 971 2HG2 VAL 128 2HG2 VAL 128 -2.587 6.516 -2.927 972 3HG2 VAL 128 3HG2 VAL 128 -2.060 5.395 -1.671 973 H LYS 129 H LYS 129 -3.697 4.067 -5.005 974 HA LYS 129 HA LYS 129 -4.729 1.299 -4.585 975 1HB LYS 129 1HB LYS 129 -5.063 2.304 -6.838 976 2HB LYS 129 2HB LYS 129 -3.316 2.472 -6.993 977 1HG LYS 129 1HG LYS 129 -3.515 -0.163 -6.299 978 2HG LYS 129 2HG LYS 129 -5.004 0.053 -7.217 979 1HD LYS 129 1HD LYS 129 -3.486 1.243 -8.964 980 2HD LYS 129 2HD LYS 129 -2.161 0.433 -8.130 981 1HE LYS 129 1HE LYS 129 -2.850 -1.017 -9.924 982 2HE LYS 129 2HE LYS 129 -3.433 -1.739 -8.425 983 1HZ LYS 129 1HZ LYS 129 -5.140 0.116 -9.951 984 2HZ LYS 129 2HZ LYS 129 -5.038 -1.519 -10.400 985 3HZ LYS 129 3HZ LYS 129 -5.594 -1.093 -8.852 986 H ILE 130 H ILE 130 -3.369 0.070 -3.400 987 HA ILE 130 HA ILE 130 -0.429 0.587 -3.579 988 HB ILE 130 HB ILE 130 -2.018 -1.001 -1.526 989 1HG1 ILE 130 1HG1 ILE 130 -2.488 1.418 -1.415 990 2HG1 ILE 130 2HG1 ILE 130 -1.542 0.903 -0.022 991 1HG2 ILE 130 1HG2 ILE 130 0.910 -0.260 -1.748 992 2HG2 ILE 130 2HG2 ILE 130 0.169 -0.765 -0.230 993 3HG2 ILE 130 3HG2 ILE 130 0.208 -1.872 -1.603 994 1HD1 ILE 130 1HD1 ILE 130 0.318 1.619 -2.050 995 2HD1 ILE 130 2HD1 ILE 130 -0.894 2.898 -1.984 996 3HD1 ILE 130 3HD1 ILE 130 0.000 2.458 -0.532 997 H VAL 131 H VAL 131 0.730 -0.868 -4.820 998 HA VAL 131 HA VAL 131 -0.366 -3.618 -5.085 999 HB VAL 131 HB VAL 131 1.010 -2.001 -7.243 1000 1HG1 VAL 131 1HG1 VAL 131 1.319 -4.446 -7.362 1001 2HG1 VAL 131 2HG1 VAL 131 -0.431 -4.659 -7.295 1002 3HG1 VAL 131 3HG1 VAL 131 0.307 -3.852 -8.680 1003 1HG2 VAL 131 1HG2 VAL 131 -1.840 -2.341 -6.445 1004 2HG2 VAL 131 2HG2 VAL 131 -1.056 -0.987 -7.259 1005 3HG2 VAL 131 3HG2 VAL 131 -1.488 -2.433 -8.172 1006 H CYS 132 H CYS 132 1.050 -5.133 -4.440 1007 HA CYS 132 HA CYS 132 3.932 -4.423 -4.154 1008 1HB CYS 132 1HB CYS 132 2.940 -5.344 -2.134 1009 2HB CYS 132 2HB CYS 132 2.244 -6.688 -3.026 1010 HG CYS 132 HG CYS 132 4.527 -7.806 -3.172 1011 H SER 133 H SER 133 5.528 -5.697 -5.275 1012 HA SER 133 HA SER 133 4.520 -7.800 -7.115 1013 1HB SER 133 1HB SER 133 5.065 -5.134 -7.936 1014 2HB SER 133 2HB SER 133 6.349 -6.144 -8.590 1015 HG SER 133 HG SER 133 4.475 -6.043 -9.939 1016 H GLN 134 H GLN 134 5.864 -9.453 -7.246 1017 HA GLN 134 HA GLN 134 8.423 -9.865 -7.764 1018 1HB GLN 134 1HB GLN 134 8.378 -8.658 -5.070 1019 2HB GLN 134 2HB GLN 134 9.407 -10.079 -5.260 1020 1HG GLN 134 1HG GLN 134 9.831 -8.515 -7.584 1021 2HG GLN 134 2HG GLN 134 9.845 -7.385 -6.239 1022 1HE2 GLN 134 2HE2 GLN 134 12.199 -7.106 -6.487 1023 2HE2 GLN 134 1HE2 GLN 134 13.273 -8.316 -5.977 1024 HA PRO 135 HA PRO 135 6.756 -13.838 -6.454 1025 1HB PRO 135 1HB PRO 135 8.507 -15.392 -7.855 1026 2HB PRO 135 2HB PRO 135 7.153 -14.541 -8.611 1027 1HG PRO 135 1HG PRO 135 10.034 -13.982 -8.775 1028 2HG PRO 135 2HG PRO 135 8.729 -13.505 -9.870 1029 1HD PRO 135 1HD PRO 135 10.017 -11.888 -7.883 1030 2HD PRO 135 2HD PRO 135 8.658 -11.440 -8.935 1031 H TYR 136 H TYR 136 7.505 -13.559 -4.204 1032 HA TYR 136 HA TYR 136 10.164 -14.812 -3.684 1033 1HB TYR 136 1HB TYR 136 9.866 -13.644 -1.374 1034 2HB TYR 136 2HB TYR 136 10.344 -12.669 -2.760 1035 HD1 TYR 136 HD1 TYR 136 7.297 -13.820 -0.899 1036 HD2 TYR 136 HD2 TYR 136 9.089 -10.777 -3.345 1037 HE1 TYR 136 HE1 TYR 136 5.296 -12.390 -0.591 1038 HE2 TYR 136 HE2 TYR 136 7.087 -9.350 -3.038 1039 HH TYR 136 HH TYR 136 5.123 -9.382 -0.893 1040 H SER 137 H SER 137 6.923 -15.573 -3.577 1041 HA SER 137 HA SER 137 7.423 -17.503 -1.350 1042 1HB SER 137 1HB SER 137 5.499 -15.491 -1.345 1043 2HB SER 137 2HB SER 137 4.594 -16.923 -1.816 1044 HG SER 137 HG SER 137 5.045 -17.841 0.069 1045 H LYS 138 H LYS 138 5.310 -19.158 -1.625 1046 HA LYS 138 HA LYS 138 4.775 -19.879 -4.394 1047 1HB LYS 138 1HB LYS 138 6.941 -21.238 -2.840 1048 2HB LYS 138 2HB LYS 138 5.908 -22.233 -3.867 1049 1HG LYS 138 1HG LYS 138 6.411 -20.248 -5.602 1050 2HG LYS 138 2HG LYS 138 7.878 -20.131 -4.629 1051 1HD LYS 138 1HD LYS 138 6.929 -22.809 -5.624 1052 2HD LYS 138 2HD LYS 138 7.863 -21.748 -6.680 1053 1HE LYS 138 1HE LYS 138 9.635 -22.814 -5.697 1054 2HE LYS 138 2HE LYS 138 9.376 -21.602 -4.443 1055 1HZ LYS 138 1HZ LYS 138 8.115 -24.289 -4.456 1056 2HZ LYS 138 2HZ LYS 138 9.519 -23.899 -3.588 1057 3HZ LYS 138 3HZ LYS 138 8.048 -23.137 -3.210 1058 H ASP 139 H ASP 139 4.933 -21.015 -1.024 1059 HA ASP 139 HA ASP 139 2.300 -22.338 -1.436 1060 1HB ASP 139 1HB ASP 139 2.951 -23.694 0.583 1061 2HB ASP 139 2HB ASP 139 3.957 -23.981 -0.831 1062 H SER 140 H SER 140 4.164 -20.198 0.581 1063 HA SER 140 HA SER 140 1.824 -19.720 2.333 1064 1HB SER 140 1HB SER 140 3.739 -18.211 3.428 1065 2HB SER 140 2HB SER 140 3.606 -19.931 3.767 1066 HG SER 140 HG SER 140 5.563 -19.993 3.002 1067 HA PRO 141 HA PRO 141 1.167 -15.790 0.293 1068 1HB PRO 141 1HB PRO 141 -0.517 -14.690 2.136 1069 2HB PRO 141 2HB PRO 141 -0.998 -15.978 1.025 1070 1HG PRO 141 1HG PRO 141 -0.547 -16.091 3.916 1071 2HG PRO 141 2HG PRO 141 -1.458 -17.189 2.873 1072 1HD PRO 141 1HD PRO 141 1.185 -17.571 3.935 1073 2HD PRO 141 2HD PRO 141 0.274 -18.648 2.855 1074 H PHE 142 H PHE 142 0.848 -13.323 1.339 1075 HA PHE 142 HA PHE 142 2.363 -12.429 3.521 1076 1HB PHE 142 1HB PHE 142 4.044 -13.413 1.375 1077 2HB PHE 142 2HB PHE 142 4.279 -11.677 1.543 1078 HD1 PHE 142 HD1 PHE 142 4.524 -10.812 4.040 1079 HD2 PHE 142 HD2 PHE 142 5.226 -14.851 2.770 1080 HE1 PHE 142 HE1 PHE 142 5.913 -11.207 6.058 1081 HE2 PHE 142 HE2 PHE 142 6.617 -15.247 4.785 1082 HZ PHE 142 HZ PHE 142 6.960 -13.423 6.429 1083 H GLY 143 H GLY 143 3.534 -10.068 2.390 1084 1HA GLY 143 1HA GLY 143 2.393 -8.687 0.367 1085 2HA GLY 143 2HA GLY 143 1.070 -8.704 1.529 1086 H LEU 144 H LEU 144 0.988 -6.982 2.802 1087 HA LEU 144 HA LEU 144 3.519 -5.491 3.347 1088 1HB LEU 144 1HB LEU 144 0.827 -4.622 2.488 1089 2HB LEU 144 2HB LEU 144 1.530 -3.653 3.780 1090 HG LEU 144 HG LEU 144 3.581 -3.358 2.424 1091 1HD1 LEU 144 1HD1 LEU 144 2.013 -5.074 0.502 1092 2HD1 LEU 144 2HD1 LEU 144 3.252 -3.963 -0.082 1093 3HD1 LEU 144 3HD1 LEU 144 3.686 -5.262 1.029 1094 1HD2 LEU 144 1HD2 LEU 144 0.945 -2.599 1.139 1095 2HD2 LEU 144 2HD2 LEU 144 1.909 -1.629 2.252 1096 3HD2 LEU 144 3HD2 LEU 144 2.498 -1.946 0.619 1097 H SER 145 H SER 145 3.872 -4.737 5.437 1098 HA SER 145 HA SER 145 2.480 -6.187 7.565 1099 1HB SER 145 1HB SER 145 4.880 -4.408 7.385 1100 2HB SER 145 2HB SER 145 4.112 -4.628 8.956 1101 HG SER 145 HG SER 145 5.597 -6.369 7.443 1102 H PHE 146 H PHE 146 2.459 -2.965 6.183 1103 HA PHE 146 HA PHE 146 -0.005 -2.268 7.463 1104 1HB PHE 146 1HB PHE 146 0.744 -0.582 9.061 1105 2HB PHE 146 2HB PHE 146 1.515 -2.115 9.460 1106 HD1 PHE 146 HD1 PHE 146 2.024 1.178 7.833 1107 HD2 PHE 146 HD2 PHE 146 3.906 -2.385 9.318 1108 HE1 PHE 146 HE1 PHE 146 4.239 2.243 7.552 1109 HE2 PHE 146 HE2 PHE 146 6.131 -1.324 9.031 1110 HZ PHE 146 HZ PHE 146 6.297 0.980 8.132 1111 H VAL 147 H VAL 147 -0.441 0.176 7.146 1112 HA VAL 147 HA VAL 147 1.192 1.454 5.051 1113 HB VAL 147 HB VAL 147 -0.755 1.768 3.546 1114 1HG1 VAL 147 1HG1 VAL 147 0.883 -0.212 3.413 1115 2HG1 VAL 147 2HG1 VAL 147 -0.420 -1.181 4.102 1116 3HG1 VAL 147 3HG1 VAL 147 -0.644 -0.381 2.547 1117 1HG2 VAL 147 1HG2 VAL 147 -2.095 0.312 5.773 1118 2HG2 VAL 147 2HG2 VAL 147 -2.737 1.552 4.697 1119 3HG2 VAL 147 3HG2 VAL 147 -2.600 -0.116 4.139 1120 H ARG 148 H ARG 148 1.201 3.645 5.426 1121 HA ARG 148 HA ARG 148 -1.101 4.896 6.818 1122 1HB ARG 148 1HB ARG 148 1.710 5.285 7.862 1123 2HB ARG 148 2HB ARG 148 0.200 5.767 8.620 1124 1HG ARG 148 1HG ARG 148 -0.384 3.276 8.707 1125 2HG ARG 148 2HG ARG 148 1.301 2.974 8.289 1126 1HD ARG 148 1HD ARG 148 1.579 4.784 10.324 1127 2HD ARG 148 2HD ARG 148 0.133 3.913 10.832 1128 HE ARG 148 HE ARG 148 2.257 2.119 9.989 1129 1HH1 ARG 148 1HH1 ARG 148 1.033 4.037 12.644 1130 2HH1 ARG 148 2HH1 ARG 148 1.804 3.055 13.840 1131 1HH2 ARG 148 1HH2 ARG 148 3.237 0.876 11.570 1132 2HH2 ARG 148 2HH2 ARG 148 3.038 1.285 13.241 1133 H PHE 149 H PHE 149 -1.539 6.431 5.264 1134 HA PHE 149 HA PHE 149 0.648 7.888 3.927 1135 1HB PHE 149 1HB PHE 149 -2.363 8.248 3.741 1136 2HB PHE 149 2HB PHE 149 -1.166 8.990 2.678 1137 HD1 PHE 149 HD1 PHE 149 0.520 7.302 1.539 1138 HD2 PHE 149 HD2 PHE 149 -3.330 6.221 3.094 1139 HE1 PHE 149 HE1 PHE 149 0.512 5.282 0.103 1140 HE2 PHE 149 HE2 PHE 149 -3.342 4.202 1.651 1141 HZ PHE 149 HZ PHE 149 -1.422 3.731 0.159 1142 H HIS 150 H HIS 150 0.752 10.284 4.059 1143 HA HIS 150 HA HIS 150 -0.719 11.572 6.254 1144 1HB HIS 150 1HB HIS 150 1.855 12.421 6.902 1145 2HB HIS 150 2HB HIS 150 0.864 11.314 7.835 1146 HD1 HIS 150 HD1 HIS 150 4.084 11.545 6.296 1147 HD2 HIS 150 HD2 HIS 150 1.363 8.452 6.899 1148 HE1 HIS 150 HE1 HIS 150 5.381 9.387 6.017 1149 H SER 151 H SER 151 -1.001 13.706 5.880 1150 HA SER 151 HA SER 151 0.384 14.879 3.509 1151 1HB SER 151 1HB SER 151 -1.613 16.325 3.313 1152 2HB SER 151 2HB SER 151 -2.061 14.630 3.285 1153 HG SER 151 HG SER 151 -3.404 15.569 4.740 Start of MODEL 8 1 H MET 1 H MET 1 -1.247 19.206 13.949 2 HA MET 1 HA MET 1 -0.803 17.052 13.445 3 1HB MET 1 1HB MET 1 -3.173 17.412 14.515 4 2HB MET 1 2HB MET 1 -3.763 16.861 12.947 5 1HG MET 1 1HG MET 1 -3.580 14.838 14.084 6 2HG MET 1 2HG MET 1 -2.001 14.929 13.305 7 1HE MET 1 1HE MET 1 -0.752 13.636 14.399 8 2HE MET 1 2HE MET 1 0.375 14.911 14.882 9 3HE MET 1 3HE MET 1 -0.153 13.706 16.054 10 HA PRO 2 HA PRO 2 -1.091 16.983 8.848 11 1HB PRO 2 1HB PRO 2 1.577 16.594 8.420 12 2HB PRO 2 2HB PRO 2 0.857 18.194 8.650 13 1HG PRO 2 1HG PRO 2 2.589 16.655 10.453 14 2HG PRO 2 2HG PRO 2 2.242 18.389 10.433 15 1HD PRO 2 1HD PRO 2 1.128 16.391 12.179 16 2HD PRO 2 2HD PRO 2 0.771 18.131 12.145 17 H GLU 3 H GLU 3 -2.166 14.927 8.906 18 HA GLU 3 HA GLU 3 -0.442 12.638 8.331 19 1HB GLU 3 1HB GLU 3 -1.451 11.213 10.132 20 2HB GLU 3 2HB GLU 3 -0.417 12.499 10.756 21 1HG GLU 3 1HG GLU 3 -2.253 13.804 11.457 22 2HG GLU 3 2HG GLU 3 -3.384 12.919 10.432 23 H ILE 4 H ILE 4 -1.892 10.641 7.951 24 HA ILE 4 HA ILE 4 -4.669 11.322 7.191 25 HB ILE 4 HB ILE 4 -2.495 10.485 5.252 26 1HG1 ILE 4 1HG1 ILE 4 -4.619 12.644 5.157 27 2HG1 ILE 4 2HG1 ILE 4 -2.944 12.902 5.644 28 1HG2 ILE 4 1HG2 ILE 4 -5.493 10.364 4.795 29 2HG2 ILE 4 2HG2 ILE 4 -4.254 10.110 3.566 30 3HG2 ILE 4 3HG2 ILE 4 -4.418 8.970 4.900 31 1HD1 ILE 4 1HD1 ILE 4 -3.689 11.704 2.970 32 2HD1 ILE 4 2HD1 ILE 4 -3.489 13.440 3.209 33 3HD1 ILE 4 3HD1 ILE 4 -2.127 12.351 3.470 34 H ARG 5 H ARG 5 -5.920 9.675 7.888 35 HA ARG 5 HA ARG 5 -4.626 7.054 8.459 36 1HB ARG 5 1HB ARG 5 -7.073 8.455 9.516 37 2HB ARG 5 2HB ARG 5 -6.892 6.710 9.704 38 1HG ARG 5 1HG ARG 5 -5.128 6.910 11.169 39 2HG ARG 5 2HG ARG 5 -4.549 8.405 10.433 40 1HD ARG 5 1HD ARG 5 -6.048 9.733 11.616 41 2HD ARG 5 2HD ARG 5 -7.194 8.414 11.849 42 HE ARG 5 HE ARG 5 -4.903 9.030 13.557 43 1HH1 ARG 5 1HH1 ARG 5 -7.128 6.546 12.497 44 2HH1 ARG 5 2HH1 ARG 5 -6.915 5.606 13.931 45 1HH2 ARG 5 1HH2 ARG 5 -4.655 7.776 15.391 46 2HH2 ARG 5 2HH2 ARG 5 -5.531 6.291 15.551 47 H LEU 6 H LEU 6 -6.044 5.106 8.068 48 HA LEU 6 HA LEU 6 -7.285 5.311 5.391 49 1HB LEU 6 1HB LEU 6 -5.455 3.554 6.375 50 2HB LEU 6 2HB LEU 6 -6.939 2.679 6.736 51 HG LEU 6 HG LEU 6 -6.089 2.049 4.521 52 1HD1 LEU 6 1HD1 LEU 6 -8.653 2.669 5.139 53 2HD1 LEU 6 2HD1 LEU 6 -8.401 3.738 3.763 54 3HD1 LEU 6 3HD1 LEU 6 -8.169 2.001 3.583 55 1HD2 LEU 6 1HD2 LEU 6 -5.238 4.640 4.328 56 2HD2 LEU 6 2HD2 LEU 6 -5.386 3.551 2.950 57 3HD2 LEU 6 3HD2 LEU 6 -6.681 4.690 3.316 58 H ARG 7 H ARG 7 -9.463 4.834 5.077 59 HA ARG 7 HA ARG 7 -11.115 4.553 7.521 60 1HB ARG 7 1HB ARG 7 -11.610 6.234 5.640 61 2HB ARG 7 2HB ARG 7 -12.124 4.840 4.689 62 1HG ARG 7 1HG ARG 7 -14.070 5.807 5.798 63 2HG ARG 7 2HG ARG 7 -13.720 4.232 6.511 64 1HD ARG 7 1HD ARG 7 -13.040 5.135 8.512 65 2HD ARG 7 2HD ARG 7 -12.401 6.594 7.758 66 HE ARG 7 HE ARG 7 -15.160 6.769 7.411 67 1HH1 ARG 7 1HH1 ARG 7 -12.987 6.431 10.130 68 2HH1 ARG 7 2HH1 ARG 7 -14.046 7.268 11.209 69 1HH2 ARG 7 1HH2 ARG 7 -16.502 7.845 8.843 70 2HH2 ARG 7 2HH2 ARG 7 -16.016 8.060 10.491 71 H HIS 8 H HIS 8 -10.949 3.048 4.300 72 HA HIS 8 HA HIS 8 -11.184 0.372 5.434 73 1HB HIS 8 1HB HIS 8 -13.296 -0.161 4.194 74 2HB HIS 8 2HB HIS 8 -13.535 0.984 5.513 75 HD1 HIS 8 HD1 HIS 8 -14.775 3.052 4.888 76 HD2 HIS 8 HD2 HIS 8 -12.903 1.339 1.580 77 HE1 HIS 8 HE1 HIS 8 -15.439 4.452 2.885 78 H VAL 9 H VAL 9 -11.018 -1.284 3.697 79 HA VAL 9 HA VAL 9 -9.275 -0.340 1.545 80 HB VAL 9 HB VAL 9 -8.790 -2.470 2.684 81 1HG1 VAL 9 1HG1 VAL 9 -11.535 -2.859 2.603 82 2HG1 VAL 9 2HG1 VAL 9 -10.936 -4.015 1.414 83 3HG1 VAL 9 3HG1 VAL 9 -10.339 -4.068 3.072 84 1HG2 VAL 9 1HG2 VAL 9 -8.257 -2.097 0.214 85 2HG2 VAL 9 2HG2 VAL 9 -8.318 -3.780 0.738 86 3HG2 VAL 9 3HG2 VAL 9 -9.674 -3.082 -0.147 87 H VAL 10 H VAL 10 -10.649 0.945 0.224 88 HA VAL 10 HA VAL 10 -13.227 0.318 -0.686 89 HB VAL 10 HB VAL 10 -12.414 2.499 -1.193 90 1HG1 VAL 10 1HG1 VAL 10 -9.950 1.329 -1.554 91 2HG1 VAL 10 2HG1 VAL 10 -10.380 1.782 -3.197 92 3HG1 VAL 10 3HG1 VAL 10 -10.334 3.003 -1.929 93 1HG2 VAL 10 1HG2 VAL 10 -13.613 0.963 -3.122 94 2HG2 VAL 10 2HG2 VAL 10 -13.318 2.693 -3.281 95 3HG2 VAL 10 3HG2 VAL 10 -12.186 1.537 -3.984 96 H SER 11 H SER 11 -10.178 -0.436 -2.457 97 HA SER 11 HA SER 11 -11.705 -2.664 -3.724 98 1HB SER 11 1HB SER 11 -10.754 -0.502 -5.085 99 2HB SER 11 2HB SER 11 -9.386 -1.602 -5.219 100 HG SER 11 HG SER 11 -12.094 -2.162 -5.877 101 H CYS 12 H CYS 12 -10.388 -4.585 -4.209 102 HA CYS 12 HA CYS 12 -7.685 -4.664 -3.002 103 1HB CYS 12 1HB CYS 12 -8.271 -6.710 -1.692 104 2HB CYS 12 2HB CYS 12 -9.116 -5.270 -1.127 105 HG CYS 12 HG CYS 12 -10.859 -7.242 -1.417 106 H SER 13 H SER 13 -6.352 -5.997 -4.155 107 HA SER 13 HA SER 13 -7.620 -7.928 -6.045 108 1HB SER 13 1HB SER 13 -6.440 -5.594 -6.852 109 2HB SER 13 2HB SER 13 -5.082 -6.711 -6.936 110 HG SER 13 HG SER 13 -6.081 -7.832 -8.460 111 H SER 14 H SER 14 -6.738 -8.762 -3.593 112 HA SER 14 HA SER 14 -5.350 -11.032 -3.809 113 1HB SER 14 1HB SER 14 -3.398 -8.807 -4.065 114 2HB SER 14 2HB SER 14 -2.945 -10.152 -3.026 115 HG SER 14 HG SER 14 -3.857 -10.336 -5.712 116 H GLN 15 H GLN 15 -6.949 -10.841 -1.966 117 HA GLN 15 HA GLN 15 -5.466 -10.195 0.539 118 1HB GLN 15 1HB GLN 15 -7.453 -9.162 1.480 119 2HB GLN 15 2HB GLN 15 -7.074 -8.374 -0.041 120 1HG GLN 15 1HG GLN 15 -9.257 -8.751 -0.537 121 2HG GLN 15 2HG GLN 15 -8.718 -10.388 -0.891 122 1HE2 GLN 15 2HE2 GLN 15 -8.213 -10.703 2.235 123 2HE2 GLN 15 1HE2 GLN 15 -9.774 -11.023 2.806 124 H ASP 16 H ASP 16 -5.831 -11.615 2.254 125 HA ASP 16 HA ASP 16 -7.338 -14.093 1.573 126 1HB ASP 16 1HB ASP 16 -4.881 -13.547 2.967 127 2HB ASP 16 2HB ASP 16 -5.994 -14.325 4.089 128 H SER 17 H SER 17 -8.882 -14.950 3.078 129 HA SER 17 HA SER 17 -10.633 -13.033 4.249 130 1HB SER 17 1HB SER 17 -10.412 -15.976 4.939 131 2HB SER 17 2HB SER 17 -11.814 -14.942 5.196 132 HG SER 17 HG SER 17 -12.352 -15.422 3.232 133 H THR 18 H THR 18 -8.441 -15.357 5.892 134 HA THR 18 HA THR 18 -8.872 -14.347 8.522 135 HB THR 18 HB THR 18 -6.326 -15.291 8.662 136 HG1 THR 18 HG1 THR 18 -5.865 -16.549 7.023 137 1HG2 THR 18 1HG2 THR 18 -8.650 -16.112 9.596 138 2HG2 THR 18 2HG2 THR 18 -8.530 -17.282 8.282 139 3HG2 THR 18 3HG2 THR 18 -7.283 -17.222 9.527 140 H HIS 19 H HIS 19 -6.115 -13.742 6.318 141 HA HIS 19 HA HIS 19 -5.601 -11.206 7.812 142 1HB HIS 19 1HB HIS 19 -3.827 -12.975 6.113 143 2HB HIS 19 2HB HIS 19 -3.357 -11.340 6.576 144 HD1 HIS 19 HD1 HIS 19 -2.241 -11.118 8.803 145 HD2 HIS 19 HD2 HIS 19 -4.443 -14.647 8.530 146 HE1 HIS 19 HE1 HIS 19 -1.795 -12.408 10.936 147 H CYS 20 H CYS 20 -7.419 -10.239 6.569 148 HA CYS 20 HA CYS 20 -7.042 -9.949 3.669 149 1HB CYS 20 1HB CYS 20 -9.139 -8.627 3.777 150 2HB CYS 20 2HB CYS 20 -9.318 -10.201 4.546 151 HG CYS 20 HG CYS 20 -9.047 -8.979 6.888 152 H ALA 21 H ALA 21 -7.061 -7.741 2.710 153 HA ALA 21 HA ALA 21 -4.929 -6.148 3.727 154 1HB ALA 21 1HB ALA 21 -6.416 -6.338 1.356 155 2HB ALA 21 2HB ALA 21 -6.705 -4.699 1.937 156 3HB ALA 21 3HB ALA 21 -5.056 -5.258 1.660 157 H GLU 22 H GLU 22 -8.335 -6.190 4.431 158 HA GLU 22 HA GLU 22 -8.646 -3.469 5.293 159 1HB GLU 22 1HB GLU 22 -10.355 -5.564 5.009 160 2HB GLU 22 2HB GLU 22 -10.149 -5.567 6.761 161 1HG GLU 22 1HG GLU 22 -10.528 -2.973 6.528 162 2HG GLU 22 2HG GLU 22 -11.278 -3.414 4.993 163 H ASN 23 H ASN 23 -6.986 -6.192 6.702 164 HA ASN 23 HA ASN 23 -7.104 -5.365 9.459 165 1HB ASN 23 1HB ASN 23 -5.257 -7.099 7.852 166 2HB ASN 23 2HB ASN 23 -4.848 -6.676 9.514 167 1HD2 ASN 23 2HD2 ASN 23 -7.027 -8.551 7.504 168 2HD2 ASN 23 1HD2 ASN 23 -7.831 -9.342 8.773 169 H LEU 24 H LEU 24 -5.501 -4.082 6.723 170 HA LEU 24 HA LEU 24 -3.213 -2.885 7.938 171 1HB LEU 24 1HB LEU 24 -4.810 -1.884 5.559 172 2HB LEU 24 2HB LEU 24 -3.128 -1.512 5.933 173 HG LEU 24 HG LEU 24 -4.006 -4.374 5.574 174 1HD1 LEU 24 1HD1 LEU 24 -4.593 -2.727 3.598 175 2HD1 LEU 24 2HD1 LEU 24 -2.859 -2.823 3.287 176 3HD1 LEU 24 3HD1 LEU 24 -3.840 -4.289 3.268 177 1HD2 LEU 24 1HD2 LEU 24 -1.648 -3.230 6.366 178 2HD2 LEU 24 2HD2 LEU 24 -1.780 -4.814 5.609 179 3HD2 LEU 24 3HD2 LEU 24 -1.388 -3.400 4.632 180 H LEU 25 H LEU 25 -6.621 -2.147 7.942 181 HA LEU 25 HA LEU 25 -6.613 0.614 8.527 182 1HB LEU 25 1HB LEU 25 -8.404 -1.715 9.090 183 2HB LEU 25 2HB LEU 25 -8.688 -0.237 9.993 184 HG LEU 25 HG LEU 25 -10.041 -0.355 7.909 185 1HD1 LEU 25 1HD1 LEU 25 -8.155 1.791 8.602 186 2HD1 LEU 25 2HD1 LEU 25 -8.756 1.875 6.949 187 3HD1 LEU 25 3HD1 LEU 25 -9.887 1.864 8.299 188 1HD2 LEU 25 1HD2 LEU 25 -8.263 -1.617 6.610 189 2HD2 LEU 25 2HD2 LEU 25 -8.998 -0.272 5.739 190 3HD2 LEU 25 3HD2 LEU 25 -7.396 -0.090 6.452 191 H LYS 26 H LYS 26 -5.593 -2.141 10.415 192 HA LYS 26 HA LYS 26 -5.257 -0.328 12.779 193 1HB LYS 26 1HB LYS 26 -5.401 -3.350 12.960 194 2HB LYS 26 2HB LYS 26 -5.567 -2.165 14.252 195 1HG LYS 26 1HG LYS 26 -7.790 -2.104 13.946 196 2HG LYS 26 2HG LYS 26 -7.559 -1.572 12.282 197 1HD LYS 26 1HD LYS 26 -8.684 -3.556 11.900 198 2HD LYS 26 2HD LYS 26 -7.026 -4.157 11.909 199 1HE LYS 26 1HE LYS 26 -8.225 -5.613 13.363 200 2HE LYS 26 2HE LYS 26 -7.333 -4.524 14.427 201 1HZ LYS 26 1HZ LYS 26 -9.487 -3.112 14.250 202 2HZ LYS 26 2HZ LYS 26 -10.207 -4.584 13.813 203 3HZ LYS 26 3HZ LYS 26 -9.428 -4.433 15.315 204 H ALA 27 H ALA 27 -3.268 0.132 11.321 205 HA ALA 27 HA ALA 27 -1.159 -1.668 10.880 206 1HB ALA 27 1HB ALA 27 -1.271 0.734 10.121 207 2HB ALA 27 2HB ALA 27 -0.814 1.211 11.756 208 3HB ALA 27 3HB ALA 27 0.296 0.256 10.773 209 H ASP 28 H ASP 28 -2.204 -0.214 13.888 210 HA ASP 28 HA ASP 28 0.189 -1.314 15.288 211 1HB ASP 28 1HB ASP 28 -0.743 1.131 15.599 212 2HB ASP 28 2HB ASP 28 -1.933 0.339 16.632 213 H THR 29 H THR 29 -0.814 -3.486 14.830 214 HA THR 29 HA THR 29 -2.407 -4.348 17.134 215 HB THR 29 HB THR 29 -3.490 -4.541 14.306 216 HG1 THR 29 HG1 THR 29 -4.357 -3.198 16.646 217 1HG2 THR 29 1HG2 THR 29 -4.042 -6.080 16.738 218 2HG2 THR 29 2HG2 THR 29 -5.480 -5.333 16.041 219 3HG2 THR 29 3HG2 THR 29 -4.490 -6.416 15.065 220 H TYR 30 H TYR 30 -2.514 -6.281 14.203 221 HA TYR 30 HA TYR 30 -0.024 -7.585 14.393 222 1HB TYR 30 1HB TYR 30 -0.916 -9.716 15.630 223 2HB TYR 30 2HB TYR 30 -0.355 -8.332 16.566 224 HD1 TYR 30 HD1 TYR 30 -3.643 -8.754 14.775 225 HD2 TYR 30 HD2 TYR 30 -1.589 -8.402 18.534 226 HE1 TYR 30 HE1 TYR 30 -5.810 -8.580 15.946 227 HE2 TYR 30 HE2 TYR 30 -3.768 -8.235 19.702 228 HH TYR 30 HH TYR 30 -6.635 -9.111 18.379 229 H ARG 31 H ARG 31 -1.745 -6.925 12.324 230 HA ARG 31 HA ARG 31 -2.247 -9.615 11.168 231 1HB ARG 31 1HB ARG 31 -4.248 -7.382 11.444 232 2HB ARG 31 2HB ARG 31 -4.359 -8.522 10.102 233 1HG ARG 31 1HG ARG 31 -4.111 -9.449 12.966 234 2HG ARG 31 2HG ARG 31 -5.676 -9.123 12.223 235 1HD ARG 31 1HD ARG 31 -3.953 -10.779 10.527 236 2HD ARG 31 2HD ARG 31 -4.296 -11.527 12.086 237 HE ARG 31 HE ARG 31 -6.216 -11.078 9.944 238 1HH1 ARG 31 1HH1 ARG 31 -5.806 -11.418 13.401 239 2HH1 ARG 31 2HH1 ARG 31 -7.435 -11.944 13.644 240 1HH2 ARG 31 1HH2 ARG 31 -8.315 -11.763 10.305 241 2HH2 ARG 31 2HH2 ARG 31 -8.841 -12.138 11.911 242 H LYS 32 H LYS 32 -0.601 -9.458 9.693 243 HA LYS 32 HA LYS 32 -0.128 -7.004 8.154 244 1HB LYS 32 1HB LYS 32 1.089 -9.739 7.707 245 2HB LYS 32 2HB LYS 32 1.765 -8.188 7.253 246 1HG LYS 32 1HG LYS 32 1.888 -7.593 9.692 247 2HG LYS 32 2HG LYS 32 1.375 -9.239 10.066 248 1HD LYS 32 1HD LYS 32 3.665 -8.938 8.190 249 2HD LYS 32 2HD LYS 32 3.966 -8.559 9.885 250 1HE LYS 32 1HE LYS 32 3.074 -10.762 10.542 251 2HE LYS 32 2HE LYS 32 2.764 -11.143 8.848 252 1HZ LYS 32 1HZ LYS 32 5.457 -10.360 9.769 253 2HZ LYS 32 2HZ LYS 32 4.927 -11.970 9.888 254 3HZ LYS 32 3HZ LYS 32 5.019 -11.219 8.369 255 H TRP 33 H TRP 33 -0.540 -6.766 5.883 256 HA TRP 33 HA TRP 33 -2.851 -8.106 4.827 257 1HB TRP 33 1HB TRP 33 -2.055 -5.882 3.965 258 2HB TRP 33 2HB TRP 33 -0.676 -6.696 3.272 259 HD1 TRP 33 HD1 TRP 33 -4.178 -8.219 3.095 260 HE1 TRP 33 HE1 TRP 33 -4.874 -8.340 0.596 261 HE3 TRP 33 HE3 TRP 33 -0.336 -5.654 1.015 262 HZ2 TRP 33 HZ2 TRP 33 -3.877 -7.449 -1.946 263 HZ3 TRP 33 HZ3 TRP 33 -0.204 -5.305 -1.441 264 HH2 TRP 33 HH2 TRP 33 -1.980 -6.192 -2.916 265 H ARG 34 H ARG 34 -2.880 -10.200 4.284 266 HA ARG 34 HA ARG 34 -0.449 -11.324 2.957 267 1HB ARG 34 1HB ARG 34 -2.552 -12.802 4.596 268 2HB ARG 34 2HB ARG 34 -1.154 -13.540 3.815 269 1HG ARG 34 1HG ARG 34 0.054 -11.557 5.256 270 2HG ARG 34 2HG ARG 34 -1.302 -11.953 6.309 271 1HD ARG 34 1HD ARG 34 -0.357 -14.448 5.504 272 2HD ARG 34 2HD ARG 34 1.111 -13.499 5.739 273 HE ARG 34 HE ARG 34 -0.381 -12.941 7.995 274 1HH1 ARG 34 1HH1 ARG 34 0.688 -15.883 6.435 275 2HH1 ARG 34 2HH1 ARG 34 0.758 -16.764 7.921 276 1HH2 ARG 34 1HH2 ARG 34 -0.278 -14.120 9.894 277 2HH2 ARG 34 2HH2 ARG 34 0.215 -15.780 9.859 278 H ALA 35 H ALA 35 -0.823 -11.910 0.867 279 HA ALA 35 HA ALA 35 -3.136 -11.293 -0.558 280 1HB ALA 35 1HB ALA 35 -0.764 -12.125 -1.349 281 2HB ALA 35 2HB ALA 35 -1.540 -13.710 -1.368 282 3HB ALA 35 3HB ALA 35 -2.172 -12.406 -2.374 283 H ALA 36 H ALA 36 -4.564 -12.844 -1.763 284 HA ALA 36 HA ALA 36 -6.073 -14.407 0.140 285 1HB ALA 36 1HB ALA 36 -6.733 -13.081 -2.106 286 2HB ALA 36 2HB ALA 36 -6.578 -14.707 -2.772 287 3HB ALA 36 3HB ALA 36 -7.715 -14.396 -1.461 288 H LYS 37 H LYS 37 -3.772 -15.136 -2.408 289 HA LYS 37 HA LYS 37 -3.906 -17.998 -1.601 290 1HB LYS 37 1HB LYS 37 -4.627 -17.136 -4.059 291 2HB LYS 37 2HB LYS 37 -2.898 -17.324 -4.317 292 1HG LYS 37 1HG LYS 37 -2.976 -19.598 -4.094 293 2HG LYS 37 2HG LYS 37 -4.245 -19.538 -2.871 294 1HD LYS 37 1HD LYS 37 -5.905 -18.998 -4.621 295 2HD LYS 37 2HD LYS 37 -4.636 -19.077 -5.844 296 1HE LYS 37 1HE LYS 37 -4.188 -21.452 -5.079 297 2HE LYS 37 2HE LYS 37 -5.654 -21.337 -4.105 298 1HZ LYS 37 1HZ LYS 37 -6.716 -20.576 -6.308 299 2HZ LYS 37 2HZ LYS 37 -5.367 -21.307 -7.036 300 3HZ LYS 37 3HZ LYS 37 -6.418 -22.229 -6.070 301 H ALA 38 H ALA 38 -1.726 -18.970 -2.673 302 HA ALA 38 HA ALA 38 0.465 -17.425 -1.383 303 1HB ALA 38 1HB ALA 38 0.079 -19.822 -0.735 304 2HB ALA 38 2HB ALA 38 0.487 -20.289 -2.386 305 3HB ALA 38 3HB ALA 38 1.698 -19.518 -1.362 306 H GLY 39 H GLY 39 2.647 -18.435 -2.739 307 1HA GLY 39 1HA GLY 39 3.931 -18.111 -4.685 308 2HA GLY 39 2HA GLY 39 2.434 -18.291 -5.607 309 H GLU 40 H GLU 40 3.330 -15.959 -3.128 310 HA GLU 40 HA GLU 40 2.098 -13.685 -4.004 311 1HB GLU 40 1HB GLU 40 4.697 -14.126 -2.587 312 2HB GLU 40 2HB GLU 40 4.232 -12.490 -3.051 313 1HG GLU 40 1HG GLU 40 3.319 -12.722 -0.901 314 2HG GLU 40 2HG GLU 40 1.953 -13.059 -1.962 315 H LYS 41 H LYS 41 2.083 -13.581 -6.258 316 HA LYS 41 HA LYS 41 4.638 -13.053 -7.673 317 1HB LYS 41 1HB LYS 41 2.600 -14.490 -8.549 318 2HB LYS 41 2HB LYS 41 1.940 -12.915 -8.990 319 1HG LYS 41 1HG LYS 41 4.322 -12.523 -10.033 320 2HG LYS 41 2HG LYS 41 4.406 -14.286 -10.018 321 1HD LYS 41 1HD LYS 41 1.943 -13.990 -11.062 322 2HD LYS 41 2HD LYS 41 2.669 -12.485 -11.630 323 1HE LYS 41 1HE LYS 41 3.323 -13.870 -13.354 324 2HE LYS 41 2HE LYS 41 4.677 -14.138 -12.255 325 1HZ LYS 41 1HZ LYS 41 3.191 -15.988 -11.309 326 2HZ LYS 41 2HZ LYS 41 2.345 -15.864 -12.773 327 3HZ LYS 41 3HZ LYS 41 3.995 -16.265 -12.779 328 H THR 42 H THR 42 1.408 -11.536 -7.641 329 HA THR 42 HA THR 42 2.597 -8.898 -7.094 330 HB THR 42 HB THR 42 1.525 -7.870 -9.093 331 HG1 THR 42 HG1 THR 42 0.343 -9.041 -10.377 332 1HG2 THR 42 1HG2 THR 42 3.938 -8.857 -9.005 333 2HG2 THR 42 2HG2 THR 42 3.291 -10.090 -10.084 334 3HG2 THR 42 3HG2 THR 42 3.265 -8.393 -10.566 335 H ILE 43 H ILE 43 1.278 -8.248 -5.458 336 HA ILE 43 HA ILE 43 -1.630 -8.915 -5.660 337 HB ILE 43 HB ILE 43 -1.653 -8.511 -3.181 338 1HG1 ILE 43 1HG1 ILE 43 1.356 -8.620 -3.405 339 2HG1 ILE 43 2HG1 ILE 43 0.456 -7.113 -3.198 340 1HG2 ILE 43 1HG2 ILE 43 -1.125 -10.754 -4.506 341 2HG2 ILE 43 2HG2 ILE 43 0.422 -10.586 -3.678 342 3HG2 ILE 43 3HG2 ILE 43 -1.069 -10.682 -2.748 343 1HD1 ILE 43 1HD1 ILE 43 -0.709 -8.406 -1.227 344 2HD1 ILE 43 2HD1 ILE 43 0.728 -9.426 -1.296 345 3HD1 ILE 43 3HD1 ILE 43 0.886 -7.699 -0.974 346 H SER 44 H SER 44 -3.177 -7.280 -5.330 347 HA SER 44 HA SER 44 -2.038 -4.519 -5.124 348 1HB SER 44 1HB SER 44 -4.603 -4.737 -6.543 349 2HB SER 44 2HB SER 44 -3.175 -3.798 -6.946 350 HG SER 44 HG SER 44 -3.167 -5.319 -8.469 351 H VAL 45 H VAL 45 -3.318 -2.997 -3.970 352 HA VAL 45 HA VAL 45 -5.796 -3.914 -2.676 353 HB VAL 45 HB VAL 45 -4.046 -4.774 -1.155 354 1HG1 VAL 45 1HG1 VAL 45 -2.422 -2.855 -1.827 355 2HG1 VAL 45 2HG1 VAL 45 -3.239 -1.937 -0.565 356 3HG1 VAL 45 3HG1 VAL 45 -2.397 -3.432 -0.163 357 1HG2 VAL 45 1HG2 VAL 45 -5.694 -2.424 -0.216 358 2HG2 VAL 45 2HG2 VAL 45 -6.069 -4.141 -0.073 359 3HG2 VAL 45 3HG2 VAL 45 -4.777 -3.437 0.899 360 H VAL 46 H VAL 46 -7.032 -2.179 -3.280 361 HA VAL 46 HA VAL 46 -5.846 0.531 -3.214 362 HB VAL 46 HB VAL 46 -8.672 -0.187 -4.004 363 1HG1 VAL 46 1HG1 VAL 46 -7.875 2.218 -3.553 364 2HG1 VAL 46 2HG1 VAL 46 -6.911 2.040 -5.019 365 3HG1 VAL 46 3HG1 VAL 46 -8.668 1.912 -5.098 366 1HG2 VAL 46 1HG2 VAL 46 -6.099 -0.366 -5.569 367 2HG2 VAL 46 2HG2 VAL 46 -7.412 -1.538 -5.484 368 3HG2 VAL 46 3HG2 VAL 46 -7.627 -0.038 -6.386 369 H LEU 47 H LEU 47 -6.052 1.747 -1.438 370 HA LEU 47 HA LEU 47 -8.100 0.984 0.584 371 1HB LEU 47 1HB LEU 47 -5.869 2.977 1.005 372 2HB LEU 47 2HB LEU 47 -6.742 2.040 2.212 373 HG LEU 47 HG LEU 47 -5.655 0.051 0.632 374 1HD1 LEU 47 1HD1 LEU 47 -3.883 2.478 0.595 375 2HD1 LEU 47 2HD1 LEU 47 -3.159 0.870 0.659 376 3HD1 LEU 47 3HD1 LEU 47 -4.204 1.314 -0.690 377 1HD2 LEU 47 1HD2 LEU 47 -5.685 0.210 3.124 378 2HD2 LEU 47 2HD2 LEU 47 -4.114 -0.297 2.502 379 3HD2 LEU 47 3HD2 LEU 47 -4.355 1.366 3.042 380 H GLN 48 H GLN 48 -9.375 2.698 1.584 381 HA GLN 48 HA GLN 48 -9.816 5.002 -0.270 382 1HB GLN 48 1HB GLN 48 -11.638 3.145 0.529 383 2HB GLN 48 2HB GLN 48 -11.862 4.365 1.783 384 1HG GLN 48 1HG GLN 48 -11.688 5.290 -1.054 385 2HG GLN 48 2HG GLN 48 -13.179 4.507 -0.530 386 1HE2 GLN 48 2HE2 GLN 48 -12.001 7.520 -0.922 387 2HE2 GLN 48 1HE2 GLN 48 -12.753 8.323 0.370 388 H LEU 49 H LEU 49 -9.098 6.929 0.514 389 HA LEU 49 HA LEU 49 -8.229 7.259 3.235 390 1HB LEU 49 1HB LEU 49 -8.727 9.378 1.120 391 2HB LEU 49 2HB LEU 49 -7.748 9.558 2.575 392 HG LEU 49 HG LEU 49 -7.170 7.481 0.451 393 1HD1 LEU 49 1HD1 LEU 49 -7.031 10.117 -0.079 394 2HD1 LEU 49 2HD1 LEU 49 -5.478 9.916 0.731 395 3HD1 LEU 49 3HD1 LEU 49 -5.852 8.966 -0.707 396 1HD2 LEU 49 1HD2 LEU 49 -5.557 8.658 2.737 397 2HD2 LEU 49 2HD2 LEU 49 -6.222 7.026 2.666 398 3HD2 LEU 49 3HD2 LEU 49 -4.935 7.504 1.558 399 H GLU 50 H GLU 50 -9.260 8.357 4.851 400 HA GLU 50 HA GLU 50 -12.171 8.494 4.732 401 1HB GLU 50 1HB GLU 50 -11.964 9.268 7.100 402 2HB GLU 50 2HB GLU 50 -11.103 7.761 6.789 403 1HG GLU 50 1HG GLU 50 -9.022 8.748 6.966 404 2HG GLU 50 2HG GLU 50 -9.607 10.323 6.427 405 H LYS 51 H LYS 51 -10.708 10.438 2.976 406 HA LYS 51 HA LYS 51 -12.305 12.681 3.069 407 1HB LYS 51 1HB LYS 51 -10.694 14.395 4.101 408 2HB LYS 51 2HB LYS 51 -11.565 13.375 5.243 409 1HG LYS 51 1HG LYS 51 -9.675 12.246 5.884 410 2HG LYS 51 2HG LYS 51 -8.961 12.319 4.272 411 1HD LYS 51 1HD LYS 51 -8.528 14.758 4.631 412 2HD LYS 51 2HD LYS 51 -9.111 14.580 6.285 413 1HE LYS 51 1HE LYS 51 -6.939 12.769 5.265 414 2HE LYS 51 2HE LYS 51 -6.539 14.397 5.813 415 1HZ LYS 51 1HZ LYS 51 -7.702 13.880 7.909 416 2HZ LYS 51 2HZ LYS 51 -7.919 12.284 7.378 417 3HZ LYS 51 3HZ LYS 51 -6.351 12.886 7.641 418 H GLU 52 H GLU 52 -11.800 13.939 1.268 419 HA GLU 52 HA GLU 52 -9.599 13.042 -0.409 420 1HB GLU 52 1HB GLU 52 -11.981 14.057 -1.052 421 2HB GLU 52 2HB GLU 52 -11.075 15.566 -0.989 422 1HG GLU 52 1HG GLU 52 -9.327 14.338 -2.457 423 2HG GLU 52 2HG GLU 52 -10.627 13.193 -2.782 424 H GLU 53 H GLU 53 -7.609 13.647 0.153 425 HA GLU 53 HA GLU 53 -7.060 16.517 0.651 426 1HB GLU 53 1HB GLU 53 -5.275 15.524 2.377 427 2HB GLU 53 2HB GLU 53 -6.908 15.934 2.885 428 1HG GLU 53 1HG GLU 53 -6.117 13.682 3.691 429 2HG GLU 53 2HG GLU 53 -7.603 13.615 2.751 430 H GLN 54 H GLN 54 -4.686 16.950 0.478 431 HA GLN 54 HA GLN 54 -3.605 15.616 -1.884 432 1HB GLN 54 1HB GLN 54 -2.308 17.680 -0.067 433 2HB GLN 54 2HB GLN 54 -1.753 17.217 -1.674 434 1HG GLN 54 1HG GLN 54 -3.611 18.206 -2.734 435 2HG GLN 54 2HG GLN 54 -4.541 18.256 -1.246 436 1HE2 GLN 54 2HE2 GLN 54 -1.128 19.283 -1.556 437 2HE2 GLN 54 1HE2 GLN 54 -1.422 20.916 -1.201 438 H ILE 55 H ILE 55 -0.975 15.208 -1.536 439 HA ILE 55 HA ILE 55 -0.554 13.730 1.013 440 HB ILE 55 HB ILE 55 -0.084 12.464 -1.713 441 1HG1 ILE 55 1HG1 ILE 55 -1.922 10.870 -0.570 442 2HG1 ILE 55 2HG1 ILE 55 -2.400 12.394 0.170 443 1HG2 ILE 55 1HG2 ILE 55 1.255 11.918 0.548 444 2HG2 ILE 55 2HG2 ILE 55 -0.175 10.929 0.844 445 3HG2 ILE 55 3HG2 ILE 55 0.804 10.655 -0.597 446 1HD1 ILE 55 1HD1 ILE 55 -1.853 12.558 -2.729 447 2HD1 ILE 55 2HD1 ILE 55 -3.238 11.554 -2.297 448 3HD1 ILE 55 3HD1 ILE 55 -3.183 13.243 -1.794 449 H HIS 56 H HIS 56 1.470 14.079 1.752 450 HA HIS 56 HA HIS 56 3.499 15.157 -0.164 451 1HB HIS 56 1HB HIS 56 2.714 16.792 1.548 452 2HB HIS 56 2HB HIS 56 3.270 15.700 2.814 453 HD1 HIS 56 HD1 HIS 56 4.491 18.081 0.197 454 HD2 HIS 56 HD2 HIS 56 6.120 15.528 3.062 455 HE1 HIS 56 HE1 HIS 56 6.944 18.682 0.381 456 H SER 57 H SER 57 2.825 12.809 2.359 457 HA SER 57 HA SER 57 5.374 11.450 1.706 458 1HB SER 57 1HB SER 57 4.710 12.686 4.347 459 2HB SER 57 2HB SER 57 5.496 11.111 4.359 460 HG SER 57 HG SER 57 6.415 13.586 3.432 461 H VAL 58 H VAL 58 5.300 9.210 2.277 462 HA VAL 58 HA VAL 58 2.626 8.204 3.141 463 HB VAL 58 HB VAL 58 4.251 7.341 0.732 464 1HG1 VAL 58 1HG1 VAL 58 1.900 6.074 2.120 465 2HG1 VAL 58 2HG1 VAL 58 2.125 5.875 0.382 466 3HG1 VAL 58 3HG1 VAL 58 3.366 5.317 1.499 467 1HG2 VAL 58 1HG2 VAL 58 1.644 8.790 1.140 468 2HG2 VAL 58 2HG2 VAL 58 3.008 9.239 0.117 469 3HG2 VAL 58 3HG2 VAL 58 1.956 7.904 -0.353 470 H ASP 59 H ASP 59 2.739 5.935 3.921 471 HA ASP 59 HA ASP 59 5.476 5.023 4.671 472 1HB ASP 59 1HB ASP 59 3.324 5.965 6.460 473 2HB ASP 59 2HB ASP 59 4.011 4.406 6.919 474 H ILE 60 H ILE 60 5.692 2.836 4.411 475 HA ILE 60 HA ILE 60 3.367 1.042 4.627 476 HB ILE 60 HB ILE 60 4.683 1.721 2.003 477 1HG1 ILE 60 1HG1 ILE 60 2.167 0.943 1.431 478 2HG1 ILE 60 2HG1 ILE 60 1.951 1.386 3.122 479 1HG2 ILE 60 1HG2 ILE 60 3.634 -1.029 2.725 480 2HG2 ILE 60 2HG2 ILE 60 3.789 -0.461 1.063 481 3HG2 ILE 60 3HG2 ILE 60 5.223 -0.624 2.076 482 1HD1 ILE 60 1HD1 ILE 60 3.483 3.468 2.117 483 2HD1 ILE 60 2HD1 ILE 60 2.376 3.102 0.794 484 3HD1 ILE 60 3HD1 ILE 60 1.741 3.510 2.388 485 H GLY 61 H GLY 61 4.118 -0.800 5.636 486 1HA GLY 61 1HA GLY 61 7.080 -1.125 5.660 487 2HA GLY 61 2HA GLY 61 6.034 -1.760 6.898 488 H ASN 62 H ASN 62 7.826 -2.550 4.313 489 HA ASN 62 HA ASN 62 6.204 -4.552 3.004 490 1HB ASN 62 1HB ASN 62 9.140 -3.916 3.044 491 2HB ASN 62 2HB ASN 62 8.551 -5.372 2.240 492 1HD2 ASN 62 2HD2 ASN 62 9.104 -4.475 0.107 493 2HD2 ASN 62 1HD2 ASN 62 8.168 -3.242 -0.589 494 H ASP 63 H ASP 63 5.979 -6.726 3.406 495 HA ASP 63 HA ASP 63 7.392 -7.792 5.826 496 1HB ASP 63 1HB ASP 63 4.811 -7.578 5.835 497 2HB ASP 63 2HB ASP 63 4.828 -8.905 4.671 498 H GLY 64 H GLY 64 8.627 -7.753 3.315 499 1HA GLY 64 1HA GLY 64 10.033 -9.709 2.593 500 2HA GLY 64 2HA GLY 64 8.534 -10.632 2.505 501 H SER 65 H SER 65 7.238 -8.013 1.429 502 HA SER 65 HA SER 65 7.255 -8.635 -1.338 503 1HB SER 65 1HB SER 65 6.356 -6.286 -1.603 504 2HB SER 65 2HB SER 65 5.488 -7.277 -0.434 505 HG SER 65 HG SER 65 6.441 -6.189 1.203 506 H ALA 66 H ALA 66 7.873 -6.548 -2.877 507 HA ALA 66 HA ALA 66 10.608 -5.649 -2.207 508 1HB ALA 66 1HB ALA 66 10.321 -7.940 -3.637 509 2HB ALA 66 2HB ALA 66 10.348 -6.750 -4.938 510 3HB ALA 66 3HB ALA 66 11.693 -6.851 -3.805 511 H PHE 67 H PHE 67 8.009 -5.658 -4.643 512 HA PHE 67 HA PHE 67 8.827 -2.877 -5.389 513 1HB PHE 67 1HB PHE 67 7.095 -4.854 -6.905 514 2HB PHE 67 2HB PHE 67 7.549 -3.255 -7.469 515 HD1 PHE 67 HD1 PHE 67 10.292 -2.886 -6.923 516 HD2 PHE 67 HD2 PHE 67 8.287 -6.521 -8.019 517 HE1 PHE 67 HE1 PHE 67 12.421 -3.791 -7.808 518 HE2 PHE 67 HE2 PHE 67 10.414 -7.429 -8.903 519 HZ PHE 67 HZ PHE 67 12.485 -6.065 -8.800 520 H VAL 68 H VAL 68 7.618 -1.320 -4.446 521 HA VAL 68 HA VAL 68 4.729 -1.947 -3.924 522 HB VAL 68 HB VAL 68 6.524 -0.114 -2.308 523 1HG1 VAL 68 1HG1 VAL 68 4.038 0.430 -2.441 524 2HG1 VAL 68 2HG1 VAL 68 3.740 -1.133 -1.678 525 3HG1 VAL 68 3HG1 VAL 68 4.650 0.109 -0.818 526 1HG2 VAL 68 1HG2 VAL 68 6.793 -2.732 -2.253 527 2HG2 VAL 68 2HG2 VAL 68 6.722 -1.831 -0.738 528 3HG2 VAL 68 3HG2 VAL 68 5.290 -2.672 -1.333 529 H GLU 69 H GLU 69 3.573 -0.890 -5.408 530 HA GLU 69 HA GLU 69 4.437 1.844 -6.256 531 1HB GLU 69 1HB GLU 69 4.199 0.185 -8.076 532 2HB GLU 69 2HB GLU 69 2.530 -0.107 -7.592 533 1HG GLU 69 1HG GLU 69 1.781 1.882 -8.468 534 2HG GLU 69 2HG GLU 69 3.292 2.724 -8.132 535 H VAL 70 H VAL 70 2.914 3.562 -6.189 536 HA VAL 70 HA VAL 70 0.306 2.952 -4.874 537 HB VAL 70 HB VAL 70 2.034 5.307 -4.098 538 1HG1 VAL 70 1HG1 VAL 70 -0.661 4.293 -3.397 539 2HG1 VAL 70 2HG1 VAL 70 0.321 4.868 -2.050 540 3HG1 VAL 70 3HG1 VAL 70 -0.042 5.944 -3.397 541 1HG2 VAL 70 1HG2 VAL 70 1.874 2.513 -3.023 542 2HG2 VAL 70 2HG2 VAL 70 3.280 3.566 -3.179 543 3HG2 VAL 70 3HG2 VAL 70 2.109 3.844 -1.890 544 H LEU 71 H LEU 71 -1.326 3.841 -5.979 545 HA LEU 71 HA LEU 71 -0.743 6.106 -7.830 546 1HB LEU 71 1HB LEU 71 -2.273 3.623 -8.114 547 2HB LEU 71 2HB LEU 71 -3.210 5.044 -8.567 548 HG LEU 71 HG LEU 71 -1.273 5.755 -10.013 549 1HD1 LEU 71 1HD1 LEU 71 0.451 4.429 -8.816 550 2HD1 LEU 71 2HD1 LEU 71 -0.306 2.947 -9.397 551 3HD1 LEU 71 3HD1 LEU 71 0.431 4.066 -10.542 552 1HD2 LEU 71 1HD2 LEU 71 -2.721 3.146 -10.476 553 2HD2 LEU 71 2HD2 LEU 71 -3.071 4.730 -11.170 554 3HD2 LEU 71 3HD2 LEU 71 -1.649 3.829 -11.698 555 H VAL 72 H VAL 72 -2.450 7.726 -7.973 556 HA VAL 72 HA VAL 72 -4.049 7.939 -5.452 557 HB VAL 72 HB VAL 72 -3.809 10.436 -5.884 558 1HG1 VAL 72 1HG1 VAL 72 -1.766 8.523 -4.907 559 2HG1 VAL 72 2HG1 VAL 72 -1.228 10.183 -5.148 560 3HG1 VAL 72 3HG1 VAL 72 -2.569 9.843 -4.057 561 1HG2 VAL 72 1HG2 VAL 72 -2.994 10.171 -8.237 562 2HG2 VAL 72 2HG2 VAL 72 -1.892 11.126 -7.245 563 3HG2 VAL 72 3HG2 VAL 72 -1.519 9.442 -7.607 564 H GLY 73 H GLY 73 -6.097 9.096 -5.645 565 1HA GLY 73 1HA GLY 73 -7.197 10.056 -8.056 566 2HA GLY 73 2HA GLY 73 -7.633 8.356 -7.917 567 H SER 74 H SER 74 -9.671 9.976 -7.911 568 HA SER 74 HA SER 74 -10.462 10.368 -5.081 569 1HB SER 74 1HB SER 74 -10.564 12.468 -6.219 570 2HB SER 74 2HB SER 74 -11.346 11.746 -7.616 571 HG SER 74 HG SER 74 -12.389 12.562 -5.200 572 H SER 75 H SER 75 -12.752 9.951 -4.655 573 HA SER 75 HA SER 75 -13.634 7.416 -5.669 574 1HB SER 75 1HB SER 75 -15.622 7.802 -4.271 575 2HB SER 75 2HB SER 75 -14.167 8.230 -3.376 576 HG SER 75 HG SER 75 -15.782 9.845 -3.224 577 H ALA 76 H ALA 76 -13.875 10.577 -6.882 578 HA ALA 76 HA ALA 76 -16.442 10.664 -8.037 579 1HB ALA 76 1HB ALA 76 -13.793 11.874 -8.749 580 2HB ALA 76 2HB ALA 76 -15.148 12.046 -9.865 581 3HB ALA 76 3HB ALA 76 -15.277 12.670 -8.221 582 H GLY 77 H GLY 77 -16.706 10.611 -10.568 583 1HA GLY 77 1HA GLY 77 -16.376 9.454 -12.637 584 2HA GLY 77 2HA GLY 77 -15.214 8.397 -11.835 585 H GLY 78 H GLY 78 -15.914 6.397 -11.268 586 1HA GLY 78 1HA GLY 78 -18.427 5.703 -10.198 587 2HA GLY 78 2HA GLY 78 -18.554 5.493 -11.946 588 H ALA 79 H ALA 79 -16.151 4.508 -12.690 589 HA ALA 79 HA ALA 79 -16.177 1.821 -11.483 590 1HB ALA 79 1HB ALA 79 -15.095 3.066 -13.961 591 2HB ALA 79 2HB ALA 79 -14.216 1.673 -13.329 592 3HB ALA 79 3HB ALA 79 -15.923 1.523 -13.748 593 H GLY 80 H GLY 80 -13.782 4.415 -12.049 594 1HA GLY 80 1HA GLY 80 -12.157 5.084 -10.381 595 2HA GLY 80 2HA GLY 80 -12.341 3.507 -9.612 596 H GLU 81 H GLU 81 -12.153 2.041 -12.155 597 HA GLU 81 HA GLU 81 -9.304 1.678 -12.243 598 1HB GLU 81 1HB GLU 81 -11.635 0.656 -13.830 599 2HB GLU 81 2HB GLU 81 -10.004 0.408 -14.455 600 1HG GLU 81 1HG GLU 81 -9.342 -0.836 -12.542 601 2HG GLU 81 2HG GLU 81 -10.743 -0.301 -11.613 602 H GLN 82 H GLN 82 -7.798 2.374 -13.779 603 HA GLN 82 HA GLN 82 -6.857 3.813 -15.372 604 1HB GLN 82 1HB GLN 82 -9.632 3.743 -16.595 605 2HB GLN 82 2HB GLN 82 -8.135 4.196 -17.412 606 1HG GLN 82 1HG GLN 82 -7.291 1.843 -16.714 607 2HG GLN 82 2HG GLN 82 -8.993 1.475 -16.439 608 1HE2 GLN 82 2HE2 GLN 82 -6.999 0.593 -18.641 609 2HE2 GLN 82 1HE2 GLN 82 -7.830 0.914 -20.086 610 H ASP 83 H ASP 83 -8.272 4.901 -12.963 611 HA ASP 83 HA ASP 83 -8.673 7.669 -14.011 612 1HB ASP 83 1HB ASP 83 -10.805 6.351 -13.267 613 2HB ASP 83 2HB ASP 83 -10.214 6.661 -11.634 614 H TYR 84 H TYR 84 -6.440 6.072 -12.535 615 HA TYR 84 HA TYR 84 -6.080 8.040 -10.337 616 1HB TYR 84 1HB TYR 84 -5.293 5.115 -10.457 617 2HB TYR 84 2HB TYR 84 -4.602 6.241 -9.292 618 HD1 TYR 84 HD1 TYR 84 -8.034 5.448 -10.621 619 HD2 TYR 84 HD2 TYR 84 -5.570 6.192 -7.188 620 HE1 TYR 84 HE1 TYR 84 -10.003 5.156 -9.151 621 HE2 TYR 84 HE2 TYR 84 -7.541 5.902 -5.713 622 HH TYR 84 HH TYR 84 -10.276 4.430 -6.577 623 H GLU 85 H GLU 85 -3.921 8.805 -10.110 624 HA GLU 85 HA GLU 85 -2.276 8.418 -12.557 625 1HB GLU 85 1HB GLU 85 -2.175 10.665 -12.641 626 2HB GLU 85 2HB GLU 85 -3.149 10.768 -11.185 627 1HG GLU 85 1HG GLU 85 -1.157 12.003 -10.754 628 2HG GLU 85 2HG GLU 85 -0.977 10.490 -9.868 629 H VAL 86 H VAL 86 -0.038 7.977 -12.329 630 HA VAL 86 HA VAL 86 0.625 6.310 -10.085 631 HB VAL 86 HB VAL 86 2.483 7.480 -12.176 632 1HG1 VAL 86 1HG1 VAL 86 2.697 5.255 -10.152 633 2HG1 VAL 86 2HG1 VAL 86 3.642 5.206 -11.641 634 3HG1 VAL 86 3HG1 VAL 86 3.852 6.539 -10.507 635 1HG2 VAL 86 1HG2 VAL 86 0.377 6.124 -12.915 636 2HG2 VAL 86 2HG2 VAL 86 1.947 5.660 -13.568 637 3HG2 VAL 86 3HG2 VAL 86 1.236 4.738 -12.245 638 H LEU 87 H LEU 87 0.376 7.700 -8.235 639 HA LEU 87 HA LEU 87 1.736 10.160 -7.794 640 1HB LEU 87 1HB LEU 87 -0.046 9.087 -6.327 641 2HB LEU 87 2HB LEU 87 1.214 8.024 -5.705 642 HG LEU 87 HG LEU 87 2.533 10.138 -5.138 643 1HD1 LEU 87 1HD1 LEU 87 0.574 11.383 -6.630 644 2HD1 LEU 87 2HD1 LEU 87 0.038 11.701 -4.979 645 3HD1 LEU 87 3HD1 LEU 87 1.648 12.200 -5.495 646 1HD2 LEU 87 1HD2 LEU 87 0.773 8.683 -3.673 647 2HD2 LEU 87 2HD2 LEU 87 1.665 10.054 -3.015 648 3HD2 LEU 87 3HD2 LEU 87 0.006 10.268 -3.574 649 H LEU 88 H LEU 88 2.746 6.851 -6.832 650 HA LEU 88 HA LEU 88 5.545 7.708 -7.277 651 1HB LEU 88 1HB LEU 88 6.341 6.820 -5.192 652 2HB LEU 88 2HB LEU 88 5.066 7.985 -4.857 653 HG LEU 88 HG LEU 88 3.675 5.600 -5.116 654 1HD1 LEU 88 1HD1 LEU 88 6.449 5.131 -4.122 655 2HD1 LEU 88 2HD1 LEU 88 5.139 4.317 -3.266 656 3HD1 LEU 88 3HD1 LEU 88 5.370 4.041 -4.993 657 1HD2 LEU 88 1HD2 LEU 88 4.748 7.154 -2.759 658 2HD2 LEU 88 2HD2 LEU 88 3.112 7.160 -3.420 659 3HD2 LEU 88 3HD2 LEU 88 3.699 5.753 -2.532 660 H VAL 89 H VAL 89 6.369 6.330 -8.716 661 HA VAL 89 HA VAL 89 5.199 3.974 -9.661 662 HB VAL 89 HB VAL 89 7.482 3.391 -10.516 663 1HG1 VAL 89 1HG1 VAL 89 6.360 6.177 -10.774 664 2HG1 VAL 89 2HG1 VAL 89 7.802 5.700 -11.671 665 3HG1 VAL 89 3HG1 VAL 89 6.281 4.845 -11.928 666 1HG2 VAL 89 1HG2 VAL 89 8.714 4.213 -8.505 667 2HG2 VAL 89 2HG2 VAL 89 9.342 4.898 -10.003 668 3HG2 VAL 89 3HG2 VAL 89 8.301 5.866 -8.960 669 H THR 90 H THR 90 6.367 1.718 -9.509 670 HA THR 90 HA THR 90 6.051 0.813 -6.819 671 HB THR 90 HB THR 90 5.878 -0.457 -9.145 672 HG1 THR 90 HG1 THR 90 5.493 -2.086 -7.887 673 1HG2 THR 90 1HG2 THR 90 8.427 -0.219 -9.478 674 2HG2 THR 90 2HG2 THR 90 8.578 -1.452 -8.226 675 3HG2 THR 90 3HG2 THR 90 7.728 -1.819 -9.726 676 H SER 91 H SER 91 7.488 0.608 -5.203 677 HA SER 91 HA SER 91 10.227 1.616 -5.651 678 1HB SER 91 1HB SER 91 10.182 1.499 -3.042 679 2HB SER 91 2HB SER 91 9.258 2.760 -3.850 680 HG SER 91 HG SER 91 8.415 0.558 -2.425 681 H SER 92 H SER 92 11.772 0.150 -5.949 682 HA SER 92 HA SER 92 11.414 -2.669 -5.290 683 1HB SER 92 1HB SER 92 13.641 -2.962 -6.214 684 2HB SER 92 2HB SER 92 12.775 -1.835 -7.251 685 HG SER 92 HG SER 92 14.814 -1.012 -6.778 686 H PHE 93 H PHE 93 10.936 -1.910 -2.988 687 HA PHE 93 HA PHE 93 12.938 -0.911 -1.243 688 1HB PHE 93 1HB PHE 93 10.537 -0.965 -0.712 689 2HB PHE 93 2HB PHE 93 10.596 -2.721 -0.653 690 HD1 PHE 93 HD1 PHE 93 12.894 -0.071 0.673 691 HD2 PHE 93 HD2 PHE 93 10.357 -3.423 1.547 692 HE1 PHE 93 HE1 PHE 93 13.600 0.016 3.050 693 HE2 PHE 93 HE2 PHE 93 11.054 -3.333 3.924 694 HZ PHE 93 HZ PHE 93 12.673 -1.609 4.675 695 H MET 94 H MET 94 11.894 -4.282 -1.787 696 HA MET 94 HA MET 94 14.511 -5.158 -0.645 697 1HB MET 94 1HB MET 94 11.727 -6.062 -0.204 698 2HB MET 94 2HB MET 94 12.912 -7.353 -0.376 699 1HG MET 94 1HG MET 94 14.258 -6.435 1.414 700 2HG MET 94 2HG MET 94 13.231 -5.005 1.511 701 1HE MET 94 1HE MET 94 13.931 -8.503 2.122 702 2HE MET 94 2HE MET 94 12.645 -9.179 3.120 703 3HE MET 94 3HE MET 94 12.423 -9.052 1.376 704 H SER 95 H SER 95 14.552 -7.770 -1.362 705 HA SER 95 HA SER 95 14.340 -7.735 -4.347 706 1HB SER 95 1HB SER 95 16.415 -8.860 -4.513 707 2HB SER 95 2HB SER 95 16.698 -7.672 -3.247 708 HG SER 95 HG SER 95 17.374 -9.870 -2.759 709 HA PRO 96 HA PRO 96 12.191 -11.618 -3.887 710 1HB PRO 96 1HB PRO 96 13.000 -12.991 -6.103 711 2HB PRO 96 2HB PRO 96 11.936 -11.579 -6.167 712 1HG PRO 96 1HG PRO 96 14.734 -11.838 -7.008 713 2HG PRO 96 2HG PRO 96 13.534 -10.616 -7.451 714 1HD PRO 96 1HD PRO 96 15.671 -10.389 -5.527 715 2HD PRO 96 2HD PRO 96 14.480 -9.153 -5.990 716 H SER 97 H SER 97 15.447 -11.593 -3.234 717 HA SER 97 HA SER 97 15.498 -14.540 -2.734 718 1HB SER 97 1HB SER 97 17.830 -12.689 -3.306 719 2HB SER 97 2HB SER 97 17.959 -14.407 -2.938 720 HG SER 97 HG SER 97 17.913 -14.303 -5.119 721 H GLU 98 H GLU 98 16.435 -11.334 -1.514 722 HA GLU 98 HA GLU 98 17.433 -12.348 1.004 723 1HB GLU 98 1HB GLU 98 17.571 -10.019 1.656 724 2HB GLU 98 2HB GLU 98 18.098 -10.156 -0.014 725 1HG GLU 98 1HG GLU 98 15.508 -9.688 -0.481 726 2HG GLU 98 2HG GLU 98 15.623 -8.903 1.095 727 H SER 99 H SER 99 14.260 -11.776 -0.220 728 HA SER 99 HA SER 99 12.840 -11.056 2.117 729 1HB SER 99 1HB SER 99 11.692 -11.022 0.018 730 2HB SER 99 2HB SER 99 12.048 -12.721 -0.277 731 HG SER 99 HG SER 99 10.387 -11.622 1.749 732 H ARG 100 H ARG 100 14.384 -14.067 1.312 733 HA ARG 100 HA ARG 100 12.757 -15.740 3.021 734 1HB ARG 100 1HB ARG 100 15.551 -16.095 1.898 735 2HB ARG 100 2HB ARG 100 14.700 -17.340 2.815 736 1HG ARG 100 1HG ARG 100 12.855 -17.283 1.166 737 2HG ARG 100 2HG ARG 100 13.732 -16.064 0.239 738 1HD ARG 100 1HD ARG 100 15.492 -17.585 -0.288 739 2HD ARG 100 2HD ARG 100 14.938 -18.751 0.913 740 HE ARG 100 HE ARG 100 12.915 -18.236 -1.098 741 1HH1 ARG 100 1HH1 ARG 100 15.842 -20.026 -0.418 742 2HH1 ARG 100 2HH1 ARG 100 15.460 -21.275 -1.552 743 1HH2 ARG 100 1HH2 ARG 100 12.462 -19.873 -2.554 744 2HH2 ARG 100 2HH2 ARG 100 13.569 -21.191 -2.749 745 H SER 101 H SER 101 16.245 -15.428 3.639 746 HA SER 101 HA SER 101 15.883 -14.030 6.162 747 1HB SER 101 1HB SER 101 15.098 -16.279 6.816 748 2HB SER 101 2HB SER 101 16.589 -16.984 6.196 749 HG SER 101 HG SER 101 16.639 -16.588 8.471 750 H GLY 102 H GLY 102 17.453 -13.662 3.808 751 1HA GLY 102 1HA GLY 102 20.207 -14.300 4.770 752 2HA GLY 102 2HA GLY 102 19.790 -13.978 3.088 753 H SER 103 H SER 103 17.975 -11.695 4.172 754 HA SER 103 HA SER 103 19.689 -9.769 5.418 755 1HB SER 103 1HB SER 103 19.985 -10.129 2.525 756 2HB SER 103 2HB SER 103 19.593 -8.471 2.968 757 HG SER 103 HG SER 103 21.666 -10.066 4.083 758 H ASN 104 H ASN 104 18.215 -8.512 6.368 759 HA ASN 104 HA ASN 104 16.155 -7.521 6.882 760 1HB ASN 104 1HB ASN 104 15.499 -5.823 5.078 761 2HB ASN 104 2HB ASN 104 17.116 -5.670 5.759 762 1HD2 ASN 104 2HD2 ASN 104 15.376 -7.053 2.927 763 2HD2 ASN 104 1HD2 ASN 104 16.695 -6.934 1.864 764 HA PRO 105 HA PRO 105 13.539 -10.464 4.389 765 1HB PRO 105 1HB PRO 105 12.684 -11.966 6.502 766 2HB PRO 105 2HB PRO 105 14.166 -12.310 5.600 767 1HG PRO 105 1HG PRO 105 13.835 -11.131 8.296 768 2HG PRO 105 2HG PRO 105 15.160 -12.105 7.644 769 1HD PRO 105 1HD PRO 105 15.180 -9.314 7.974 770 2HD PRO 105 2HD PRO 105 16.325 -10.254 6.993 771 H ASN 106 H ASN 106 13.010 -8.747 7.431 772 HA ASN 106 HA ASN 106 10.334 -7.966 6.447 773 1HB ASN 106 1HB ASN 106 10.867 -9.351 9.080 774 2HB ASN 106 2HB ASN 106 9.396 -8.444 8.751 775 1HD2 ASN 106 2HD2 ASN 106 8.883 -9.174 6.060 776 2HD2 ASN 106 1HD2 ASN 106 8.597 -10.841 5.977 777 H ARG 107 H ARG 107 10.542 -5.816 6.407 778 HA ARG 107 HA ARG 107 11.073 -4.371 8.906 779 1HB ARG 107 1HB ARG 107 12.808 -2.907 7.836 780 2HB ARG 107 2HB ARG 107 13.339 -4.573 8.038 781 1HG ARG 107 1HG ARG 107 12.696 -5.041 5.685 782 2HG ARG 107 2HG ARG 107 12.268 -3.344 5.490 783 1HD ARG 107 1HD ARG 107 15.021 -4.322 6.305 784 2HD ARG 107 2HD ARG 107 14.571 -3.879 4.665 785 HE ARG 107 HE ARG 107 14.528 -1.588 5.306 786 1HH1 ARG 107 1HH1 ARG 107 15.069 -3.663 8.078 787 2HH1 ARG 107 2HH1 ARG 107 15.504 -2.342 9.097 788 1HH2 ARG 107 1HH2 ARG 107 15.113 0.076 6.665 789 2HH2 ARG 107 2HH2 ARG 107 15.534 -0.253 8.312 790 H VAL 108 H VAL 108 11.244 -1.753 7.619 791 HA VAL 108 HA VAL 108 8.714 -1.764 6.048 792 HB VAL 108 HB VAL 108 7.849 0.106 7.292 793 1HG1 VAL 108 1HG1 VAL 108 7.579 -2.243 8.178 794 2HG1 VAL 108 2HG1 VAL 108 8.938 -1.925 9.256 795 3HG1 VAL 108 3HG1 VAL 108 7.453 -0.985 9.407 796 1HG2 VAL 108 1HG2 VAL 108 10.494 -0.036 8.746 797 2HG2 VAL 108 2HG2 VAL 108 9.855 1.319 7.813 798 3HG2 VAL 108 3HG2 VAL 108 9.102 0.869 9.343 799 H ARG 109 H ARG 109 8.324 0.501 5.038 800 HA ARG 109 HA ARG 109 10.818 1.916 4.346 801 1HB ARG 109 1HB ARG 109 10.589 0.156 2.629 802 2HB ARG 109 2HB ARG 109 8.949 0.685 2.291 803 1HG ARG 109 1HG ARG 109 10.455 1.607 0.607 804 2HG ARG 109 2HG ARG 109 9.836 2.910 1.610 805 1HD ARG 109 1HD ARG 109 11.971 2.662 3.001 806 2HD ARG 109 2HD ARG 109 12.577 1.647 1.701 807 HE ARG 109 HE ARG 109 12.322 4.533 1.627 808 1HH1 ARG 109 1HH1 ARG 109 12.232 1.624 -0.311 809 2HH1 ARG 109 2HH1 ARG 109 12.676 2.455 -1.760 810 1HH2 ARG 109 1HH2 ARG 109 12.891 5.570 -0.272 811 2HH2 ARG 109 2HH2 ARG 109 13.046 4.665 -1.741 812 H MET 110 H MET 110 10.408 4.070 3.704 813 HA MET 110 HA MET 110 7.551 4.945 3.852 814 1HB MET 110 1HB MET 110 9.951 6.439 4.950 815 2HB MET 110 2HB MET 110 8.261 6.929 5.078 816 1HG MET 110 1HG MET 110 7.811 5.434 6.746 817 2HG MET 110 2HG MET 110 8.869 4.201 6.070 818 1HE MET 110 1HE MET 110 8.464 7.425 7.970 819 2HE MET 110 2HE MET 110 10.051 7.824 8.625 820 3HE MET 110 3HE MET 110 9.747 8.002 6.898 821 H PHE 111 H PHE 111 7.096 6.952 2.699 822 HA PHE 111 HA PHE 111 9.085 7.606 0.564 823 1HB PHE 111 1HB PHE 111 6.089 7.682 0.157 824 2HB PHE 111 2HB PHE 111 7.350 7.781 -1.066 825 HD1 PHE 111 HD1 PHE 111 5.964 5.494 1.551 826 HD2 PHE 111 HD2 PHE 111 8.075 5.836 -2.174 827 HE1 PHE 111 HE1 PHE 111 5.879 3.044 1.275 828 HE2 PHE 111 HE2 PHE 111 7.991 3.372 -2.445 829 HZ PHE 111 HZ PHE 111 6.891 1.970 -0.717 830 H GLY 112 H GLY 112 8.689 9.846 -0.314 831 1HA GLY 112 1HA GLY 112 7.316 11.648 1.600 832 2HA GLY 112 2HA GLY 112 8.982 11.949 1.173 833 HA PRO 113 HA PRO 113 6.585 14.358 -1.935 834 1HB PRO 113 1HB PRO 113 8.397 16.393 -2.048 835 2HB PRO 113 2HB PRO 113 7.111 16.298 -0.837 836 1HG PRO 113 1HG PRO 113 10.016 15.740 -0.555 837 2HG PRO 113 2HG PRO 113 8.873 16.403 0.623 838 1HD PRO 113 1HD PRO 113 9.769 13.761 0.597 839 2HD PRO 113 2HD PRO 113 8.293 14.318 1.396 840 H ASP 114 H ASP 114 10.066 13.714 -1.847 841 HA ASP 114 HA ASP 114 10.602 14.154 -4.620 842 1HB ASP 114 1HB ASP 114 11.988 12.788 -2.357 843 2HB ASP 114 2HB ASP 114 12.516 12.389 -3.993 844 H LYS 115 H LYS 115 9.244 11.454 -2.863 845 HA LYS 115 HA LYS 115 9.523 9.681 -5.207 846 1HB LYS 115 1HB LYS 115 8.695 9.316 -2.348 847 2HB LYS 115 2HB LYS 115 8.194 8.125 -3.548 848 1HG LYS 115 1HG LYS 115 10.238 7.230 -2.917 849 2HG LYS 115 2HG LYS 115 10.749 8.258 -4.256 850 1HD LYS 115 1HD LYS 115 11.088 10.104 -2.507 851 2HD LYS 115 2HD LYS 115 10.938 8.830 -1.296 852 1HE LYS 115 1HE LYS 115 13.265 8.965 -1.693 853 2HE LYS 115 2HE LYS 115 12.746 7.586 -2.661 854 1HZ LYS 115 1HZ LYS 115 13.104 10.358 -3.664 855 2HZ LYS 115 2HZ LYS 115 14.182 9.070 -3.919 856 3HZ LYS 115 3HZ LYS 115 12.623 9.022 -4.592 857 H LEU 116 H LEU 116 7.391 12.104 -4.430 858 HA LEU 116 HA LEU 116 5.163 10.615 -5.770 859 1HB LEU 116 1HB LEU 116 3.598 12.210 -4.554 860 2HB LEU 116 2HB LEU 116 4.343 10.951 -3.579 861 HG LEU 116 HG LEU 116 6.165 12.728 -3.076 862 1HD1 LEU 116 1HD1 LEU 116 4.472 14.248 -4.785 863 2HD1 LEU 116 2HD1 LEU 116 4.319 14.919 -3.167 864 3HD1 LEU 116 3HD1 LEU 116 5.904 14.791 -3.922 865 1HD2 LEU 116 1HD2 LEU 116 3.335 12.825 -2.023 866 2HD2 LEU 116 2HD2 LEU 116 4.704 11.942 -1.348 867 3HD2 LEU 116 3HD2 LEU 116 4.667 13.703 -1.272 868 H VAL 117 H VAL 117 4.136 11.595 -7.417 869 HA VAL 117 HA VAL 117 5.481 13.651 -8.881 870 HB VAL 117 HB VAL 117 3.912 12.035 -9.925 871 1HG1 VAL 117 1HG1 VAL 117 2.308 11.996 -8.033 872 2HG1 VAL 117 2HG1 VAL 117 1.774 13.604 -8.493 873 3HG1 VAL 117 3HG1 VAL 117 1.515 12.248 -9.586 874 1HG2 VAL 117 1HG2 VAL 117 4.327 14.463 -10.809 875 2HG2 VAL 117 2HG2 VAL 117 3.000 13.528 -11.500 876 3HG2 VAL 117 3HG2 VAL 117 2.670 14.757 -10.278 877 H ARG 118 H ARG 118 5.229 15.891 -8.859 878 HA ARG 118 HA ARG 118 3.864 17.059 -6.560 879 1HB ARG 118 1HB ARG 118 5.797 17.916 -8.571 880 2HB ARG 118 2HB ARG 118 4.558 19.143 -8.317 881 1HG ARG 118 1HG ARG 118 6.063 19.709 -6.643 882 2HG ARG 118 2HG ARG 118 4.999 18.610 -5.764 883 1HD ARG 118 1HD ARG 118 6.667 17.124 -5.444 884 2HD ARG 118 2HD ARG 118 7.114 17.155 -7.149 885 HE ARG 118 HE ARG 118 8.387 18.675 -5.014 886 1HH1 ARG 118 1HH1 ARG 118 7.673 18.578 -8.437 887 2HH1 ARG 118 2HH1 ARG 118 9.017 19.584 -8.848 888 1HH2 ARG 118 1HH2 ARG 118 10.115 19.974 -5.593 889 2HH2 ARG 118 2HH2 ARG 118 10.386 20.366 -7.258 890 H ALA 119 H ALA 119 3.324 16.942 -10.067 891 HA ALA 119 HA ALA 119 1.119 18.717 -10.196 892 1HB ALA 119 1HB ALA 119 2.310 17.825 -12.181 893 2HB ALA 119 2HB ALA 119 1.604 16.239 -11.872 894 3HB ALA 119 3HB ALA 119 0.566 17.598 -12.303 895 H ALA 120 H ALA 120 1.307 15.494 -8.893 896 HA ALA 120 HA ALA 120 -1.678 15.411 -8.755 897 1HB ALA 120 1HB ALA 120 -0.027 13.509 -9.811 898 2HB ALA 120 2HB ALA 120 -0.197 12.930 -8.155 899 3HB ALA 120 3HB ALA 120 -1.630 13.176 -9.153 900 H ALA 121 H ALA 121 1.286 14.622 -6.872 901 HA ALA 121 HA ALA 121 0.149 13.903 -4.436 902 1HB ALA 121 1HB ALA 121 2.590 15.599 -4.981 903 2HB ALA 121 2HB ALA 121 2.184 14.966 -3.387 904 3HB ALA 121 3HB ALA 121 2.527 13.858 -4.712 905 H GLU 122 H GLU 122 0.448 17.200 -5.738 906 HA GLU 122 HA GLU 122 -0.614 18.323 -3.224 907 1HB GLU 122 1HB GLU 122 -0.338 20.505 -4.284 908 2HB GLU 122 2HB GLU 122 1.126 19.554 -4.516 909 1HG GLU 122 1HG GLU 122 -0.077 18.831 -6.758 910 2HG GLU 122 2HG GLU 122 -0.968 20.329 -6.517 911 H LYS 123 H LYS 123 -2.111 16.638 -5.543 912 HA LYS 123 HA LYS 123 -4.456 18.438 -5.761 913 1HB LYS 123 1HB LYS 123 -3.960 15.752 -7.071 914 2HB LYS 123 2HB LYS 123 -5.285 16.856 -7.431 915 1HG LYS 123 1HG LYS 123 -3.367 18.574 -7.899 916 2HG LYS 123 2HG LYS 123 -2.360 17.137 -8.057 917 1HD LYS 123 1HD LYS 123 -3.394 16.455 -9.988 918 2HD LYS 123 2HD LYS 123 -4.963 17.091 -9.495 919 1HE LYS 123 1HE LYS 123 -2.680 18.942 -10.171 920 2HE LYS 123 2HE LYS 123 -3.733 18.297 -11.430 921 1HZ LYS 123 1HZ LYS 123 -5.614 19.112 -9.915 922 2HZ LYS 123 2HZ LYS 123 -4.420 20.069 -9.176 923 3HZ LYS 123 3HZ LYS 123 -4.759 20.263 -10.827 924 H ARG 124 H ARG 124 -6.345 17.946 -4.660 925 HA ARG 124 HA ARG 124 -6.162 16.176 -2.407 926 1HB ARG 124 1HB ARG 124 -8.459 17.691 -3.651 927 2HB ARG 124 2HB ARG 124 -8.671 16.666 -2.231 928 1HG ARG 124 1HG ARG 124 -7.455 18.060 -0.864 929 2HG ARG 124 2HG ARG 124 -6.405 18.601 -2.174 930 1HD ARG 124 1HD ARG 124 -7.769 20.482 -1.637 931 2HD ARG 124 2HD ARG 124 -8.448 19.814 -3.121 932 HE ARG 124 HE ARG 124 -10.394 19.254 -1.917 933 1HH1 ARG 124 1HH1 ARG 124 -7.761 19.905 0.289 934 2HH1 ARG 124 2HH1 ARG 124 -8.779 19.831 1.686 935 1HH2 ARG 124 1HH2 ARG 124 -11.674 19.164 -0.087 936 2HH2 ARG 124 2HH2 ARG 124 -10.972 19.415 1.477 937 H TRP 125 H TRP 125 -6.186 14.043 -2.562 938 HA TRP 125 HA TRP 125 -8.071 12.712 -4.488 939 1HB TRP 125 1HB TRP 125 -5.486 11.618 -3.316 940 2HB TRP 125 2HB TRP 125 -6.506 10.828 -4.512 941 HD1 TRP 125 HD1 TRP 125 -3.567 12.996 -4.225 942 HE1 TRP 125 HE1 TRP 125 -2.949 14.016 -6.511 943 HE3 TRP 125 HE3 TRP 125 -7.805 11.919 -6.856 944 HZ2 TRP 125 HZ2 TRP 125 -4.088 14.321 -9.110 945 HZ3 TRP 125 HZ3 TRP 125 -8.011 12.571 -9.232 946 HH2 TRP 125 HH2 TRP 125 -6.162 13.777 -10.364 947 H ASP 126 H ASP 126 -9.085 10.730 -3.585 948 HA ASP 126 HA ASP 126 -8.932 10.590 -0.610 949 1HB ASP 126 1HB ASP 126 -11.355 10.336 -0.435 950 2HB ASP 126 2HB ASP 126 -10.957 11.864 -1.213 951 H ARG 127 H ARG 127 -8.203 8.946 -3.244 952 HA ARG 127 HA ARG 127 -8.827 6.327 -2.005 953 1HB ARG 127 1HB ARG 127 -9.258 7.049 -4.923 954 2HB ARG 127 2HB ARG 127 -9.283 5.405 -4.294 955 1HG ARG 127 1HG ARG 127 -11.029 6.869 -2.624 956 2HG ARG 127 2HG ARG 127 -11.392 7.402 -4.265 957 1HD ARG 127 1HD ARG 127 -11.247 4.782 -4.751 958 2HD ARG 127 2HD ARG 127 -11.674 4.696 -3.048 959 HE ARG 127 HE ARG 127 -13.537 6.423 -3.950 960 1HH1 ARG 127 1HH1 ARG 127 -12.437 3.356 -5.227 961 2HH1 ARG 127 2HH1 ARG 127 -13.954 3.016 -5.978 962 1HH2 ARG 127 1HH2 ARG 127 -15.488 5.925 -4.925 963 2HH2 ARG 127 2HH2 ARG 127 -15.660 4.447 -5.809 964 H VAL 128 H VAL 128 -7.130 4.815 -2.412 965 HA VAL 128 HA VAL 128 -4.879 5.786 -4.076 966 HB VAL 128 HB VAL 128 -4.613 6.471 -1.641 967 1HG1 VAL 128 1HG1 VAL 128 -5.289 3.816 -1.139 968 2HG1 VAL 128 2HG1 VAL 128 -3.552 3.874 -0.839 969 3HG1 VAL 128 3HG1 VAL 128 -4.636 4.962 0.028 970 1HG2 VAL 128 1HG2 VAL 128 -2.623 4.808 -3.155 971 2HG2 VAL 128 2HG2 VAL 128 -2.674 6.558 -2.942 972 3HG2 VAL 128 3HG2 VAL 128 -2.203 5.521 -1.597 973 H LYS 129 H LYS 129 -3.696 4.147 -5.040 974 HA LYS 129 HA LYS 129 -4.745 1.384 -4.587 975 1HB LYS 129 1HB LYS 129 -5.201 2.345 -6.833 976 2HB LYS 129 2HB LYS 129 -3.469 2.541 -7.073 977 1HG LYS 129 1HG LYS 129 -3.621 -0.098 -6.325 978 2HG LYS 129 2HG LYS 129 -5.119 0.105 -7.233 979 1HD LYS 129 1HD LYS 129 -3.549 1.338 -8.960 980 2HD LYS 129 2HD LYS 129 -2.286 0.396 -8.169 981 1HE LYS 129 1HE LYS 129 -3.278 -1.663 -8.769 982 2HE LYS 129 2HE LYS 129 -4.831 -0.908 -9.126 983 1HZ LYS 129 1HZ LYS 129 -3.674 0.304 -10.953 984 2HZ LYS 129 2HZ LYS 129 -2.314 -0.677 -10.677 985 3HZ LYS 129 3HZ LYS 129 -3.775 -1.377 -11.180 986 H ILE 130 H ILE 130 -3.318 0.363 -3.278 987 HA ILE 130 HA ILE 130 -0.399 0.812 -3.657 988 HB ILE 130 HB ILE 130 -1.952 -0.645 -1.482 989 1HG1 ILE 130 1HG1 ILE 130 -2.249 1.815 -1.479 990 2HG1 ILE 130 2HG1 ILE 130 -1.314 1.285 -0.082 991 1HG2 ILE 130 1HG2 ILE 130 0.745 -0.973 -2.208 992 2HG2 ILE 130 2HG2 ILE 130 0.784 0.120 -0.824 993 3HG2 ILE 130 3HG2 ILE 130 0.000 -1.452 -0.684 994 1HD1 ILE 130 1HD1 ILE 130 0.784 1.832 -1.353 995 2HD1 ILE 130 2HD1 ILE 130 -0.222 2.507 -2.634 996 3HD1 ILE 130 3HD1 ILE 130 -0.226 3.241 -1.033 997 H VAL 131 H VAL 131 0.701 -0.671 -4.897 998 HA VAL 131 HA VAL 131 -0.454 -3.400 -5.104 999 HB VAL 131 HB VAL 131 1.010 -1.854 -7.255 1000 1HG1 VAL 131 1HG1 VAL 131 -0.450 -4.503 -7.250 1001 2HG1 VAL 131 2HG1 VAL 131 0.224 -3.717 -8.678 1002 3HG1 VAL 131 3HG1 VAL 131 1.294 -4.279 -7.393 1003 1HG2 VAL 131 1HG2 VAL 131 -1.900 -2.293 -6.625 1004 2HG2 VAL 131 2HG2 VAL 131 -1.088 -0.808 -7.121 1005 3HG2 VAL 131 3HG2 VAL 131 -1.381 -2.088 -8.299 1006 H CYS 132 H CYS 132 0.855 -4.783 -4.095 1007 HA CYS 132 HA CYS 132 3.760 -4.226 -3.884 1008 1HB CYS 132 1HB CYS 132 1.801 -5.612 -2.280 1009 2HB CYS 132 2HB CYS 132 3.065 -6.756 -2.726 1010 HG CYS 132 HG CYS 132 3.616 -4.080 -1.198 1011 H SER 133 H SER 133 5.293 -5.448 -5.047 1012 HA SER 133 HA SER 133 4.283 -7.728 -6.679 1013 1HB SER 133 1HB SER 133 4.787 -5.100 -7.657 1014 2HB SER 133 2HB SER 133 6.051 -6.141 -8.298 1015 HG SER 133 HG SER 133 4.126 -6.099 -9.584 1016 H GLN 134 H GLN 134 5.700 -9.366 -6.803 1017 HA GLN 134 HA GLN 134 8.341 -9.566 -7.300 1018 1HB GLN 134 1HB GLN 134 8.940 -8.076 -5.407 1019 2HB GLN 134 2HB GLN 134 8.120 -9.159 -4.289 1020 1HG GLN 134 1HG GLN 134 10.242 -9.998 -4.048 1021 2HG GLN 134 2HG GLN 134 9.808 -10.917 -5.485 1022 1HE2 GLN 134 2HE2 GLN 134 10.261 -9.536 -7.646 1023 2HE2 GLN 134 1HE2 GLN 134 11.751 -8.729 -7.671 1024 HA PRO 135 HA PRO 135 6.843 -13.726 -6.401 1025 1HB PRO 135 1HB PRO 135 8.814 -15.068 -7.720 1026 2HB PRO 135 2HB PRO 135 7.486 -14.245 -8.550 1027 1HG PRO 135 1HG PRO 135 10.327 -13.512 -8.394 1028 2HG PRO 135 2HG PRO 135 9.102 -13.029 -9.573 1029 1HD PRO 135 1HD PRO 135 10.097 -11.501 -7.357 1030 2HD PRO 135 2HD PRO 135 8.824 -11.042 -8.511 1031 H TYR 136 H TYR 136 7.256 -13.862 -4.111 1032 HA TYR 136 HA TYR 136 9.953 -14.936 -3.426 1033 1HB TYR 136 1HB TYR 136 9.533 -13.820 -1.123 1034 2HB TYR 136 2HB TYR 136 10.048 -12.800 -2.463 1035 HD1 TYR 136 HD1 TYR 136 7.181 -13.793 -0.343 1036 HD2 TYR 136 HD2 TYR 136 8.546 -11.201 -3.484 1037 HE1 TYR 136 HE1 TYR 136 5.132 -12.415 -0.099 1038 HE2 TYR 136 HE2 TYR 136 6.496 -9.824 -3.241 1039 HH TYR 136 HH TYR 136 4.054 -10.311 -2.342 1040 H SER 137 H SER 137 6.618 -15.561 -3.343 1041 HA SER 137 HA SER 137 7.085 -17.604 -1.206 1042 1HB SER 137 1HB SER 137 5.121 -15.574 -1.297 1043 2HB SER 137 2HB SER 137 4.274 -17.085 -1.599 1044 HG SER 137 HG SER 137 5.707 -16.224 0.637 1045 H LYS 138 H LYS 138 5.065 -19.277 -1.494 1046 HA LYS 138 HA LYS 138 4.493 -19.951 -4.279 1047 1HB LYS 138 1HB LYS 138 6.934 -20.775 -3.532 1048 2HB LYS 138 2HB LYS 138 5.991 -22.103 -2.857 1049 1HG LYS 138 1HG LYS 138 5.189 -22.775 -4.947 1050 2HG LYS 138 2HG LYS 138 5.468 -21.191 -5.671 1051 1HD LYS 138 1HD LYS 138 7.827 -21.534 -5.760 1052 2HD LYS 138 2HD LYS 138 7.734 -22.940 -4.700 1053 1HE LYS 138 1HE LYS 138 6.164 -23.897 -6.582 1054 2HE LYS 138 2HE LYS 138 6.971 -22.700 -7.593 1055 1HZ LYS 138 1HZ LYS 138 9.111 -23.652 -6.689 1056 2HZ LYS 138 2HZ LYS 138 8.183 -24.950 -6.104 1057 3HZ LYS 138 3HZ LYS 138 8.247 -24.638 -7.770 1058 H ASP 139 H ASP 139 4.635 -21.108 -0.912 1059 HA ASP 139 HA ASP 139 2.007 -22.430 -1.348 1060 1HB ASP 139 1HB ASP 139 2.644 -23.793 0.672 1061 2HB ASP 139 2HB ASP 139 3.660 -24.071 -0.737 1062 H SER 140 H SER 140 3.829 -20.249 0.661 1063 HA SER 140 HA SER 140 1.468 -19.804 2.391 1064 1HB SER 140 1HB SER 140 3.360 -18.321 3.550 1065 2HB SER 140 2HB SER 140 3.222 -20.046 3.853 1066 HG SER 140 HG SER 140 5.245 -18.702 2.777 1067 HA PRO 141 HA PRO 141 0.950 -15.854 0.290 1068 1HB PRO 141 1HB PRO 141 -1.084 -14.919 1.834 1069 2HB PRO 141 2HB PRO 141 -1.292 -16.194 0.628 1070 1HG PRO 141 1HG PRO 141 -1.360 -16.381 3.547 1071 2HG PRO 141 2HG PRO 141 -1.981 -17.504 2.330 1072 1HD PRO 141 1HD PRO 141 0.471 -17.704 3.844 1073 2HD PRO 141 2HD PRO 141 -0.185 -18.845 2.650 1074 H PHE 142 H PHE 142 1.292 -13.542 0.727 1075 HA PHE 142 HA PHE 142 1.937 -12.645 3.430 1076 1HB PHE 142 1HB PHE 142 4.045 -13.536 1.561 1077 2HB PHE 142 2HB PHE 142 4.323 -11.944 2.258 1078 HD1 PHE 142 HD1 PHE 142 4.181 -11.687 4.801 1079 HD2 PHE 142 HD2 PHE 142 4.385 -15.498 2.833 1080 HE1 PHE 142 HE1 PHE 142 4.897 -12.746 6.926 1081 HE2 PHE 142 HE2 PHE 142 5.101 -16.558 4.958 1082 HZ PHE 142 HZ PHE 142 5.357 -15.181 7.005 1083 H GLY 143 H GLY 143 3.364 -10.365 2.867 1084 1HA GLY 143 1HA GLY 143 2.773 -8.846 0.595 1085 2HA GLY 143 2HA GLY 143 1.375 -8.659 1.654 1086 H LEU 144 H LEU 144 1.533 -7.306 3.404 1087 HA LEU 144 HA LEU 144 4.220 -6.439 4.288 1088 1HB LEU 144 1HB LEU 144 3.168 -3.991 4.416 1089 2HB LEU 144 2HB LEU 144 4.086 -4.539 3.026 1090 HG LEU 144 HG LEU 144 2.001 -3.321 2.476 1091 1HD1 LEU 144 1HD1 LEU 144 3.085 -5.379 1.166 1092 2HD1 LEU 144 2HD1 LEU 144 1.509 -6.092 1.501 1093 3HD1 LEU 144 3HD1 LEU 144 1.618 -4.582 0.599 1094 1HD2 LEU 144 1HD2 LEU 144 0.760 -5.616 3.958 1095 2HD2 LEU 144 2HD2 LEU 144 0.485 -3.895 4.169 1096 3HD2 LEU 144 3HD2 LEU 144 -0.141 -4.721 2.745 1097 H SER 145 H SER 145 4.118 -5.148 6.322 1098 HA SER 145 HA SER 145 2.183 -6.455 8.099 1099 1HB SER 145 1HB SER 145 4.526 -4.613 8.589 1100 2HB SER 145 2HB SER 145 3.492 -5.213 9.883 1101 HG SER 145 HG SER 145 5.168 -6.646 8.113 1102 H PHE 146 H PHE 146 2.385 -3.379 6.492 1103 HA PHE 146 HA PHE 146 -0.168 -2.537 7.475 1104 1HB PHE 146 1HB PHE 146 0.503 -0.679 8.962 1105 2HB PHE 146 2HB PHE 146 1.080 -2.211 9.614 1106 HD1 PHE 146 HD1 PHE 146 3.464 -2.882 9.306 1107 HD2 PHE 146 HD2 PHE 146 2.016 0.995 8.175 1108 HE1 PHE 146 HE1 PHE 146 5.791 -2.078 9.090 1109 HE2 PHE 146 HE2 PHE 146 4.339 1.820 7.980 1110 HZ PHE 146 HZ PHE 146 6.249 0.269 8.424 1111 H VAL 147 H VAL 147 -0.658 -0.282 6.822 1112 HA VAL 147 HA VAL 147 1.241 0.899 4.883 1113 HB VAL 147 HB VAL 147 -0.511 1.191 3.197 1114 1HG1 VAL 147 1HG1 VAL 147 0.911 -0.919 3.328 1115 2HG1 VAL 147 2HG1 VAL 147 -0.490 -1.710 4.052 1116 3HG1 VAL 147 3HG1 VAL 147 -0.589 -1.066 2.413 1117 1HG2 VAL 147 1HG2 VAL 147 -2.202 0.171 5.407 1118 2HG2 VAL 147 2HG2 VAL 147 -2.627 1.243 4.074 1119 3HG2 VAL 147 3HG2 VAL 147 -2.577 -0.502 3.821 1120 H ARG 148 H ARG 148 0.932 3.188 4.663 1121 HA ARG 148 HA ARG 148 -1.172 4.492 6.270 1122 1HB ARG 148 1HB ARG 148 1.779 4.842 6.878 1123 2HB ARG 148 2HB ARG 148 0.466 5.721 7.649 1124 1HG ARG 148 1HG ARG 148 -0.461 3.459 8.357 1125 2HG ARG 148 2HG ARG 148 1.073 2.769 7.831 1126 1HD ARG 148 1HD ARG 148 1.907 3.281 9.860 1127 2HD ARG 148 2HD ARG 148 1.771 4.984 9.424 1128 HE ARG 148 HE ARG 148 -0.782 4.146 10.308 1129 1HH1 ARG 148 1HH1 ARG 148 2.450 4.532 11.586 1130 2HH1 ARG 148 2HH1 ARG 148 1.887 4.846 13.190 1131 1HH2 ARG 148 1HH2 ARG 148 -1.467 4.558 12.398 1132 2HH2 ARG 148 2HH2 ARG 148 -0.306 4.862 13.647 1133 H PHE 149 H PHE 149 -1.057 6.875 6.034 1134 HA PHE 149 HA PHE 149 0.555 7.895 3.763 1135 1HB PHE 149 1HB PHE 149 -2.472 8.117 3.931 1136 2HB PHE 149 2HB PHE 149 -1.460 8.947 2.751 1137 HD1 PHE 149 HD1 PHE 149 0.349 7.210 1.612 1138 HD2 PHE 149 HD2 PHE 149 -3.546 6.225 3.136 1139 HE1 PHE 149 HE1 PHE 149 0.276 5.202 0.149 1140 HE2 PHE 149 HE2 PHE 149 -3.618 4.232 1.664 1141 HZ PHE 149 HZ PHE 149 -1.710 3.719 0.178 1142 H HIS 150 H HIS 150 0.764 10.248 3.866 1143 HA HIS 150 HA HIS 150 -0.603 11.637 6.067 1144 1HB HIS 150 1HB HIS 150 2.008 12.490 6.555 1145 2HB HIS 150 2HB HIS 150 1.053 11.436 7.584 1146 HD1 HIS 150 HD1 HIS 150 4.208 11.565 5.931 1147 HD2 HIS 150 HD2 HIS 150 1.470 8.525 6.706 1148 HE1 HIS 150 HE1 HIS 150 5.468 9.384 5.671 1149 H SER 151 H SER 151 -0.883 13.764 5.614 1150 HA SER 151 HA SER 151 0.655 14.927 3.329 1151 1HB SER 151 1HB SER 151 -1.389 15.851 2.424 1152 2HB SER 151 2HB SER 151 -1.615 14.123 2.654 1153 HG SER 151 HG SER 151 -3.022 16.120 3.680 Start of MODEL 9 1 H MET 1 H MET 1 -4.579 19.868 11.105 2 HA MET 1 HA MET 1 -4.184 19.209 8.889 3 1HB MET 1 1HB MET 1 -1.808 21.050 9.172 4 2HB MET 1 2HB MET 1 -1.856 19.805 7.924 5 1HG MET 1 1HG MET 1 -4.139 20.759 7.266 6 2HG MET 1 2HG MET 1 -3.746 22.135 8.296 7 1HE MET 1 1HE MET 1 -4.367 21.524 5.196 8 2HE MET 1 2HE MET 1 -4.234 23.252 5.514 9 3HE MET 1 3HE MET 1 -3.295 22.514 4.209 10 HA PRO 2 HA PRO 2 -1.735 16.288 11.478 11 1HB PRO 2 1HB PRO 2 -3.634 14.329 11.545 12 2HB PRO 2 2HB PRO 2 -3.604 15.688 12.678 13 1HG PRO 2 1HG PRO 2 -5.472 15.140 10.485 14 2HG PRO 2 2HG PRO 2 -5.658 16.210 11.881 15 1HD PRO 2 1HD PRO 2 -4.986 16.935 9.170 16 2HD PRO 2 2HD PRO 2 -5.196 18.008 10.571 17 H GLU 3 H GLU 3 -1.892 13.597 10.910 18 HA GLU 3 HA GLU 3 -0.727 13.444 8.229 19 1HB GLU 3 1HB GLU 3 -1.357 11.182 10.152 20 2HB GLU 3 2HB GLU 3 -0.216 11.147 8.808 21 1HG GLU 3 1HG GLU 3 1.137 12.895 9.919 22 2HG GLU 3 2HG GLU 3 0.010 12.897 11.275 23 H ILE 4 H ILE 4 -1.636 10.864 7.463 24 HA ILE 4 HA ILE 4 -4.534 11.351 6.942 25 HB ILE 4 HB ILE 4 -2.325 10.573 5.021 26 1HG1 ILE 4 1HG1 ILE 4 -4.499 12.640 4.705 27 2HG1 ILE 4 2HG1 ILE 4 -3.011 12.997 5.582 28 1HG2 ILE 4 1HG2 ILE 4 -5.320 10.404 4.552 29 2HG2 ILE 4 2HG2 ILE 4 -4.080 10.218 3.312 30 3HG2 ILE 4 3HG2 ILE 4 -4.208 9.036 4.614 31 1HD1 ILE 4 1HD1 ILE 4 -3.007 11.854 2.786 32 2HD1 ILE 4 2HD1 ILE 4 -3.017 13.590 3.099 33 3HD1 ILE 4 3HD1 ILE 4 -1.666 12.601 3.654 34 H ARG 5 H ARG 5 -5.775 9.656 7.504 35 HA ARG 5 HA ARG 5 -4.430 7.033 8.010 36 1HB ARG 5 1HB ARG 5 -6.814 8.368 9.307 37 2HB ARG 5 2HB ARG 5 -6.467 6.652 9.519 38 1HG ARG 5 1HG ARG 5 -4.710 7.050 10.905 39 2HG ARG 5 2HG ARG 5 -4.133 8.409 9.939 40 1HD ARG 5 1HD ARG 5 -6.688 8.830 11.398 41 2HD ARG 5 2HD ARG 5 -5.232 8.718 12.388 42 HE ARG 5 HE ARG 5 -4.601 10.481 10.298 43 1HH1 ARG 5 1HH1 ARG 5 -6.922 10.319 12.908 44 2HH1 ARG 5 2HH1 ARG 5 -7.019 12.039 13.063 45 1HH2 ARG 5 1HH2 ARG 5 -4.757 12.698 10.531 46 2HH2 ARG 5 2HH2 ARG 5 -5.805 13.374 11.733 47 H LEU 6 H LEU 6 -6.042 5.148 7.813 48 HA LEU 6 HA LEU 6 -7.492 5.454 5.234 49 1HB LEU 6 1HB LEU 6 -5.902 3.352 6.506 50 2HB LEU 6 2HB LEU 6 -7.438 2.744 5.899 51 HG LEU 6 HG LEU 6 -6.957 3.667 3.676 52 1HD1 LEU 6 1HD1 LEU 6 -5.532 5.589 4.632 53 2HD1 LEU 6 2HD1 LEU 6 -4.214 4.421 4.711 54 3HD1 LEU 6 3HD1 LEU 6 -4.939 4.829 3.158 55 1HD2 LEU 6 1HD2 LEU 6 -4.719 2.030 4.898 56 2HD2 LEU 6 2HD2 LEU 6 -6.180 1.413 4.127 57 3HD2 LEU 6 3HD2 LEU 6 -4.956 2.240 3.163 58 H ARG 7 H ARG 7 -9.567 4.253 5.043 59 HA ARG 7 HA ARG 7 -11.062 4.217 7.636 60 1HB ARG 7 1HB ARG 7 -11.674 6.036 5.926 61 2HB ARG 7 2HB ARG 7 -12.295 4.725 4.922 62 1HG ARG 7 1HG ARG 7 -14.063 4.298 6.329 63 2HG ARG 7 2HG ARG 7 -13.165 4.769 7.772 64 1HD ARG 7 1HD ARG 7 -13.275 7.166 6.879 65 2HD ARG 7 2HD ARG 7 -14.469 6.573 5.725 66 HE ARG 7 HE ARG 7 -15.213 5.762 8.371 67 1HH1 ARG 7 1HH1 ARG 7 -15.040 8.590 6.322 68 2HH1 ARG 7 2HH1 ARG 7 -16.328 9.393 7.151 69 1HH2 ARG 7 1HH2 ARG 7 -16.875 6.836 9.414 70 2HH2 ARG 7 2HH2 ARG 7 -17.358 8.413 8.882 71 H HIS 8 H HIS 8 -10.922 2.854 4.368 72 HA HIS 8 HA HIS 8 -11.319 0.159 5.396 73 1HB HIS 8 1HB HIS 8 -13.396 -0.288 4.115 74 2HB HIS 8 2HB HIS 8 -13.652 0.919 5.370 75 HD1 HIS 8 HD1 HIS 8 -15.033 2.804 4.536 76 HD2 HIS 8 HD2 HIS 8 -12.585 1.272 1.529 77 HE1 HIS 8 HE1 HIS 8 -15.499 4.180 2.463 78 H VAL 9 H VAL 9 -11.963 -1.159 3.055 79 HA VAL 9 HA VAL 9 -9.680 -0.386 1.311 80 HB VAL 9 HB VAL 9 -9.540 -2.631 2.308 81 1HG1 VAL 9 1HG1 VAL 9 -12.306 -2.698 1.850 82 2HG1 VAL 9 2HG1 VAL 9 -11.641 -3.892 0.739 83 3HG1 VAL 9 3HG1 VAL 9 -11.310 -4.013 2.465 84 1HG2 VAL 9 1HG2 VAL 9 -10.085 -2.595 -0.676 85 2HG2 VAL 9 2HG2 VAL 9 -8.531 -2.334 0.116 86 3HG2 VAL 9 3HG2 VAL 9 -9.294 -3.924 0.172 87 H VAL 10 H VAL 10 -10.636 1.068 -0.126 88 HA VAL 10 HA VAL 10 -13.228 0.859 -1.244 89 HB VAL 10 HB VAL 10 -12.168 2.949 -1.536 90 1HG1 VAL 10 1HG1 VAL 10 -9.791 1.479 -1.802 91 2HG1 VAL 10 2HG1 VAL 10 -9.974 2.333 -3.329 92 3HG1 VAL 10 3HG1 VAL 10 -9.961 3.227 -1.810 93 1HG2 VAL 10 1HG2 VAL 10 -13.231 1.655 -3.716 94 2HG2 VAL 10 2HG2 VAL 10 -12.796 3.363 -3.687 95 3HG2 VAL 10 3HG2 VAL 10 -11.668 2.176 -4.344 96 H SER 11 H SER 11 -10.165 -0.069 -2.927 97 HA SER 11 HA SER 11 -11.819 -2.092 -4.368 98 1HB SER 11 1HB SER 11 -10.168 0.013 -5.443 99 2HB SER 11 2HB SER 11 -9.513 -1.549 -5.925 100 HG SER 11 HG SER 11 -11.405 -2.048 -6.893 101 H CYS 12 H CYS 12 -10.464 -4.051 -5.045 102 HA CYS 12 HA CYS 12 -7.942 -4.419 -3.577 103 1HB CYS 12 1HB CYS 12 -8.834 -6.352 -2.281 104 2HB CYS 12 2HB CYS 12 -9.526 -4.815 -1.787 105 HG CYS 12 HG CYS 12 -11.382 -6.763 -2.216 106 H SER 13 H SER 13 -6.738 -6.147 -4.336 107 HA SER 13 HA SER 13 -7.969 -8.136 -6.127 108 1HB SER 13 1HB SER 13 -6.946 -5.828 -7.263 109 2HB SER 13 2HB SER 13 -5.594 -6.946 -7.383 110 HG SER 13 HG SER 13 -7.997 -6.928 -8.688 111 H SER 14 H SER 14 -6.988 -8.757 -3.734 112 HA SER 14 HA SER 14 -5.295 -10.859 -3.833 113 1HB SER 14 1HB SER 14 -3.066 -9.677 -3.022 114 2HB SER 14 2HB SER 14 -3.383 -9.938 -4.732 115 HG SER 14 HG SER 14 -4.339 -7.585 -3.527 116 H GLN 15 H GLN 15 -7.132 -10.563 -2.083 117 HA GLN 15 HA GLN 15 -5.763 -9.798 0.466 118 1HB GLN 15 1HB GLN 15 -8.714 -9.685 0.546 119 2HB GLN 15 2HB GLN 15 -7.542 -8.567 1.200 120 1HG GLN 15 1HG GLN 15 -8.390 -8.732 -1.703 121 2HG GLN 15 2HG GLN 15 -8.923 -7.512 -0.549 122 1HE2 GLN 15 2HE2 GLN 15 -6.167 -7.331 0.702 123 2HE2 GLN 15 1HE2 GLN 15 -5.240 -6.466 -0.423 124 H ASP 16 H ASP 16 -6.209 -11.095 2.268 125 HA ASP 16 HA ASP 16 -7.265 -13.796 1.602 126 1HB ASP 16 1HB ASP 16 -4.967 -13.074 2.833 127 2HB ASP 16 2HB ASP 16 -6.022 -13.242 4.230 128 H SER 17 H SER 17 -7.986 -14.652 4.148 129 HA SER 17 HA SER 17 -10.419 -13.010 4.617 130 1HB SER 17 1HB SER 17 -10.104 -15.728 5.810 131 2HB SER 17 2HB SER 17 -11.546 -14.947 5.167 132 HG SER 17 HG SER 17 -10.626 -16.675 3.852 133 H THR 18 H THR 18 -8.389 -15.156 6.652 134 HA THR 18 HA THR 18 -8.987 -13.779 9.085 135 HB THR 18 HB THR 18 -6.555 -14.909 9.594 136 HG1 THR 18 HG1 THR 18 -6.168 -15.647 7.568 137 1HG2 THR 18 1HG2 THR 18 -8.889 -15.367 10.556 138 2HG2 THR 18 2HG2 THR 18 -9.042 -16.590 9.296 139 3HG2 THR 18 3HG2 THR 18 -7.771 -16.729 10.510 140 H HIS 19 H HIS 19 -6.476 -13.362 6.652 141 HA HIS 19 HA HIS 19 -5.610 -10.877 8.078 142 1HB HIS 19 1HB HIS 19 -3.869 -12.636 6.322 143 2HB HIS 19 2HB HIS 19 -3.354 -11.234 7.258 144 HD1 HIS 19 HD1 HIS 19 -3.264 -14.760 7.457 145 HD2 HIS 19 HD2 HIS 19 -4.178 -11.774 10.219 146 HE1 HIS 19 HE1 HIS 19 -3.010 -15.803 9.752 147 H CYS 20 H CYS 20 -7.408 -9.990 6.710 148 HA CYS 20 HA CYS 20 -6.866 -9.856 3.810 149 1HB CYS 20 1HB CYS 20 -9.022 -8.635 3.713 150 2HB CYS 20 2HB CYS 20 -9.185 -10.176 4.547 151 HG CYS 20 HG CYS 20 -8.638 -8.003 6.565 152 H ALA 21 H ALA 21 -7.183 -7.593 2.823 153 HA ALA 21 HA ALA 21 -5.068 -5.884 3.663 154 1HB ALA 21 1HB ALA 21 -7.238 -5.830 1.644 155 2HB ALA 21 2HB ALA 21 -6.620 -4.250 2.130 156 3HB ALA 21 3HB ALA 21 -5.523 -5.460 1.465 157 H GLU 22 H GLU 22 -8.446 -6.041 4.567 158 HA GLU 22 HA GLU 22 -8.805 -3.400 5.554 159 1HB GLU 22 1HB GLU 22 -10.397 -5.596 5.381 160 2HB GLU 22 2HB GLU 22 -10.056 -5.592 7.111 161 1HG GLU 22 1HG GLU 22 -10.701 -3.142 7.135 162 2HG GLU 22 2HG GLU 22 -11.262 -3.346 5.474 163 H ASN 23 H ASN 23 -6.864 -6.011 6.792 164 HA ASN 23 HA ASN 23 -6.832 -5.250 9.567 165 1HB ASN 23 1HB ASN 23 -5.002 -6.809 7.778 166 2HB ASN 23 2HB ASN 23 -4.466 -6.371 9.399 167 1HD2 ASN 23 2HD2 ASN 23 -6.061 -8.768 7.690 168 2HD2 ASN 23 1HD2 ASN 23 -6.929 -9.479 8.965 169 H LEU 24 H LEU 24 -5.472 -3.854 6.742 170 HA LEU 24 HA LEU 24 -3.236 -2.488 7.875 171 1HB LEU 24 1HB LEU 24 -4.948 -1.657 5.511 172 2HB LEU 24 2HB LEU 24 -3.288 -1.158 5.837 173 HG LEU 24 HG LEU 24 -3.894 -4.095 5.647 174 1HD1 LEU 24 1HD1 LEU 24 -4.888 -2.708 3.659 175 2HD1 LEU 24 2HD1 LEU 24 -3.199 -2.542 3.178 176 3HD1 LEU 24 3HD1 LEU 24 -3.922 -4.144 3.323 177 1HD2 LEU 24 1HD2 LEU 24 -1.628 -2.661 6.140 178 2HD2 LEU 24 2HD2 LEU 24 -1.639 -4.276 5.436 179 3HD2 LEU 24 3HD2 LEU 24 -1.521 -2.859 4.391 180 H LEU 25 H LEU 25 -6.693 -1.929 7.915 181 HA LEU 25 HA LEU 25 -6.741 0.846 8.514 182 1HB LEU 25 1HB LEU 25 -8.525 -1.508 9.023 183 2HB LEU 25 2HB LEU 25 -8.850 -0.023 9.895 184 HG LEU 25 HG LEU 25 -10.132 -0.222 7.754 185 1HD1 LEU 25 1HD1 LEU 25 -8.285 2.011 8.411 186 2HD1 LEU 25 2HD1 LEU 25 -9.059 2.063 6.829 187 3HD1 LEU 25 3HD1 LEU 25 -10.040 1.995 8.292 188 1HD2 LEU 25 1HD2 LEU 25 -8.196 -1.380 6.547 189 2HD2 LEU 25 2HD2 LEU 25 -9.030 -0.123 5.635 190 3HD2 LEU 25 3HD2 LEU 25 -7.469 0.218 6.380 191 H LYS 26 H LYS 26 -5.689 -1.917 10.358 192 HA LYS 26 HA LYS 26 -5.475 -0.178 12.788 193 1HB LYS 26 1HB LYS 26 -5.527 -3.211 12.772 194 2HB LYS 26 2HB LYS 26 -5.656 -2.141 14.165 195 1HG LYS 26 1HG LYS 26 -7.896 -2.524 13.875 196 2HG LYS 26 2HG LYS 26 -7.731 -1.210 12.710 197 1HD LYS 26 1HD LYS 26 -7.828 -2.628 10.886 198 2HD LYS 26 2HD LYS 26 -7.153 -3.992 11.778 199 1HE LYS 26 1HE LYS 26 -9.885 -2.873 12.414 200 2HE LYS 26 2HE LYS 26 -9.652 -4.122 11.191 201 1HZ LYS 26 1HZ LYS 26 -8.368 -5.331 13.019 202 2HZ LYS 26 2HZ LYS 26 -9.133 -4.261 14.093 203 3HZ LYS 26 3HZ LYS 26 -10.061 -5.305 13.126 204 H ALA 27 H ALA 27 -3.484 0.432 11.376 205 HA ALA 27 HA ALA 27 -1.293 -1.297 10.959 206 1HB ALA 27 1HB ALA 27 -1.607 1.167 10.242 207 2HB ALA 27 2HB ALA 27 -0.944 1.572 11.826 208 3HB ALA 27 3HB ALA 27 0.021 0.647 10.675 209 H ASP 28 H ASP 28 -2.502 0.044 13.943 210 HA ASP 28 HA ASP 28 -0.101 -1.049 15.355 211 1HB ASP 28 1HB ASP 28 -1.924 1.252 16.114 212 2HB ASP 28 2HB ASP 28 -0.698 0.572 17.186 213 H THR 29 H THR 29 -1.321 -3.138 15.253 214 HA THR 29 HA THR 29 -2.946 -3.454 17.681 215 HB THR 29 HB THR 29 -4.660 -4.800 16.189 216 HG1 THR 29 HG1 THR 29 -4.451 -4.452 14.151 217 1HG2 THR 29 1HG2 THR 29 -4.981 -2.669 17.594 218 2HG2 THR 29 2HG2 THR 29 -4.792 -1.788 16.079 219 3HG2 THR 29 3HG2 THR 29 -6.118 -2.935 16.273 220 H TYR 30 H TYR 30 -2.918 -5.656 14.883 221 HA TYR 30 HA TYR 30 -0.667 -7.220 15.681 222 1HB TYR 30 1HB TYR 30 -1.877 -9.151 16.707 223 2HB TYR 30 2HB TYR 30 -1.962 -7.694 17.697 224 HD1 TYR 30 HD1 TYR 30 -4.041 -6.354 17.803 225 HD2 TYR 30 HD2 TYR 30 -3.845 -10.050 15.622 226 HE1 TYR 30 HE1 TYR 30 -6.518 -6.437 17.720 227 HE2 TYR 30 HE2 TYR 30 -6.322 -10.132 15.540 228 HH TYR 30 HH TYR 30 -8.220 -8.507 15.672 229 H ARG 31 H ARG 31 -1.975 -6.305 13.256 230 HA ARG 31 HA ARG 31 -1.973 -8.833 11.788 231 1HB ARG 31 1HB ARG 31 -4.429 -8.006 12.774 232 2HB ARG 31 2HB ARG 31 -4.431 -7.350 11.139 233 1HG ARG 31 1HG ARG 31 -4.414 -9.428 10.156 234 2HG ARG 31 2HG ARG 31 -3.473 -10.153 11.460 235 1HD ARG 31 1HD ARG 31 -5.815 -9.476 12.749 236 2HD ARG 31 2HD ARG 31 -6.391 -9.947 11.150 237 HE ARG 31 HE ARG 31 -4.478 -11.847 12.237 238 1HH1 ARG 31 1HH1 ARG 31 -7.834 -10.859 12.246 239 2HH1 ARG 31 2HH1 ARG 31 -8.399 -12.431 12.692 240 1HH2 ARG 31 1HH2 ARG 31 -5.254 -13.864 12.814 241 2HH2 ARG 31 2HH2 ARG 31 -6.957 -14.115 13.011 242 H LYS 32 H LYS 32 -1.977 -8.445 9.435 243 HA LYS 32 HA LYS 32 -1.741 -5.631 8.570 244 1HB LYS 32 1HB LYS 32 0.474 -5.993 7.559 245 2HB LYS 32 2HB LYS 32 0.533 -6.218 9.302 246 1HG LYS 32 1HG LYS 32 -0.097 -8.751 8.254 247 2HG LYS 32 2HG LYS 32 1.146 -8.112 7.187 248 1HD LYS 32 1HD LYS 32 2.346 -9.205 8.918 249 2HD LYS 32 2HD LYS 32 2.426 -7.492 9.331 250 1HE LYS 32 1HE LYS 32 0.278 -7.939 10.714 251 2HE LYS 32 2HE LYS 32 0.712 -9.642 10.567 252 1HZ LYS 32 1HZ LYS 32 3.023 -8.774 11.339 253 2HZ LYS 32 2HZ LYS 32 2.125 -7.477 11.960 254 3HZ LYS 32 3HZ LYS 32 1.798 -9.061 12.479 255 H TRP 33 H TRP 33 -0.619 -6.231 5.993 256 HA TRP 33 HA TRP 33 -2.993 -7.471 4.776 257 1HB TRP 33 1HB TRP 33 -2.023 -5.364 3.814 258 2HB TRP 33 2HB TRP 33 -0.567 -6.256 3.434 259 HD1 TRP 33 HD1 TRP 33 -4.006 -7.842 2.981 260 HE1 TRP 33 HE1 TRP 33 -4.382 -8.283 0.461 261 HE3 TRP 33 HE3 TRP 33 0.063 -5.452 1.080 262 HZ2 TRP 33 HZ2 TRP 33 -3.120 -7.651 -2.005 263 HZ3 TRP 33 HZ3 TRP 33 0.455 -5.398 -1.373 264 HH2 TRP 33 HH2 TRP 33 -1.137 -6.479 -2.911 265 H ARG 34 H ARG 34 -3.035 -9.397 3.748 266 HA ARG 34 HA ARG 34 -0.519 -10.815 3.140 267 1HB ARG 34 1HB ARG 34 -2.805 -11.979 4.771 268 2HB ARG 34 2HB ARG 34 -1.444 -12.907 4.142 269 1HG ARG 34 1HG ARG 34 -0.141 -10.864 5.420 270 2HG ARG 34 2HG ARG 34 -1.558 -11.064 6.451 271 1HD ARG 34 1HD ARG 34 -1.002 -13.617 6.242 272 2HD ARG 34 2HD ARG 34 0.603 -13.034 5.804 273 HE ARG 34 HE ARG 34 -0.568 -12.967 8.459 274 1HH1 ARG 34 1HH1 ARG 34 1.648 -11.351 6.291 275 2HH1 ARG 34 2HH1 ARG 34 2.576 -10.676 7.584 276 1HH2 ARG 34 1HH2 ARG 34 0.658 -12.071 10.101 277 2HH2 ARG 34 2HH2 ARG 34 2.023 -11.075 9.718 278 H ALA 35 H ALA 35 -0.733 -11.430 1.039 279 HA ALA 35 HA ALA 35 -2.956 -11.026 -0.601 280 1HB ALA 35 1HB ALA 35 -0.564 -11.683 -1.269 281 2HB ALA 35 2HB ALA 35 -1.055 -13.355 -0.995 282 3HB ALA 35 3HB ALA 35 -1.861 -12.391 -2.233 283 H ALA 36 H ALA 36 -4.440 -12.524 -1.603 284 HA ALA 36 HA ALA 36 -5.927 -14.049 0.273 285 1HB ALA 36 1HB ALA 36 -6.497 -12.998 -2.120 286 2HB ALA 36 2HB ALA 36 -6.187 -14.657 -2.630 287 3HB ALA 36 3HB ALA 36 -7.443 -14.320 -1.438 288 H LYS 37 H LYS 37 -3.632 -15.055 -2.230 289 HA LYS 37 HA LYS 37 -3.609 -17.753 -0.969 290 1HB LYS 37 1HB LYS 37 -4.466 -17.270 -3.496 291 2HB LYS 37 2HB LYS 37 -2.747 -17.497 -3.799 292 1HG LYS 37 1HG LYS 37 -2.845 -19.716 -3.360 293 2HG LYS 37 2HG LYS 37 -3.871 -19.482 -1.945 294 1HD LYS 37 1HD LYS 37 -5.250 -20.663 -3.464 295 2HD LYS 37 2HD LYS 37 -5.762 -18.984 -3.636 296 1HE LYS 37 1HE LYS 37 -3.634 -20.197 -5.406 297 2HE LYS 37 2HE LYS 37 -5.349 -20.280 -5.812 298 1HZ LYS 37 1HZ LYS 37 -5.259 -17.747 -5.348 299 2HZ LYS 37 2HZ LYS 37 -3.594 -17.929 -5.634 300 3HZ LYS 37 3HZ LYS 37 -4.711 -18.348 -6.840 301 H ALA 38 H ALA 38 -1.448 -18.806 -2.118 302 HA ALA 38 HA ALA 38 0.756 -17.134 -1.049 303 1HB ALA 38 1HB ALA 38 0.444 -19.558 -0.354 304 2HB ALA 38 2HB ALA 38 0.881 -20.009 -2.001 305 3HB ALA 38 3HB ALA 38 2.045 -19.166 -0.980 306 H GLY 39 H GLY 39 2.883 -18.139 -2.512 307 1HA GLY 39 1HA GLY 39 4.049 -17.794 -4.525 308 2HA GLY 39 2HA GLY 39 2.522 -18.099 -5.357 309 H GLU 40 H GLU 40 3.404 -15.593 -3.035 310 HA GLU 40 HA GLU 40 1.996 -13.464 -4.140 311 1HB GLU 40 1HB GLU 40 4.509 -13.606 -2.500 312 2HB GLU 40 2HB GLU 40 3.867 -12.052 -3.026 313 1HG GLU 40 1HG GLU 40 2.742 -12.263 -1.034 314 2HG GLU 40 2HG GLU 40 1.602 -13.087 -2.091 315 H LYS 41 H LYS 41 2.247 -13.580 -6.417 316 HA LYS 41 HA LYS 41 4.899 -12.937 -7.579 317 1HB LYS 41 1HB LYS 41 3.180 -14.598 -8.595 318 2HB LYS 41 2HB LYS 41 2.302 -13.157 -9.108 319 1HG LYS 41 1HG LYS 41 4.236 -12.362 -10.353 320 2HG LYS 41 2HG LYS 41 5.212 -13.704 -9.754 321 1HD LYS 41 1HD LYS 41 4.226 -15.230 -11.157 322 2HD LYS 41 2HD LYS 41 2.663 -14.413 -11.117 323 1HE LYS 41 1HE LYS 41 4.981 -13.044 -12.437 324 2HE LYS 41 2HE LYS 41 4.142 -14.332 -13.303 325 1HZ LYS 41 1HZ LYS 41 2.863 -11.924 -12.125 326 2HZ LYS 41 2HZ LYS 41 3.177 -12.169 -13.778 327 3HZ LYS 41 3HZ LYS 41 2.061 -13.160 -12.966 328 H THR 42 H THR 42 1.598 -11.623 -7.519 329 HA THR 42 HA THR 42 2.603 -8.888 -7.304 330 HB THR 42 HB THR 42 1.215 -8.176 -9.351 331 HG1 THR 42 HG1 THR 42 0.951 -9.820 -10.893 332 1HG2 THR 42 1HG2 THR 42 3.827 -8.562 -9.103 333 2HG2 THR 42 2HG2 THR 42 3.515 -9.872 -10.242 334 3HG2 THR 42 3HG2 THR 42 3.114 -8.211 -10.677 335 H ILE 43 H ILE 43 1.188 -7.914 -5.924 336 HA ILE 43 HA ILE 43 -1.654 -8.867 -5.949 337 HB ILE 43 HB ILE 43 -1.565 -8.338 -3.423 338 1HG1 ILE 43 1HG1 ILE 43 1.391 -8.709 -3.969 339 2HG1 ILE 43 2HG1 ILE 43 0.623 -7.207 -3.457 340 1HG2 ILE 43 1HG2 ILE 43 -1.475 -10.622 -4.737 341 2HG2 ILE 43 2HG2 ILE 43 0.141 -10.687 -4.035 342 3HG2 ILE 43 3HG2 ILE 43 -1.272 -10.560 -2.986 343 1HD1 ILE 43 1HD1 ILE 43 -0.306 -8.812 -1.513 344 2HD1 ILE 43 2HD1 ILE 43 1.184 -9.678 -1.883 345 3HD1 ILE 43 3HD1 ILE 43 1.247 -7.990 -1.379 346 H SER 44 H SER 44 -3.204 -7.266 -5.903 347 HA SER 44 HA SER 44 -2.187 -4.482 -5.481 348 1HB SER 44 1HB SER 44 -4.219 -5.525 -7.433 349 2HB SER 44 2HB SER 44 -4.136 -3.822 -7.004 350 HG SER 44 HG SER 44 -2.872 -4.411 -8.866 351 H VAL 45 H VAL 45 -3.322 -3.213 -4.089 352 HA VAL 45 HA VAL 45 -5.947 -4.110 -3.056 353 HB VAL 45 HB VAL 45 -4.299 -5.125 -1.533 354 1HG1 VAL 45 1HG1 VAL 45 -2.549 -3.296 -2.021 355 2HG1 VAL 45 2HG1 VAL 45 -3.382 -2.348 -0.792 356 3HG1 VAL 45 3HG1 VAL 45 -2.651 -3.895 -0.370 357 1HG2 VAL 45 1HG2 VAL 45 -5.958 -2.813 -0.549 358 2HG2 VAL 45 2HG2 VAL 45 -6.252 -4.541 -0.372 359 3HG2 VAL 45 3HG2 VAL 45 -4.990 -3.759 0.579 360 H VAL 46 H VAL 46 -7.157 -2.267 -3.470 361 HA VAL 46 HA VAL 46 -5.832 0.376 -3.205 362 HB VAL 46 HB VAL 46 -8.632 -0.149 -4.181 363 1HG1 VAL 46 1HG1 VAL 46 -7.892 2.175 -3.536 364 2HG1 VAL 46 2HG1 VAL 46 -6.696 2.078 -4.830 365 3HG1 VAL 46 3HG1 VAL 46 -8.417 2.010 -5.212 366 1HG2 VAL 46 1HG2 VAL 46 -6.004 -0.526 -5.541 367 2HG2 VAL 46 2HG2 VAL 46 -7.529 -1.372 -5.804 368 3HG2 VAL 46 3HG2 VAL 46 -7.288 0.242 -6.474 369 H LEU 47 H LEU 47 -6.037 1.427 -1.330 370 HA LEU 47 HA LEU 47 -8.253 0.654 0.490 371 1HB LEU 47 1HB LEU 47 -5.995 2.458 1.300 372 2HB LEU 47 2HB LEU 47 -6.940 1.349 2.288 373 HG LEU 47 HG LEU 47 -5.771 -0.355 0.440 374 1HD1 LEU 47 1HD1 LEU 47 -4.026 2.031 0.905 375 2HD1 LEU 47 2HD1 LEU 47 -3.265 0.441 0.864 376 3HD1 LEU 47 3HD1 LEU 47 -4.182 1.016 -0.530 377 1HD2 LEU 47 1HD2 LEU 47 -5.960 -0.297 3.082 378 2HD2 LEU 47 2HD2 LEU 47 -4.714 -1.269 2.300 379 3HD2 LEU 47 3HD2 LEU 47 -4.306 0.306 2.975 380 H GLN 48 H GLN 48 -9.328 2.370 1.714 381 HA GLN 48 HA GLN 48 -9.855 4.734 -0.008 382 1HB GLN 48 1HB GLN 48 -11.845 3.508 0.582 383 2HB GLN 48 2HB GLN 48 -11.367 3.422 2.272 384 1HG GLN 48 1HG GLN 48 -13.140 5.112 1.928 385 2HG GLN 48 2HG GLN 48 -11.648 5.861 2.489 386 1HE2 GLN 48 2HE2 GLN 48 -12.464 4.759 -0.832 387 2HE2 GLN 48 1HE2 GLN 48 -12.290 6.288 -1.541 388 H LEU 49 H LEU 49 -9.728 6.851 0.871 389 HA LEU 49 HA LEU 49 -7.990 7.097 3.261 390 1HB LEU 49 1HB LEU 49 -8.747 9.125 1.127 391 2HB LEU 49 2HB LEU 49 -7.626 9.414 2.457 392 HG LEU 49 HG LEU 49 -7.258 7.220 0.400 393 1HD1 LEU 49 1HD1 LEU 49 -6.499 10.103 0.413 394 2HD1 LEU 49 2HD1 LEU 49 -5.285 8.957 -0.153 395 3HD1 LEU 49 3HD1 LEU 49 -6.857 9.043 -0.949 396 1HD2 LEU 49 1HD2 LEU 49 -5.589 8.365 2.645 397 2HD2 LEU 49 2HD2 LEU 49 -6.060 6.686 2.385 398 3HD2 LEU 49 3HD2 LEU 49 -4.866 7.440 1.329 399 H GLU 50 H GLU 50 -8.977 7.672 5.112 400 HA GLU 50 HA GLU 50 -11.731 8.052 5.470 401 1HB GLU 50 1HB GLU 50 -9.909 7.616 7.217 402 2HB GLU 50 2HB GLU 50 -9.677 9.364 7.242 403 1HG GLU 50 1HG GLU 50 -12.381 9.245 7.460 404 2HG GLU 50 2HG GLU 50 -11.939 7.741 8.269 405 H LYS 51 H LYS 51 -9.672 10.307 3.949 406 HA LYS 51 HA LYS 51 -11.788 12.281 3.827 407 1HB LYS 51 1HB LYS 51 -10.353 14.130 4.790 408 2HB LYS 51 2HB LYS 51 -10.927 12.965 5.982 409 1HG LYS 51 1HG LYS 51 -8.798 11.827 6.001 410 2HG LYS 51 2HG LYS 51 -8.218 12.783 4.638 411 1HD LYS 51 1HD LYS 51 -8.654 14.838 6.149 412 2HD LYS 51 2HD LYS 51 -8.723 13.677 7.474 413 1HE LYS 51 1HE LYS 51 -6.454 12.845 6.247 414 2HE LYS 51 2HE LYS 51 -6.398 14.564 5.856 415 1HZ LYS 51 1HZ LYS 51 -6.882 13.556 8.599 416 2HZ LYS 51 2HZ LYS 51 -5.327 13.899 8.006 417 3HZ LYS 51 3HZ LYS 51 -6.485 15.136 8.124 418 H GLU 52 H GLU 52 -11.509 13.520 1.971 419 HA GLU 52 HA GLU 52 -9.394 12.748 0.142 420 1HB GLU 52 1HB GLU 52 -11.819 13.489 -0.431 421 2HB GLU 52 2HB GLU 52 -11.195 15.124 -0.230 422 1HG GLU 52 1HG GLU 52 -9.270 14.247 -1.818 423 2HG GLU 52 2HG GLU 52 -10.505 13.088 -2.309 424 H GLU 53 H GLU 53 -7.412 13.519 0.404 425 HA GLU 53 HA GLU 53 -6.994 16.417 0.796 426 1HB GLU 53 1HB GLU 53 -5.032 15.527 2.461 427 2HB GLU 53 2HB GLU 53 -6.602 16.079 3.028 428 1HG GLU 53 1HG GLU 53 -5.928 13.896 4.032 429 2HG GLU 53 2HG GLU 53 -7.424 13.779 3.108 430 H GLN 54 H GLN 54 -4.429 16.716 0.810 431 HA GLN 54 HA GLN 54 -3.512 15.495 -1.702 432 1HB GLN 54 1HB GLN 54 -2.141 17.505 0.118 433 2HB GLN 54 2HB GLN 54 -1.628 17.067 -1.510 434 1HG GLN 54 1HG GLN 54 -3.482 18.096 -2.513 435 2HG GLN 54 2HG GLN 54 -4.405 18.096 -1.018 436 1HE2 GLN 54 2HE2 GLN 54 -1.006 19.162 -1.427 437 2HE2 GLN 54 1HE2 GLN 54 -1.294 20.771 -0.973 438 H ILE 55 H ILE 55 -0.909 15.026 -1.518 439 HA ILE 55 HA ILE 55 -0.408 13.417 0.937 440 HB ILE 55 HB ILE 55 0.018 12.363 -1.874 441 1HG1 ILE 55 1HG1 ILE 55 -1.823 10.708 -0.733 442 2HG1 ILE 55 2HG1 ILE 55 -2.293 12.248 -0.012 443 1HG2 ILE 55 1HG2 ILE 55 0.382 11.210 0.900 444 2HG2 ILE 55 2HG2 ILE 55 0.292 10.199 -0.543 445 3HG2 ILE 55 3HG2 ILE 55 1.594 11.376 -0.371 446 1HD1 ILE 55 1HD1 ILE 55 -1.907 11.782 -2.984 447 2HD1 ILE 55 2HD1 ILE 55 -3.469 11.811 -2.165 448 3HD1 ILE 55 3HD1 ILE 55 -2.478 13.269 -2.226 449 H HIS 56 H HIS 56 1.473 14.212 1.728 450 HA HIS 56 HA HIS 56 3.540 15.182 -0.198 451 1HB HIS 56 1HB HIS 56 2.685 16.732 1.629 452 2HB HIS 56 2HB HIS 56 3.451 15.648 2.792 453 HD1 HIS 56 HD1 HIS 56 4.335 17.847 -0.178 454 HD2 HIS 56 HD2 HIS 56 6.203 16.008 3.064 455 HE1 HIS 56 HE1 HIS 56 6.720 18.695 -0.151 456 H SER 57 H SER 57 2.911 12.912 2.416 457 HA SER 57 HA SER 57 5.428 11.501 1.705 458 1HB SER 57 1HB SER 57 4.814 12.760 4.336 459 2HB SER 57 2HB SER 57 5.531 11.151 4.369 460 HG SER 57 HG SER 57 6.541 13.561 3.324 461 H VAL 58 H VAL 58 5.381 9.250 2.542 462 HA VAL 58 HA VAL 58 2.681 8.290 3.319 463 HB VAL 58 HB VAL 58 4.221 7.415 0.863 464 1HG1 VAL 58 1HG1 VAL 58 1.837 6.250 2.281 465 2HG1 VAL 58 2HG1 VAL 58 2.018 6.062 0.536 466 3HG1 VAL 58 3HG1 VAL 58 3.249 5.431 1.624 467 1HG2 VAL 58 1HG2 VAL 58 1.711 9.001 1.347 468 2HG2 VAL 58 2HG2 VAL 58 3.072 9.377 0.289 469 3HG2 VAL 58 3HG2 VAL 58 1.928 8.112 -0.160 470 H ASP 59 H ASP 59 2.716 6.043 4.077 471 HA ASP 59 HA ASP 59 5.436 5.044 4.818 472 1HB ASP 59 1HB ASP 59 4.153 6.231 6.711 473 2HB ASP 59 2HB ASP 59 3.040 4.868 6.643 474 H ILE 60 H ILE 60 5.680 2.850 4.630 475 HA ILE 60 HA ILE 60 3.358 1.062 4.512 476 HB ILE 60 HB ILE 60 4.921 1.837 2.074 477 1HG1 ILE 60 1HG1 ILE 60 2.461 0.947 1.282 478 2HG1 ILE 60 2HG1 ILE 60 2.118 1.460 2.934 479 1HG2 ILE 60 1HG2 ILE 60 4.142 -0.978 2.749 480 2HG2 ILE 60 2HG2 ILE 60 3.948 -0.422 1.087 481 3HG2 ILE 60 3HG2 ILE 60 5.540 -0.392 1.847 482 1HD1 ILE 60 1HD1 ILE 60 3.641 3.543 2.060 483 2HD1 ILE 60 2HD1 ILE 60 2.822 3.078 0.569 484 3HD1 ILE 60 3HD1 ILE 60 1.880 3.513 1.994 485 H GLY 61 H GLY 61 3.957 -0.835 5.451 486 1HA GLY 61 1HA GLY 61 6.825 -1.210 6.021 487 2HA GLY 61 2HA GLY 61 5.523 -2.020 6.868 488 H ASN 62 H ASN 62 7.962 -2.684 4.957 489 HA ASN 62 HA ASN 62 6.610 -4.368 2.953 490 1HB ASN 62 1HB ASN 62 8.971 -5.086 2.393 491 2HB ASN 62 2HB ASN 62 8.666 -3.356 2.238 492 1HD2 ASN 62 2HD2 ASN 62 9.773 -1.923 3.677 493 2HD2 ASN 62 1HD2 ASN 62 10.944 -2.455 4.784 494 H ASP 63 H ASP 63 5.709 -6.271 3.618 495 HA ASP 63 HA ASP 63 6.960 -7.750 5.868 496 1HB ASP 63 1HB ASP 63 4.302 -7.309 5.110 497 2HB ASP 63 2HB ASP 63 4.599 -8.976 4.630 498 H GLY 64 H GLY 64 8.690 -7.807 3.900 499 1HA GLY 64 1HA GLY 64 9.947 -9.619 2.894 500 2HA GLY 64 2HA GLY 64 8.444 -10.526 2.716 501 H SER 65 H SER 65 7.226 -7.814 1.770 502 HA SER 65 HA SER 65 7.168 -8.251 -1.006 503 1HB SER 65 1HB SER 65 6.601 -5.712 -1.020 504 2HB SER 65 2HB SER 65 5.531 -6.802 -0.144 505 HG SER 65 HG SER 65 6.138 -5.920 1.671 506 H ALA 66 H ALA 66 8.078 -6.925 -2.715 507 HA ALA 66 HA ALA 66 10.814 -5.915 -2.071 508 1HB ALA 66 1HB ALA 66 9.880 -7.896 -4.030 509 2HB ALA 66 2HB ALA 66 10.949 -6.675 -4.711 510 3HB ALA 66 3HB ALA 66 11.487 -7.670 -3.362 511 H PHE 67 H PHE 67 8.349 -5.853 -4.697 512 HA PHE 67 HA PHE 67 9.073 -2.981 -5.130 513 1HB PHE 67 1HB PHE 67 7.386 -4.792 -6.884 514 2HB PHE 67 2HB PHE 67 7.922 -3.174 -7.282 515 HD1 PHE 67 HD1 PHE 67 10.711 -3.115 -6.414 516 HD2 PHE 67 HD2 PHE 67 8.500 -6.266 -8.321 517 HE1 PHE 67 HE1 PHE 67 12.818 -4.027 -7.345 518 HE2 PHE 67 HE2 PHE 67 10.605 -7.181 -9.247 519 HZ PHE 67 HZ PHE 67 12.766 -6.063 -8.763 520 H VAL 68 H VAL 68 7.642 -1.384 -4.624 521 HA VAL 68 HA VAL 68 4.823 -2.175 -4.025 522 HB VAL 68 HB VAL 68 6.525 -0.311 -2.343 523 1HG1 VAL 68 1HG1 VAL 68 4.060 0.228 -2.505 524 2HG1 VAL 68 2HG1 VAL 68 3.727 -1.374 -1.846 525 3HG1 VAL 68 3HG1 VAL 68 4.600 -0.186 -0.878 526 1HG2 VAL 68 1HG2 VAL 68 5.661 -3.182 -2.083 527 2HG2 VAL 68 2HG2 VAL 68 7.253 -2.478 -1.808 528 3HG2 VAL 68 3HG2 VAL 68 5.958 -2.211 -0.641 529 H GLU 69 H GLU 69 3.651 -1.131 -5.511 530 HA GLU 69 HA GLU 69 4.452 1.628 -6.339 531 1HB GLU 69 1HB GLU 69 4.254 -0.016 -8.170 532 2HB GLU 69 2HB GLU 69 2.604 -0.381 -7.675 533 1HG GLU 69 1HG GLU 69 1.760 1.528 -8.605 534 2HG GLU 69 2HG GLU 69 3.172 2.489 -8.167 535 H VAL 70 H VAL 70 2.994 3.334 -6.089 536 HA VAL 70 HA VAL 70 0.355 2.655 -4.871 537 HB VAL 70 HB VAL 70 2.051 4.993 -3.987 538 1HG1 VAL 70 1HG1 VAL 70 -0.642 3.928 -3.362 539 2HG1 VAL 70 2HG1 VAL 70 0.317 4.452 -1.977 540 3HG1 VAL 70 3HG1 VAL 70 -0.039 5.583 -3.281 541 1HG2 VAL 70 1HG2 VAL 70 1.735 2.222 -2.803 542 2HG2 VAL 70 2HG2 VAL 70 3.234 3.008 -3.298 543 3HG2 VAL 70 3HG2 VAL 70 2.354 3.597 -1.888 544 H LEU 71 H LEU 71 -1.265 3.535 -5.991 545 HA LEU 71 HA LEU 71 -0.698 5.847 -7.779 546 1HB LEU 71 1HB LEU 71 -2.163 3.354 -8.126 547 2HB LEU 71 2HB LEU 71 -3.193 4.742 -8.473 548 HG LEU 71 HG LEU 71 -1.294 5.614 -9.928 549 1HD1 LEU 71 1HD1 LEU 71 0.422 4.096 -8.871 550 2HD1 LEU 71 2HD1 LEU 71 -0.346 2.745 -9.706 551 3HD1 LEU 71 3HD1 LEU 71 0.404 4.044 -10.634 552 1HD2 LEU 71 1HD2 LEU 71 -2.832 3.089 -10.513 553 2HD2 LEU 71 2HD2 LEU 71 -3.145 4.726 -11.089 554 3HD2 LEU 71 3HD2 LEU 71 -1.782 3.811 -11.733 555 H VAL 72 H VAL 72 -2.545 7.402 -7.961 556 HA VAL 72 HA VAL 72 -4.066 7.585 -5.393 557 HB VAL 72 HB VAL 72 -3.933 10.093 -5.852 558 1HG1 VAL 72 1HG1 VAL 72 -1.595 8.383 -5.025 559 2HG1 VAL 72 2HG1 VAL 72 -1.542 10.142 -4.905 560 3HG1 VAL 72 3HG1 VAL 72 -2.745 9.230 -3.992 561 1HG2 VAL 72 1HG2 VAL 72 -3.096 9.901 -8.176 562 2HG2 VAL 72 2HG2 VAL 72 -1.973 10.814 -7.167 563 3HG2 VAL 72 3HG2 VAL 72 -1.628 9.134 -7.573 564 H GLY 73 H GLY 73 -6.157 8.612 -5.528 565 1HA GLY 73 1HA GLY 73 -7.318 9.469 -7.999 566 2HA GLY 73 2HA GLY 73 -7.799 7.810 -7.651 567 H SER 74 H SER 74 -9.629 9.872 -7.725 568 HA SER 74 HA SER 74 -10.353 10.251 -4.875 569 1HB SER 74 1HB SER 74 -10.027 12.395 -5.900 570 2HB SER 74 2HB SER 74 -10.963 11.925 -7.310 571 HG SER 74 HG SER 74 -11.808 13.021 -5.043 572 H SER 75 H SER 75 -12.694 10.292 -4.485 573 HA SER 75 HA SER 75 -14.028 8.054 -5.773 574 1HB SER 75 1HB SER 75 -14.331 8.512 -3.355 575 2HB SER 75 2HB SER 75 -15.070 10.058 -3.749 576 HG SER 75 HG SER 75 -16.844 9.063 -4.339 577 H ALA 76 H ALA 76 -13.610 11.212 -6.724 578 HA ALA 76 HA ALA 76 -16.109 12.199 -7.474 579 1HB ALA 76 1HB ALA 76 -13.661 13.125 -7.823 580 2HB ALA 76 2HB ALA 76 -13.844 12.401 -9.419 581 3HB ALA 76 3HB ALA 76 -14.970 13.647 -8.882 582 H GLY 77 H GLY 77 -14.369 9.492 -8.829 583 1HA GLY 77 1HA GLY 77 -16.212 9.368 -11.155 584 2HA GLY 77 2HA GLY 77 -14.766 8.382 -10.940 585 H GLY 78 H GLY 78 -15.539 7.795 -8.095 586 1HA GLY 78 1HA GLY 78 -16.709 6.124 -6.938 587 2HA GLY 78 2HA GLY 78 -18.077 6.495 -7.988 588 H ALA 79 H ALA 79 -15.095 5.570 -9.507 589 HA ALA 79 HA ALA 79 -15.334 2.745 -9.542 590 1HB ALA 79 1HB ALA 79 -16.853 4.196 -11.725 591 2HB ALA 79 2HB ALA 79 -16.287 2.537 -11.910 592 3HB ALA 79 3HB ALA 79 -17.451 2.935 -10.648 593 H GLY 80 H GLY 80 -13.293 4.723 -9.500 594 1HA GLY 80 1HA GLY 80 -12.060 5.118 -12.060 595 2HA GLY 80 2HA GLY 80 -11.242 5.255 -10.503 596 H GLU 81 H GLU 81 -10.638 3.137 -9.455 597 HA GLU 81 HA GLU 81 -9.523 1.081 -9.530 598 1HB GLU 81 1HB GLU 81 -11.661 0.840 -11.555 599 2HB GLU 81 2HB GLU 81 -10.289 -0.234 -11.824 600 1HG GLU 81 1HG GLU 81 -10.598 -0.589 -9.168 601 2HG GLU 81 2HG GLU 81 -12.265 -0.204 -9.599 602 H GLN 82 H GLN 82 -9.785 1.469 -13.060 603 HA GLN 82 HA GLN 82 -6.812 1.618 -13.162 604 1HB GLN 82 1HB GLN 82 -7.141 1.100 -15.595 605 2HB GLN 82 2HB GLN 82 -7.784 -0.148 -14.527 606 1HG GLN 82 1HG GLN 82 -9.969 0.336 -15.047 607 2HG GLN 82 2HG GLN 82 -9.640 2.052 -15.288 608 1HE2 GLN 82 2HE2 GLN 82 -8.412 2.612 -17.356 609 2HE2 GLN 82 1HE2 GLN 82 -8.656 1.634 -18.723 610 H ASP 83 H ASP 83 -8.611 3.902 -12.466 611 HA ASP 83 HA ASP 83 -7.800 5.736 -14.685 612 1HB ASP 83 1HB ASP 83 -10.384 5.174 -14.160 613 2HB ASP 83 2HB ASP 83 -10.134 6.469 -12.988 614 H TYR 84 H TYR 84 -6.258 5.088 -12.349 615 HA TYR 84 HA TYR 84 -6.514 7.506 -10.642 616 1HB TYR 84 1HB TYR 84 -5.189 4.816 -10.337 617 2HB TYR 84 2HB TYR 84 -4.637 6.176 -9.367 618 HD1 TYR 84 HD1 TYR 84 -8.123 5.320 -10.497 619 HD2 TYR 84 HD2 TYR 84 -5.408 5.729 -7.189 620 HE1 TYR 84 HE1 TYR 84 -9.990 4.946 -8.923 621 HE2 TYR 84 HE2 TYR 84 -7.287 5.357 -5.613 622 HH TYR 84 HH TYR 84 -9.628 4.104 -5.812 623 H GLU 85 H GLU 85 -3.952 7.955 -9.915 624 HA GLU 85 HA GLU 85 -2.435 8.204 -12.468 625 1HB GLU 85 1HB GLU 85 -2.656 10.445 -12.430 626 2HB GLU 85 2HB GLU 85 -3.629 10.335 -10.975 627 1HG GLU 85 1HG GLU 85 -1.838 11.807 -10.455 628 2HG GLU 85 2HG GLU 85 -1.415 10.282 -9.676 629 H VAL 86 H VAL 86 -0.307 7.661 -12.300 630 HA VAL 86 HA VAL 86 0.590 6.159 -10.066 631 HB VAL 86 HB VAL 86 2.275 7.461 -12.222 632 1HG1 VAL 86 1HG1 VAL 86 2.756 5.080 -10.402 633 2HG1 VAL 86 2HG1 VAL 86 3.796 5.538 -11.750 634 3HG1 VAL 86 3HG1 VAL 86 3.623 6.615 -10.364 635 1HG2 VAL 86 1HG2 VAL 86 0.203 5.771 -12.677 636 2HG2 VAL 86 2HG2 VAL 86 1.673 5.768 -13.651 637 3HG2 VAL 86 3HG2 VAL 86 1.476 4.598 -12.347 638 H LEU 87 H LEU 87 0.353 7.471 -8.175 639 HA LEU 87 HA LEU 87 1.603 10.029 -7.793 640 1HB LEU 87 1HB LEU 87 -0.138 8.895 -6.289 641 2HB LEU 87 2HB LEU 87 1.184 7.917 -5.657 642 HG LEU 87 HG LEU 87 2.386 10.151 -5.202 643 1HD1 LEU 87 1HD1 LEU 87 -0.278 11.043 -6.153 644 2HD1 LEU 87 2HD1 LEU 87 0.312 11.842 -4.697 645 3HD1 LEU 87 3HD1 LEU 87 1.267 11.890 -6.179 646 1HD2 LEU 87 1HD2 LEU 87 0.052 8.968 -3.762 647 2HD2 LEU 87 2HD2 LEU 87 1.727 9.137 -3.235 648 3HD2 LEU 87 3HD2 LEU 87 0.643 10.528 -3.189 649 H LEU 88 H LEU 88 2.662 6.753 -6.796 650 HA LEU 88 HA LEU 88 5.458 7.628 -7.266 651 1HB LEU 88 1HB LEU 88 6.226 6.632 -5.179 652 2HB LEU 88 2HB LEU 88 5.045 7.899 -4.861 653 HG LEU 88 HG LEU 88 3.474 5.627 -5.143 654 1HD1 LEU 88 1HD1 LEU 88 6.178 4.952 -4.088 655 2HD1 LEU 88 2HD1 LEU 88 4.795 4.264 -3.239 656 3HD1 LEU 88 3HD1 LEU 88 5.025 3.939 -4.957 657 1HD2 LEU 88 1HD2 LEU 88 4.528 7.281 -2.881 658 2HD2 LEU 88 2HD2 LEU 88 2.868 7.081 -3.442 659 3HD2 LEU 88 3HD2 LEU 88 3.634 5.812 -2.486 660 H VAL 89 H VAL 89 6.273 6.244 -8.720 661 HA VAL 89 HA VAL 89 5.087 3.875 -9.632 662 HB VAL 89 HB VAL 89 7.339 3.318 -10.564 663 1HG1 VAL 89 1HG1 VAL 89 6.256 6.130 -10.760 664 2HG1 VAL 89 2HG1 VAL 89 7.613 5.590 -11.750 665 3HG1 VAL 89 3HG1 VAL 89 6.045 4.796 -11.894 666 1HG2 VAL 89 1HG2 VAL 89 8.660 4.105 -8.617 667 2HG2 VAL 89 2HG2 VAL 89 9.202 4.863 -10.113 668 3HG2 VAL 89 3HG2 VAL 89 8.193 5.766 -8.984 669 H THR 90 H THR 90 6.415 1.661 -9.534 670 HA THR 90 HA THR 90 6.102 0.690 -6.868 671 HB THR 90 HB THR 90 6.041 -0.542 -9.220 672 HG1 THR 90 HG1 THR 90 6.039 -2.395 -8.062 673 1HG2 THR 90 1HG2 THR 90 8.447 -0.251 -9.727 674 2HG2 THR 90 2HG2 THR 90 8.858 -1.140 -8.261 675 3HG2 THR 90 3HG2 THR 90 8.020 -1.956 -9.582 676 H SER 91 H SER 91 7.532 0.509 -5.228 677 HA SER 91 HA SER 91 10.274 1.557 -5.683 678 1HB SER 91 1HB SER 91 10.144 1.760 -3.087 679 2HB SER 91 2HB SER 91 9.246 2.915 -4.066 680 HG SER 91 HG SER 91 7.390 1.783 -3.680 681 H SER 92 H SER 92 11.909 0.164 -5.512 682 HA SER 92 HA SER 92 11.431 -2.603 -4.625 683 1HB SER 92 1HB SER 92 13.706 -3.017 -5.443 684 2HB SER 92 2HB SER 92 12.779 -2.143 -6.658 685 HG SER 92 HG SER 92 14.026 -0.457 -6.388 686 H PHE 93 H PHE 93 11.659 -3.112 -2.511 687 HA PHE 93 HA PHE 93 13.579 -1.509 -0.875 688 1HB PHE 93 1HB PHE 93 11.187 -3.106 0.040 689 2HB PHE 93 2HB PHE 93 12.233 -2.141 1.072 690 HD1 PHE 93 HD1 PHE 93 12.663 0.309 -0.412 691 HD2 PHE 93 HD2 PHE 93 9.096 -2.064 -0.076 692 HE1 PHE 93 HE1 PHE 93 11.288 2.311 -0.896 693 HE2 PHE 93 HE2 PHE 93 7.722 -0.056 -0.559 694 HZ PHE 93 HZ PHE 93 8.820 2.128 -0.969 695 H MET 94 H MET 94 12.251 -4.795 -1.271 696 HA MET 94 HA MET 94 14.841 -5.837 -0.183 697 1HB MET 94 1HB MET 94 12.006 -6.776 0.197 698 2HB MET 94 2HB MET 94 13.356 -7.893 0.395 699 1HG MET 94 1HG MET 94 14.327 -6.530 2.130 700 2HG MET 94 2HG MET 94 13.169 -5.233 1.829 701 1HE MET 94 1HE MET 94 13.922 -8.688 2.999 702 2HE MET 94 2HE MET 94 12.469 -9.309 3.773 703 3HE MET 94 3HE MET 94 12.562 -9.213 2.012 704 H SER 95 H SER 95 14.849 -8.372 -0.838 705 HA SER 95 HA SER 95 14.521 -8.431 -3.809 706 1HB SER 95 1HB SER 95 16.509 -9.665 -3.951 707 2HB SER 95 2HB SER 95 16.860 -8.612 -2.588 708 HG SER 95 HG SER 95 17.032 -11.152 -2.551 709 HA PRO 96 HA PRO 96 12.019 -12.104 -3.263 710 1HB PRO 96 1HB PRO 96 12.895 -13.807 -5.206 711 2HB PRO 96 2HB PRO 96 12.002 -12.317 -5.547 712 1HG PRO 96 1HG PRO 96 14.834 -12.941 -6.016 713 2HG PRO 96 2HG PRO 96 13.820 -11.689 -6.747 714 1HD PRO 96 1HD PRO 96 15.754 -11.380 -4.638 715 2HD PRO 96 2HD PRO 96 14.721 -10.129 -5.364 716 H SER 97 H SER 97 14.867 -12.200 -1.872 717 HA SER 97 HA SER 97 14.833 -15.148 -1.371 718 1HB SER 97 1HB SER 97 16.913 -14.421 -2.490 719 2HB SER 97 2HB SER 97 17.185 -13.234 -1.217 720 HG SER 97 HG SER 97 18.336 -15.110 -0.757 721 H GLU 98 H GLU 98 15.359 -11.932 0.072 722 HA GLU 98 HA GLU 98 15.670 -12.781 2.768 723 1HB GLU 98 1HB GLU 98 14.544 -10.235 1.578 724 2HB GLU 98 2HB GLU 98 14.850 -10.450 3.301 725 1HG GLU 98 1HG GLU 98 16.887 -9.585 2.727 726 2HG GLU 98 2HG GLU 98 17.225 -11.269 2.348 727 H SER 99 H SER 99 12.830 -12.528 0.751 728 HA SER 99 HA SER 99 10.719 -12.185 2.503 729 1HB SER 99 1HB SER 99 9.434 -13.757 1.021 730 2HB SER 99 2HB SER 99 10.316 -12.501 0.156 731 HG SER 99 HG SER 99 10.487 -15.062 -0.223 732 H ARG 100 H ARG 100 12.815 -15.007 2.359 733 HA ARG 100 HA ARG 100 10.980 -16.514 4.120 734 1HB ARG 100 1HB ARG 100 13.038 -18.181 4.118 735 2HB ARG 100 2HB ARG 100 11.946 -18.095 2.744 736 1HG ARG 100 1HG ARG 100 14.295 -16.258 2.720 737 2HG ARG 100 2HG ARG 100 14.612 -17.972 2.468 738 1HD ARG 100 1HD ARG 100 12.580 -16.352 0.905 739 2HD ARG 100 2HD ARG 100 14.192 -16.774 0.326 740 HE ARG 100 HE ARG 100 12.912 -19.180 1.103 741 1HH1 ARG 100 1HH1 ARG 100 12.580 -16.657 -1.297 742 2HH1 ARG 100 2HH1 ARG 100 11.853 -17.714 -2.454 743 1HH2 ARG 100 1HH2 ARG 100 11.967 -20.513 -0.426 744 2HH2 ARG 100 2HH2 ARG 100 11.508 -19.874 -1.969 745 H SER 101 H SER 101 14.484 -16.570 4.706 746 HA SER 101 HA SER 101 14.327 -14.826 7.018 747 1HB SER 101 1HB SER 101 13.205 -16.853 7.914 748 2HB SER 101 2HB SER 101 14.612 -17.816 7.470 749 HG SER 101 HG SER 101 14.681 -17.141 9.657 750 H GLY 102 H GLY 102 15.932 -15.035 4.666 751 1HA GLY 102 1HA GLY 102 18.523 -16.135 5.570 752 2HA GLY 102 2HA GLY 102 18.179 -15.485 3.965 753 H SER 103 H SER 103 16.858 -13.073 5.207 754 HA SER 103 HA SER 103 18.754 -11.672 6.836 755 1HB SER 103 1HB SER 103 19.305 -11.772 3.946 756 2HB SER 103 2HB SER 103 19.268 -10.142 4.607 757 HG SER 103 HG SER 103 20.700 -10.981 6.278 758 H ASN 104 H ASN 104 17.340 -10.302 7.795 759 HA ASN 104 HA ASN 104 15.438 -8.971 8.136 760 1HB ASN 104 1HB ASN 104 15.483 -6.933 6.581 761 2HB ASN 104 2HB ASN 104 16.932 -7.237 7.531 762 1HD2 ASN 104 2HD2 ASN 104 15.558 -7.783 4.246 763 2HD2 ASN 104 1HD2 ASN 104 17.059 -7.800 3.456 764 HA PRO 105 HA PRO 105 12.866 -10.944 4.813 765 1HB PRO 105 1HB PRO 105 11.177 -12.256 6.521 766 2HB PRO 105 2HB PRO 105 12.698 -12.942 5.935 767 1HG PRO 105 1HG PRO 105 12.054 -11.785 8.591 768 2HG PRO 105 2HG PRO 105 13.163 -13.099 8.170 769 1HD PRO 105 1HD PRO 105 13.937 -10.489 8.761 770 2HD PRO 105 2HD PRO 105 14.925 -11.666 7.868 771 H ASN 106 H ASN 106 12.113 -9.225 7.777 772 HA ASN 106 HA ASN 106 9.789 -7.969 6.383 773 1HB ASN 106 1HB ASN 106 9.987 -8.816 9.286 774 2HB ASN 106 2HB ASN 106 8.704 -7.792 8.647 775 1HD2 ASN 106 2HD2 ASN 106 8.314 -9.135 6.112 776 2HD2 ASN 106 1HD2 ASN 106 7.676 -10.667 6.428 777 H ARG 107 H ARG 107 10.050 -5.825 6.183 778 HA ARG 107 HA ARG 107 11.502 -4.335 8.303 779 1HB ARG 107 1HB ARG 107 12.419 -4.782 5.539 780 2HB ARG 107 2HB ARG 107 12.383 -3.082 6.000 781 1HG ARG 107 1HG ARG 107 13.597 -5.129 7.844 782 2HG ARG 107 2HG ARG 107 14.535 -4.462 6.508 783 1HD ARG 107 1HD ARG 107 13.387 -2.206 7.647 784 2HD ARG 107 2HD ARG 107 13.763 -3.214 9.044 785 HE ARG 107 HE ARG 107 16.032 -2.775 8.651 786 1HH1 ARG 107 1HH1 ARG 107 14.207 -2.249 5.713 787 2HH1 ARG 107 2HH1 ARG 107 15.585 -1.673 4.842 788 1HH2 ARG 107 1HH2 ARG 107 17.785 -2.020 7.486 789 2HH2 ARG 107 2HH2 ARG 107 17.589 -1.542 5.833 790 H VAL 108 H VAL 108 11.449 -1.838 7.237 791 HA VAL 108 HA VAL 108 8.604 -1.346 6.448 792 HB VAL 108 HB VAL 108 10.215 -0.093 8.664 793 1HG1 VAL 108 1HG1 VAL 108 7.727 0.953 7.305 794 2HG1 VAL 108 2HG1 VAL 108 8.166 1.417 8.948 795 3HG1 VAL 108 3HG1 VAL 108 9.238 1.812 7.604 796 1HG2 VAL 108 1HG2 VAL 108 7.782 -1.788 8.421 797 2HG2 VAL 108 2HG2 VAL 108 9.057 -1.822 9.640 798 3HG2 VAL 108 3HG2 VAL 108 7.801 -0.584 9.710 799 H ARG 109 H ARG 109 8.348 0.806 5.381 800 HA ARG 109 HA ARG 109 10.729 2.313 4.643 801 1HB ARG 109 1HB ARG 109 9.896 0.146 2.945 802 2HB ARG 109 2HB ARG 109 9.584 1.662 2.104 803 1HG ARG 109 1HG ARG 109 11.778 1.674 1.563 804 2HG ARG 109 2HG ARG 109 12.099 2.057 3.250 805 1HD ARG 109 1HD ARG 109 12.631 -0.144 3.793 806 2HD ARG 109 2HD ARG 109 11.685 -0.808 2.461 807 HE ARG 109 HE ARG 109 13.587 -0.607 1.094 808 1HH1 ARG 109 1HH1 ARG 109 13.917 1.455 3.900 809 2HH1 ARG 109 2HH1 ARG 109 15.537 1.910 3.499 810 1HH2 ARG 109 1HH2 ARG 109 15.682 0.008 0.615 811 2HH2 ARG 109 2HH2 ARG 109 16.529 1.098 1.662 812 H MET 110 H MET 110 10.172 4.382 3.982 813 HA MET 110 HA MET 110 7.248 4.928 3.643 814 1HB MET 110 1HB MET 110 9.271 6.696 5.043 815 2HB MET 110 2HB MET 110 7.538 6.990 4.904 816 1HG MET 110 1HG MET 110 7.037 5.563 6.587 817 2HG MET 110 2HG MET 110 8.187 4.350 6.031 818 1HE MET 110 1HE MET 110 7.932 7.924 7.401 819 2HE MET 110 2HE MET 110 7.341 6.892 8.701 820 3HE MET 110 3HE MET 110 8.823 7.835 8.918 821 H PHE 111 H PHE 111 6.752 6.815 2.351 822 HA PHE 111 HA PHE 111 8.921 7.512 0.418 823 1HB PHE 111 1HB PHE 111 5.937 7.799 -0.020 824 2HB PHE 111 2HB PHE 111 7.212 7.925 -1.226 825 HD1 PHE 111 HD1 PHE 111 5.718 5.523 1.230 826 HD2 PHE 111 HD2 PHE 111 7.858 6.043 -2.459 827 HE1 PHE 111 HE1 PHE 111 5.532 3.098 0.773 828 HE2 PHE 111 HE2 PHE 111 7.675 3.611 -2.907 829 HZ PHE 111 HZ PHE 111 6.511 2.134 -1.286 830 H GLY 112 H GLY 112 8.479 9.791 -0.534 831 1HA GLY 112 1HA GLY 112 7.341 11.665 1.449 832 2HA GLY 112 2HA GLY 112 9.007 11.871 0.967 833 HA PRO 113 HA PRO 113 6.620 14.330 -2.114 834 1HB PRO 113 1HB PRO 113 8.456 16.342 -2.241 835 2HB PRO 113 2HB PRO 113 7.170 16.268 -1.027 836 1HG PRO 113 1HG PRO 113 10.070 15.694 -0.745 837 2HG PRO 113 2HG PRO 113 8.927 16.351 0.437 838 1HD PRO 113 1HD PRO 113 9.822 13.702 0.379 839 2HD PRO 113 2HD PRO 113 8.369 14.265 1.213 840 H ASP 114 H ASP 114 10.084 13.620 -2.028 841 HA ASP 114 HA ASP 114 10.624 14.043 -4.805 842 1HB ASP 114 1HB ASP 114 12.303 13.801 -2.870 843 2HB ASP 114 2HB ASP 114 12.084 12.061 -3.057 844 H LYS 115 H LYS 115 9.238 11.369 -3.033 845 HA LYS 115 HA LYS 115 9.488 9.593 -5.383 846 1HB LYS 115 1HB LYS 115 8.278 9.056 -2.657 847 2HB LYS 115 2HB LYS 115 8.602 7.853 -3.907 848 1HG LYS 115 1HG LYS 115 11.034 8.538 -3.810 849 2HG LYS 115 2HG LYS 115 10.634 9.516 -2.396 850 1HD LYS 115 1HD LYS 115 9.521 7.244 -1.573 851 2HD LYS 115 2HD LYS 115 10.696 6.540 -2.685 852 1HE LYS 115 1HE LYS 115 12.355 8.215 -1.468 853 2HE LYS 115 2HE LYS 115 11.163 8.100 -0.172 854 1HZ LYS 115 1HZ LYS 115 11.353 5.605 -0.510 855 2HZ LYS 115 2HZ LYS 115 12.767 5.938 -1.391 856 3HZ LYS 115 3HZ LYS 115 12.662 6.383 0.242 857 H LEU 116 H LEU 116 7.398 12.037 -4.639 858 HA LEU 116 HA LEU 116 5.126 10.522 -5.876 859 1HB LEU 116 1HB LEU 116 3.596 12.140 -4.657 860 2HB LEU 116 2HB LEU 116 4.372 10.908 -3.672 861 HG LEU 116 HG LEU 116 6.201 12.693 -3.257 862 1HD1 LEU 116 1HD1 LEU 116 4.449 14.173 -4.964 863 2HD1 LEU 116 2HD1 LEU 116 4.395 14.903 -3.364 864 3HD1 LEU 116 3HD1 LEU 116 5.933 14.716 -4.197 865 1HD2 LEU 116 1HD2 LEU 116 3.394 12.939 -2.154 866 2HD2 LEU 116 2HD2 LEU 116 4.687 11.924 -1.519 867 3HD2 LEU 116 3HD2 LEU 116 4.815 13.680 -1.422 868 H VAL 117 H VAL 117 4.002 11.495 -7.473 869 HA VAL 117 HA VAL 117 5.302 13.510 -9.043 870 HB VAL 117 HB VAL 117 3.685 11.897 -10.005 871 1HG1 VAL 117 1HG1 VAL 117 2.173 11.857 -8.039 872 2HG1 VAL 117 2HG1 VAL 117 1.608 13.459 -8.478 873 3HG1 VAL 117 3HG1 VAL 117 1.308 12.100 -9.554 874 1HG2 VAL 117 1HG2 VAL 117 4.024 14.388 -10.852 875 2HG2 VAL 117 2HG2 VAL 117 2.781 13.365 -11.570 876 3HG2 VAL 117 3HG2 VAL 117 2.343 14.557 -10.346 877 H ARG 118 H ARG 118 4.976 15.757 -9.122 878 HA ARG 118 HA ARG 118 3.722 16.961 -6.759 879 1HB ARG 118 1HB ARG 118 5.555 17.815 -8.895 880 2HB ARG 118 2HB ARG 118 4.367 19.049 -8.474 881 1HG ARG 118 1HG ARG 118 5.931 19.537 -6.865 882 2HG ARG 118 2HG ARG 118 5.054 18.278 -5.994 883 1HD ARG 118 1HD ARG 118 6.669 16.595 -6.915 884 2HD ARG 118 2HD ARG 118 7.592 17.924 -7.615 885 HE ARG 118 HE ARG 118 7.554 17.157 -4.807 886 1HH1 ARG 118 1HH1 ARG 118 8.007 19.802 -7.050 887 2HH1 ARG 118 2HH1 ARG 118 8.984 20.704 -5.946 888 1HH2 ARG 118 1HH2 ARG 118 8.821 18.360 -3.409 889 2HH2 ARG 118 2HH2 ARG 118 9.441 19.899 -3.907 890 H ALA 119 H ALA 119 2.993 16.537 -10.173 891 HA ALA 119 HA ALA 119 0.819 18.401 -10.310 892 1HB ALA 119 1HB ALA 119 1.483 15.938 -11.936 893 2HB ALA 119 2HB ALA 119 0.143 17.018 -12.320 894 3HB ALA 119 3HB ALA 119 1.800 17.620 -12.362 895 H ALA 120 H ALA 120 1.086 15.319 -8.788 896 HA ALA 120 HA ALA 120 -1.894 15.173 -8.584 897 1HB ALA 120 1HB ALA 120 -0.337 13.253 -9.695 898 2HB ALA 120 2HB ALA 120 -0.309 12.735 -8.009 899 3HB ALA 120 3HB ALA 120 -1.846 12.910 -8.850 900 H ALA 121 H ALA 121 1.168 14.480 -6.838 901 HA ALA 121 HA ALA 121 0.178 13.797 -4.330 902 1HB ALA 121 1HB ALA 121 2.544 15.532 -5.042 903 2HB ALA 121 2HB ALA 121 2.234 14.936 -3.413 904 3HB ALA 121 3HB ALA 121 2.535 13.799 -4.724 905 H GLU 122 H GLU 122 0.485 17.107 -5.643 906 HA GLU 122 HA GLU 122 -0.567 18.225 -3.133 907 1HB GLU 122 1HB GLU 122 -0.339 20.405 -4.215 908 2HB GLU 122 2HB GLU 122 1.131 19.467 -4.461 909 1HG GLU 122 1HG GLU 122 -0.098 18.710 -6.678 910 2HG GLU 122 2HG GLU 122 -0.998 20.206 -6.438 911 H LYS 123 H LYS 123 -2.087 16.549 -5.479 912 HA LYS 123 HA LYS 123 -4.450 18.325 -5.619 913 1HB LYS 123 1HB LYS 123 -3.959 15.650 -6.958 914 2HB LYS 123 2HB LYS 123 -5.311 16.736 -7.272 915 1HG LYS 123 1HG LYS 123 -3.394 18.485 -7.745 916 2HG LYS 123 2HG LYS 123 -2.423 17.038 -8.011 917 1HD LYS 123 1HD LYS 123 -3.572 16.448 -9.908 918 2HD LYS 123 2HD LYS 123 -5.098 17.099 -9.311 919 1HE LYS 123 1HE LYS 123 -2.828 18.953 -9.992 920 2HE LYS 123 2HE LYS 123 -3.887 18.341 -11.263 921 1HZ LYS 123 1HZ LYS 123 -4.854 19.688 -8.802 922 2HZ LYS 123 2HZ LYS 123 -4.611 20.482 -10.284 923 3HZ LYS 123 3HZ LYS 123 -5.775 19.251 -10.158 924 H ARG 124 H ARG 124 -6.277 17.853 -4.437 925 HA ARG 124 HA ARG 124 -6.061 16.053 -2.218 926 1HB ARG 124 1HB ARG 124 -8.410 17.553 -3.393 927 2HB ARG 124 2HB ARG 124 -8.524 16.586 -1.922 928 1HG ARG 124 1HG ARG 124 -6.860 17.943 -0.815 929 2HG ARG 124 2HG ARG 124 -6.509 18.814 -2.310 930 1HD ARG 124 1HD ARG 124 -8.760 19.762 -2.330 931 2HD ARG 124 2HD ARG 124 -9.194 18.824 -0.900 932 HE ARG 124 HE ARG 124 -6.900 20.376 -0.263 933 1HH1 ARG 124 1HH1 ARG 124 -10.281 20.810 -1.050 934 2HH1 ARG 124 2HH1 ARG 124 -10.408 22.272 -0.137 935 1HH2 ARG 124 1HH2 ARG 124 -7.110 22.273 0.904 936 2HH2 ARG 124 2HH2 ARG 124 -8.635 23.095 0.956 937 H TRP 125 H TRP 125 -6.073 13.902 -2.445 938 HA TRP 125 HA TRP 125 -8.046 12.640 -4.326 939 1HB TRP 125 1HB TRP 125 -5.436 11.496 -3.258 940 2HB TRP 125 2HB TRP 125 -6.530 10.701 -4.384 941 HD1 TRP 125 HD1 TRP 125 -3.632 12.999 -4.237 942 HE1 TRP 125 HE1 TRP 125 -3.086 13.896 -6.590 943 HE3 TRP 125 HE3 TRP 125 -7.817 11.524 -6.747 944 HZ2 TRP 125 HZ2 TRP 125 -4.256 13.964 -9.196 945 HZ3 TRP 125 HZ3 TRP 125 -8.077 11.994 -9.159 946 HH2 TRP 125 HH2 TRP 125 -6.305 13.223 -10.390 947 H ASP 126 H ASP 126 -8.860 10.477 -3.443 948 HA ASP 126 HA ASP 126 -8.723 10.331 -0.481 949 1HB ASP 126 1HB ASP 126 -11.148 10.077 -0.262 950 2HB ASP 126 2HB ASP 126 -10.747 11.637 -0.974 951 H ARG 127 H ARG 127 -7.969 8.737 -3.083 952 HA ARG 127 HA ARG 127 -8.692 6.104 -1.932 953 1HB ARG 127 1HB ARG 127 -8.893 6.682 -4.900 954 2HB ARG 127 2HB ARG 127 -9.364 5.206 -4.063 955 1HG ARG 127 1HG ARG 127 -10.881 7.040 -2.731 956 2HG ARG 127 2HG ARG 127 -10.825 7.768 -4.336 957 1HD ARG 127 1HD ARG 127 -11.746 5.804 -5.357 958 2HD ARG 127 2HD ARG 127 -11.509 4.862 -3.894 959 HE ARG 127 HE ARG 127 -13.208 6.940 -3.148 960 1HH1 ARG 127 1HH1 ARG 127 -13.243 4.350 -5.495 961 2HH1 ARG 127 2HH1 ARG 127 -14.964 4.197 -5.451 962 1HH2 ARG 127 1HH2 ARG 127 -15.436 6.707 -3.121 963 2HH2 ARG 127 2HH2 ARG 127 -16.193 5.516 -4.124 964 H VAL 128 H VAL 128 -6.954 4.673 -2.104 965 HA VAL 128 HA VAL 128 -4.679 5.561 -3.813 966 HB VAL 128 HB VAL 128 -4.462 6.115 -1.319 967 1HG1 VAL 128 1HG1 VAL 128 -5.173 3.496 -0.929 968 2HG1 VAL 128 2HG1 VAL 128 -3.417 3.415 -0.781 969 3HG1 VAL 128 3HG1 VAL 128 -4.344 4.496 0.260 970 1HG2 VAL 128 1HG2 VAL 128 -2.633 5.780 -3.172 971 2HG2 VAL 128 2HG2 VAL 128 -2.159 5.959 -1.484 972 3HG2 VAL 128 3HG2 VAL 128 -2.216 4.357 -2.217 973 H LYS 129 H LYS 129 -3.631 3.949 -4.896 974 HA LYS 129 HA LYS 129 -4.734 1.195 -4.561 975 1HB LYS 129 1HB LYS 129 -5.159 2.282 -6.752 976 2HB LYS 129 2HB LYS 129 -3.422 2.438 -6.983 977 1HG LYS 129 1HG LYS 129 -3.635 -0.225 -6.378 978 2HG LYS 129 2HG LYS 129 -5.146 0.057 -7.245 979 1HD LYS 129 1HD LYS 129 -3.496 1.379 -8.891 980 2HD LYS 129 2HD LYS 129 -2.337 0.226 -8.229 981 1HE LYS 129 1HE LYS 129 -3.381 -1.586 -9.187 982 2HE LYS 129 2HE LYS 129 -4.982 -0.856 -9.071 983 1HZ LYS 129 1HZ LYS 129 -4.315 0.685 -10.854 984 2HZ LYS 129 2HZ LYS 129 -2.849 -0.158 -11.015 985 3HZ LYS 129 3HZ LYS 129 -4.317 -0.938 -11.355 986 H ILE 130 H ILE 130 -3.332 0.060 -3.307 987 HA ILE 130 HA ILE 130 -0.407 0.473 -3.647 988 HB ILE 130 HB ILE 130 -1.947 -1.153 -1.586 989 1HG1 ILE 130 1HG1 ILE 130 -2.415 1.271 -1.427 990 2HG1 ILE 130 2HG1 ILE 130 -1.448 0.725 -0.060 991 1HG2 ILE 130 1HG2 ILE 130 0.954 -0.618 -2.091 992 2HG2 ILE 130 2HG2 ILE 130 0.409 -0.661 -0.414 993 3HG2 ILE 130 3HG2 ILE 130 0.171 -2.066 -1.454 994 1HD1 ILE 130 1HD1 ILE 130 0.603 1.533 -1.212 995 2HD1 ILE 130 2HD1 ILE 130 -0.397 2.130 -2.537 996 3HD1 ILE 130 3HD1 ILE 130 -0.549 2.837 -0.929 997 H VAL 131 H VAL 131 0.582 -0.893 -5.102 998 HA VAL 131 HA VAL 131 -0.469 -3.669 -5.311 999 HB VAL 131 HB VAL 131 0.728 -1.959 -7.505 1000 1HG1 VAL 131 1HG1 VAL 131 -0.286 -4.786 -7.341 1001 2HG1 VAL 131 2HG1 VAL 131 -0.268 -3.907 -8.871 1002 3HG1 VAL 131 3HG1 VAL 131 1.240 -4.202 -8.005 1003 1HG2 VAL 131 1HG2 VAL 131 -2.095 -2.744 -6.777 1004 2HG2 VAL 131 2HG2 VAL 131 -1.454 -1.124 -7.051 1005 3HG2 VAL 131 3HG2 VAL 131 -1.659 -2.233 -8.407 1006 H CYS 132 H CYS 132 1.007 -4.937 -4.325 1007 HA CYS 132 HA CYS 132 3.863 -4.211 -4.306 1008 1HB CYS 132 1HB CYS 132 2.891 -5.156 -2.254 1009 2HB CYS 132 2HB CYS 132 2.391 -6.596 -3.129 1010 HG CYS 132 HG CYS 132 4.614 -7.433 -2.362 1011 H SER 133 H SER 133 5.499 -5.466 -5.384 1012 HA SER 133 HA SER 133 4.528 -7.559 -7.265 1013 1HB SER 133 1HB SER 133 5.148 -4.899 -8.012 1014 2HB SER 133 2HB SER 133 6.481 -5.891 -8.589 1015 HG SER 133 HG SER 133 4.315 -5.617 -9.830 1016 H GLN 134 H GLN 134 5.835 -9.253 -7.358 1017 HA GLN 134 HA GLN 134 8.398 -9.723 -7.787 1018 1HB GLN 134 1HB GLN 134 8.312 -8.532 -5.084 1019 2HB GLN 134 2HB GLN 134 9.308 -9.975 -5.265 1020 1HG GLN 134 1HG GLN 134 9.806 -8.365 -7.557 1021 2HG GLN 134 2HG GLN 134 9.871 -7.292 -6.168 1022 1HE2 GLN 134 2HE2 GLN 134 12.237 -7.116 -6.351 1023 2HE2 GLN 134 1HE2 GLN 134 13.247 -8.406 -5.909 1024 HA PRO 135 HA PRO 135 6.485 -13.639 -6.586 1025 1HB PRO 135 1HB PRO 135 8.154 -15.248 -8.027 1026 2HB PRO 135 2HB PRO 135 6.813 -14.350 -8.753 1027 1HG PRO 135 1HG PRO 135 9.721 -13.839 -8.908 1028 2HG PRO 135 2HG PRO 135 8.438 -13.422 -10.052 1029 1HD PRO 135 1HD PRO 135 9.682 -11.665 -8.222 1030 2HD PRO 135 2HD PRO 135 8.206 -11.340 -9.157 1031 H TYR 136 H TYR 136 7.231 -13.464 -4.357 1032 HA TYR 136 HA TYR 136 9.902 -14.689 -3.875 1033 1HB TYR 136 1HB TYR 136 9.648 -13.549 -1.572 1034 2HB TYR 136 2HB TYR 136 10.034 -12.534 -2.955 1035 HD1 TYR 136 HD1 TYR 136 7.181 -13.759 -0.868 1036 HD2 TYR 136 HD2 TYR 136 8.609 -10.759 -3.588 1037 HE1 TYR 136 HE1 TYR 136 5.137 -12.413 -0.463 1038 HE2 TYR 136 HE2 TYR 136 6.565 -9.415 -3.186 1039 HH TYR 136 HH TYR 136 4.094 -10.027 -2.396 1040 H SER 137 H SER 137 6.515 -15.020 -3.231 1041 HA SER 137 HA SER 137 7.118 -17.115 -1.196 1042 1HB SER 137 1HB SER 137 5.049 -15.181 -1.436 1043 2HB SER 137 2HB SER 137 4.298 -16.765 -1.569 1044 HG SER 137 HG SER 137 5.255 -15.538 0.595 1045 H LYS 138 H LYS 138 5.095 -18.851 -1.434 1046 HA LYS 138 HA LYS 138 4.515 -19.672 -4.148 1047 1HB LYS 138 1HB LYS 138 7.029 -20.234 -3.725 1048 2HB LYS 138 2HB LYS 138 6.398 -21.529 -2.707 1049 1HG LYS 138 1HG LYS 138 5.293 -22.573 -4.519 1050 2HG LYS 138 2HG LYS 138 5.410 -21.132 -5.530 1051 1HD LYS 138 1HD LYS 138 7.902 -22.506 -4.546 1052 2HD LYS 138 2HD LYS 138 7.062 -23.099 -5.979 1053 1HE LYS 138 1HE LYS 138 7.361 -21.035 -7.133 1054 2HE LYS 138 2HE LYS 138 7.842 -20.196 -5.659 1055 1HZ LYS 138 1HZ LYS 138 9.795 -21.683 -5.563 1056 2HZ LYS 138 2HZ LYS 138 9.355 -22.323 -7.074 1057 3HZ LYS 138 3HZ LYS 138 9.784 -20.685 -6.935 1058 H ASP 139 H ASP 139 4.922 -20.699 -0.764 1059 HA ASP 139 HA ASP 139 2.443 -22.317 -1.046 1060 1HB ASP 139 1HB ASP 139 3.302 -23.520 0.993 1061 2HB ASP 139 2HB ASP 139 4.289 -23.744 -0.446 1062 H SER 140 H SER 140 4.155 -19.997 0.926 1063 HA SER 140 HA SER 140 1.747 -19.633 2.620 1064 1HB SER 140 1HB SER 140 3.574 -18.108 3.826 1065 2HB SER 140 2HB SER 140 3.480 -19.838 4.115 1066 HG SER 140 HG SER 140 5.390 -18.346 2.825 1067 HA PRO 141 HA PRO 141 1.160 -15.678 0.552 1068 1HB PRO 141 1HB PRO 141 -0.859 -14.766 2.132 1069 2HB PRO 141 2HB PRO 141 -1.075 -16.046 0.931 1070 1HG PRO 141 1HG PRO 141 -1.079 -16.226 3.855 1071 2HG PRO 141 2HG PRO 141 -1.723 -17.355 2.656 1072 1HD PRO 141 1HD PRO 141 0.759 -17.546 4.115 1073 2HD PRO 141 2HD PRO 141 0.092 -18.683 2.924 1074 H PHE 142 H PHE 142 1.136 -13.298 1.142 1075 HA PHE 142 HA PHE 142 1.830 -12.292 3.710 1076 1HB PHE 142 1HB PHE 142 4.022 -13.520 2.252 1077 2HB PHE 142 2HB PHE 142 4.323 -11.795 2.453 1078 HD1 PHE 142 HD1 PHE 142 3.874 -10.822 4.853 1079 HD2 PHE 142 HD2 PHE 142 4.508 -14.983 4.010 1080 HE1 PHE 142 HE1 PHE 142 4.495 -11.207 7.223 1081 HE2 PHE 142 HE2 PHE 142 5.130 -15.371 6.379 1082 HZ PHE 142 HZ PHE 142 5.122 -13.482 7.986 1083 H GLY 143 H GLY 143 3.308 -10.042 3.064 1084 1HA GLY 143 1HA GLY 143 2.975 -8.778 0.624 1085 2HA GLY 143 2HA GLY 143 1.415 -8.576 1.416 1086 H LEU 144 H LEU 144 1.194 -6.871 2.748 1087 HA LEU 144 HA LEU 144 3.674 -5.400 3.513 1088 1HB LEU 144 1HB LEU 144 0.979 -4.572 2.610 1089 2HB LEU 144 2HB LEU 144 1.648 -3.611 3.928 1090 HG LEU 144 HG LEU 144 3.732 -3.310 2.598 1091 1HD1 LEU 144 1HD1 LEU 144 2.140 -4.960 0.649 1092 2HD1 LEU 144 2HD1 LEU 144 3.334 -3.804 0.059 1093 3HD1 LEU 144 3HD1 LEU 144 3.833 -5.126 1.115 1094 1HD2 LEU 144 1HD2 LEU 144 1.073 -2.432 1.465 1095 2HD2 LEU 144 2HD2 LEU 144 2.192 -1.506 2.467 1096 3HD2 LEU 144 3HD2 LEU 144 2.600 -1.865 0.788 1097 H SER 145 H SER 145 3.833 -4.499 5.611 1098 HA SER 145 HA SER 145 2.451 -6.070 7.688 1099 1HB SER 145 1HB SER 145 4.580 -3.925 7.957 1100 2HB SER 145 2HB SER 145 4.038 -5.016 9.228 1101 HG SER 145 HG SER 145 5.770 -5.438 7.150 1102 H PHE 146 H PHE 146 2.445 -2.840 6.315 1103 HA PHE 146 HA PHE 146 -0.089 -2.153 7.423 1104 1HB PHE 146 1HB PHE 146 0.568 -0.451 9.086 1105 2HB PHE 146 2HB PHE 146 1.164 -2.037 9.567 1106 HD1 PHE 146 HD1 PHE 146 3.565 -2.613 9.315 1107 HD2 PHE 146 HD2 PHE 146 2.064 1.304 8.400 1108 HE1 PHE 146 HE1 PHE 146 5.881 -1.730 9.296 1109 HE2 PHE 146 HE2 PHE 146 4.374 2.193 8.386 1110 HZ PHE 146 HZ PHE 146 6.288 0.666 8.820 1111 H VAL 147 H VAL 147 -0.373 0.396 7.230 1112 HA VAL 147 HA VAL 147 1.411 1.621 5.231 1113 HB VAL 147 HB VAL 147 -0.420 2.029 3.620 1114 1HG1 VAL 147 1HG1 VAL 147 1.058 -0.074 3.576 1115 2HG1 VAL 147 2HG1 VAL 147 -0.337 -0.930 4.230 1116 3HG1 VAL 147 3HG1 VAL 147 -0.444 -0.144 2.654 1117 1HG2 VAL 147 1HG2 VAL 147 -1.990 0.467 5.674 1118 2HG2 VAL 147 2HG2 VAL 147 -2.404 2.003 4.911 1119 3HG2 VAL 147 3HG2 VAL 147 -2.499 0.505 3.985 1120 H ARG 148 H ARG 148 1.499 3.825 5.627 1121 HA ARG 148 HA ARG 148 -0.820 5.104 6.990 1122 1HB ARG 148 1HB ARG 148 1.946 5.761 7.976 1123 2HB ARG 148 2HB ARG 148 0.405 5.950 8.793 1124 1HG ARG 148 1HG ARG 148 0.338 3.315 8.634 1125 2HG ARG 148 2HG ARG 148 2.086 3.491 8.487 1126 1HD ARG 148 1HD ARG 148 0.758 5.069 10.635 1127 2HD ARG 148 2HD ARG 148 0.855 3.324 10.875 1128 HE ARG 148 HE ARG 148 3.415 4.282 10.048 1129 1HH1 ARG 148 1HH1 ARG 148 1.235 4.389 12.779 1130 2HH1 ARG 148 2HH1 ARG 148 2.518 4.578 13.922 1131 1HH2 ARG 148 1HH2 ARG 148 5.041 4.530 11.560 1132 2HH2 ARG 148 2HH2 ARG 148 4.650 4.657 13.241 1133 H PHE 149 H PHE 149 -1.352 6.634 5.490 1134 HA PHE 149 HA PHE 149 0.726 8.032 3.936 1135 1HB PHE 149 1HB PHE 149 -2.288 8.402 4.006 1136 2HB PHE 149 2HB PHE 149 -1.192 9.157 2.851 1137 HD1 PHE 149 HD1 PHE 149 0.328 7.551 1.464 1138 HD2 PHE 149 HD2 PHE 149 -3.232 6.308 3.517 1139 HE1 PHE 149 HE1 PHE 149 0.184 5.548 0.006 1140 HE2 PHE 149 HE2 PHE 149 -3.373 4.309 2.052 1141 HZ PHE 149 HZ PHE 149 -1.666 3.931 0.303 1142 H HIS 150 H HIS 150 0.970 10.384 4.036 1143 HA HIS 150 HA HIS 150 -0.319 11.766 6.311 1144 1HB HIS 150 1HB HIS 150 2.382 12.630 6.475 1145 2HB HIS 150 2HB HIS 150 1.449 11.779 7.693 1146 HD1 HIS 150 HD1 HIS 150 4.522 11.518 6.027 1147 HD2 HIS 150 HD2 HIS 150 1.571 8.736 6.971 1148 HE1 HIS 150 HE1 HIS 150 5.621 9.239 5.903 1149 H SER 151 H SER 151 -0.793 13.802 5.806 1150 HA SER 151 HA SER 151 -0.140 14.801 3.141 1151 1HB SER 151 1HB SER 151 -2.284 15.106 4.854 1152 2HB SER 151 2HB SER 151 -1.476 16.663 4.977 1153 HG SER 151 HG SER 151 -2.927 16.651 3.238 Start of MODEL 10 1 H MET 1 H MET 1 -3.527 16.711 15.080 2 HA MET 1 HA MET 1 -2.951 14.993 13.590 3 1HB MET 1 1HB MET 1 -5.150 13.772 13.397 4 2HB MET 1 2HB MET 1 -4.830 14.414 15.008 5 1HG MET 1 1HG MET 1 -6.463 16.034 14.842 6 2HG MET 1 2HG MET 1 -6.296 16.174 13.092 7 1HE MET 1 1HE MET 1 -7.107 14.301 16.008 8 2HE MET 1 2HE MET 1 -8.848 14.110 15.811 9 3HE MET 1 3HE MET 1 -7.776 12.752 15.475 10 HA PRO 2 HA PRO 2 -4.074 16.831 9.457 11 1HB PRO 2 1HB PRO 2 -1.566 17.603 8.705 12 2HB PRO 2 2HB PRO 2 -2.663 18.633 9.637 13 1HG PRO 2 1HG PRO 2 -0.201 17.292 10.492 14 2HG PRO 2 2HG PRO 2 -1.067 18.636 11.244 15 1HD PRO 2 1HD PRO 2 -1.106 15.847 12.001 16 2HD PRO 2 2HD PRO 2 -1.935 17.209 12.786 17 H GLU 3 H GLU 3 -2.750 14.100 10.546 18 HA GLU 3 HA GLU 3 -1.213 13.182 8.220 19 1HB GLU 3 1HB GLU 3 -0.997 12.357 10.653 20 2HB GLU 3 2HB GLU 3 -2.482 11.452 10.358 21 1HG GLU 3 1HG GLU 3 -1.457 9.961 8.961 22 2HG GLU 3 2HG GLU 3 -0.384 11.183 8.279 23 H ILE 4 H ILE 4 -1.953 11.235 7.030 24 HA ILE 4 HA ILE 4 -4.624 11.660 5.939 25 HB ILE 4 HB ILE 4 -2.583 9.500 5.391 26 1HG1 ILE 4 1HG1 ILE 4 -1.649 11.766 5.054 27 2HG1 ILE 4 2HG1 ILE 4 -1.824 10.910 3.526 28 1HG2 ILE 4 1HG2 ILE 4 -5.148 10.326 4.106 29 2HG2 ILE 4 2HG2 ILE 4 -3.840 9.755 3.067 30 3HG2 ILE 4 3HG2 ILE 4 -4.478 8.710 4.337 31 1HD1 ILE 4 1HD1 ILE 4 -3.843 12.901 4.612 32 2HD1 ILE 4 2HD1 ILE 4 -2.607 13.288 3.415 33 3HD1 ILE 4 3HD1 ILE 4 -3.872 12.123 3.029 34 H ARG 5 H ARG 5 -6.401 10.255 6.201 35 HA ARG 5 HA ARG 5 -6.023 8.048 8.190 36 1HB ARG 5 1HB ARG 5 -7.339 10.221 8.863 37 2HB ARG 5 2HB ARG 5 -8.634 9.504 7.904 38 1HG ARG 5 1HG ARG 5 -9.132 8.497 9.905 39 2HG ARG 5 2HG ARG 5 -7.921 7.342 9.345 40 1HD ARG 5 1HD ARG 5 -6.241 9.030 10.503 41 2HD ARG 5 2HD ARG 5 -7.675 9.486 11.424 42 HE ARG 5 HE ARG 5 -7.614 6.699 11.526 43 1HH1 ARG 5 1HH1 ARG 5 -5.455 9.302 12.415 44 2HH1 ARG 5 2HH1 ARG 5 -4.729 8.396 13.695 45 1HH2 ARG 5 1HH2 ARG 5 -6.647 5.564 13.193 46 2HH2 ARG 5 2HH2 ARG 5 -5.395 6.302 14.134 47 H LEU 6 H LEU 6 -6.589 6.083 7.433 48 HA LEU 6 HA LEU 6 -7.913 5.842 4.823 49 1HB LEU 6 1HB LEU 6 -6.139 4.263 6.425 50 2HB LEU 6 2HB LEU 6 -7.587 3.306 6.130 51 HG LEU 6 HG LEU 6 -7.369 3.749 3.696 52 1HD1 LEU 6 1HD1 LEU 6 -6.013 5.940 4.220 53 2HD1 LEU 6 2HD1 LEU 6 -4.622 4.859 4.233 54 3HD1 LEU 6 3HD1 LEU 6 -5.611 5.004 2.780 55 1HD2 LEU 6 1HD2 LEU 6 -5.123 2.500 5.258 56 2HD2 LEU 6 2HD2 LEU 6 -6.387 1.714 4.311 57 3HD2 LEU 6 3HD2 LEU 6 -5.058 2.538 3.496 58 H ARG 7 H ARG 7 -9.953 4.851 4.502 59 HA ARG 7 HA ARG 7 -11.691 4.809 6.927 60 1HB ARG 7 1HB ARG 7 -12.270 6.342 4.989 61 2HB ARG 7 2HB ARG 7 -12.565 4.891 4.030 62 1HG ARG 7 1HG ARG 7 -14.296 4.161 5.572 63 2HG ARG 7 2HG ARG 7 -13.939 5.500 6.663 64 1HD ARG 7 1HD ARG 7 -14.715 7.118 5.071 65 2HD ARG 7 2HD ARG 7 -14.804 5.907 3.792 66 HE ARG 7 HE ARG 7 -16.891 5.224 4.648 67 1HH1 ARG 7 1HH1 ARG 7 -15.195 7.168 7.010 68 2HH1 ARG 7 2HH1 ARG 7 -16.560 7.258 8.065 69 1HH2 ARG 7 1HH2 ARG 7 -18.631 5.359 6.046 70 2HH2 ARG 7 2HH2 ARG 7 -18.487 6.244 7.528 71 H HIS 8 H HIS 8 -11.423 3.110 3.814 72 HA HIS 8 HA HIS 8 -11.465 0.501 5.111 73 1HB HIS 8 1HB HIS 8 -13.549 -0.242 3.930 74 2HB HIS 8 2HB HIS 8 -13.852 0.959 5.184 75 HD1 HIS 8 HD1 HIS 8 -15.533 2.603 4.386 76 HD2 HIS 8 HD2 HIS 8 -12.984 1.424 1.306 77 HE1 HIS 8 HE1 HIS 8 -16.229 3.920 2.338 78 H VAL 9 H VAL 9 -11.744 -1.214 3.196 79 HA VAL 9 HA VAL 9 -9.763 -0.425 1.176 80 HB VAL 9 HB VAL 9 -9.563 -2.612 2.286 81 1HG1 VAL 9 1HG1 VAL 9 -12.324 -2.716 2.047 82 2HG1 VAL 9 2HG1 VAL 9 -11.775 -3.903 0.863 83 3HG1 VAL 9 3HG1 VAL 9 -11.285 -4.047 2.550 84 1HG2 VAL 9 1HG2 VAL 9 -8.749 -2.326 -0.049 85 2HG2 VAL 9 2HG2 VAL 9 -9.264 -3.981 0.278 86 3HG2 VAL 9 3HG2 VAL 9 -10.309 -2.898 -0.641 87 H VAL 10 H VAL 10 -10.968 1.055 -0.124 88 HA VAL 10 HA VAL 10 -13.549 0.703 -1.169 89 HB VAL 10 HB VAL 10 -12.559 2.818 -1.563 90 1HG1 VAL 10 1HG1 VAL 10 -10.159 1.429 -1.857 91 2HG1 VAL 10 2HG1 VAL 10 -10.443 2.117 -3.452 92 3HG1 VAL 10 3HG1 VAL 10 -10.385 3.163 -2.037 93 1HG2 VAL 10 1HG2 VAL 10 -13.882 1.701 -3.525 94 2HG2 VAL 10 2HG2 VAL 10 -12.993 3.187 -3.851 95 3HG2 VAL 10 3HG2 VAL 10 -12.313 1.633 -4.327 96 H SER 11 H SER 11 -10.510 -0.209 -2.889 97 HA SER 11 HA SER 11 -12.146 -2.310 -4.234 98 1HB SER 11 1HB SER 11 -10.438 -0.221 -5.423 99 2HB SER 11 2HB SER 11 -10.128 -1.845 -6.033 100 HG SER 11 HG SER 11 -11.959 -0.355 -6.894 101 H CYS 12 H CYS 12 -10.713 -4.220 -4.922 102 HA CYS 12 HA CYS 12 -8.103 -4.399 -3.569 103 1HB CYS 12 1HB CYS 12 -8.840 -6.271 -2.121 104 2HB CYS 12 2HB CYS 12 -9.586 -4.747 -1.685 105 HG CYS 12 HG CYS 12 -11.163 -7.125 -2.234 106 H SER 13 H SER 13 -6.860 -6.078 -4.319 107 HA SER 13 HA SER 13 -8.087 -8.221 -5.947 108 1HB SER 13 1HB SER 13 -5.793 -6.714 -7.164 109 2HB SER 13 2HB SER 13 -7.017 -7.703 -7.955 110 HG SER 13 HG SER 13 -7.354 -5.449 -8.264 111 H SER 14 H SER 14 -7.098 -8.805 -3.597 112 HA SER 14 HA SER 14 -5.266 -10.796 -3.668 113 1HB SER 14 1HB SER 14 -3.139 -9.471 -2.815 114 2HB SER 14 2HB SER 14 -3.409 -9.756 -4.527 115 HG SER 14 HG SER 14 -4.546 -7.461 -3.383 116 H GLN 15 H GLN 15 -7.236 -10.424 -1.958 117 HA GLN 15 HA GLN 15 -5.881 -9.729 0.627 118 1HB GLN 15 1HB GLN 15 -8.838 -9.608 0.664 119 2HB GLN 15 2HB GLN 15 -7.669 -8.507 1.360 120 1HG GLN 15 1HG GLN 15 -8.499 -8.618 -1.550 121 2HG GLN 15 2HG GLN 15 -8.982 -7.391 -0.383 122 1HE2 GLN 15 2HE2 GLN 15 -6.261 -7.274 0.877 123 2HE2 GLN 15 1HE2 GLN 15 -5.284 -6.456 -0.243 124 H ASP 16 H ASP 16 -6.120 -11.136 2.299 125 HA ASP 16 HA ASP 16 -7.258 -13.792 1.674 126 1HB ASP 16 1HB ASP 16 -5.020 -13.040 3.000 127 2HB ASP 16 2HB ASP 16 -6.132 -13.201 4.352 128 H SER 17 H SER 17 -8.050 -14.547 4.274 129 HA SER 17 HA SER 17 -10.542 -12.957 4.540 130 1HB SER 17 1HB SER 17 -9.761 -15.774 5.159 131 2HB SER 17 2HB SER 17 -11.017 -15.037 6.149 132 HG SER 17 HG SER 17 -12.268 -15.514 4.531 133 H THR 18 H THR 18 -8.370 -14.690 6.808 134 HA THR 18 HA THR 18 -9.106 -13.042 9.050 135 HB THR 18 HB THR 18 -6.646 -14.049 9.736 136 HG1 THR 18 HG1 THR 18 -6.160 -15.706 8.536 137 1HG2 THR 18 1HG2 THR 18 -9.043 -14.371 10.695 138 2HG2 THR 18 2HG2 THR 18 -9.066 -15.834 9.712 139 3HG2 THR 18 3HG2 THR 18 -7.848 -15.639 10.972 140 H HIS 19 H HIS 19 -6.033 -13.190 7.208 141 HA HIS 19 HA HIS 19 -5.346 -10.490 8.206 142 1HB HIS 19 1HB HIS 19 -3.803 -12.535 6.587 143 2HB HIS 19 2HB HIS 19 -3.170 -10.941 7.003 144 HD1 HIS 19 HD1 HIS 19 -1.996 -10.784 9.200 145 HD2 HIS 19 HD2 HIS 19 -4.570 -14.060 9.068 146 HE1 HIS 19 HE1 HIS 19 -1.664 -12.044 11.372 147 H CYS 20 H CYS 20 -7.334 -9.789 6.829 148 HA CYS 20 HA CYS 20 -6.799 -9.627 3.941 149 1HB CYS 20 1HB CYS 20 -9.029 -8.551 3.838 150 2HB CYS 20 2HB CYS 20 -9.090 -10.085 4.698 151 HG CYS 20 HG CYS 20 -8.727 -7.633 6.525 152 H ALA 21 H ALA 21 -7.021 -7.461 2.874 153 HA ALA 21 HA ALA 21 -5.076 -5.622 3.815 154 1HB ALA 21 1HB ALA 21 -7.149 -5.659 1.672 155 2HB ALA 21 2HB ALA 21 -6.484 -4.086 2.113 156 3HB ALA 21 3HB ALA 21 -5.413 -5.371 1.553 157 H GLU 22 H GLU 22 -8.495 -5.886 4.530 158 HA GLU 22 HA GLU 22 -8.973 -3.183 5.343 159 1HB GLU 22 1HB GLU 22 -10.484 -5.504 5.192 160 2HB GLU 22 2HB GLU 22 -10.398 -5.205 6.928 161 1HG GLU 22 1HG GLU 22 -11.192 -2.895 6.580 162 2HG GLU 22 2HG GLU 22 -11.260 -3.176 4.839 163 H ASN 23 H ASN 23 -7.178 -5.758 6.854 164 HA ASN 23 HA ASN 23 -7.362 -4.847 9.577 165 1HB ASN 23 1HB ASN 23 -5.267 -6.436 8.101 166 2HB ASN 23 2HB ASN 23 -5.192 -6.122 9.833 167 1HD2 ASN 23 2HD2 ASN 23 -5.862 -8.610 8.002 168 2HD2 ASN 23 1HD2 ASN 23 -7.226 -9.270 8.768 169 H LEU 24 H LEU 24 -5.786 -3.582 6.814 170 HA LEU 24 HA LEU 24 -3.575 -2.249 8.041 171 1HB LEU 24 1HB LEU 24 -5.154 -1.394 5.594 172 2HB LEU 24 2HB LEU 24 -3.499 -0.936 5.993 173 HG LEU 24 HG LEU 24 -4.208 -3.852 5.745 174 1HD1 LEU 24 1HD1 LEU 24 -4.961 -2.397 3.705 175 2HD1 LEU 24 2HD1 LEU 24 -3.232 -2.289 3.377 176 3HD1 LEU 24 3HD1 LEU 24 -4.025 -3.863 3.423 177 1HD2 LEU 24 1HD2 LEU 24 -1.791 -2.123 5.765 178 2HD2 LEU 24 2HD2 LEU 24 -2.026 -3.740 6.428 179 3HD2 LEU 24 3HD2 LEU 24 -1.747 -3.528 4.700 180 H LEU 25 H LEU 25 -7.016 -1.620 7.874 181 HA LEU 25 HA LEU 25 -7.046 1.159 8.458 182 1HB LEU 25 1HB LEU 25 -8.908 -1.158 8.882 183 2HB LEU 25 2HB LEU 25 -9.269 0.367 9.669 184 HG LEU 25 HG LEU 25 -10.384 0.097 7.439 185 1HD1 LEU 25 1HD1 LEU 25 -8.533 2.338 8.109 186 2HD1 LEU 25 2HD1 LEU 25 -9.279 2.335 6.513 187 3HD1 LEU 25 3HD1 LEU 25 -10.286 2.331 7.958 188 1HD2 LEU 25 1HD2 LEU 25 -8.528 -1.145 6.339 189 2HD2 LEU 25 2HD2 LEU 25 -9.025 0.267 5.406 190 3HD2 LEU 25 3HD2 LEU 25 -7.550 0.323 6.371 191 H LYS 26 H LYS 26 -6.190 -1.616 10.379 192 HA LYS 26 HA LYS 26 -6.150 0.105 12.829 193 1HB LYS 26 1HB LYS 26 -6.100 -2.929 12.789 194 2HB LYS 26 2HB LYS 26 -6.384 -1.872 14.169 195 1HG LYS 26 1HG LYS 26 -8.580 -2.292 13.714 196 2HG LYS 26 2HG LYS 26 -8.362 -1.027 12.505 197 1HD LYS 26 1HD LYS 26 -7.607 -2.917 10.922 198 2HD LYS 26 2HD LYS 26 -8.307 -4.019 12.108 199 1HE LYS 26 1HE LYS 26 -9.988 -1.709 11.270 200 2HE LYS 26 2HE LYS 26 -9.747 -2.990 10.082 201 1HZ LYS 26 1HZ LYS 26 -10.374 -4.569 11.925 202 2HZ LYS 26 2HZ LYS 26 -10.905 -3.211 12.797 203 3HZ LYS 26 3HZ LYS 26 -11.628 -3.607 11.311 204 H ALA 27 H ALA 27 -4.092 0.778 11.538 205 HA ALA 27 HA ALA 27 -1.827 -0.858 11.223 206 1HB ALA 27 1HB ALA 27 -2.286 2.049 11.644 207 2HB ALA 27 2HB ALA 27 -0.647 1.463 11.929 208 3HB ALA 27 3HB ALA 27 -1.409 1.222 10.356 209 H ASP 28 H ASP 28 -3.238 0.367 14.178 210 HA ASP 28 HA ASP 28 -0.900 -0.720 15.695 211 1HB ASP 28 1HB ASP 28 -1.757 1.820 15.842 212 2HB ASP 28 2HB ASP 28 -2.849 1.101 17.026 213 H THR 29 H THR 29 -1.951 -2.859 15.486 214 HA THR 29 HA THR 29 -3.713 -3.370 17.766 215 HB THR 29 HB THR 29 -5.314 -4.684 16.157 216 HG1 THR 29 HG1 THR 29 -5.027 -4.299 14.135 217 1HG2 THR 29 1HG2 THR 29 -5.687 -2.511 17.549 218 2HG2 THR 29 2HG2 THR 29 -5.552 -1.691 15.994 219 3HG2 THR 29 3HG2 THR 29 -6.820 -2.890 16.252 220 H TYR 30 H TYR 30 -3.556 -5.510 14.939 221 HA TYR 30 HA TYR 30 -1.197 -6.941 15.674 222 1HB TYR 30 1HB TYR 30 -2.267 -8.950 16.708 223 2HB TYR 30 2HB TYR 30 -2.410 -7.508 17.713 224 HD1 TYR 30 HD1 TYR 30 -4.555 -6.296 17.893 225 HD2 TYR 30 HD2 TYR 30 -4.208 -9.940 15.643 226 HE1 TYR 30 HE1 TYR 30 -7.025 -6.514 17.864 227 HE2 TYR 30 HE2 TYR 30 -6.678 -10.157 15.615 228 HH TYR 30 HH TYR 30 -8.702 -8.368 17.622 229 H ARG 31 H ARG 31 -2.728 -6.105 13.291 230 HA ARG 31 HA ARG 31 -2.680 -8.708 11.882 231 1HB ARG 31 1HB ARG 31 -5.088 -6.909 12.130 232 2HB ARG 31 2HB ARG 31 -4.863 -7.910 10.696 233 1HG ARG 31 1HG ARG 31 -4.884 -9.928 11.982 234 2HG ARG 31 2HG ARG 31 -4.741 -9.040 13.498 235 1HD ARG 31 1HD ARG 31 -6.965 -8.610 13.597 236 2HD ARG 31 2HD ARG 31 -7.065 -8.244 11.876 237 HE ARG 31 HE ARG 31 -6.684 -11.051 12.178 238 1HH1 ARG 31 1HH1 ARG 31 -9.087 -8.580 12.779 239 2HH1 ARG 31 2HH1 ARG 31 -10.409 -9.680 12.597 240 1HH2 ARG 31 1HH2 ARG 31 -8.424 -12.440 11.955 241 2HH2 ARG 31 2HH2 ARG 31 -10.041 -11.842 12.138 242 H LYS 32 H LYS 32 -1.960 -8.471 9.760 243 HA LYS 32 HA LYS 32 -1.580 -5.665 8.782 244 1HB LYS 32 1HB LYS 32 0.377 -7.875 8.150 245 2HB LYS 32 2HB LYS 32 0.611 -6.135 8.054 246 1HG LYS 32 1HG LYS 32 1.522 -6.182 10.119 247 2HG LYS 32 2HG LYS 32 -0.039 -6.673 10.760 248 1HD LYS 32 1HD LYS 32 1.599 -8.797 9.475 249 2HD LYS 32 2HD LYS 32 2.177 -8.180 11.024 250 1HE LYS 32 1HE LYS 32 -0.427 -8.468 11.637 251 2HE LYS 32 2HE LYS 32 -0.294 -9.721 10.403 252 1HZ LYS 32 1HZ LYS 32 1.815 -10.373 11.705 253 2HZ LYS 32 2HZ LYS 32 1.113 -9.497 12.979 254 3HZ LYS 32 3HZ LYS 32 0.301 -10.832 12.312 255 H TRP 33 H TRP 33 -0.473 -6.466 6.226 256 HA TRP 33 HA TRP 33 -2.968 -7.552 5.012 257 1HB TRP 33 1HB TRP 33 -1.994 -5.410 4.073 258 2HB TRP 33 2HB TRP 33 -0.584 -6.333 3.605 259 HD1 TRP 33 HD1 TRP 33 -4.007 -7.943 3.269 260 HE1 TRP 33 HE1 TRP 33 -4.536 -8.259 0.763 261 HE3 TRP 33 HE3 TRP 33 -0.142 -5.333 1.207 262 HZ2 TRP 33 HZ2 TRP 33 -3.483 -7.471 -1.747 263 HZ3 TRP 33 HZ3 TRP 33 0.068 -5.148 -1.261 264 HH2 TRP 33 HH2 TRP 33 -1.601 -6.207 -2.735 265 H ARG 34 H ARG 34 -3.008 -9.492 3.971 266 HA ARG 34 HA ARG 34 -0.463 -10.802 3.299 267 1HB ARG 34 1HB ARG 34 -0.931 -11.692 5.502 268 2HB ARG 34 2HB ARG 34 -2.613 -11.992 5.076 269 1HG ARG 34 1HG ARG 34 -0.607 -13.275 3.321 270 2HG ARG 34 2HG ARG 34 -0.673 -13.892 4.972 271 1HD ARG 34 1HD ARG 34 -3.141 -13.525 3.273 272 2HD ARG 34 2HD ARG 34 -2.235 -15.027 3.308 273 HE ARG 34 HE ARG 34 -4.039 -14.088 5.362 274 1HH1 ARG 34 1HH1 ARG 34 -1.089 -15.879 4.833 275 2HH1 ARG 34 2HH1 ARG 34 -1.268 -16.802 6.282 276 1HH2 ARG 34 1HH2 ARG 34 -4.233 -15.300 7.231 277 2HH2 ARG 34 2HH2 ARG 34 -3.030 -16.482 7.625 278 H ALA 35 H ALA 35 -0.721 -11.398 1.177 279 HA ALA 35 HA ALA 35 -3.089 -11.097 -0.322 280 1HB ALA 35 1HB ALA 35 -0.652 -11.484 -1.121 281 2HB ALA 35 2HB ALA 35 -1.022 -13.204 -0.990 282 3HB ALA 35 3HB ALA 35 -1.948 -12.184 -2.091 283 H ALA 36 H ALA 36 -4.556 -12.672 -1.208 284 HA ALA 36 HA ALA 36 -5.364 -14.704 0.720 285 1HB ALA 36 1HB ALA 36 -6.590 -13.208 -1.349 286 2HB ALA 36 2HB ALA 36 -6.764 -14.904 -1.795 287 3HB ALA 36 3HB ALA 36 -7.365 -14.336 -0.238 288 H LYS 37 H LYS 37 -3.517 -14.652 -2.242 289 HA LYS 37 HA LYS 37 -3.770 -17.562 -2.625 290 1HB LYS 37 1HB LYS 37 -3.514 -15.552 -4.416 291 2HB LYS 37 2HB LYS 37 -1.813 -15.967 -4.203 292 1HG LYS 37 1HG LYS 37 -2.269 -17.535 -5.798 293 2HG LYS 37 2HG LYS 37 -2.885 -18.452 -4.424 294 1HD LYS 37 1HD LYS 37 -5.150 -17.599 -4.840 295 2HD LYS 37 2HD LYS 37 -4.550 -16.622 -6.181 296 1HE LYS 37 1HE LYS 37 -5.250 -18.472 -7.367 297 2HE LYS 37 2HE LYS 37 -3.609 -18.992 -6.987 298 1HZ LYS 37 1HZ LYS 37 -4.631 -19.966 -4.893 299 2HZ LYS 37 2HZ LYS 37 -6.133 -19.763 -5.660 300 3HZ LYS 37 3HZ LYS 37 -4.957 -20.766 -6.355 301 H ALA 38 H ALA 38 -1.094 -18.002 -3.540 302 HA ALA 38 HA ALA 38 0.670 -17.401 -1.254 303 1HB ALA 38 1HB ALA 38 -0.732 -19.907 -1.548 304 2HB ALA 38 2HB ALA 38 1.001 -20.182 -1.724 305 3HB ALA 38 3HB ALA 38 0.373 -19.407 -0.269 306 H GLY 39 H GLY 39 2.898 -18.464 -1.741 307 1HA GLY 39 1HA GLY 39 4.594 -19.078 -3.306 308 2HA GLY 39 2HA GLY 39 3.459 -18.823 -4.625 309 H GLU 40 H GLU 40 2.863 -16.137 -3.079 310 HA GLU 40 HA GLU 40 3.534 -13.941 -3.295 311 1HB GLU 40 1HB GLU 40 6.267 -15.224 -3.227 312 2HB GLU 40 2HB GLU 40 5.937 -13.510 -3.017 313 1HG GLU 40 1HG GLU 40 5.627 -13.911 -0.808 314 2HG GLU 40 2HG GLU 40 4.181 -14.816 -1.231 315 H LYS 41 H LYS 41 3.177 -12.848 -5.113 316 HA LYS 41 HA LYS 41 5.049 -13.085 -7.372 317 1HB LYS 41 1HB LYS 41 3.316 -14.807 -7.849 318 2HB LYS 41 2HB LYS 41 2.071 -13.564 -7.747 319 1HG LYS 41 1HG LYS 41 3.089 -12.353 -9.620 320 2HG LYS 41 2HG LYS 41 4.393 -13.537 -9.700 321 1HD LYS 41 1HD LYS 41 1.602 -14.579 -9.832 322 2HD LYS 41 2HD LYS 41 2.213 -13.726 -11.251 323 1HE LYS 41 1HE LYS 41 4.345 -15.279 -10.782 324 2HE LYS 41 2HE LYS 41 3.110 -16.310 -10.059 325 1HZ LYS 41 1HZ LYS 41 1.828 -15.961 -12.183 326 2HZ LYS 41 2HZ LYS 41 3.253 -15.309 -12.841 327 3HZ LYS 41 3HZ LYS 41 3.221 -16.921 -12.306 328 H THR 42 H THR 42 1.739 -11.784 -6.998 329 HA THR 42 HA THR 42 2.730 -9.037 -6.746 330 HB THR 42 HB THR 42 1.433 -8.290 -8.797 331 HG1 THR 42 HG1 THR 42 1.554 -11.067 -9.352 332 1HG2 THR 42 1HG2 THR 42 4.000 -8.835 -8.618 333 2HG2 THR 42 2HG2 THR 42 3.587 -10.184 -9.675 334 3HG2 THR 42 3HG2 THR 42 3.276 -8.528 -10.197 335 H ILE 43 H ILE 43 1.097 -7.702 -5.866 336 HA ILE 43 HA ILE 43 -1.663 -8.794 -5.754 337 HB ILE 43 HB ILE 43 -1.682 -8.147 -3.264 338 1HG1 ILE 43 1HG1 ILE 43 1.296 -8.564 -3.604 339 2HG1 ILE 43 2HG1 ILE 43 0.528 -7.016 -3.251 340 1HG2 ILE 43 1HG2 ILE 43 -1.546 -10.483 -4.462 341 2HG2 ILE 43 2HG2 ILE 43 0.061 -10.515 -3.738 342 3HG2 ILE 43 3HG2 ILE 43 -1.363 -10.352 -2.716 343 1HD1 ILE 43 1HD1 ILE 43 -0.598 -8.470 -1.291 344 2HD1 ILE 43 2HD1 ILE 43 0.885 -9.396 -1.480 345 3HD1 ILE 43 3HD1 ILE 43 0.965 -7.681 -1.080 346 H SER 44 H SER 44 -3.250 -7.189 -5.720 347 HA SER 44 HA SER 44 -2.226 -4.388 -5.422 348 1HB SER 44 1HB SER 44 -4.245 -5.386 -7.408 349 2HB SER 44 2HB SER 44 -3.838 -3.700 -7.167 350 HG SER 44 HG SER 44 -2.653 -4.654 -8.887 351 H VAL 45 H VAL 45 -3.139 -3.543 -3.685 352 HA VAL 45 HA VAL 45 -5.976 -4.219 -3.031 353 HB VAL 45 HB VAL 45 -4.441 -5.016 -1.311 354 1HG1 VAL 45 1HG1 VAL 45 -2.616 -3.356 -1.799 355 2HG1 VAL 45 2HG1 VAL 45 -3.588 -2.131 -0.985 356 3HG1 VAL 45 3HG1 VAL 45 -2.981 -3.517 -0.082 357 1HG2 VAL 45 1HG2 VAL 45 -6.191 -2.657 -0.659 358 2HG2 VAL 45 2HG2 VAL 45 -6.460 -4.365 -0.321 359 3HG2 VAL 45 3HG2 VAL 45 -5.271 -3.459 0.612 360 H VAL 46 H VAL 46 -7.355 -2.473 -3.212 361 HA VAL 46 HA VAL 46 -6.139 0.244 -3.434 362 HB VAL 46 HB VAL 46 -8.983 -0.429 -4.138 363 1HG1 VAL 46 1HG1 VAL 46 -6.956 1.629 -5.034 364 2HG1 VAL 46 2HG1 VAL 46 -8.542 1.430 -5.782 365 3HG1 VAL 46 3HG1 VAL 46 -8.418 1.912 -4.089 366 1HG2 VAL 46 1HG2 VAL 46 -6.545 -1.370 -5.483 367 2HG2 VAL 46 2HG2 VAL 46 -8.211 -1.888 -5.708 368 3HG2 VAL 46 3HG2 VAL 46 -7.613 -0.462 -6.553 369 H LEU 47 H LEU 47 -6.222 1.349 -1.549 370 HA LEU 47 HA LEU 47 -8.389 0.737 0.386 371 1HB LEU 47 1HB LEU 47 -6.058 2.581 0.882 372 2HB LEU 47 2HB LEU 47 -7.034 1.703 2.060 373 HG LEU 47 HG LEU 47 -6.106 -0.372 0.561 374 1HD1 LEU 47 1HD1 LEU 47 -4.279 1.943 0.176 375 2HD1 LEU 47 2HD1 LEU 47 -3.512 0.404 0.569 376 3HD1 LEU 47 3HD1 LEU 47 -4.548 0.535 -0.852 377 1HD2 LEU 47 1HD2 LEU 47 -5.992 0.174 3.101 378 2HD2 LEU 47 2HD2 LEU 47 -4.748 -0.880 2.429 379 3HD2 LEU 47 3HD2 LEU 47 -4.388 0.816 2.744 380 H GLN 48 H GLN 48 -9.231 2.665 1.638 381 HA GLN 48 HA GLN 48 -9.837 4.872 -0.273 382 1HB GLN 48 1HB GLN 48 -11.840 3.615 0.162 383 2HB GLN 48 2HB GLN 48 -11.505 3.551 1.885 384 1HG GLN 48 1HG GLN 48 -13.263 5.184 1.490 385 2HG GLN 48 2HG GLN 48 -11.808 6.040 1.990 386 1HE2 GLN 48 1HE2 GLN 48 -13.705 7.496 0.566 387 2HE2 GLN 48 2HE2 GLN 48 -13.148 7.800 -1.008 388 H LEU 49 H LEU 49 -10.022 6.998 0.626 389 HA LEU 49 HA LEU 49 -8.429 7.402 3.111 390 1HB LEU 49 1HB LEU 49 -9.010 9.165 0.711 391 2HB LEU 49 2HB LEU 49 -8.348 9.813 2.208 392 HG LEU 49 HG LEU 49 -6.537 9.334 0.635 393 1HD1 LEU 49 1HD1 LEU 49 -6.425 8.769 3.197 394 2HD1 LEU 49 2HD1 LEU 49 -6.364 7.099 2.634 395 3HD1 LEU 49 3HD1 LEU 49 -5.120 8.244 2.133 396 1HD2 LEU 49 1HD2 LEU 49 -8.079 7.302 -0.273 397 2HD2 LEU 49 2HD2 LEU 49 -6.344 7.397 -0.562 398 3HD2 LEU 49 3HD2 LEU 49 -6.964 6.398 0.751 399 H GLU 50 H GLU 50 -9.513 8.253 4.846 400 HA GLU 50 HA GLU 50 -12.406 8.684 4.629 401 1HB GLU 50 1HB GLU 50 -10.854 7.713 6.625 402 2HB GLU 50 2HB GLU 50 -11.000 9.391 7.147 403 1HG GLU 50 1HG GLU 50 -13.446 9.245 7.012 404 2HG GLU 50 2HG GLU 50 -13.327 7.584 6.429 405 H LYS 51 H LYS 51 -11.018 10.603 3.094 406 HA LYS 51 HA LYS 51 -12.205 13.027 3.614 407 1HB LYS 51 1HB LYS 51 -10.343 14.403 4.604 408 2HB LYS 51 2HB LYS 51 -11.006 13.249 5.754 409 1HG LYS 51 1HG LYS 51 -9.114 11.665 4.859 410 2HG LYS 51 2HG LYS 51 -8.384 13.160 4.281 411 1HD LYS 51 1HD LYS 51 -8.970 13.935 6.786 412 2HD LYS 51 2HD LYS 51 -8.775 12.204 7.071 413 1HE LYS 51 1HE LYS 51 -6.532 12.221 6.509 414 2HE LYS 51 2HE LYS 51 -6.714 13.575 5.395 415 1HZ LYS 51 1HZ LYS 51 -6.939 13.806 8.345 416 2HZ LYS 51 2HZ LYS 51 -5.525 14.141 7.471 417 3HZ LYS 51 3HZ LYS 51 -6.919 15.078 7.218 418 H GLU 52 H GLU 52 -12.004 13.820 1.512 419 HA GLU 52 HA GLU 52 -9.887 13.000 -0.262 420 1HB GLU 52 1HB GLU 52 -12.235 14.087 -0.797 421 2HB GLU 52 2HB GLU 52 -11.335 15.591 -0.635 422 1HG GLU 52 1HG GLU 52 -9.822 15.001 -2.384 423 2HG GLU 52 2HG GLU 52 -10.407 13.339 -2.416 424 H GLU 53 H GLU 53 -7.858 13.474 0.372 425 HA GLU 53 HA GLU 53 -7.196 16.316 0.895 426 1HB GLU 53 1HB GLU 53 -5.860 15.800 2.807 427 2HB GLU 53 2HB GLU 53 -7.384 14.958 3.048 428 1HG GLU 53 1HG GLU 53 -4.823 13.715 2.002 429 2HG GLU 53 2HG GLU 53 -5.438 13.568 3.642 430 H GLN 54 H GLN 54 -4.646 16.442 0.991 431 HA GLN 54 HA GLN 54 -3.736 15.327 -1.589 432 1HB GLN 54 1HB GLN 54 -2.357 17.308 0.255 433 2HB GLN 54 2HB GLN 54 -1.903 16.935 -1.408 434 1HG GLN 54 1HG GLN 54 -3.723 18.064 -2.305 435 2HG GLN 54 2HG GLN 54 -4.703 17.847 -0.860 436 1HE2 GLN 54 2HE2 GLN 54 -1.353 19.117 -0.985 437 2HE2 GLN 54 1HE2 GLN 54 -1.746 20.651 -0.373 438 H ILE 55 H ILE 55 -1.182 14.800 -1.473 439 HA ILE 55 HA ILE 55 -0.572 13.286 1.016 440 HB ILE 55 HB ILE 55 -0.270 12.085 -1.748 441 1HG1 ILE 55 1HG1 ILE 55 -2.108 10.524 -0.515 442 2HG1 ILE 55 2HG1 ILE 55 -2.521 12.082 0.198 443 1HG2 ILE 55 1HG2 ILE 55 0.065 11.004 1.063 444 2HG2 ILE 55 2HG2 ILE 55 0.076 10.001 -0.387 445 3HG2 ILE 55 3HG2 ILE 55 1.330 11.218 -0.146 446 1HD1 ILE 55 1HD1 ILE 55 -2.298 12.880 -2.343 447 2HD1 ILE 55 2HD1 ILE 55 -2.702 11.189 -2.645 448 3HD1 ILE 55 3HD1 ILE 55 -3.804 12.206 -1.716 449 H HIS 56 H HIS 56 1.525 13.542 1.604 450 HA HIS 56 HA HIS 56 3.436 14.610 -0.441 451 1HB HIS 56 1HB HIS 56 2.607 16.163 1.482 452 2HB HIS 56 2HB HIS 56 3.671 15.192 2.500 453 HD1 HIS 56 HD1 HIS 56 4.416 18.110 2.114 454 HD2 HIS 56 HD2 HIS 56 5.754 15.103 -0.445 455 HE1 HIS 56 HE1 HIS 56 6.504 19.000 0.992 456 H SER 57 H SER 57 2.964 12.498 2.350 457 HA SER 57 HA SER 57 5.444 11.037 1.589 458 1HB SER 57 1HB SER 57 4.850 12.327 4.236 459 2HB SER 57 2HB SER 57 5.743 10.809 4.205 460 HG SER 57 HG SER 57 6.566 13.305 3.598 461 H VAL 58 H VAL 58 5.456 8.846 2.539 462 HA VAL 58 HA VAL 58 2.813 7.883 3.488 463 HB VAL 58 HB VAL 58 4.242 6.831 1.031 464 1HG1 VAL 58 1HG1 VAL 58 1.787 5.934 2.540 465 2HG1 VAL 58 2HG1 VAL 58 2.025 5.529 0.839 466 3HG1 VAL 58 3HG1 VAL 58 3.182 4.979 2.049 467 1HG2 VAL 58 1HG2 VAL 58 1.803 8.553 1.449 468 2HG2 VAL 58 2HG2 VAL 58 3.173 8.828 0.373 469 3HG2 VAL 58 3HG2 VAL 58 1.989 7.579 -0.010 470 H ASP 59 H ASP 59 2.968 5.564 4.203 471 HA ASP 59 HA ASP 59 5.744 4.673 4.814 472 1HB ASP 59 1HB ASP 59 3.584 5.415 6.736 473 2HB ASP 59 2HB ASP 59 4.568 4.006 7.129 474 H ILE 60 H ILE 60 5.971 2.479 4.585 475 HA ILE 60 HA ILE 60 3.589 0.733 4.769 476 HB ILE 60 HB ILE 60 5.027 1.380 2.230 477 1HG1 ILE 60 1HG1 ILE 60 2.577 0.468 1.558 478 2HG1 ILE 60 2HG1 ILE 60 2.274 0.915 3.235 479 1HG2 ILE 60 1HG2 ILE 60 3.960 -1.408 2.791 480 2HG2 ILE 60 2HG2 ILE 60 4.452 -0.801 1.210 481 3HG2 ILE 60 3HG2 ILE 60 5.649 -0.995 2.490 482 1HD1 ILE 60 1HD1 ILE 60 3.717 3.073 2.320 483 2HD1 ILE 60 2HD1 ILE 60 2.766 2.630 0.903 484 3HD1 ILE 60 3HD1 ILE 60 1.958 3.003 2.424 485 H GLY 61 H GLY 61 4.209 -0.895 6.083 486 1HA GLY 61 1HA GLY 61 7.048 -1.419 6.528 487 2HA GLY 61 2HA GLY 61 5.749 -2.213 7.354 488 H ASN 62 H ASN 62 7.948 -2.424 4.767 489 HA ASN 62 HA ASN 62 6.618 -4.356 3.118 490 1HB ASN 62 1HB ASN 62 9.101 -3.103 3.111 491 2HB ASN 62 2HB ASN 62 9.518 -4.797 3.364 492 1HD2 ASN 62 2HD2 ASN 62 7.601 -2.667 1.192 493 2HD2 ASN 62 1HD2 ASN 62 7.719 -3.685 -0.161 494 H ASP 63 H ASP 63 6.046 -6.450 3.528 495 HA ASP 63 HA ASP 63 7.321 -7.794 5.880 496 1HB ASP 63 1HB ASP 63 4.831 -7.476 5.929 497 2HB ASP 63 2HB ASP 63 4.716 -8.496 4.494 498 H GLY 64 H GLY 64 8.668 -7.711 3.365 499 1HA GLY 64 1HA GLY 64 10.034 -9.634 2.591 500 2HA GLY 64 2HA GLY 64 8.563 -10.603 2.613 501 H SER 65 H SER 65 8.372 -7.334 1.429 502 HA SER 65 HA SER 65 7.897 -8.414 -1.299 503 1HB SER 65 1HB SER 65 7.284 -5.588 -0.577 504 2HB SER 65 2HB SER 65 6.419 -6.683 -1.650 505 HG SER 65 HG SER 65 5.999 -6.171 0.945 506 H ALA 66 H ALA 66 8.462 -6.780 -3.068 507 HA ALA 66 HA ALA 66 11.143 -5.602 -2.509 508 1HB ALA 66 1HB ALA 66 10.731 -7.871 -3.989 509 2HB ALA 66 2HB ALA 66 10.692 -6.628 -5.238 510 3HB ALA 66 3HB ALA 66 12.104 -6.791 -4.195 511 H PHE 67 H PHE 67 8.400 -5.671 -4.789 512 HA PHE 67 HA PHE 67 9.030 -2.836 -5.499 513 1HB PHE 67 1HB PHE 67 7.291 -4.831 -6.976 514 2HB PHE 67 2HB PHE 67 7.739 -3.237 -7.540 515 HD1 PHE 67 HD1 PHE 67 10.498 -2.883 -7.058 516 HD2 PHE 67 HD2 PHE 67 8.440 -6.495 -8.133 517 HE1 PHE 67 HE1 PHE 67 12.596 -3.790 -8.007 518 HE2 PHE 67 HE2 PHE 67 10.539 -7.406 -9.083 519 HZ PHE 67 HZ PHE 67 12.620 -6.056 -9.023 520 H VAL 68 H VAL 68 7.762 -1.324 -4.585 521 HA VAL 68 HA VAL 68 4.919 -2.070 -3.967 522 HB VAL 68 HB VAL 68 6.713 -0.226 -2.359 523 1HG1 VAL 68 1HG1 VAL 68 4.230 0.341 -2.463 524 2HG1 VAL 68 2HG1 VAL 68 3.928 -1.221 -1.702 525 3HG1 VAL 68 3HG1 VAL 68 4.859 0.010 -0.848 526 1HG2 VAL 68 1HG2 VAL 68 7.059 -2.785 -2.275 527 2HG2 VAL 68 2HG2 VAL 68 6.809 -1.951 -0.741 528 3HG2 VAL 68 3HG2 VAL 68 5.481 -2.838 -1.489 529 H GLU 69 H GLU 69 3.696 -1.025 -5.425 530 HA GLU 69 HA GLU 69 4.497 1.728 -6.277 531 1HB GLU 69 1HB GLU 69 4.265 0.014 -8.071 532 2HB GLU 69 2HB GLU 69 2.578 -0.205 -7.610 533 1HG GLU 69 1HG GLU 69 1.936 1.866 -8.432 534 2HG GLU 69 2HG GLU 69 3.539 2.568 -8.212 535 H VAL 70 H VAL 70 3.037 3.432 -6.111 536 HA VAL 70 HA VAL 70 0.401 2.816 -4.860 537 HB VAL 70 HB VAL 70 2.204 5.105 -4.038 538 1HG1 VAL 70 1HG1 VAL 70 -0.610 4.411 -3.559 539 2HG1 VAL 70 2HG1 VAL 70 0.300 4.692 -2.075 540 3HG1 VAL 70 3HG1 VAL 70 0.228 5.943 -3.315 541 1HG2 VAL 70 1HG2 VAL 70 1.821 2.328 -3.003 542 2HG2 VAL 70 2HG2 VAL 70 3.276 3.324 -3.026 543 3HG2 VAL 70 3HG2 VAL 70 2.022 3.624 -1.824 544 H LEU 71 H LEU 71 -1.251 3.798 -5.872 545 HA LEU 71 HA LEU 71 -0.654 6.054 -7.743 546 1HB LEU 71 1HB LEU 71 -2.096 3.535 -8.106 547 2HB LEU 71 2HB LEU 71 -3.091 4.926 -8.525 548 HG LEU 71 HG LEU 71 -1.245 5.753 -9.982 549 1HD1 LEU 71 1HD1 LEU 71 0.534 4.474 -8.673 550 2HD1 LEU 71 2HD1 LEU 71 -0.006 3.027 -9.525 551 3HD1 LEU 71 3HD1 LEU 71 0.673 4.381 -10.428 552 1HD2 LEU 71 1HD2 LEU 71 -3.142 3.954 -10.577 553 2HD2 LEU 71 2HD2 LEU 71 -1.939 4.464 -11.761 554 3HD2 LEU 71 3HD2 LEU 71 -1.725 2.950 -10.883 555 H VAL 72 H VAL 72 -2.469 7.608 -7.926 556 HA VAL 72 HA VAL 72 -4.117 7.714 -5.431 557 HB VAL 72 HB VAL 72 -3.918 10.216 -5.732 558 1HG1 VAL 72 1HG1 VAL 72 -1.537 8.483 -5.087 559 2HG1 VAL 72 2HG1 VAL 72 -1.535 10.225 -4.817 560 3HG1 VAL 72 3HG1 VAL 72 -2.688 9.203 -3.962 561 1HG2 VAL 72 1HG2 VAL 72 -3.093 9.982 -8.126 562 2HG2 VAL 72 2HG2 VAL 72 -2.155 11.081 -7.114 563 3HG2 VAL 72 3HG2 VAL 72 -1.552 9.459 -7.451 564 H GLY 73 H GLY 73 -6.025 9.329 -5.759 565 1HA GLY 73 1HA GLY 73 -7.100 10.130 -8.160 566 2HA GLY 73 2HA GLY 73 -7.546 8.431 -8.058 567 H SER 74 H SER 74 -9.529 10.184 -8.122 568 HA SER 74 HA SER 74 -10.474 10.473 -5.330 569 1HB SER 74 1HB SER 74 -10.447 12.617 -6.384 570 2HB SER 74 2HB SER 74 -11.168 11.977 -7.851 571 HG SER 74 HG SER 74 -12.321 12.481 -5.337 572 H SER 75 H SER 75 -12.752 10.076 -5.009 573 HA SER 75 HA SER 75 -13.693 7.696 -6.404 574 1HB SER 75 1HB SER 75 -15.239 9.281 -4.360 575 2HB SER 75 2HB SER 75 -15.324 7.560 -4.699 576 HG SER 75 HG SER 75 -13.796 8.825 -2.941 577 H ALA 76 H ALA 76 -13.735 10.809 -7.370 578 HA ALA 76 HA ALA 76 -16.342 11.631 -7.850 579 1HB ALA 76 1HB ALA 76 -13.778 11.931 -9.346 580 2HB ALA 76 2HB ALA 76 -15.267 12.431 -10.150 581 3HB ALA 76 3HB ALA 76 -14.803 13.166 -8.615 582 H GLY 77 H GLY 77 -14.674 8.950 -9.371 583 1HA GLY 77 1HA GLY 77 -17.127 7.888 -10.452 584 2HA GLY 77 2HA GLY 77 -16.158 8.610 -11.736 585 H GLY 78 H GLY 78 -15.833 6.335 -8.999 586 1HA GLY 78 1HA GLY 78 -13.455 5.087 -10.110 587 2HA GLY 78 2HA GLY 78 -14.393 4.485 -8.744 588 H ALA 79 H ALA 79 -14.799 4.906 -12.282 589 HA ALA 79 HA ALA 79 -16.537 2.520 -12.366 590 1HB ALA 79 1HB ALA 79 -15.607 4.472 -14.490 591 2HB ALA 79 2HB ALA 79 -16.630 3.078 -14.834 592 3HB ALA 79 3HB ALA 79 -17.215 4.359 -13.774 593 H GLY 80 H GLY 80 -13.658 3.559 -14.225 594 1HA GLY 80 1HA GLY 80 -12.782 0.696 -14.249 595 2HA GLY 80 2HA GLY 80 -12.488 1.806 -15.590 596 H GLU 81 H GLU 81 -11.710 1.235 -12.172 597 HA GLU 81 HA GLU 81 -9.794 1.765 -10.931 598 1HB GLU 81 1HB GLU 81 -8.501 2.204 -13.638 599 2HB GLU 81 2HB GLU 81 -7.678 1.883 -12.112 600 1HG GLU 81 1HG GLU 81 -7.723 -0.274 -12.881 601 2HG GLU 81 2HG GLU 81 -9.340 -0.248 -12.177 602 H GLN 82 H GLN 82 -11.679 3.924 -12.166 603 HA GLN 82 HA GLN 82 -11.768 6.259 -12.401 604 1HB GLN 82 1HB GLN 82 -11.451 5.499 -9.831 605 2HB GLN 82 2HB GLN 82 -10.061 6.571 -10.008 606 1HG GLN 82 1HG GLN 82 -12.646 7.546 -11.113 607 2HG GLN 82 2HG GLN 82 -12.502 7.493 -9.355 608 1HE2 GLN 82 1HE2 GLN 82 -12.467 9.856 -11.326 609 2HE2 GLN 82 2HE2 GLN 82 -11.052 10.703 -10.928 610 H ASP 83 H ASP 83 -9.397 5.150 -13.788 611 HA ASP 83 HA ASP 83 -7.342 5.818 -14.679 612 1HB ASP 83 1HB ASP 83 -9.050 7.142 -15.766 613 2HB ASP 83 2HB ASP 83 -8.945 8.349 -14.503 614 H TYR 84 H TYR 84 -6.948 5.571 -11.970 615 HA TYR 84 HA TYR 84 -6.166 7.698 -10.390 616 1HB TYR 84 1HB TYR 84 -4.996 4.936 -10.716 617 2HB TYR 84 2HB TYR 84 -4.322 6.079 -9.566 618 HD1 TYR 84 HD1 TYR 84 -7.984 5.951 -10.321 619 HD2 TYR 84 HD2 TYR 84 -4.842 4.768 -7.623 620 HE1 TYR 84 HE1 TYR 84 -9.665 5.245 -8.637 621 HE2 TYR 84 HE2 TYR 84 -6.534 4.081 -5.955 622 HH TYR 84 HH TYR 84 -9.870 4.862 -6.286 623 H GLU 85 H GLU 85 -4.050 8.549 -9.963 624 HA GLU 85 HA GLU 85 -2.414 8.817 -12.441 625 1HB GLU 85 1HB GLU 85 -2.594 11.046 -12.142 626 2HB GLU 85 2HB GLU 85 -3.566 10.781 -10.707 627 1HG GLU 85 1HG GLU 85 -1.778 12.147 -9.988 628 2HG GLU 85 2HG GLU 85 -1.321 10.534 -9.448 629 H VAL 86 H VAL 86 -0.341 8.110 -12.367 630 HA VAL 86 HA VAL 86 0.544 6.440 -10.248 631 HB VAL 86 HB VAL 86 2.233 7.784 -12.374 632 1HG1 VAL 86 1HG1 VAL 86 3.150 6.399 -10.231 633 2HG1 VAL 86 2HG1 VAL 86 2.826 5.061 -11.332 634 3HG1 VAL 86 3HG1 VAL 86 3.933 6.348 -11.810 635 1HG2 VAL 86 1HG2 VAL 86 0.073 6.226 -12.872 636 2HG2 VAL 86 2HG2 VAL 86 1.519 6.204 -13.880 637 3HG2 VAL 86 3HG2 VAL 86 1.290 4.973 -12.637 638 H LEU 87 H LEU 87 0.346 7.701 -8.309 639 HA LEU 87 HA LEU 87 1.709 10.164 -7.804 640 1HB LEU 87 1HB LEU 87 -0.033 8.812 -6.364 641 2HB LEU 87 2HB LEU 87 1.397 8.021 -5.705 642 HG LEU 87 HG LEU 87 2.321 10.348 -5.239 643 1HD1 LEU 87 1HD1 LEU 87 -0.280 11.014 -6.457 644 2HD1 LEU 87 2HD1 LEU 87 0.031 11.855 -4.938 645 3HD1 LEU 87 3HD1 LEU 87 1.165 12.007 -6.279 646 1HD2 LEU 87 1HD2 LEU 87 0.088 8.957 -3.875 647 2HD2 LEU 87 2HD2 LEU 87 1.643 9.486 -3.233 648 3HD2 LEU 87 3HD2 LEU 87 0.317 10.637 -3.392 649 H LEU 88 H LEU 88 2.722 6.854 -6.833 650 HA LEU 88 HA LEU 88 5.510 7.662 -7.458 651 1HB LEU 88 1HB LEU 88 6.359 6.678 -5.401 652 2HB LEU 88 2HB LEU 88 5.207 7.959 -5.034 653 HG LEU 88 HG LEU 88 3.599 5.706 -5.232 654 1HD1 LEU 88 1HD1 LEU 88 6.345 4.982 -4.342 655 2HD1 LEU 88 2HD1 LEU 88 5.008 4.322 -3.398 656 3HD1 LEU 88 3HD1 LEU 88 5.118 3.988 -5.127 657 1HD2 LEU 88 1HD2 LEU 88 4.891 7.074 -2.857 658 2HD2 LEU 88 2HD2 LEU 88 3.302 7.399 -3.549 659 3HD2 LEU 88 3HD2 LEU 88 3.598 5.885 -2.695 660 H VAL 89 H VAL 89 6.307 6.234 -8.876 661 HA VAL 89 HA VAL 89 5.036 3.873 -9.725 662 HB VAL 89 HB VAL 89 7.237 3.265 -10.728 663 1HG1 VAL 89 1HG1 VAL 89 5.646 5.037 -11.670 664 2HG1 VAL 89 2HG1 VAL 89 6.742 6.237 -10.985 665 3HG1 VAL 89 3HG1 VAL 89 7.320 5.122 -12.223 666 1HG2 VAL 89 1HG2 VAL 89 8.129 5.422 -8.834 667 2HG2 VAL 89 2HG2 VAL 89 8.891 3.873 -9.194 668 3HG2 VAL 89 3HG2 VAL 89 8.995 5.197 -10.353 669 H THR 90 H THR 90 6.369 1.641 -9.605 670 HA THR 90 HA THR 90 6.103 0.761 -6.896 671 HB THR 90 HB THR 90 5.946 -0.544 -9.198 672 HG1 THR 90 HG1 THR 90 5.507 -2.029 -7.827 673 1HG2 THR 90 1HG2 THR 90 8.469 -0.205 -9.593 674 2HG2 THR 90 2HG2 THR 90 8.707 -1.403 -8.320 675 3HG2 THR 90 3HG2 THR 90 7.843 -1.842 -9.793 676 H SER 91 H SER 91 7.566 0.594 -5.301 677 HA SER 91 HA SER 91 10.255 1.723 -5.765 678 1HB SER 91 1HB SER 91 10.270 1.705 -3.198 679 2HB SER 91 2HB SER 91 9.126 2.801 -3.968 680 HG SER 91 HG SER 91 8.687 0.339 -2.680 681 H SER 92 H SER 92 11.870 0.335 -6.046 682 HA SER 92 HA SER 92 11.637 -2.499 -5.402 683 1HB SER 92 1HB SER 92 13.914 -2.663 -6.276 684 2HB SER 92 2HB SER 92 12.966 -1.639 -7.350 685 HG SER 92 HG SER 92 14.342 -0.119 -6.938 686 H PHE 93 H PHE 93 11.113 -1.815 -3.082 687 HA PHE 93 HA PHE 93 13.066 -0.695 -1.351 688 1HB PHE 93 1HB PHE 93 10.665 -0.881 -0.800 689 2HB PHE 93 2HB PHE 93 10.844 -2.627 -0.692 690 HD1 PHE 93 HD1 PHE 93 12.940 0.238 0.523 691 HD2 PHE 93 HD2 PHE 93 10.742 -3.311 1.527 692 HE1 PHE 93 HE1 PHE 93 13.693 0.439 2.879 693 HE2 PHE 93 HE2 PHE 93 11.494 -3.112 3.883 694 HZ PHE 93 HZ PHE 93 12.971 -1.237 4.558 695 H MET 94 H MET 94 12.162 -4.136 -1.746 696 HA MET 94 HA MET 94 14.869 -4.810 -0.681 697 1HB MET 94 1HB MET 94 12.249 -5.674 0.130 698 2HB MET 94 2HB MET 94 13.139 -7.070 -0.471 699 1HG MET 94 1HG MET 94 14.888 -6.772 1.102 700 2HG MET 94 2HG MET 94 14.382 -5.124 1.475 701 1HE MET 94 1HE MET 94 12.879 -8.490 0.928 702 2HE MET 94 2HE MET 94 13.773 -8.998 2.367 703 3HE MET 94 3HE MET 94 12.014 -8.926 2.400 704 H SER 95 H SER 95 15.242 -7.320 -1.327 705 HA SER 95 HA SER 95 14.996 -7.424 -4.303 706 1HB SER 95 1HB SER 95 16.998 -9.192 -3.655 707 2HB SER 95 2HB SER 95 17.266 -7.517 -4.114 708 HG SER 95 HG SER 95 17.393 -6.966 -1.979 709 HA PRO 96 HA PRO 96 13.023 -11.401 -3.817 710 1HB PRO 96 1HB PRO 96 14.041 -12.840 -5.901 711 2HB PRO 96 2HB PRO 96 12.912 -11.494 -6.102 712 1HG PRO 96 1HG PRO 96 15.765 -11.642 -6.760 713 2HG PRO 96 2HG PRO 96 14.536 -10.510 -7.339 714 1HD PRO 96 1HD PRO 96 16.533 -10.068 -5.314 715 2HD PRO 96 2HD PRO 96 15.304 -8.927 -5.901 716 H SER 97 H SER 97 16.012 -11.144 -2.671 717 HA SER 97 HA SER 97 16.349 -14.084 -2.240 718 1HB SER 97 1HB SER 97 18.227 -13.141 -3.528 719 2HB SER 97 2HB SER 97 18.475 -11.917 -2.287 720 HG SER 97 HG SER 97 19.856 -13.762 -2.067 721 H GLU 98 H GLU 98 16.825 -10.852 -0.793 722 HA GLU 98 HA GLU 98 17.370 -11.718 1.852 723 1HB GLU 98 1HB GLU 98 16.753 -9.238 0.492 724 2HB GLU 98 2HB GLU 98 15.887 -9.306 2.024 725 1HG GLU 98 1HG GLU 98 17.808 -8.655 3.001 726 2HG GLU 98 2HG GLU 98 18.419 -10.270 2.669 727 H SER 99 H SER 99 14.397 -11.761 0.060 728 HA SER 99 HA SER 99 12.407 -11.484 1.995 729 1HB SER 99 1HB SER 99 12.676 -13.193 -0.447 730 2HB SER 99 2HB SER 99 11.302 -13.463 0.623 731 HG SER 99 HG SER 99 12.084 -11.004 -0.572 732 H ARG 100 H ARG 100 14.717 -14.097 1.662 733 HA ARG 100 HA ARG 100 13.259 -15.821 3.544 734 1HB ARG 100 1HB ARG 100 15.998 -16.111 2.267 735 2HB ARG 100 2HB ARG 100 15.199 -17.345 3.244 736 1HG ARG 100 1HG ARG 100 13.516 -17.694 1.640 737 2HG ARG 100 2HG ARG 100 13.812 -16.143 0.858 738 1HD ARG 100 1HD ARG 100 16.180 -17.121 0.358 739 2HD ARG 100 2HD ARG 100 15.417 -18.679 0.676 740 HE ARG 100 HE ARG 100 13.902 -17.053 -1.204 741 1HH1 ARG 100 1HH1 ARG 100 16.556 -19.304 -0.853 742 2HH1 ARG 100 2HH1 ARG 100 16.454 -19.835 -2.496 743 1HH2 ARG 100 1HH2 ARG 100 13.806 -17.770 -3.321 744 2HH2 ARG 100 2HH2 ARG 100 14.915 -18.977 -3.879 745 H SER 101 H SER 101 16.758 -15.179 3.778 746 HA SER 101 HA SER 101 16.548 -13.576 6.172 747 1HB SER 101 1HB SER 101 16.074 -16.133 6.774 748 2HB SER 101 2HB SER 101 17.830 -16.239 6.674 749 HG SER 101 HG SER 101 17.497 -15.620 8.719 750 H GLY 102 H GLY 102 17.813 -13.438 3.617 751 1HA GLY 102 1HA GLY 102 20.636 -14.121 3.961 752 2HA GLY 102 2HA GLY 102 19.933 -13.274 2.585 753 H SER 103 H SER 103 18.605 -11.426 4.744 754 HA SER 103 HA SER 103 20.746 -10.040 6.041 755 1HB SER 103 1HB SER 103 20.421 -9.497 3.214 756 2HB SER 103 2HB SER 103 20.225 -8.033 4.172 757 HG SER 103 HG SER 103 22.438 -8.643 3.535 758 H ASN 104 H ASN 104 17.600 -9.804 4.614 759 HA ASN 104 HA ASN 104 16.364 -8.733 6.947 760 1HB ASN 104 1HB ASN 104 15.790 -6.447 5.824 761 2HB ASN 104 2HB ASN 104 17.349 -6.621 6.624 762 1HD2 ASN 104 2HD2 ASN 104 15.833 -6.838 3.361 763 2HD2 ASN 104 1HD2 ASN 104 17.237 -6.403 2.511 764 HA PRO 105 HA PRO 105 13.498 -10.395 3.776 765 1HB PRO 105 1HB PRO 105 12.141 -12.042 5.484 766 2HB PRO 105 2HB PRO 105 13.651 -12.501 4.688 767 1HG PRO 105 1HG PRO 105 13.161 -11.778 7.508 768 2HG PRO 105 2HG PRO 105 14.426 -12.797 6.809 769 1HD PRO 105 1HD PRO 105 14.704 -10.111 7.667 770 2HD PRO 105 2HD PRO 105 15.890 -11.058 6.742 771 H ASN 106 H ASN 106 12.905 -9.130 7.006 772 HA ASN 106 HA ASN 106 10.318 -7.988 6.023 773 1HB ASN 106 1HB ASN 106 10.906 -9.583 8.424 774 2HB ASN 106 2HB ASN 106 10.056 -8.080 8.780 775 1HD2 ASN 106 2HD2 ASN 106 9.732 -10.014 5.779 776 2HD2 ASN 106 1HD2 ASN 106 8.092 -10.388 6.010 777 H ARG 107 H ARG 107 10.217 -5.792 6.162 778 HA ARG 107 HA ARG 107 11.665 -4.323 8.237 779 1HB ARG 107 1HB ARG 107 12.795 -4.692 5.558 780 2HB ARG 107 2HB ARG 107 12.619 -2.992 5.984 781 1HG ARG 107 1HG ARG 107 13.679 -3.751 8.271 782 2HG ARG 107 2HG ARG 107 14.266 -5.117 7.322 783 1HD ARG 107 1HD ARG 107 15.465 -3.694 5.830 784 2HD ARG 107 2HD ARG 107 14.646 -2.253 6.432 785 HE ARG 107 HE ARG 107 15.954 -3.331 8.654 786 1HH1 ARG 107 1HH1 ARG 107 16.876 -2.181 5.483 787 2HH1 ARG 107 2HH1 ARG 107 18.443 -1.677 6.010 788 1HH2 ARG 107 1HH2 ARG 107 17.993 -2.664 9.293 789 2HH2 ARG 107 2HH2 ARG 107 19.071 -1.947 8.142 790 H VAL 108 H VAL 108 11.606 -1.810 7.231 791 HA VAL 108 HA VAL 108 8.774 -1.370 6.362 792 HB VAL 108 HB VAL 108 10.387 0.083 8.450 793 1HG1 VAL 108 1HG1 VAL 108 7.705 0.787 7.233 794 2HG1 VAL 108 2HG1 VAL 108 8.325 1.502 8.722 795 3HG1 VAL 108 3HG1 VAL 108 9.172 1.766 7.197 796 1HG2 VAL 108 1HG2 VAL 108 7.822 -1.516 8.523 797 2HG2 VAL 108 2HG2 VAL 108 9.354 -1.933 9.292 798 3HG2 VAL 108 3HG2 VAL 108 8.419 -0.558 9.879 799 H ARG 109 H ARG 109 8.498 0.606 5.085 800 HA ARG 109 HA ARG 109 10.973 1.984 4.217 801 1HB ARG 109 1HB ARG 109 10.551 0.102 2.603 802 2HB ARG 109 2HB ARG 109 8.994 0.841 2.225 803 1HG ARG 109 1HG ARG 109 10.488 3.005 1.869 804 2HG ARG 109 2HG ARG 109 11.754 1.811 1.590 805 1HD ARG 109 1HD ARG 109 9.760 0.740 0.094 806 2HD ARG 109 2HD ARG 109 9.370 2.454 -0.047 807 HE ARG 109 HE ARG 109 11.594 1.131 -1.313 808 1HH1 ARG 109 1HH1 ARG 109 10.651 4.125 0.233 809 2HH1 ARG 109 2HH1 ARG 109 11.826 5.055 -0.628 810 1HH2 ARG 109 1HH2 ARG 109 13.095 2.377 -2.408 811 2HH2 ARG 109 2HH2 ARG 109 13.195 4.080 -2.108 812 H MET 110 H MET 110 10.604 4.141 4.015 813 HA MET 110 HA MET 110 7.757 5.052 4.085 814 1HB MET 110 1HB MET 110 10.250 6.512 5.007 815 2HB MET 110 2HB MET 110 8.586 7.072 5.188 816 1HG MET 110 1HG MET 110 8.120 5.588 6.878 817 2HG MET 110 2HG MET 110 9.217 4.362 6.252 818 1HE MET 110 1HE MET 110 8.562 7.487 8.003 819 2HE MET 110 2HE MET 110 9.954 7.864 9.013 820 3HE MET 110 3HE MET 110 9.957 8.300 7.298 821 H PHE 111 H PHE 111 7.085 6.627 2.630 822 HA PHE 111 HA PHE 111 9.013 7.286 0.448 823 1HB PHE 111 1HB PHE 111 5.988 7.326 0.308 824 2HB PHE 111 2HB PHE 111 7.111 7.506 -1.033 825 HD1 PHE 111 HD1 PHE 111 6.211 5.102 1.704 826 HD2 PHE 111 HD2 PHE 111 7.712 5.637 -2.285 827 HE1 PHE 111 HE1 PHE 111 6.220 2.655 1.376 828 HE2 PHE 111 HE2 PHE 111 7.722 3.181 -2.609 829 HZ PHE 111 HZ PHE 111 6.978 1.682 -0.779 830 H GLY 112 H GLY 112 8.581 9.407 -0.578 831 1HA GLY 112 1HA GLY 112 7.268 11.450 1.078 832 2HA GLY 112 2HA GLY 112 8.987 11.643 0.794 833 HA PRO 113 HA PRO 113 6.921 13.646 -2.834 834 1HB PRO 113 1HB PRO 113 8.610 15.790 -2.888 835 2HB PRO 113 2HB PRO 113 7.153 15.722 -1.885 836 1HG PRO 113 1HG PRO 113 10.001 15.428 -1.098 837 2HG PRO 113 2HG PRO 113 8.637 16.086 -0.181 838 1HD PRO 113 1HD PRO 113 9.725 13.531 0.168 839 2HD PRO 113 2HD PRO 113 8.121 14.036 0.718 840 H ASP 114 H ASP 114 10.216 12.784 -2.115 841 HA ASP 114 HA ASP 114 11.581 13.257 -4.502 842 1HB ASP 114 1HB ASP 114 12.215 12.036 -2.207 843 2HB ASP 114 2HB ASP 114 11.968 10.603 -3.206 844 H LYS 115 H LYS 115 9.354 10.584 -3.757 845 HA LYS 115 HA LYS 115 9.519 9.793 -6.638 846 1HB LYS 115 1HB LYS 115 9.044 8.147 -4.149 847 2HB LYS 115 2HB LYS 115 8.647 7.548 -5.759 848 1HG LYS 115 1HG LYS 115 10.953 7.815 -6.484 849 2HG LYS 115 2HG LYS 115 11.383 8.570 -4.949 850 1HD LYS 115 1HD LYS 115 10.099 5.887 -4.810 851 2HD LYS 115 2HD LYS 115 11.756 5.947 -5.408 852 1HE LYS 115 1HE LYS 115 11.159 7.552 -2.974 853 2HE LYS 115 2HE LYS 115 11.178 5.799 -2.783 854 1HZ LYS 115 1HZ LYS 115 13.354 7.426 -3.984 855 2HZ LYS 115 2HZ LYS 115 13.367 6.767 -2.421 856 3HZ LYS 115 3HZ LYS 115 13.372 5.739 -3.775 857 H LEU 116 H LEU 116 7.629 11.697 -4.921 858 HA LEU 116 HA LEU 116 5.114 10.478 -5.982 859 1HB LEU 116 1HB LEU 116 4.271 10.586 -3.919 860 2HB LEU 116 2HB LEU 116 5.798 11.188 -3.341 861 HG LEU 116 HG LEU 116 4.689 13.499 -4.296 862 1HD1 LEU 116 1HD1 LEU 116 2.538 11.532 -3.662 863 2HD1 LEU 116 2HD1 LEU 116 2.320 13.178 -3.086 864 3HD1 LEU 116 3HD1 LEU 116 2.520 12.871 -4.810 865 1HD2 LEU 116 1HD2 LEU 116 5.553 12.550 -1.903 866 2HD2 LEU 116 2HD2 LEU 116 4.758 14.112 -2.091 867 3HD2 LEU 116 3HD2 LEU 116 3.831 12.708 -1.567 868 H VAL 117 H VAL 117 4.255 11.504 -7.618 869 HA VAL 117 HA VAL 117 5.365 13.701 -8.934 870 HB VAL 117 HB VAL 117 3.688 12.225 -9.938 871 1HG1 VAL 117 1HG1 VAL 117 2.350 11.970 -7.878 872 2HG1 VAL 117 2HG1 VAL 117 1.725 13.593 -8.110 873 3HG1 VAL 117 3HG1 VAL 117 1.357 12.335 -9.285 874 1HG2 VAL 117 1HG2 VAL 117 3.611 15.112 -10.099 875 2HG2 VAL 117 2HG2 VAL 117 3.317 13.932 -11.372 876 3HG2 VAL 117 3HG2 VAL 117 1.989 14.466 -10.344 877 H ARG 118 H ARG 118 5.394 15.888 -8.588 878 HA ARG 118 HA ARG 118 4.271 17.021 -6.185 879 1HB ARG 118 1HB ARG 118 5.917 17.928 -8.439 880 2HB ARG 118 2HB ARG 118 4.802 19.172 -7.874 881 1HG ARG 118 1HG ARG 118 5.665 19.063 -5.644 882 2HG ARG 118 2HG ARG 118 6.565 17.587 -5.994 883 1HD ARG 118 1HD ARG 118 8.050 19.570 -5.982 884 2HD ARG 118 2HD ARG 118 7.993 18.815 -7.576 885 HE ARG 118 HE ARG 118 5.999 20.756 -7.649 886 1HH1 ARG 118 1HH1 ARG 118 9.435 20.719 -6.994 887 2HH1 ARG 118 2HH1 ARG 118 9.666 22.328 -7.583 888 1HH2 ARG 118 1HH2 ARG 118 6.344 22.834 -8.401 889 2HH2 ARG 118 2HH2 ARG 118 7.938 23.514 -8.371 890 H ALA 119 H ALA 119 3.263 16.986 -9.579 891 HA ALA 119 HA ALA 119 1.136 18.853 -9.410 892 1HB ALA 119 1HB ALA 119 1.464 16.402 -11.158 893 2HB ALA 119 2HB ALA 119 0.211 17.621 -11.393 894 3HB ALA 119 3HB ALA 119 1.911 18.060 -11.564 895 H ALA 120 H ALA 120 1.178 15.348 -8.765 896 HA ALA 120 HA ALA 120 -1.683 15.442 -8.007 897 1HB ALA 120 1HB ALA 120 -0.261 13.488 -9.235 898 2HB ALA 120 2HB ALA 120 -0.133 12.957 -7.559 899 3HB ALA 120 3HB ALA 120 -1.720 13.179 -8.295 900 H ALA 121 H ALA 121 1.523 14.996 -6.526 901 HA ALA 121 HA ALA 121 0.933 14.189 -3.947 902 1HB ALA 121 1HB ALA 121 3.217 14.777 -4.712 903 2HB ALA 121 2HB ALA 121 2.775 16.478 -4.696 904 3HB ALA 121 3HB ALA 121 2.835 15.568 -3.189 905 H GLU 122 H GLU 122 0.349 17.413 -5.301 906 HA GLU 122 HA GLU 122 -0.793 18.223 -2.678 907 1HB GLU 122 1HB GLU 122 -0.765 20.535 -3.631 908 2HB GLU 122 2HB GLU 122 0.835 19.794 -3.573 909 1HG GLU 122 1HG GLU 122 1.021 19.718 -5.841 910 2HG GLU 122 2HG GLU 122 -0.671 19.274 -6.065 911 H LYS 123 H LYS 123 -2.012 16.605 -5.127 912 HA LYS 123 HA LYS 123 -4.403 18.257 -5.621 913 1HB LYS 123 1HB LYS 123 -3.237 15.770 -6.772 914 2HB LYS 123 2HB LYS 123 -4.986 15.958 -6.862 915 1HG LYS 123 1HG LYS 123 -3.643 18.425 -7.585 916 2HG LYS 123 2HG LYS 123 -3.052 17.085 -8.558 917 1HD LYS 123 1HD LYS 123 -5.714 16.569 -8.630 918 2HD LYS 123 2HD LYS 123 -5.745 18.328 -8.497 919 1HE LYS 123 1HE LYS 123 -4.273 16.702 -10.591 920 2HE LYS 123 2HE LYS 123 -5.688 17.721 -10.854 921 1HZ LYS 123 1HZ LYS 123 -4.231 19.564 -9.878 922 2HZ LYS 123 2HZ LYS 123 -2.926 18.527 -10.208 923 3HZ LYS 123 3HZ LYS 123 -3.927 19.066 -11.471 924 H ARG 124 H ARG 124 -6.328 17.870 -4.535 925 HA ARG 124 HA ARG 124 -6.249 16.128 -2.221 926 1HB ARG 124 1HB ARG 124 -8.373 17.849 -3.491 927 2HB ARG 124 2HB ARG 124 -8.774 16.754 -2.167 928 1HG ARG 124 1HG ARG 124 -7.095 17.800 -0.737 929 2HG ARG 124 2HG ARG 124 -6.579 18.844 -2.064 930 1HD ARG 124 1HD ARG 124 -8.863 19.828 -2.144 931 2HD ARG 124 2HD ARG 124 -9.320 18.828 -0.765 932 HE ARG 124 HE ARG 124 -6.956 20.467 -0.266 933 1HH1 ARG 124 1HH1 ARG 124 -10.453 20.360 -0.210 934 2HH1 ARG 124 2HH1 ARG 124 -10.570 21.610 0.979 935 1HH2 ARG 124 1HH2 ARG 124 -7.157 22.081 1.266 936 2HH2 ARG 124 2HH2 ARG 124 -8.726 22.574 1.807 937 H TRP 125 H TRP 125 -6.242 13.990 -2.565 938 HA TRP 125 HA TRP 125 -8.193 12.817 -4.513 939 1HB TRP 125 1HB TRP 125 -5.716 11.526 -3.309 940 2HB TRP 125 2HB TRP 125 -6.726 10.874 -4.595 941 HD1 TRP 125 HD1 TRP 125 -3.736 12.974 -4.008 942 HE1 TRP 125 HE1 TRP 125 -2.924 14.021 -6.220 943 HE3 TRP 125 HE3 TRP 125 -7.761 11.982 -6.979 944 HZ2 TRP 125 HZ2 TRP 125 -3.865 14.385 -8.900 945 HZ3 TRP 125 HZ3 TRP 125 -7.779 12.672 -9.352 946 HH2 TRP 125 HH2 TRP 125 -5.839 13.880 -10.319 947 H ASP 126 H ASP 126 -9.147 10.700 -3.694 948 HA ASP 126 HA ASP 126 -9.184 10.584 -0.719 949 1HB ASP 126 1HB ASP 126 -11.652 10.276 -0.745 950 2HB ASP 126 2HB ASP 126 -11.144 11.873 -1.274 951 H ARG 127 H ARG 127 -8.414 8.915 -3.359 952 HA ARG 127 HA ARG 127 -9.141 6.307 -2.127 953 1HB ARG 127 1HB ARG 127 -9.272 6.958 -5.094 954 2HB ARG 127 2HB ARG 127 -9.491 5.363 -4.391 955 1HG ARG 127 1HG ARG 127 -11.333 6.907 -2.995 956 2HG ARG 127 2HG ARG 127 -11.412 7.572 -4.625 957 1HD ARG 127 1HD ARG 127 -11.706 5.287 -5.538 958 2HD ARG 127 2HD ARG 127 -11.658 4.642 -3.914 959 HE ARG 127 HE ARG 127 -13.903 6.106 -5.135 960 1HH1 ARG 127 1HH1 ARG 127 -12.501 4.757 -2.225 961 2HH1 ARG 127 2HH1 ARG 127 -14.035 4.576 -1.454 962 1HH2 ARG 127 1HH2 ARG 127 -15.873 5.843 -4.074 963 2HH2 ARG 127 2HH2 ARG 127 -15.908 5.194 -2.473 964 H VAL 128 H VAL 128 -7.368 4.785 -2.338 965 HA VAL 128 HA VAL 128 -5.057 5.758 -3.929 966 HB VAL 128 HB VAL 128 -4.901 6.407 -1.458 967 1HG1 VAL 128 1HG1 VAL 128 -5.560 3.820 -0.943 968 2HG1 VAL 128 2HG1 VAL 128 -3.801 3.726 -0.860 969 3HG1 VAL 128 3HG1 VAL 128 -4.675 4.845 0.186 970 1HG2 VAL 128 1HG2 VAL 128 -2.868 4.994 -3.112 971 2HG2 VAL 128 2HG2 VAL 128 -2.914 6.674 -2.576 972 3HG2 VAL 128 3HG2 VAL 128 -2.442 5.400 -1.449 973 H LYS 129 H LYS 129 -3.897 4.203 -4.921 974 HA LYS 129 HA LYS 129 -4.860 1.396 -4.632 975 1HB LYS 129 1HB LYS 129 -5.088 2.338 -6.876 976 2HB LYS 129 2HB LYS 129 -3.401 2.831 -6.872 977 1HG LYS 129 1HG LYS 129 -3.501 0.815 -8.156 978 2HG LYS 129 2HG LYS 129 -2.810 0.360 -6.600 979 1HD LYS 129 1HD LYS 129 -4.694 -0.782 -5.940 980 2HD LYS 129 2HD LYS 129 -5.777 0.258 -6.868 981 1HE LYS 129 1HE LYS 129 -4.945 -0.780 -8.965 982 2HE LYS 129 2HE LYS 129 -3.924 -1.855 -8.011 983 1HZ LYS 129 1HZ LYS 129 -5.954 -2.650 -6.895 984 2HZ LYS 129 2HZ LYS 129 -6.887 -1.703 -7.952 985 3HZ LYS 129 3HZ LYS 129 -5.949 -2.977 -8.562 986 H ILE 130 H ILE 130 -3.472 -0.091 -3.773 987 HA ILE 130 HA ILE 130 -0.567 0.623 -3.621 988 HB ILE 130 HB ILE 130 -2.215 -0.852 -1.531 989 1HG1 ILE 130 1HG1 ILE 130 -2.729 1.559 -1.596 990 2HG1 ILE 130 2HG1 ILE 130 -1.817 1.161 -0.142 991 1HG2 ILE 130 1HG2 ILE 130 0.710 -0.095 -1.718 992 2HG2 ILE 130 2HG2 ILE 130 -0.069 -0.457 -0.178 993 3HG2 ILE 130 3HG2 ILE 130 0.013 -1.691 -1.434 994 1HD1 ILE 130 1HD1 ILE 130 0.115 1.760 -2.118 995 2HD1 ILE 130 2HD1 ILE 130 -1.130 2.999 -2.264 996 3HD1 ILE 130 3HD1 ILE 130 -0.321 2.743 -0.720 997 H VAL 131 H VAL 131 0.453 -0.779 -5.007 998 HA VAL 131 HA VAL 131 -0.510 -3.600 -5.079 999 HB VAL 131 HB VAL 131 0.903 -2.005 -7.233 1000 1HG1 VAL 131 1HG1 VAL 131 -0.292 -4.781 -7.159 1001 2HG1 VAL 131 2HG1 VAL 131 0.228 -3.965 -8.632 1002 3HG1 VAL 131 3HG1 VAL 131 1.407 -4.367 -7.383 1003 1HG2 VAL 131 1HG2 VAL 131 -1.978 -2.647 -6.653 1004 2HG2 VAL 131 2HG2 VAL 131 -1.266 -1.121 -7.180 1005 3HG2 VAL 131 3HG2 VAL 131 -1.442 -2.454 -8.322 1006 H CYS 132 H CYS 132 0.905 -4.974 -4.136 1007 HA CYS 132 HA CYS 132 3.756 -4.199 -3.828 1008 1HB CYS 132 1HB CYS 132 1.929 -5.571 -2.185 1009 2HB CYS 132 2HB CYS 132 3.002 -6.836 -2.781 1010 HG CYS 132 HG CYS 132 4.996 -5.117 -1.929 1011 H SER 133 H SER 133 5.480 -5.674 -4.722 1012 HA SER 133 HA SER 133 4.568 -7.813 -6.542 1013 1HB SER 133 1HB SER 133 4.931 -5.097 -7.436 1014 2HB SER 133 2HB SER 133 6.099 -6.134 -8.242 1015 HG SER 133 HG SER 133 3.499 -5.892 -8.710 1016 H GLN 134 H GLN 134 6.041 -9.328 -6.801 1017 HA GLN 134 HA GLN 134 8.514 -9.563 -7.603 1018 1HB GLN 134 1HB GLN 134 9.456 -7.896 -6.100 1019 2HB GLN 134 2HB GLN 134 8.851 -8.759 -4.703 1020 1HG GLN 134 1HG GLN 134 10.940 -9.700 -4.687 1021 2HG GLN 134 2HG GLN 134 10.294 -10.729 -5.959 1022 1HE2 GLN 134 2HE2 GLN 134 11.798 -10.847 -7.629 1023 2HE2 GLN 134 1HE2 GLN 134 12.696 -9.536 -8.224 1024 HA PRO 135 HA PRO 135 7.092 -13.552 -6.053 1025 1HB PRO 135 1HB PRO 135 8.568 -15.087 -7.763 1026 2HB PRO 135 2HB PRO 135 7.087 -14.251 -8.251 1027 1HG PRO 135 1HG PRO 135 9.886 -13.653 -8.938 1028 2HG PRO 135 2HG PRO 135 8.397 -13.203 -9.781 1029 1HD PRO 135 1HD PRO 135 9.993 -11.548 -8.077 1030 2HD PRO 135 2HD PRO 135 8.442 -11.135 -8.838 1031 H TYR 136 H TYR 136 7.963 -14.166 -4.070 1032 HA TYR 136 HA TYR 136 10.915 -14.594 -3.995 1033 1HB TYR 136 1HB TYR 136 9.993 -14.314 -1.321 1034 2HB TYR 136 2HB TYR 136 11.059 -13.250 -2.219 1035 HD1 TYR 136 HD1 TYR 136 7.587 -13.836 -1.110 1036 HD2 TYR 136 HD2 TYR 136 10.180 -11.151 -3.253 1037 HE1 TYR 136 HE1 TYR 136 5.893 -12.034 -0.992 1038 HE2 TYR 136 HE2 TYR 136 8.486 -9.398 -3.088 1039 HH TYR 136 HH TYR 136 5.736 -9.524 -2.835 1040 H SER 137 H SER 137 8.122 -16.399 -4.069 1041 HA SER 137 HA SER 137 9.544 -18.733 -3.086 1042 1HB SER 137 1HB SER 137 8.072 -17.253 -1.168 1043 2HB SER 137 2HB SER 137 7.142 -18.711 -1.495 1044 HG SER 137 HG SER 137 8.668 -19.871 -0.612 1045 H LYS 138 H LYS 138 7.257 -20.369 -2.575 1046 HA LYS 138 HA LYS 138 5.484 -20.072 -4.914 1047 1HB LYS 138 1HB LYS 138 7.670 -21.315 -5.573 1048 2HB LYS 138 2HB LYS 138 7.014 -22.652 -4.628 1049 1HG LYS 138 1HG LYS 138 4.861 -22.338 -6.010 1050 2HG LYS 138 2HG LYS 138 5.850 -21.361 -7.095 1051 1HD LYS 138 1HD LYS 138 6.964 -24.002 -6.300 1052 2HD LYS 138 2HD LYS 138 5.579 -24.027 -7.392 1053 1HE LYS 138 1HE LYS 138 8.036 -22.323 -7.870 1054 2HE LYS 138 2HE LYS 138 7.831 -23.938 -8.548 1055 1HZ LYS 138 1HZ LYS 138 5.593 -23.003 -9.367 1056 2HZ LYS 138 2HZ LYS 138 6.306 -21.485 -9.116 1057 3HZ LYS 138 3HZ LYS 138 7.012 -22.584 -10.202 1058 H ASP 139 H ASP 139 5.346 -20.314 -1.848 1059 HA ASP 139 HA ASP 139 3.168 -22.280 -1.836 1060 1HB ASP 139 1HB ASP 139 4.117 -23.175 0.362 1061 2HB ASP 139 2HB ASP 139 4.886 -23.726 -1.118 1062 H SER 140 H SER 140 4.951 -19.868 0.018 1063 HA SER 140 HA SER 140 2.617 -19.448 1.781 1064 1HB SER 140 1HB SER 140 4.418 -17.669 2.671 1065 2HB SER 140 2HB SER 140 4.438 -19.360 3.154 1066 HG SER 140 HG SER 140 6.073 -17.961 1.367 1067 HA PRO 141 HA PRO 141 1.369 -15.631 -0.181 1068 1HB PRO 141 1HB PRO 141 0.046 -14.506 1.923 1069 2HB PRO 141 2HB PRO 141 -0.576 -15.896 1.028 1070 1HG PRO 141 1HG PRO 141 0.559 -15.770 3.740 1071 2HG PRO 141 2HG PRO 141 -0.549 -16.954 3.034 1072 1HD PRO 141 1HD PRO 141 2.260 -17.253 3.448 1073 2HD PRO 141 2HD PRO 141 1.166 -18.376 2.615 1074 H PHE 142 H PHE 142 1.111 -13.073 1.163 1075 HA PHE 142 HA PHE 142 3.404 -12.359 2.695 1076 1HB PHE 142 1HB PHE 142 4.845 -11.343 1.036 1077 2HB PHE 142 2HB PHE 142 4.554 -13.008 0.556 1078 HD1 PHE 142 HD1 PHE 142 2.625 -13.461 -1.055 1079 HD2 PHE 142 HD2 PHE 142 4.294 -9.569 -0.418 1080 HE1 PHE 142 HE1 PHE 142 1.658 -12.697 -3.219 1081 HE2 PHE 142 HE2 PHE 142 3.347 -8.800 -2.580 1082 HZ PHE 142 HZ PHE 142 2.026 -10.366 -3.980 1083 H GLY 143 H GLY 143 3.930 -9.798 1.791 1084 1HA GLY 143 1HA GLY 143 2.252 -8.008 0.798 1085 2HA GLY 143 2HA GLY 143 1.332 -8.447 2.239 1086 H LEU 144 H LEU 144 1.581 -6.893 3.698 1087 HA LEU 144 HA LEU 144 4.321 -6.172 4.517 1088 1HB LEU 144 1HB LEU 144 3.351 -3.684 4.758 1089 2HB LEU 144 2HB LEU 144 4.251 -4.224 3.356 1090 HG LEU 144 HG LEU 144 2.193 -2.919 2.860 1091 1HD1 LEU 144 1HD1 LEU 144 3.305 -4.904 1.469 1092 2HD1 LEU 144 2HD1 LEU 144 1.717 -5.628 1.715 1093 3HD1 LEU 144 3HD1 LEU 144 1.857 -4.070 0.904 1094 1HD2 LEU 144 1HD2 LEU 144 0.919 -5.214 4.291 1095 2HD2 LEU 144 2HD2 LEU 144 0.548 -3.501 4.365 1096 3HD2 LEU 144 3HD2 LEU 144 0.059 -4.449 2.965 1097 H SER 145 H SER 145 4.333 -4.919 6.555 1098 HA SER 145 HA SER 145 2.551 -6.185 8.467 1099 1HB SER 145 1HB SER 145 3.886 -4.641 10.060 1100 2HB SER 145 2HB SER 145 4.757 -5.904 9.214 1101 HG SER 145 HG SER 145 5.745 -4.460 8.022 1102 H PHE 146 H PHE 146 2.744 -3.068 6.879 1103 HA PHE 146 HA PHE 146 0.118 -2.304 7.804 1104 1HB PHE 146 1HB PHE 146 0.762 -0.457 9.312 1105 2HB PHE 146 2HB PHE 146 1.355 -1.996 9.936 1106 HD1 PHE 146 HD1 PHE 146 3.777 -2.613 9.670 1107 HD2 PHE 146 HD2 PHE 146 2.257 1.241 8.551 1108 HE1 PHE 146 HE1 PHE 146 6.097 -1.730 9.538 1109 HE2 PHE 146 HE2 PHE 146 4.561 2.135 8.441 1110 HZ PHE 146 HZ PHE 146 6.491 0.630 8.925 1111 H VAL 147 H VAL 147 -0.257 0.121 7.344 1112 HA VAL 147 HA VAL 147 1.542 1.287 5.325 1113 HB VAL 147 HB VAL 147 -0.194 1.480 3.619 1114 1HG1 VAL 147 1HG1 VAL 147 1.225 -0.642 3.856 1115 2HG1 VAL 147 2HG1 VAL 147 -0.214 -1.396 4.542 1116 3HG1 VAL 147 3HG1 VAL 147 -0.243 -0.783 2.889 1117 1HG2 VAL 147 1HG2 VAL 147 -1.903 0.238 5.768 1118 2HG2 VAL 147 2HG2 VAL 147 -2.255 1.629 4.742 1119 3HG2 VAL 147 3HG2 VAL 147 -2.318 0.000 4.070 1120 H ARG 148 H ARG 148 1.554 3.503 5.641 1121 HA ARG 148 HA ARG 148 -0.829 4.770 6.896 1122 1HB ARG 148 1HB ARG 148 1.996 5.207 7.896 1123 2HB ARG 148 2HB ARG 148 0.517 5.855 8.590 1124 1HG ARG 148 1HG ARG 148 -0.204 3.377 8.835 1125 2HG ARG 148 2HG ARG 148 1.507 3.021 8.601 1126 1HD ARG 148 1HD ARG 148 2.001 4.669 10.462 1127 2HD ARG 148 2HD ARG 148 0.268 4.709 10.781 1128 HE ARG 148 HE ARG 148 0.913 2.004 10.797 1129 1HH1 ARG 148 1HH1 ARG 148 2.012 4.847 12.512 1130 2HH1 ARG 148 2HH1 ARG 148 2.433 3.952 13.930 1131 1HH2 ARG 148 1HH2 ARG 148 1.471 0.886 12.653 1132 2HH2 ARG 148 2HH2 ARG 148 2.130 1.734 14.012 1133 H PHE 149 H PHE 149 -1.363 6.417 5.558 1134 HA PHE 149 HA PHE 149 0.706 7.742 3.912 1135 1HB PHE 149 1HB PHE 149 -2.295 8.177 4.058 1136 2HB PHE 149 2HB PHE 149 -1.216 8.927 2.888 1137 HD1 PHE 149 HD1 PHE 149 0.405 7.113 1.677 1138 HD2 PHE 149 HD2 PHE 149 -3.466 6.306 3.345 1139 HE1 PHE 149 HE1 PHE 149 0.184 5.130 0.204 1140 HE2 PHE 149 HE2 PHE 149 -3.688 4.325 1.870 1141 HZ PHE 149 HZ PHE 149 -1.862 3.736 0.303 1142 H HIS 150 H HIS 150 1.019 10.079 4.040 1143 HA HIS 150 HA HIS 150 -0.171 11.529 6.326 1144 1HB HIS 150 1HB HIS 150 2.478 12.188 6.766 1145 2HB HIS 150 2HB HIS 150 1.527 11.094 7.755 1146 HD1 HIS 150 HD1 HIS 150 4.600 11.237 5.909 1147 HD2 HIS 150 HD2 HIS 150 1.807 8.251 6.708 1148 HE1 HIS 150 HE1 HIS 150 5.763 9.031 5.465 1149 H SER 151 H SER 151 -0.655 13.465 5.575 1150 HA SER 151 HA SER 151 0.363 14.501 3.083 1151 1HB SER 151 1HB SER 151 -1.915 14.914 4.446 1152 2HB SER 151 2HB SER 151 -1.011 16.322 4.991 1153 HG SER 151 HG SER 151 -1.749 17.073 3.143 Start of MODEL 11 1 H MET 1 H MET 1 -4.302 19.980 11.074 2 HA MET 1 HA MET 1 -4.119 19.312 8.715 3 1HB MET 1 1HB MET 1 -1.893 21.279 8.939 4 2HB MET 1 2HB MET 1 -1.575 19.827 7.988 5 1HG MET 1 1HG MET 1 -3.731 20.276 6.746 6 2HG MET 1 2HG MET 1 -3.811 21.828 7.580 7 1HE MET 1 1HE MET 1 -4.112 21.757 4.832 8 2HE MET 1 2HE MET 1 -2.796 22.283 3.785 9 3HE MET 1 3HE MET 1 -2.986 20.572 4.158 10 HA PRO 2 HA PRO 2 -1.819 16.419 11.464 11 1HB PRO 2 1HB PRO 2 -3.774 14.514 11.538 12 2HB PRO 2 2HB PRO 2 -3.738 15.909 12.626 13 1HG PRO 2 1HG PRO 2 -5.558 15.334 10.399 14 2HG PRO 2 2HG PRO 2 -5.752 16.461 11.748 15 1HD PRO 2 1HD PRO 2 -4.976 17.059 9.030 16 2HD PRO 2 2HD PRO 2 -5.208 18.192 10.379 17 H GLU 3 H GLU 3 -2.034 13.715 10.981 18 HA GLU 3 HA GLU 3 -0.785 13.433 8.350 19 1HB GLU 3 1HB GLU 3 -0.567 11.037 9.039 20 2HB GLU 3 2HB GLU 3 0.076 12.150 10.245 21 1HG GLU 3 1HG GLU 3 -1.739 11.836 11.696 22 2HG GLU 3 2HG GLU 3 -2.785 11.232 10.410 23 H ILE 4 H ILE 4 -1.668 11.016 7.421 24 HA ILE 4 HA ILE 4 -4.563 11.503 6.881 25 HB ILE 4 HB ILE 4 -2.310 10.674 5.034 26 1HG1 ILE 4 1HG1 ILE 4 -4.452 12.768 4.660 27 2HG1 ILE 4 2HG1 ILE 4 -2.967 13.108 5.547 28 1HG2 ILE 4 1HG2 ILE 4 -5.300 10.470 4.542 29 2HG2 ILE 4 2HG2 ILE 4 -4.079 10.391 3.271 30 3HG2 ILE 4 3HG2 ILE 4 -4.136 9.145 4.518 31 1HD1 ILE 4 1HD1 ILE 4 -2.952 11.944 2.761 32 2HD1 ILE 4 2HD1 ILE 4 -2.948 13.682 3.057 33 3HD1 ILE 4 3HD1 ILE 4 -1.613 12.687 3.636 34 H ARG 5 H ARG 5 -5.848 9.857 7.452 35 HA ARG 5 HA ARG 5 -4.595 7.197 7.987 36 1HB ARG 5 1HB ARG 5 -6.546 6.813 9.493 37 2HB ARG 5 2HB ARG 5 -5.574 8.196 9.988 38 1HG ARG 5 1HG ARG 5 -7.557 9.116 8.122 39 2HG ARG 5 2HG ARG 5 -8.362 8.137 9.346 40 1HD ARG 5 1HD ARG 5 -6.358 9.957 10.482 41 2HD ARG 5 2HD ARG 5 -7.658 10.797 9.637 42 HE ARG 5 HE ARG 5 -8.932 8.881 11.226 43 1HH1 ARG 5 1HH1 ARG 5 -6.777 11.587 11.742 44 2HH1 ARG 5 2HH1 ARG 5 -7.409 11.918 13.317 45 1HH2 ARG 5 1HH2 ARG 5 -9.720 9.345 13.267 46 2HH2 ARG 5 2HH2 ARG 5 -9.057 10.663 14.174 47 H LEU 6 H LEU 6 -6.394 5.392 7.783 48 HA LEU 6 HA LEU 6 -7.722 5.812 5.139 49 1HB LEU 6 1HB LEU 6 -6.098 3.651 6.281 50 2HB LEU 6 2HB LEU 6 -7.599 3.073 5.566 51 HG LEU 6 HG LEU 6 -7.063 4.054 3.434 52 1HD1 LEU 6 1HD1 LEU 6 -4.720 5.327 4.888 53 2HD1 LEU 6 2HD1 LEU 6 -4.882 5.291 3.133 54 3HD1 LEU 6 3HD1 LEU 6 -6.063 6.163 4.108 55 1HD2 LEU 6 1HD2 LEU 6 -5.974 1.909 3.987 56 2HD2 LEU 6 2HD2 LEU 6 -4.962 2.881 2.917 57 3HD2 LEU 6 3HD2 LEU 6 -4.587 2.784 4.637 58 H ARG 7 H ARG 7 -9.767 4.688 4.828 59 HA ARG 7 HA ARG 7 -11.340 4.531 7.358 60 1HB ARG 7 1HB ARG 7 -12.000 6.133 5.445 61 2HB ARG 7 2HB ARG 7 -12.481 4.681 4.568 62 1HG ARG 7 1HG ARG 7 -14.441 5.509 5.698 63 2HG ARG 7 2HG ARG 7 -13.915 4.062 6.557 64 1HD ARG 7 1HD ARG 7 -12.490 6.084 7.817 65 2HD ARG 7 2HD ARG 7 -14.052 6.836 7.495 66 HE ARG 7 HE ARG 7 -13.550 4.661 9.370 67 1HH1 ARG 7 1HH1 ARG 7 -15.929 6.198 7.316 68 2HH1 ARG 7 2HH1 ARG 7 -17.260 5.606 8.247 69 1HH2 ARG 7 1HH2 ARG 7 -15.301 3.916 10.542 70 2HH2 ARG 7 2HH2 ARG 7 -16.912 4.327 10.054 71 H HIS 8 H HIS 8 -11.163 2.974 4.166 72 HA HIS 8 HA HIS 8 -11.172 0.318 5.366 73 1HB HIS 8 1HB HIS 8 -13.266 -0.408 4.216 74 2HB HIS 8 2HB HIS 8 -13.564 0.779 5.485 75 HD1 HIS 8 HD1 HIS 8 -14.812 2.842 4.807 76 HD2 HIS 8 HD2 HIS 8 -13.197 0.860 1.514 77 HE1 HIS 8 HE1 HIS 8 -15.662 4.055 2.752 78 H VAL 9 H VAL 9 -11.215 -1.371 3.527 79 HA VAL 9 HA VAL 9 -9.393 -0.448 1.430 80 HB VAL 9 HB VAL 9 -9.030 -2.632 2.507 81 1HG1 VAL 9 1HG1 VAL 9 -11.792 -2.879 2.376 82 2HG1 VAL 9 2HG1 VAL 9 -11.229 -4.035 1.169 83 3HG1 VAL 9 3HG1 VAL 9 -10.666 -4.155 2.834 84 1HG2 VAL 9 1HG2 VAL 9 -8.584 -2.147 -0.030 85 2HG2 VAL 9 2HG2 VAL 9 -8.463 -3.805 0.559 86 3HG2 VAL 9 3HG2 VAL 9 -9.911 -3.277 -0.299 87 H VAL 10 H VAL 10 -10.680 0.942 0.125 88 HA VAL 10 HA VAL 10 -13.280 0.455 -0.825 89 HB VAL 10 HB VAL 10 -12.407 2.615 -1.264 90 1HG1 VAL 10 1HG1 VAL 10 -9.955 1.341 -1.636 91 2HG1 VAL 10 2HG1 VAL 10 -10.327 1.999 -3.224 92 3HG1 VAL 10 3HG1 VAL 10 -10.269 3.062 -1.819 93 1HG2 VAL 10 1HG2 VAL 10 -13.653 1.265 -3.222 94 2HG2 VAL 10 2HG2 VAL 10 -13.102 2.925 -3.446 95 3HG2 VAL 10 3HG2 VAL 10 -12.132 1.584 -4.056 96 H SER 11 H SER 11 -10.257 -0.325 -2.640 97 HA SER 11 HA SER 11 -11.826 -2.514 -3.919 98 1HB SER 11 1HB SER 11 -10.856 -0.302 -5.250 99 2HB SER 11 2HB SER 11 -9.571 -1.479 -5.504 100 HG SER 11 HG SER 11 -11.795 -1.330 -6.810 101 H CYS 12 H CYS 12 -10.435 -4.417 -4.516 102 HA CYS 12 HA CYS 12 -7.696 -4.444 -3.489 103 1HB CYS 12 1HB CYS 12 -8.136 -6.252 -1.828 104 2HB CYS 12 2HB CYS 12 -8.874 -4.713 -1.389 105 HG CYS 12 HG CYS 12 -10.656 -6.781 -2.881 106 H SER 13 H SER 13 -6.564 -5.752 -4.772 107 HA SER 13 HA SER 13 -7.967 -8.057 -6.059 108 1HB SER 13 1HB SER 13 -6.175 -5.966 -7.155 109 2HB SER 13 2HB SER 13 -5.817 -7.609 -7.681 110 HG SER 13 HG SER 13 -7.609 -7.626 -8.792 111 H SER 14 H SER 14 -7.085 -8.643 -3.672 112 HA SER 14 HA SER 14 -5.456 -10.805 -3.646 113 1HB SER 14 1HB SER 14 -3.229 -9.649 -2.754 114 2HB SER 14 2HB SER 14 -3.471 -9.961 -4.469 115 HG SER 14 HG SER 14 -4.449 -7.548 -3.431 116 H GLN 15 H GLN 15 -6.903 -11.080 -1.830 117 HA GLN 15 HA GLN 15 -5.723 -10.275 0.701 118 1HB GLN 15 1HB GLN 15 -8.239 -9.431 1.366 119 2HB GLN 15 2HB GLN 15 -6.900 -8.364 0.979 120 1HG GLN 15 1HG GLN 15 -8.572 -7.518 -0.386 121 2HG GLN 15 2HG GLN 15 -7.778 -8.623 -1.498 122 1HE2 GLN 15 2HE2 GLN 15 -8.768 -10.967 -1.377 123 2HE2 GLN 15 1HE2 GLN 15 -10.463 -11.050 -1.292 124 H ASP 16 H ASP 16 -6.378 -11.620 2.398 125 HA ASP 16 HA ASP 16 -7.981 -13.963 1.526 126 1HB ASP 16 1HB ASP 16 -5.714 -13.530 3.307 127 2HB ASP 16 2HB ASP 16 -6.986 -14.455 4.105 128 H SER 17 H SER 17 -8.923 -14.905 3.943 129 HA SER 17 HA SER 17 -11.109 -13.004 4.469 130 1HB SER 17 1HB SER 17 -11.663 -15.367 4.093 131 2HB SER 17 2HB SER 17 -10.640 -15.836 5.449 132 HG SER 17 HG SER 17 -12.176 -15.268 6.769 133 H THR 18 H THR 18 -9.024 -15.023 6.588 134 HA THR 18 HA THR 18 -9.536 -13.446 8.930 135 HB THR 18 HB THR 18 -7.136 -14.608 9.474 136 HG1 THR 18 HG1 THR 18 -7.240 -16.647 8.345 137 1HG2 THR 18 1HG2 THR 18 -9.939 -15.696 9.474 138 2HG2 THR 18 2HG2 THR 18 -8.597 -16.674 10.070 139 3HG2 THR 18 3HG2 THR 18 -8.974 -15.131 10.838 140 H HIS 19 H HIS 19 -6.477 -13.747 7.103 141 HA HIS 19 HA HIS 19 -5.657 -11.075 8.064 142 1HB HIS 19 1HB HIS 19 -4.209 -13.051 6.269 143 2HB HIS 19 2HB HIS 19 -3.511 -11.594 6.978 144 HD1 HIS 19 HD1 HIS 19 -3.606 -11.539 9.721 145 HD2 HIS 19 HD2 HIS 19 -3.994 -15.274 7.910 146 HE1 HIS 19 HE1 HIS 19 -3.131 -13.259 11.518 147 H CYS 20 H CYS 20 -7.520 -10.111 6.819 148 HA CYS 20 HA CYS 20 -7.187 -10.071 3.887 149 1HB CYS 20 1HB CYS 20 -9.280 -8.738 3.913 150 2HB CYS 20 2HB CYS 20 -9.462 -10.256 4.787 151 HG CYS 20 HG CYS 20 -10.191 -8.849 6.689 152 H ALA 21 H ALA 21 -7.344 -7.878 2.822 153 HA ALA 21 HA ALA 21 -5.140 -6.237 3.595 154 1HB ALA 21 1HB ALA 21 -7.445 -5.844 1.676 155 2HB ALA 21 2HB ALA 21 -6.177 -4.634 1.878 156 3HB ALA 21 3HB ALA 21 -5.772 -6.249 1.294 157 H GLU 22 H GLU 22 -8.512 -6.200 4.506 158 HA GLU 22 HA GLU 22 -8.725 -3.473 5.331 159 1HB GLU 22 1HB GLU 22 -10.465 -5.550 5.226 160 2HB GLU 22 2HB GLU 22 -10.137 -5.517 6.957 161 1HG GLU 22 1HG GLU 22 -10.485 -2.897 6.613 162 2HG GLU 22 2HG GLU 22 -11.438 -3.447 5.234 163 H ASN 23 H ASN 23 -6.943 -6.126 6.689 164 HA ASN 23 HA ASN 23 -6.913 -5.294 9.439 165 1HB ASN 23 1HB ASN 23 -5.047 -6.920 7.732 166 2HB ASN 23 2HB ASN 23 -4.653 -6.545 9.409 167 1HD2 ASN 23 2HD2 ASN 23 -5.859 -9.002 7.674 168 2HD2 ASN 23 1HD2 ASN 23 -6.996 -9.639 8.764 169 H LEU 24 H LEU 24 -5.486 -3.990 6.606 170 HA LEU 24 HA LEU 24 -3.190 -2.714 7.728 171 1HB LEU 24 1HB LEU 24 -4.889 -1.803 5.384 172 2HB LEU 24 2HB LEU 24 -3.207 -1.372 5.696 173 HG LEU 24 HG LEU 24 -3.952 -4.278 5.475 174 1HD1 LEU 24 1HD1 LEU 24 -4.791 -2.703 3.491 175 2HD1 LEU 24 2HD1 LEU 24 -3.096 -2.826 3.017 176 3HD1 LEU 24 3HD1 LEU 24 -4.074 -4.284 3.181 177 1HD2 LEU 24 1HD2 LEU 24 -1.539 -2.571 5.403 178 2HD2 LEU 24 2HD2 LEU 24 -1.726 -4.240 5.941 179 3HD2 LEU 24 3HD2 LEU 24 -1.562 -3.880 4.222 180 H LEU 25 H LEU 25 -6.620 -1.994 7.733 181 HA LEU 25 HA LEU 25 -6.518 0.774 8.387 182 1HB LEU 25 1HB LEU 25 -8.474 -1.467 8.841 183 2HB LEU 25 2HB LEU 25 -8.754 0.101 9.578 184 HG LEU 25 HG LEU 25 -9.905 -0.079 7.401 185 1HD1 LEU 25 1HD1 LEU 25 -8.869 2.099 8.256 186 2HD1 LEU 25 2HD1 LEU 25 -7.569 1.812 7.100 187 3HD1 LEU 25 3HD1 LEU 25 -9.222 2.024 6.531 188 1HD2 LEU 25 1HD2 LEU 25 -8.198 -1.662 6.413 189 2HD2 LEU 25 2HD2 LEU 25 -8.672 -0.345 5.341 190 3HD2 LEU 25 3HD2 LEU 25 -7.130 -0.276 6.195 191 H LYS 26 H LYS 26 -5.696 -2.076 10.197 192 HA LYS 26 HA LYS 26 -5.540 -0.420 12.687 193 1HB LYS 26 1HB LYS 26 -5.645 -3.449 12.579 194 2HB LYS 26 2HB LYS 26 -5.843 -2.413 13.989 195 1HG LYS 26 1HG LYS 26 -7.719 -2.351 11.614 196 2HG LYS 26 2HG LYS 26 -8.007 -3.331 13.052 197 1HD LYS 26 1HD LYS 26 -7.965 -1.314 14.456 198 2HD LYS 26 2HD LYS 26 -7.637 -0.321 13.036 199 1HE LYS 26 1HE LYS 26 -9.961 -0.114 13.270 200 2HE LYS 26 2HE LYS 26 -9.809 -1.406 12.078 201 1HZ LYS 26 1HZ LYS 26 -9.961 -1.983 14.971 202 2HZ LYS 26 2HZ LYS 26 -11.364 -1.789 14.034 203 3HZ LYS 26 3HZ LYS 26 -10.265 -3.027 13.666 204 H ALA 27 H ALA 27 -3.478 0.178 11.358 205 HA ALA 27 HA ALA 27 -1.308 -1.580 10.988 206 1HB ALA 27 1HB ALA 27 -1.391 1.360 11.687 207 2HB ALA 27 2HB ALA 27 0.115 0.512 11.335 208 3HB ALA 27 3HB ALA 27 -1.140 0.629 10.101 209 H ASP 28 H ASP 28 -2.606 -0.290 13.961 210 HA ASP 28 HA ASP 28 -0.309 -1.515 15.436 211 1HB ASP 28 1HB ASP 28 -0.858 0.105 17.269 212 2HB ASP 28 2HB ASP 28 -0.324 0.893 15.784 213 H THR 29 H THR 29 -1.611 -3.537 15.283 214 HA THR 29 HA THR 29 -3.376 -3.775 17.623 215 HB THR 29 HB THR 29 -5.016 -5.105 16.007 216 HG1 THR 29 HG1 THR 29 -4.665 -4.715 13.996 217 1HG2 THR 29 1HG2 THR 29 -5.334 -2.945 17.436 218 2HG2 THR 29 2HG2 THR 29 -5.171 -2.105 15.894 219 3HG2 THR 29 3HG2 THR 29 -6.471 -3.274 16.128 220 H TYR 30 H TYR 30 -3.315 -6.060 14.901 221 HA TYR 30 HA TYR 30 -1.118 -7.643 15.781 222 1HB TYR 30 1HB TYR 30 -2.358 -9.505 16.873 223 2HB TYR 30 2HB TYR 30 -2.447 -8.011 17.803 224 HD1 TYR 30 HD1 TYR 30 -4.521 -6.634 17.780 225 HD2 TYR 30 HD2 TYR 30 -4.314 -10.463 15.846 226 HE1 TYR 30 HE1 TYR 30 -6.998 -6.712 17.671 227 HE2 TYR 30 HE2 TYR 30 -6.790 -10.542 15.738 228 HH TYR 30 HH TYR 30 -8.737 -7.853 16.245 229 H ARG 31 H ARG 31 -2.361 -6.791 13.313 230 HA ARG 31 HA ARG 31 -2.477 -9.403 11.970 231 1HB ARG 31 1HB ARG 31 -4.847 -7.545 12.141 232 2HB ARG 31 2HB ARG 31 -4.635 -8.618 10.758 233 1HG ARG 31 1HG ARG 31 -4.183 -10.360 12.801 234 2HG ARG 31 2HG ARG 31 -5.340 -9.269 13.561 235 1HD ARG 31 1HD ARG 31 -6.620 -9.569 11.252 236 2HD ARG 31 2HD ARG 31 -5.702 -11.074 11.202 237 HE ARG 31 HE ARG 31 -6.892 -10.851 13.775 238 1HH1 ARG 31 1HH1 ARG 31 -7.812 -11.303 10.432 239 2HH1 ARG 31 2HH1 ARG 31 -9.241 -12.186 10.840 240 1HH2 ARG 31 1HH2 ARG 31 -8.749 -12.000 14.258 241 2HH2 ARG 31 2HH2 ARG 31 -9.768 -12.580 12.983 242 H LYS 32 H LYS 32 -2.040 -9.211 9.712 243 HA LYS 32 HA LYS 32 -1.361 -6.454 8.771 244 1HB LYS 32 1HB LYS 32 0.262 -8.985 8.382 245 2HB LYS 32 2HB LYS 32 0.639 -7.416 7.682 246 1HG LYS 32 1HG LYS 32 1.304 -6.513 9.698 247 2HG LYS 32 2HG LYS 32 0.223 -7.546 10.633 248 1HD LYS 32 1HD LYS 32 1.878 -9.418 9.550 249 2HD LYS 32 2HD LYS 32 2.988 -8.057 9.702 250 1HE LYS 32 1HE LYS 32 1.229 -9.052 11.959 251 2HE LYS 32 2HE LYS 32 2.911 -9.536 11.739 252 1HZ LYS 32 1HZ LYS 32 3.480 -7.130 11.778 253 2HZ LYS 32 2HZ LYS 32 1.877 -6.798 12.220 254 3HZ LYS 32 3HZ LYS 32 2.867 -7.723 13.247 255 H TRP 33 H TRP 33 -0.614 -6.979 6.199 256 HA TRP 33 HA TRP 33 -3.149 -7.902 4.996 257 1HB TRP 33 1HB TRP 33 -2.049 -5.811 4.154 258 2HB TRP 33 2HB TRP 33 -0.665 -6.768 3.676 259 HD1 TRP 33 HD1 TRP 33 -4.216 -8.069 3.151 260 HE1 TRP 33 HE1 TRP 33 -4.670 -8.232 0.598 261 HE3 TRP 33 HE3 TRP 33 -0.013 -5.820 1.407 262 HZ2 TRP 33 HZ2 TRP 33 -3.373 -7.458 -1.826 263 HZ3 TRP 33 HZ3 TRP 33 0.370 -5.559 -1.035 264 HH2 TRP 33 HH2 TRP 33 -1.313 -6.368 -2.650 265 H ARG 34 H ARG 34 -3.331 -9.743 3.772 266 HA ARG 34 HA ARG 34 -0.889 -11.287 3.142 267 1HB ARG 34 1HB ARG 34 -2.412 -11.947 5.354 268 2HB ARG 34 2HB ARG 34 -3.116 -12.968 4.103 269 1HG ARG 34 1HG ARG 34 -1.400 -14.391 4.482 270 2HG ARG 34 2HG ARG 34 -0.377 -13.214 3.660 271 1HD ARG 34 1HD ARG 34 0.140 -12.125 5.786 272 2HD ARG 34 2HD ARG 34 -0.964 -13.206 6.637 273 HE ARG 34 HE ARG 34 1.102 -14.632 5.158 274 1HH1 ARG 34 1HH1 ARG 34 0.316 -13.014 8.157 275 2HH1 ARG 34 2HH1 ARG 34 1.497 -13.896 9.059 276 1HH2 ARG 34 1HH2 ARG 34 2.617 -15.750 6.364 277 2HH2 ARG 34 2HH2 ARG 34 2.787 -15.429 8.058 278 H ALA 35 H ALA 35 -1.046 -11.944 1.021 279 HA ALA 35 HA ALA 35 -3.205 -11.286 -0.672 280 1HB ALA 35 1HB ALA 35 -0.914 -12.048 -1.421 281 2HB ALA 35 2HB ALA 35 -1.412 -13.702 -1.063 282 3HB ALA 35 3HB ALA 35 -2.246 -12.781 -2.316 283 H ALA 36 H ALA 36 -4.903 -12.532 -1.595 284 HA ALA 36 HA ALA 36 -6.430 -14.092 0.207 285 1HB ALA 36 1HB ALA 36 -6.814 -12.955 -2.279 286 2HB ALA 36 2HB ALA 36 -6.911 -14.677 -2.630 287 3HB ALA 36 3HB ALA 36 -7.988 -13.961 -1.433 288 H LYS 37 H LYS 37 -3.841 -15.017 -1.937 289 HA LYS 37 HA LYS 37 -4.120 -17.814 -0.996 290 1HB LYS 37 1HB LYS 37 -3.528 -18.588 -3.306 291 2HB LYS 37 2HB LYS 37 -5.097 -17.791 -3.232 292 1HG LYS 37 1HG LYS 37 -4.005 -15.665 -3.958 293 2HG LYS 37 2HG LYS 37 -2.487 -16.545 -4.142 294 1HD LYS 37 1HD LYS 37 -3.272 -16.741 -6.300 295 2HD LYS 37 2HD LYS 37 -4.049 -18.161 -5.598 296 1HE LYS 37 1HE LYS 37 -6.034 -16.651 -5.065 297 2HE LYS 37 2HE LYS 37 -5.270 -15.438 -6.091 298 1HZ LYS 37 1HZ LYS 37 -5.878 -18.202 -6.981 299 2HZ LYS 37 2HZ LYS 37 -6.908 -16.876 -7.249 300 3HZ LYS 37 3HZ LYS 37 -5.357 -16.905 -7.943 301 H ALA 38 H ALA 38 -1.933 -18.889 -2.205 302 HA ALA 38 HA ALA 38 0.298 -17.325 -1.008 303 1HB ALA 38 1HB ALA 38 -0.223 -20.212 -1.575 304 2HB ALA 38 2HB ALA 38 1.450 -19.661 -1.615 305 3HB ALA 38 3HB ALA 38 0.492 -19.459 -0.149 306 H GLY 39 H GLY 39 2.472 -18.149 -2.378 307 1HA GLY 39 1HA GLY 39 3.705 -17.732 -4.333 308 2HA GLY 39 2HA GLY 39 2.270 -18.246 -5.228 309 H GLU 40 H GLU 40 2.830 -15.552 -3.011 310 HA GLU 40 HA GLU 40 1.224 -13.691 -4.439 311 1HB GLU 40 1HB GLU 40 3.552 -12.794 -2.765 312 2HB GLU 40 2HB GLU 40 1.978 -12.036 -2.955 313 1HG GLU 40 1HG GLU 40 1.254 -14.447 -1.929 314 2HG GLU 40 2HG GLU 40 2.813 -14.223 -1.151 315 H LYS 41 H LYS 41 2.030 -14.063 -6.638 316 HA LYS 41 HA LYS 41 4.682 -13.252 -7.454 317 1HB LYS 41 1HB LYS 41 3.093 -14.639 -8.856 318 2HB LYS 41 2HB LYS 41 2.139 -13.178 -9.115 319 1HG LYS 41 1HG LYS 41 3.737 -12.204 -10.467 320 2HG LYS 41 2HG LYS 41 5.071 -13.036 -9.666 321 1HD LYS 41 1HD LYS 41 3.825 -15.176 -10.703 322 2HD LYS 41 2HD LYS 41 3.314 -13.970 -11.884 323 1HE LYS 41 1HE LYS 41 5.844 -13.286 -11.885 324 2HE LYS 41 2HE LYS 41 6.093 -14.897 -11.213 325 1HZ LYS 41 1HZ LYS 41 4.563 -14.362 -13.697 326 2HZ LYS 41 2HZ LYS 41 6.205 -14.788 -13.675 327 3HZ LYS 41 3HZ LYS 41 5.039 -15.876 -13.088 328 H THR 42 H THR 42 1.510 -11.654 -7.532 329 HA THR 42 HA THR 42 2.709 -9.062 -6.881 330 HB THR 42 HB THR 42 1.830 -7.901 -8.865 331 HG1 THR 42 HG1 THR 42 0.400 -8.867 -10.027 332 1HG2 THR 42 1HG2 THR 42 4.138 -8.960 -8.890 333 2HG2 THR 42 2HG2 THR 42 3.430 -10.282 -9.816 334 3HG2 THR 42 3HG2 THR 42 3.433 -8.646 -10.475 335 H ILE 43 H ILE 43 1.263 -8.153 -5.484 336 HA ILE 43 HA ILE 43 -1.609 -8.969 -5.733 337 HB ILE 43 HB ILE 43 -1.644 -8.334 -3.212 338 1HG1 ILE 43 1HG1 ILE 43 1.308 -8.923 -3.559 339 2HG1 ILE 43 2HG1 ILE 43 0.637 -7.334 -3.193 340 1HG2 ILE 43 1HG2 ILE 43 -1.614 -10.665 -4.454 341 2HG2 ILE 43 2HG2 ILE 43 -0.029 -10.789 -3.693 342 3HG2 ILE 43 3HG2 ILE 43 -1.467 -10.566 -2.699 343 1HD1 ILE 43 1HD1 ILE 43 -0.566 -8.789 -1.252 344 2HD1 ILE 43 2HD1 ILE 43 0.922 -9.715 -1.440 345 3HD1 ILE 43 3HD1 ILE 43 0.997 -8.004 -1.029 346 H SER 44 H SER 44 -3.169 -7.364 -5.713 347 HA SER 44 HA SER 44 -2.136 -4.559 -5.475 348 1HB SER 44 1HB SER 44 -4.504 -4.321 -6.845 349 2HB SER 44 2HB SER 44 -2.920 -4.388 -7.598 350 HG SER 44 HG SER 44 -3.407 -6.281 -8.359 351 H VAL 45 H VAL 45 -3.263 -3.170 -4.115 352 HA VAL 45 HA VAL 45 -5.820 -4.065 -2.927 353 HB VAL 45 HB VAL 45 -4.089 -4.981 -1.424 354 1HG1 VAL 45 1HG1 VAL 45 -2.442 -3.069 -2.071 355 2HG1 VAL 45 2HG1 VAL 45 -3.233 -2.168 -0.777 356 3HG1 VAL 45 3HG1 VAL 45 -2.410 -3.686 -0.420 357 1HG2 VAL 45 1HG2 VAL 45 -5.652 -2.601 -0.394 358 2HG2 VAL 45 2HG2 VAL 45 -6.127 -4.299 -0.350 359 3HG2 VAL 45 3HG2 VAL 45 -4.804 -3.727 0.667 360 H VAL 46 H VAL 46 -7.050 -2.300 -3.484 361 HA VAL 46 HA VAL 46 -5.859 0.407 -3.361 362 HB VAL 46 HB VAL 46 -8.683 -0.315 -4.153 363 1HG1 VAL 46 1HG1 VAL 46 -8.057 2.077 -3.651 364 2HG1 VAL 46 2HG1 VAL 46 -6.913 1.989 -4.990 365 3HG1 VAL 46 3HG1 VAL 46 -8.641 1.806 -5.294 366 1HG2 VAL 46 1HG2 VAL 46 -6.104 -0.557 -5.656 367 2HG2 VAL 46 2HG2 VAL 46 -7.551 -1.562 -5.752 368 3HG2 VAL 46 3HG2 VAL 46 -7.522 0.020 -6.532 369 H LEU 47 H LEU 47 -5.982 1.485 -1.474 370 HA LEU 47 HA LEU 47 -8.069 0.705 0.488 371 1HB LEU 47 1HB LEU 47 -5.834 2.671 0.981 372 2HB LEU 47 2HB LEU 47 -6.735 1.711 2.153 373 HG LEU 47 HG LEU 47 -5.641 -0.216 0.455 374 1HD1 LEU 47 1HD1 LEU 47 -3.630 1.999 0.968 375 2HD1 LEU 47 2HD1 LEU 47 -3.213 0.377 0.419 376 3HD1 LEU 47 3HD1 LEU 47 -4.187 1.432 -0.606 377 1HD2 LEU 47 1HD2 LEU 47 -5.822 0.028 3.053 378 2HD2 LEU 47 2HD2 LEU 47 -4.494 -0.920 2.385 379 3HD2 LEU 47 3HD2 LEU 47 -4.210 0.732 2.935 380 H GLN 48 H GLN 48 -9.020 2.577 1.783 381 HA GLN 48 HA GLN 48 -9.745 4.780 -0.105 382 1HB GLN 48 1HB GLN 48 -11.461 2.974 0.883 383 2HB GLN 48 2HB GLN 48 -11.485 4.119 2.224 384 1HG GLN 48 1HG GLN 48 -11.827 5.012 -0.638 385 2HG GLN 48 2HG GLN 48 -13.199 4.508 0.350 386 1HE2 GLN 48 2HE2 GLN 48 -12.725 5.594 2.813 387 2HE2 GLN 48 1HE2 GLN 48 -12.553 7.280 2.722 388 H LEU 49 H LEU 49 -9.277 6.817 0.537 389 HA LEU 49 HA LEU 49 -8.085 7.297 3.180 390 1HB LEU 49 1HB LEU 49 -8.665 9.288 0.960 391 2HB LEU 49 2HB LEU 49 -7.554 9.494 2.314 392 HG LEU 49 HG LEU 49 -7.258 7.374 0.166 393 1HD1 LEU 49 1HD1 LEU 49 -6.944 9.947 -0.380 394 2HD1 LEU 49 2HD1 LEU 49 -5.419 9.720 0.475 395 3HD1 LEU 49 3HD1 LEU 49 -5.776 8.760 -0.962 396 1HD2 LEU 49 1HD2 LEU 49 -5.789 8.114 2.661 397 2HD2 LEU 49 2HD2 LEU 49 -6.041 6.525 1.937 398 3HD2 LEU 49 3HD2 LEU 49 -4.827 7.616 1.269 399 H GLU 50 H GLU 50 -9.216 8.290 4.801 400 HA GLU 50 HA GLU 50 -12.106 8.589 4.501 401 1HB GLU 50 1HB GLU 50 -12.040 9.197 6.914 402 2HB GLU 50 2HB GLU 50 -11.204 7.681 6.576 403 1HG GLU 50 1HG GLU 50 -9.144 8.551 7.062 404 2HG GLU 50 2HG GLU 50 -9.550 10.143 6.422 405 H LYS 51 H LYS 51 -10.754 10.469 2.821 406 HA LYS 51 HA LYS 51 -12.127 12.824 3.063 407 1HB LYS 51 1HB LYS 51 -10.315 14.388 4.023 408 2HB LYS 51 2HB LYS 51 -11.229 13.439 5.193 409 1HG LYS 51 1HG LYS 51 -9.426 12.142 5.751 410 2HG LYS 51 2HG LYS 51 -8.782 12.151 4.109 411 1HD LYS 51 1HD LYS 51 -7.958 14.426 4.399 412 2HD LYS 51 2HD LYS 51 -8.692 14.518 6.000 413 1HE LYS 51 1HE LYS 51 -6.586 12.484 5.222 414 2HE LYS 51 2HE LYS 51 -6.231 14.001 6.047 415 1HZ LYS 51 1HZ LYS 51 -7.830 13.292 7.790 416 2HZ LYS 51 2HZ LYS 51 -7.928 11.777 7.034 417 3HZ LYS 51 3HZ LYS 51 -6.449 12.309 7.681 418 H GLU 52 H GLU 52 -11.673 14.016 1.217 419 HA GLU 52 HA GLU 52 -9.572 13.041 -0.560 420 1HB GLU 52 1HB GLU 52 -11.967 14.267 -1.006 421 2HB GLU 52 2HB GLU 52 -10.866 15.632 -1.162 422 1HG GLU 52 1HG GLU 52 -9.588 14.515 -2.868 423 2HG GLU 52 2HG GLU 52 -10.463 13.008 -2.609 424 H GLU 53 H GLU 53 -7.547 13.538 0.265 425 HA GLU 53 HA GLU 53 -6.936 16.426 0.654 426 1HB GLU 53 1HB GLU 53 -5.143 15.444 2.345 427 2HB GLU 53 2HB GLU 53 -6.789 15.773 2.880 428 1HG GLU 53 1HG GLU 53 -5.977 13.544 3.633 429 2HG GLU 53 2HG GLU 53 -7.385 13.415 2.586 430 H GLN 54 H GLN 54 -4.479 16.724 0.628 431 HA GLN 54 HA GLN 54 -3.448 15.432 -1.812 432 1HB GLN 54 1HB GLN 54 -2.360 17.673 -0.077 433 2HB GLN 54 2HB GLN 54 -1.587 17.092 -1.548 434 1HG GLN 54 1HG GLN 54 -3.436 17.764 -2.902 435 2HG GLN 54 2HG GLN 54 -4.435 18.068 -1.494 436 1HE2 GLN 54 2HE2 GLN 54 -1.016 19.070 -1.713 437 2HE2 GLN 54 1HE2 GLN 54 -1.339 20.735 -1.716 438 H ILE 55 H ILE 55 -1.022 14.787 -1.714 439 HA ILE 55 HA ILE 55 -0.423 13.485 0.912 440 HB ILE 55 HB ILE 55 0.067 12.271 -1.824 441 1HG1 ILE 55 1HG1 ILE 55 -1.709 10.615 -0.676 442 2HG1 ILE 55 2HG1 ILE 55 -2.210 12.118 0.100 443 1HG2 ILE 55 1HG2 ILE 55 1.443 11.757 0.433 444 2HG2 ILE 55 2HG2 ILE 55 0.061 10.695 0.705 445 3HG2 ILE 55 3HG2 ILE 55 1.053 10.499 -0.740 446 1HD1 ILE 55 1HD1 ILE 55 -1.719 12.217 -2.836 447 2HD1 ILE 55 2HD1 ILE 55 -3.164 11.365 -2.295 448 3HD1 ILE 55 3HD1 ILE 55 -2.929 13.060 -1.870 449 H HIS 56 H HIS 56 1.503 14.147 1.678 450 HA HIS 56 HA HIS 56 3.514 15.219 -0.259 451 1HB HIS 56 1HB HIS 56 2.562 16.704 1.627 452 2HB HIS 56 2HB HIS 56 3.511 15.695 2.722 453 HD1 HIS 56 HD1 HIS 56 4.114 17.630 -0.522 454 HD2 HIS 56 HD2 HIS 56 6.080 16.641 3.019 455 HE1 HIS 56 HE1 HIS 56 6.368 18.781 -0.609 456 H SER 57 H SER 57 2.975 12.999 2.434 457 HA SER 57 HA SER 57 5.502 11.610 1.707 458 1HB SER 57 1HB SER 57 4.914 12.940 4.319 459 2HB SER 57 2HB SER 57 5.717 11.373 4.364 460 HG SER 57 HG SER 57 7.275 12.964 4.201 461 H VAL 58 H VAL 58 5.475 9.385 2.434 462 HA VAL 58 HA VAL 58 2.818 8.426 3.385 463 HB VAL 58 HB VAL 58 4.355 7.487 0.952 464 1HG1 VAL 58 1HG1 VAL 58 2.049 6.235 2.436 465 2HG1 VAL 58 2HG1 VAL 58 2.311 5.936 0.718 466 3HG1 VAL 58 3HG1 VAL 58 3.544 5.479 1.890 467 1HG2 VAL 58 1HG2 VAL 58 1.780 8.949 1.439 468 2HG2 VAL 58 2HG2 VAL 58 3.056 9.298 0.271 469 3HG2 VAL 58 3HG2 VAL 58 1.954 7.948 -0.003 470 H ASP 59 H ASP 59 2.895 6.253 4.270 471 HA ASP 59 HA ASP 59 5.614 5.267 4.996 472 1HB ASP 59 1HB ASP 59 3.416 6.185 6.779 473 2HB ASP 59 2HB ASP 59 4.201 4.675 7.241 474 H ILE 60 H ILE 60 5.734 3.018 4.865 475 HA ILE 60 HA ILE 60 3.344 1.344 4.995 476 HB ILE 60 HB ILE 60 4.574 2.122 2.369 477 1HG1 ILE 60 1HG1 ILE 60 1.925 1.184 2.081 478 2HG1 ILE 60 2HG1 ILE 60 1.958 2.023 3.623 479 1HG2 ILE 60 1HG2 ILE 60 3.665 -0.679 3.031 480 2HG2 ILE 60 2HG2 ILE 60 3.540 -0.040 1.392 481 3HG2 ILE 60 3HG2 ILE 60 5.118 -0.171 2.169 482 1HD1 ILE 60 1HD1 ILE 60 3.408 3.517 1.599 483 2HD1 ILE 60 2HD1 ILE 60 1.747 3.200 1.104 484 3HD1 ILE 60 3HD1 ILE 60 2.069 4.030 2.624 485 H GLY 61 H GLY 61 3.985 -0.654 5.753 486 1HA GLY 61 1HA GLY 61 6.918 -1.127 5.811 487 2HA GLY 61 2HA GLY 61 5.791 -1.866 6.920 488 H ASN 62 H ASN 62 7.722 -2.572 4.513 489 HA ASN 62 HA ASN 62 6.002 -4.246 2.844 490 1HB ASN 62 1HB ASN 62 8.904 -3.568 2.924 491 2HB ASN 62 2HB ASN 62 8.389 -5.007 2.037 492 1HD2 ASN 62 2HD2 ASN 62 7.009 -1.692 2.456 493 2HD2 ASN 62 1HD2 ASN 62 6.773 -1.426 0.797 494 H ASP 63 H ASP 63 5.571 -6.427 3.190 495 HA ASP 63 HA ASP 63 7.000 -7.753 5.448 496 1HB ASP 63 1HB ASP 63 4.349 -7.661 4.999 497 2HB ASP 63 2HB ASP 63 4.732 -9.072 4.013 498 H GLY 64 H GLY 64 8.808 -7.630 3.687 499 1HA GLY 64 1HA GLY 64 10.278 -9.109 2.530 500 2HA GLY 64 2HA GLY 64 8.964 -10.281 2.408 501 H SER 65 H SER 65 7.665 -7.341 1.514 502 HA SER 65 HA SER 65 7.637 -8.076 -1.306 503 1HB SER 65 1HB SER 65 6.593 -5.457 -0.315 504 2HB SER 65 2HB SER 65 5.902 -6.555 -1.504 505 HG SER 65 HG SER 65 4.927 -7.605 0.044 506 H ALA 66 H ALA 66 8.967 -7.284 -2.838 507 HA ALA 66 HA ALA 66 11.015 -5.325 -2.127 508 1HB ALA 66 1HB ALA 66 10.497 -6.997 -4.596 509 2HB ALA 66 2HB ALA 66 11.819 -5.839 -4.479 510 3HB ALA 66 3HB ALA 66 11.764 -7.230 -3.395 511 H PHE 67 H PHE 67 8.647 -5.649 -4.839 512 HA PHE 67 HA PHE 67 8.942 -2.755 -5.365 513 1HB PHE 67 1HB PHE 67 7.201 -4.760 -6.817 514 2HB PHE 67 2HB PHE 67 7.666 -3.176 -7.382 515 HD1 PHE 67 HD1 PHE 67 10.529 -3.033 -6.694 516 HD2 PHE 67 HD2 PHE 67 8.223 -6.291 -8.280 517 HE1 PHE 67 HE1 PHE 67 12.576 -3.987 -7.705 518 HE2 PHE 67 HE2 PHE 67 10.267 -7.250 -9.286 519 HZ PHE 67 HZ PHE 67 12.450 -6.100 -9.004 520 H VAL 68 H VAL 68 7.491 -1.233 -4.817 521 HA VAL 68 HA VAL 68 4.737 -2.062 -4.031 522 HB VAL 68 HB VAL 68 6.546 -0.291 -2.353 523 1HG1 VAL 68 1HG1 VAL 68 3.602 -0.897 -2.297 524 2HG1 VAL 68 2HG1 VAL 68 4.455 -0.649 -0.772 525 3HG1 VAL 68 3HG1 VAL 68 4.431 0.629 -1.988 526 1HG2 VAL 68 1HG2 VAL 68 5.646 -3.137 -2.237 527 2HG2 VAL 68 2HG2 VAL 68 7.189 -2.426 -1.758 528 3HG2 VAL 68 3HG2 VAL 68 5.776 -2.255 -0.715 529 H GLU 69 H GLU 69 3.611 -1.008 -5.576 530 HA GLU 69 HA GLU 69 4.396 1.775 -6.311 531 1HB GLU 69 1HB GLU 69 4.122 0.088 -8.135 532 2HB GLU 69 2HB GLU 69 2.429 -0.085 -7.676 533 1HG GLU 69 1HG GLU 69 1.837 1.935 -8.574 534 2HG GLU 69 2HG GLU 69 3.366 2.696 -8.133 535 H VAL 70 H VAL 70 2.913 3.481 -6.196 536 HA VAL 70 HA VAL 70 0.298 2.872 -4.910 537 HB VAL 70 HB VAL 70 2.090 5.140 -4.041 538 1HG1 VAL 70 1HG1 VAL 70 -0.670 4.255 -3.439 539 2HG1 VAL 70 2HG1 VAL 70 0.301 4.740 -2.049 540 3HG1 VAL 70 3HG1 VAL 70 0.032 5.871 -3.376 541 1HG2 VAL 70 1HG2 VAL 70 1.732 2.340 -3.023 542 2HG2 VAL 70 2HG2 VAL 70 3.212 3.289 -3.163 543 3HG2 VAL 70 3HG2 VAL 70 2.059 3.639 -1.876 544 H LEU 71 H LEU 71 -1.265 3.717 -6.116 545 HA LEU 71 HA LEU 71 -0.672 6.072 -7.838 546 1HB LEU 71 1HB LEU 71 -2.132 3.571 -8.257 547 2HB LEU 71 2HB LEU 71 -3.123 4.976 -8.642 548 HG LEU 71 HG LEU 71 -1.250 5.841 -10.066 549 1HD1 LEU 71 1HD1 LEU 71 -0.060 3.182 -9.254 550 2HD1 LEU 71 2HD1 LEU 71 0.460 4.037 -10.706 551 3HD1 LEU 71 3HD1 LEU 71 0.665 4.784 -9.122 552 1HD2 LEU 71 1HD2 LEU 71 -2.610 3.211 -10.581 553 2HD2 LEU 71 2HD2 LEU 71 -2.887 4.776 -11.347 554 3HD2 LEU 71 3HD2 LEU 71 -1.456 3.832 -11.762 555 H VAL 72 H VAL 72 -2.553 7.599 -8.034 556 HA VAL 72 HA VAL 72 -4.093 7.705 -5.475 557 HB VAL 72 HB VAL 72 -4.022 10.226 -5.926 558 1HG1 VAL 72 1HG1 VAL 72 -1.543 8.689 -5.135 559 2HG1 VAL 72 2HG1 VAL 72 -1.819 10.395 -4.784 560 3HG1 VAL 72 3HG1 VAL 72 -2.861 9.167 -4.066 561 1HG2 VAL 72 1HG2 VAL 72 -3.113 10.065 -8.224 562 2HG2 VAL 72 2HG2 VAL 72 -2.042 10.995 -7.174 563 3HG2 VAL 72 3HG2 VAL 72 -1.650 9.324 -7.575 564 H GLY 73 H GLY 73 -6.160 8.880 -5.612 565 1HA GLY 73 1HA GLY 73 -7.397 9.654 -8.042 566 2HA GLY 73 2HA GLY 73 -7.823 7.974 -7.713 567 H SER 74 H SER 74 -9.802 9.832 -7.706 568 HA SER 74 HA SER 74 -10.364 10.377 -4.858 569 1HB SER 74 1HB SER 74 -10.542 12.402 -6.092 570 2HB SER 74 2HB SER 74 -11.392 11.610 -7.409 571 HG SER 74 HG SER 74 -12.295 12.344 -4.848 572 H SER 75 H SER 75 -12.464 9.894 -4.073 573 HA SER 75 HA SER 75 -13.631 7.490 -5.318 574 1HB SER 75 1HB SER 75 -14.806 7.184 -3.246 575 2HB SER 75 2HB SER 75 -13.172 7.682 -2.819 576 HG SER 75 HG SER 75 -15.565 9.183 -2.815 577 H ALA 76 H ALA 76 -13.951 10.573 -6.105 578 HA ALA 76 HA ALA 76 -16.780 11.035 -5.816 579 1HB ALA 76 1HB ALA 76 -14.614 12.310 -7.484 580 2HB ALA 76 2HB ALA 76 -16.300 12.813 -7.612 581 3HB ALA 76 3HB ALA 76 -15.444 12.979 -6.079 582 H GLY 77 H GLY 77 -15.032 10.847 -8.915 583 1HA GLY 77 1HA GLY 77 -17.268 9.143 -9.945 584 2HA GLY 77 2HA GLY 77 -16.424 10.336 -10.932 585 H GLY 78 H GLY 78 -16.199 7.162 -9.463 586 1HA GLY 78 1HA GLY 78 -13.499 6.700 -10.568 587 2HA GLY 78 2HA GLY 78 -14.435 5.553 -9.605 588 H ALA 79 H ALA 79 -13.117 4.874 -12.049 589 HA ALA 79 HA ALA 79 -15.495 4.186 -13.724 590 1HB ALA 79 1HB ALA 79 -12.903 5.428 -14.508 591 2HB ALA 79 2HB ALA 79 -13.557 4.198 -15.588 592 3HB ALA 79 3HB ALA 79 -14.506 5.635 -15.213 593 H GLY 80 H GLY 80 -12.107 3.352 -12.957 594 1HA GLY 80 1HA GLY 80 -12.819 0.529 -12.701 595 2HA GLY 80 2HA GLY 80 -11.814 0.872 -14.109 596 H GLU 81 H GLU 81 -9.832 0.084 -13.517 597 HA GLU 81 HA GLU 81 -8.741 0.889 -10.857 598 1HB GLU 81 1HB GLU 81 -8.014 -1.358 -12.751 599 2HB GLU 81 2HB GLU 81 -7.038 -0.932 -11.345 600 1HG GLU 81 1HG GLU 81 -8.821 -1.445 -9.834 601 2HG GLU 81 2HG GLU 81 -9.992 -1.552 -11.148 602 H GLN 82 H GLN 82 -8.335 1.285 -14.296 603 HA GLN 82 HA GLN 82 -5.632 2.453 -13.939 604 1HB GLN 82 1HB GLN 82 -7.305 1.817 -16.380 605 2HB GLN 82 2HB GLN 82 -5.772 2.686 -16.470 606 1HG GLN 82 1HG GLN 82 -4.735 0.743 -15.188 607 2HG GLN 82 2HG GLN 82 -6.241 -0.131 -15.470 608 1HE2 GLN 82 2HE2 GLN 82 -3.542 -0.762 -16.593 609 2HE2 GLN 82 1HE2 GLN 82 -3.721 -0.707 -18.281 610 H ASP 83 H ASP 83 -8.169 3.741 -12.916 611 HA ASP 83 HA ASP 83 -8.176 6.216 -14.583 612 1HB ASP 83 1HB ASP 83 -10.331 4.886 -13.813 613 2HB ASP 83 2HB ASP 83 -10.078 5.770 -12.307 614 H TYR 84 H TYR 84 -6.103 5.352 -12.535 615 HA TYR 84 HA TYR 84 -6.390 7.562 -10.559 616 1HB TYR 84 1HB TYR 84 -4.928 4.936 -10.603 617 2HB TYR 84 2HB TYR 84 -4.296 6.244 -9.613 618 HD1 TYR 84 HD1 TYR 84 -7.868 5.360 -10.356 619 HD2 TYR 84 HD2 TYR 84 -4.751 5.601 -7.411 620 HE1 TYR 84 HE1 TYR 84 -9.499 4.792 -8.584 621 HE2 TYR 84 HE2 TYR 84 -6.387 5.039 -5.636 622 HH TYR 84 HH TYR 84 -8.599 3.822 -5.508 623 H GLU 85 H GLU 85 -3.876 8.130 -9.958 624 HA GLU 85 HA GLU 85 -2.443 8.649 -12.512 625 1HB GLU 85 1HB GLU 85 -2.795 10.874 -12.301 626 2HB GLU 85 2HB GLU 85 -3.724 10.600 -10.839 627 1HG GLU 85 1HG GLU 85 -2.006 12.126 -10.235 628 2HG GLU 85 2HG GLU 85 -1.473 10.570 -9.599 629 H VAL 86 H VAL 86 -0.317 8.068 -12.385 630 HA VAL 86 HA VAL 86 0.616 6.524 -10.199 631 HB VAL 86 HB VAL 86 2.310 7.896 -12.301 632 1HG1 VAL 86 1HG1 VAL 86 3.462 6.818 -10.313 633 2HG1 VAL 86 2HG1 VAL 86 2.759 5.285 -10.829 634 3HG1 VAL 86 3HG1 VAL 86 3.895 6.132 -11.879 635 1HG2 VAL 86 1HG2 VAL 86 0.532 5.475 -12.349 636 2HG2 VAL 86 2HG2 VAL 86 0.770 6.707 -13.589 637 3HG2 VAL 86 3HG2 VAL 86 2.006 5.479 -13.317 638 H LEU 87 H LEU 87 0.406 7.776 -8.257 639 HA LEU 87 HA LEU 87 1.728 10.318 -7.845 640 1HB LEU 87 1HB LEU 87 -0.082 9.251 -6.373 641 2HB LEU 87 2HB LEU 87 1.180 8.196 -5.742 642 HG LEU 87 HG LEU 87 2.444 10.522 -5.402 643 1HD1 LEU 87 1HD1 LEU 87 -0.387 11.217 -5.902 644 2HD1 LEU 87 2HD1 LEU 87 0.293 11.929 -4.439 645 3HD1 LEU 87 3HD1 LEU 87 1.055 12.227 -6.000 646 1HD2 LEU 87 1HD2 LEU 87 0.460 9.035 -3.725 647 2HD2 LEU 87 2HD2 LEU 87 2.188 9.272 -3.467 648 3HD2 LEU 87 3HD2 LEU 87 1.057 10.578 -3.115 649 H LEU 88 H LEU 88 2.648 6.945 -7.016 650 HA LEU 88 HA LEU 88 5.466 7.733 -7.419 651 1HB LEU 88 1HB LEU 88 6.231 6.770 -5.334 652 2HB LEU 88 2HB LEU 88 5.061 8.045 -5.017 653 HG LEU 88 HG LEU 88 3.491 5.757 -5.254 654 1HD1 LEU 88 1HD1 LEU 88 6.202 5.139 -4.174 655 2HD1 LEU 88 2HD1 LEU 88 4.822 4.457 -3.313 656 3HD1 LEU 88 3HD1 LEU 88 5.065 4.091 -5.022 657 1HD2 LEU 88 1HD2 LEU 88 4.534 7.479 -3.036 658 2HD2 LEU 88 2HD2 LEU 88 2.876 7.258 -3.594 659 3HD2 LEU 88 3HD2 LEU 88 3.646 6.017 -2.604 660 H VAL 89 H VAL 89 6.305 6.323 -8.788 661 HA VAL 89 HA VAL 89 5.044 3.950 -9.688 662 HB VAL 89 HB VAL 89 8.047 4.283 -9.775 663 1HG1 VAL 89 1HG1 VAL 89 5.927 2.923 -11.389 664 2HG1 VAL 89 2HG1 VAL 89 7.378 3.489 -12.216 665 3HG1 VAL 89 3HG1 VAL 89 7.512 2.328 -10.894 666 1HG2 VAL 89 1HG2 VAL 89 5.932 5.918 -11.155 667 2HG2 VAL 89 2HG2 VAL 89 7.480 6.439 -10.489 668 3HG2 VAL 89 3HG2 VAL 89 7.430 5.547 -12.009 669 H THR 90 H THR 90 6.192 1.694 -9.514 670 HA THR 90 HA THR 90 5.998 0.808 -6.848 671 HB THR 90 HB THR 90 5.961 -0.466 -9.187 672 HG1 THR 90 HG1 THR 90 5.566 -2.087 -7.928 673 1HG2 THR 90 1HG2 THR 90 8.427 -0.194 -9.560 674 2HG2 THR 90 2HG2 THR 90 8.712 -1.171 -8.120 675 3HG2 THR 90 3HG2 THR 90 7.909 -1.879 -9.521 676 H SER 91 H SER 91 7.364 0.748 -5.199 677 HA SER 91 HA SER 91 10.092 1.812 -5.564 678 1HB SER 91 1HB SER 91 9.932 1.799 -2.961 679 2HB SER 91 2HB SER 91 8.982 2.987 -3.845 680 HG SER 91 HG SER 91 7.952 1.553 -2.140 681 H SER 92 H SER 92 11.735 0.417 -5.582 682 HA SER 92 HA SER 92 11.304 -2.404 -4.815 683 1HB SER 92 1HB SER 92 13.494 -2.784 -5.864 684 2HB SER 92 2HB SER 92 12.450 -1.867 -6.947 685 HG SER 92 HG SER 92 14.671 -1.069 -6.623 686 H PHE 93 H PHE 93 11.167 -1.928 -2.469 687 HA PHE 93 HA PHE 93 13.382 -0.720 -1.065 688 1HB PHE 93 1HB PHE 93 11.155 -2.510 -0.091 689 2HB PHE 93 2HB PHE 93 12.305 -1.714 0.973 690 HD1 PHE 93 HD1 PHE 93 12.581 0.936 -0.429 691 HD2 PHE 93 HD2 PHE 93 9.092 -1.444 0.447 692 HE1 PHE 93 HE1 PHE 93 11.182 2.972 -0.472 693 HE2 PHE 93 HE2 PHE 93 7.704 0.612 0.403 694 HZ PHE 93 HZ PHE 93 8.753 2.814 -0.052 695 H MET 94 H MET 94 12.301 -4.114 -1.250 696 HA MET 94 HA MET 94 15.135 -4.919 -0.699 697 1HB MET 94 1HB MET 94 12.636 -6.491 -0.002 698 2HB MET 94 2HB MET 94 14.290 -6.867 0.470 699 1HG MET 94 1HG MET 94 14.386 -5.130 2.027 700 2HG MET 94 2HG MET 94 13.084 -4.228 1.252 701 1HE MET 94 1HE MET 94 14.026 -7.586 2.559 702 2HE MET 94 2HE MET 94 12.712 -8.139 3.603 703 3HE MET 94 3HE MET 94 12.554 -8.242 1.852 704 H SER 95 H SER 95 14.812 -7.643 -1.241 705 HA SER 95 HA SER 95 13.914 -7.723 -4.085 706 1HB SER 95 1HB SER 95 15.904 -8.805 -4.757 707 2HB SER 95 2HB SER 95 16.491 -7.587 -3.634 708 HG SER 95 HG SER 95 17.410 -9.480 -3.004 709 HA PRO 96 HA PRO 96 12.096 -11.602 -2.797 710 1HB PRO 96 1HB PRO 96 12.432 -13.208 -4.977 711 2HB PRO 96 2HB PRO 96 11.334 -11.823 -4.947 712 1HG PRO 96 1HG PRO 96 13.877 -12.147 -6.373 713 2HG PRO 96 2HG PRO 96 12.565 -10.998 -6.662 714 1HD PRO 96 1HD PRO 96 15.068 -10.522 -5.312 715 2HD PRO 96 2HD PRO 96 13.754 -9.365 -5.620 716 H SER 97 H SER 97 15.265 -11.380 -2.516 717 HA SER 97 HA SER 97 15.700 -14.303 -2.079 718 1HB SER 97 1HB SER 97 17.938 -12.336 -2.510 719 2HB SER 97 2HB SER 97 17.952 -14.084 -2.722 720 HG SER 97 HG SER 97 17.312 -13.784 -4.692 721 H GLU 98 H GLU 98 16.313 -11.014 -0.870 722 HA GLU 98 HA GLU 98 17.492 -12.021 1.611 723 1HB GLU 98 1HB GLU 98 17.906 -9.736 2.121 724 2HB GLU 98 2HB GLU 98 18.093 -9.836 0.380 725 1HG GLU 98 1HG GLU 98 15.452 -9.262 0.499 726 2HG GLU 98 2HG GLU 98 15.991 -8.466 1.977 727 H SER 99 H SER 99 14.369 -10.943 0.455 728 HA SER 99 HA SER 99 13.077 -10.424 2.928 729 1HB SER 99 1HB SER 99 10.982 -10.893 1.683 730 2HB SER 99 2HB SER 99 12.069 -9.847 0.774 731 HG SER 99 HG SER 99 11.044 -12.138 0.018 732 H ARG 100 H ARG 100 14.140 -13.436 1.567 733 HA ARG 100 HA ARG 100 12.217 -15.135 2.895 734 1HB ARG 100 1HB ARG 100 14.975 -15.688 1.764 735 2HB ARG 100 2HB ARG 100 13.918 -16.941 2.416 736 1HG ARG 100 1HG ARG 100 12.172 -16.324 0.784 737 2HG ARG 100 2HG ARG 100 13.225 -15.069 0.132 738 1HD ARG 100 1HD ARG 100 14.093 -16.608 -1.263 739 2HD ARG 100 2HD ARG 100 14.772 -17.435 0.137 740 HE ARG 100 HE ARG 100 12.159 -18.330 0.063 741 1HH1 ARG 100 1HH1 ARG 100 14.773 -18.215 -2.257 742 2HH1 ARG 100 2HH1 ARG 100 14.225 -19.623 -3.096 743 1HH2 ARG 100 1HH2 ARG 100 11.486 -20.149 -1.052 744 2HH2 ARG 100 2HH2 ARG 100 12.384 -20.709 -2.423 745 H SER 101 H SER 101 15.688 -15.451 3.609 746 HA SER 101 HA SER 101 15.379 -14.571 6.373 747 1HB SER 101 1HB SER 101 14.411 -17.016 6.099 748 2HB SER 101 2HB SER 101 16.113 -17.468 6.082 749 HG SER 101 HG SER 101 14.758 -15.954 8.071 750 H GLY 102 H GLY 102 17.094 -13.886 4.194 751 1HA GLY 102 1HA GLY 102 19.722 -14.926 5.185 752 2HA GLY 102 2HA GLY 102 19.445 -14.440 3.514 753 H SER 103 H SER 103 17.770 -12.091 4.613 754 HA SER 103 HA SER 103 19.478 -10.403 6.153 755 1HB SER 103 1HB SER 103 19.977 -10.552 3.243 756 2HB SER 103 2HB SER 103 19.777 -8.919 3.870 757 HG SER 103 HG SER 103 21.747 -9.132 4.554 758 H ASN 104 H ASN 104 18.005 -9.042 7.007 759 HA ASN 104 HA ASN 104 15.983 -7.934 7.345 760 1HB ASN 104 1HB ASN 104 15.630 -6.085 5.783 761 2HB ASN 104 2HB ASN 104 17.344 -6.263 6.136 762 1HD2 ASN 104 2HD2 ASN 104 18.710 -7.283 4.405 763 2HD2 ASN 104 1HD2 ASN 104 18.178 -7.259 2.791 764 HA PRO 105 HA PRO 105 13.311 -10.727 4.863 765 1HB PRO 105 1HB PRO 105 12.034 -11.835 7.003 766 2HB PRO 105 2HB PRO 105 13.576 -12.432 6.381 767 1HG PRO 105 1HG PRO 105 13.012 -10.929 8.851 768 2HG PRO 105 2HG PRO 105 14.360 -12.010 8.471 769 1HD PRO 105 1HD PRO 105 14.394 -9.161 8.467 770 2HD PRO 105 2HD PRO 105 15.687 -10.249 7.917 771 H ASN 106 H ASN 106 12.661 -8.509 7.502 772 HA ASN 106 HA ASN 106 10.186 -7.653 6.126 773 1HB ASN 106 1HB ASN 106 10.338 -8.573 9.004 774 2HB ASN 106 2HB ASN 106 9.011 -7.608 8.370 775 1HD2 ASN 106 2HD2 ASN 106 8.668 -8.794 5.804 776 2HD2 ASN 106 1HD2 ASN 106 8.190 -10.406 6.004 777 H ARG 107 H ARG 107 11.440 -5.769 5.629 778 HA ARG 107 HA ARG 107 11.976 -4.001 7.983 779 1HB ARG 107 1HB ARG 107 13.420 -4.459 5.421 780 2HB ARG 107 2HB ARG 107 13.339 -2.791 5.988 781 1HG ARG 107 1HG ARG 107 14.110 -3.684 8.263 782 2HG ARG 107 2HG ARG 107 14.494 -5.187 7.423 783 1HD ARG 107 1HD ARG 107 16.516 -3.925 7.412 784 2HD ARG 107 2HD ARG 107 15.849 -3.755 5.789 785 HE ARG 107 HE ARG 107 14.876 -1.616 7.410 786 1HH1 ARG 107 1HH1 ARG 107 17.829 -2.763 5.929 787 2HH1 ARG 107 2HH1 ARG 107 18.493 -1.173 5.787 788 1HH2 ARG 107 1HH2 ARG 107 15.776 0.423 7.206 789 2HH2 ARG 107 2HH2 ARG 107 17.346 0.612 6.500 790 H VAL 108 H VAL 108 10.673 -2.231 8.123 791 HA VAL 108 HA VAL 108 8.693 -1.745 6.035 792 HB VAL 108 HB VAL 108 7.756 -0.118 7.532 793 1HG1 VAL 108 1HG1 VAL 108 8.819 -2.562 8.972 794 2HG1 VAL 108 2HG1 VAL 108 7.513 -1.542 9.575 795 3HG1 VAL 108 3HG1 VAL 108 7.304 -2.447 8.076 796 1HG2 VAL 108 1HG2 VAL 108 10.430 -0.343 8.873 797 2HG2 VAL 108 2HG2 VAL 108 9.528 1.107 8.432 798 3HG2 VAL 108 3HG2 VAL 108 9.010 0.130 9.806 799 H ARG 109 H ARG 109 8.368 0.551 5.189 800 HA ARG 109 HA ARG 109 10.796 2.199 5.066 801 1HB ARG 109 1HB ARG 109 10.201 0.285 3.027 802 2HB ARG 109 2HB ARG 109 9.889 1.883 2.359 803 1HG ARG 109 1HG ARG 109 12.134 1.862 1.948 804 2HG ARG 109 2HG ARG 109 12.239 2.355 3.636 805 1HD ARG 109 1HD ARG 109 12.109 -0.296 4.008 806 2HD ARG 109 2HD ARG 109 12.825 -0.292 2.396 807 HE ARG 109 HE ARG 109 14.146 0.531 4.854 808 1HH1 ARG 109 1HH1 ARG 109 14.005 0.997 1.390 809 2HH1 ARG 109 2HH1 ARG 109 15.641 1.546 1.296 810 1HH2 ARG 109 1HH2 ARG 109 16.258 1.250 4.686 811 2HH2 ARG 109 2HH2 ARG 109 16.906 1.688 3.140 812 H MET 110 H MET 110 10.277 4.204 3.700 813 HA MET 110 HA MET 110 7.373 4.837 3.661 814 1HB MET 110 1HB MET 110 9.426 6.642 4.968 815 2HB MET 110 2HB MET 110 7.681 6.891 4.903 816 1HG MET 110 1HG MET 110 7.287 4.959 6.297 817 2HG MET 110 2HG MET 110 8.983 4.506 6.218 818 1HE MET 110 1HE MET 110 9.278 4.137 8.254 819 2HE MET 110 2HE MET 110 10.536 5.303 8.689 820 3HE MET 110 3HE MET 110 9.091 5.148 9.684 821 H PHE 111 H PHE 111 6.962 6.923 2.540 822 HA PHE 111 HA PHE 111 9.029 7.489 0.457 823 1HB PHE 111 1HB PHE 111 6.046 7.802 0.077 824 2HB PHE 111 2HB PHE 111 7.296 7.837 -1.154 825 HD1 PHE 111 HD1 PHE 111 5.998 5.499 1.523 826 HD2 PHE 111 HD2 PHE 111 7.607 5.946 -2.445 827 HE1 PHE 111 HE1 PHE 111 5.689 3.084 1.114 828 HE2 PHE 111 HE2 PHE 111 7.305 3.516 -2.836 829 HZ PHE 111 HZ PHE 111 6.341 2.082 -1.054 830 H GLY 112 H GLY 112 8.608 9.776 -0.480 831 1HA GLY 112 1HA GLY 112 7.433 11.647 1.476 832 2HA GLY 112 2HA GLY 112 9.119 11.842 1.063 833 HA PRO 113 HA PRO 113 6.907 14.372 -2.081 834 1HB PRO 113 1HB PRO 113 8.839 16.296 -2.185 835 2HB PRO 113 2HB PRO 113 7.530 16.288 -0.993 836 1HG PRO 113 1HG PRO 113 10.394 15.566 -0.661 837 2HG PRO 113 2HG PRO 113 9.271 16.298 0.496 838 1HD PRO 113 1HD PRO 113 10.017 13.609 0.492 839 2HD PRO 113 2HD PRO 113 8.567 14.254 1.272 840 H ASP 114 H ASP 114 10.354 13.563 -1.936 841 HA ASP 114 HA ASP 114 10.921 13.900 -4.722 842 1HB ASP 114 1HB ASP 114 12.558 13.646 -2.717 843 2HB ASP 114 2HB ASP 114 12.350 11.913 -2.965 844 H LYS 115 H LYS 115 9.490 11.299 -2.875 845 HA LYS 115 HA LYS 115 9.719 9.446 -5.161 846 1HB LYS 115 1HB LYS 115 8.627 9.122 -2.358 847 2HB LYS 115 2HB LYS 115 8.563 7.850 -3.579 848 1HG LYS 115 1HG LYS 115 10.574 7.297 -2.596 849 2HG LYS 115 2HG LYS 115 11.160 8.453 -3.793 850 1HD LYS 115 1HD LYS 115 11.078 10.254 -2.124 851 2HD LYS 115 2HD LYS 115 10.445 9.127 -0.923 852 1HE LYS 115 1HE LYS 115 12.487 7.810 -1.011 853 2HE LYS 115 2HE LYS 115 13.113 8.804 -2.325 854 1HZ LYS 115 1HZ LYS 115 12.451 9.795 0.395 855 2HZ LYS 115 2HZ LYS 115 14.018 9.442 -0.158 856 3HZ LYS 115 3HZ LYS 115 13.135 10.704 -0.868 857 H LEU 116 H LEU 116 7.668 11.959 -4.504 858 HA LEU 116 HA LEU 116 5.385 10.473 -5.755 859 1HB LEU 116 1HB LEU 116 3.868 12.145 -4.622 860 2HB LEU 116 2HB LEU 116 4.646 10.993 -3.542 861 HG LEU 116 HG LEU 116 6.462 12.797 -3.231 862 1HD1 LEU 116 1HD1 LEU 116 4.627 14.163 -5.031 863 2HD1 LEU 116 2HD1 LEU 116 4.841 15.064 -3.532 864 3HD1 LEU 116 3HD1 LEU 116 6.239 14.641 -4.514 865 1HD2 LEU 116 1HD2 LEU 116 3.627 13.170 -2.234 866 2HD2 LEU 116 2HD2 LEU 116 4.901 12.223 -1.466 867 3HD2 LEU 116 3HD2 LEU 116 5.029 13.980 -1.539 868 H VAL 117 H VAL 117 4.144 11.629 -7.260 869 HA VAL 117 HA VAL 117 5.689 13.562 -8.811 870 HB VAL 117 HB VAL 117 4.227 11.865 -9.909 871 1HG1 VAL 117 1HG1 VAL 117 2.444 12.399 -7.955 872 2HG1 VAL 117 2HG1 VAL 117 1.785 13.355 -9.278 873 3HG1 VAL 117 3HG1 VAL 117 2.026 11.623 -9.482 874 1HG2 VAL 117 1HG2 VAL 117 4.608 14.452 -10.663 875 2HG2 VAL 117 2HG2 VAL 117 3.723 13.283 -11.642 876 3HG2 VAL 117 3HG2 VAL 117 2.847 14.399 -10.596 877 H ARG 118 H ARG 118 5.330 15.783 -8.915 878 HA ARG 118 HA ARG 118 3.860 17.006 -6.724 879 1HB ARG 118 1HB ARG 118 5.489 17.979 -9.043 880 2HB ARG 118 2HB ARG 118 4.374 19.115 -8.283 881 1HG ARG 118 1HG ARG 118 5.500 19.081 -6.253 882 2HG ARG 118 2HG ARG 118 6.167 17.472 -6.533 883 1HD ARG 118 1HD ARG 118 7.912 18.266 -7.818 884 2HD ARG 118 2HD ARG 118 6.995 19.658 -8.393 885 HE ARG 118 HE ARG 118 8.699 19.618 -6.072 886 1HH1 ARG 118 1HH1 ARG 118 5.679 20.902 -7.277 887 2HH1 ARG 118 2HH1 ARG 118 5.735 22.282 -6.238 888 1HH2 ARG 118 1HH2 ARG 118 8.731 21.417 -4.742 889 2HH2 ARG 118 2HH2 ARG 118 7.442 22.572 -4.816 890 H ALA 119 H ALA 119 3.236 16.290 -10.106 891 HA ALA 119 HA ALA 119 0.947 17.988 -10.424 892 1HB ALA 119 1HB ALA 119 2.425 16.602 -12.160 893 2HB ALA 119 2HB ALA 119 1.132 15.424 -11.934 894 3HB ALA 119 3HB ALA 119 0.755 17.046 -12.515 895 H ALA 120 H ALA 120 1.357 15.140 -8.574 896 HA ALA 120 HA ALA 120 -1.611 14.779 -8.480 897 1HB ALA 120 1HB ALA 120 -0.103 12.868 -9.495 898 2HB ALA 120 2HB ALA 120 0.267 12.534 -7.803 899 3HB ALA 120 3HB ALA 120 -1.398 12.455 -8.373 900 H ALA 121 H ALA 121 1.454 14.383 -6.673 901 HA ALA 121 HA ALA 121 0.442 13.890 -4.109 902 1HB ALA 121 1HB ALA 121 2.832 15.460 -5.055 903 2HB ALA 121 2HB ALA 121 2.489 15.260 -3.337 904 3HB ALA 121 3HB ALA 121 2.788 13.845 -4.347 905 H GLU 122 H GLU 122 0.429 16.919 -5.913 906 HA GLU 122 HA GLU 122 -0.492 18.379 -3.497 907 1HB GLU 122 1HB GLU 122 -0.327 20.402 -4.844 908 2HB GLU 122 2HB GLU 122 1.148 19.458 -5.040 909 1HG GLU 122 1HG GLU 122 0.763 19.774 -7.264 910 2HG GLU 122 2HG GLU 122 -0.372 18.439 -7.065 911 H LYS 123 H LYS 123 -1.961 16.520 -5.873 912 HA LYS 123 HA LYS 123 -4.402 18.166 -5.997 913 1HB LYS 123 1HB LYS 123 -3.879 15.419 -7.155 914 2HB LYS 123 2HB LYS 123 -5.233 16.477 -7.541 915 1HG LYS 123 1HG LYS 123 -3.322 18.190 -8.139 916 2HG LYS 123 2HG LYS 123 -2.349 16.730 -8.300 917 1HD LYS 123 1HD LYS 123 -3.190 16.906 -10.458 918 2HD LYS 123 2HD LYS 123 -4.428 15.892 -9.714 919 1HE LYS 123 1HE LYS 123 -5.460 18.272 -9.075 920 2HE LYS 123 2HE LYS 123 -4.557 18.767 -10.507 921 1HZ LYS 123 1HZ LYS 123 -5.645 16.751 -11.598 922 2HZ LYS 123 2HZ LYS 123 -6.730 16.780 -10.295 923 3HZ LYS 123 3HZ LYS 123 -6.612 18.122 -11.330 924 H ARG 124 H ARG 124 -6.145 17.769 -4.702 925 HA ARG 124 HA ARG 124 -5.886 16.050 -2.421 926 1HB ARG 124 1HB ARG 124 -8.298 17.467 -3.580 927 2HB ARG 124 2HB ARG 124 -8.289 16.641 -2.022 928 1HG ARG 124 1HG ARG 124 -6.974 18.236 -1.023 929 2HG ARG 124 2HG ARG 124 -6.094 18.592 -2.508 930 1HD ARG 124 1HD ARG 124 -8.774 19.363 -2.998 931 2HD ARG 124 2HD ARG 124 -8.378 19.962 -1.387 932 HE ARG 124 HE ARG 124 -6.266 20.526 -3.288 933 1HH1 ARG 124 1HH1 ARG 124 -9.391 21.587 -2.131 934 2HH1 ARG 124 2HH1 ARG 124 -9.125 23.226 -2.613 935 1HH2 ARG 124 1HH2 ARG 124 -5.965 22.657 -3.896 936 2HH2 ARG 124 2HH2 ARG 124 -7.207 23.827 -3.602 937 H TRP 125 H TRP 125 -5.907 13.884 -2.603 938 HA TRP 125 HA TRP 125 -7.891 12.599 -4.448 939 1HB TRP 125 1HB TRP 125 -5.356 11.437 -3.242 940 2HB TRP 125 2HB TRP 125 -6.419 10.637 -4.398 941 HD1 TRP 125 HD1 TRP 125 -3.437 12.786 -4.217 942 HE1 TRP 125 HE1 TRP 125 -2.835 13.711 -6.547 943 HE3 TRP 125 HE3 TRP 125 -7.689 11.598 -6.774 944 HZ2 TRP 125 HZ2 TRP 125 -3.988 13.896 -9.153 945 HZ3 TRP 125 HZ3 TRP 125 -7.910 12.144 -9.177 946 HH2 TRP 125 HH2 TRP 125 -6.067 13.298 -10.372 947 H ASP 126 H ASP 126 -8.942 10.647 -3.558 948 HA ASP 126 HA ASP 126 -9.004 10.595 -0.585 949 1HB ASP 126 1HB ASP 126 -10.935 11.808 -1.084 950 2HB ASP 126 2HB ASP 126 -11.276 10.841 -2.490 951 H ARG 127 H ARG 127 -8.309 8.822 -3.277 952 HA ARG 127 HA ARG 127 -8.850 6.269 -1.854 953 1HB ARG 127 1HB ARG 127 -9.280 6.694 -4.834 954 2HB ARG 127 2HB ARG 127 -9.508 5.188 -3.951 955 1HG ARG 127 1HG ARG 127 -11.053 7.219 -2.644 956 2HG ARG 127 2HG ARG 127 -11.400 7.297 -4.368 957 1HD ARG 127 1HD ARG 127 -11.322 4.534 -3.563 958 2HD ARG 127 2HD ARG 127 -12.385 5.420 -2.477 959 HE ARG 127 HE ARG 127 -13.892 5.704 -4.253 960 1HH1 ARG 127 1HH1 ARG 127 -10.765 4.741 -5.477 961 2HH1 ARG 127 2HH1 ARG 127 -11.348 4.539 -7.093 962 1HH2 ARG 127 1HH2 ARG 127 -14.604 5.426 -6.353 963 2HH2 ARG 127 2HH2 ARG 127 -13.497 4.921 -7.585 964 H VAL 128 H VAL 128 -7.125 4.755 -2.167 965 HA VAL 128 HA VAL 128 -4.918 5.722 -3.922 966 HB VAL 128 HB VAL 128 -4.667 6.272 -1.424 967 1HG1 VAL 128 1HG1 VAL 128 -5.197 3.585 -1.072 968 2HG1 VAL 128 2HG1 VAL 128 -3.441 3.653 -0.922 969 3HG1 VAL 128 3HG1 VAL 128 -4.457 4.643 0.128 970 1HG2 VAL 128 1HG2 VAL 128 -2.882 6.262 -3.215 971 2HG2 VAL 128 2HG2 VAL 128 -2.300 6.027 -1.567 972 3HG2 VAL 128 3HG2 VAL 128 -2.446 4.647 -2.657 973 H LYS 129 H LYS 129 -3.751 4.147 -4.971 974 HA LYS 129 HA LYS 129 -4.792 1.358 -4.693 975 1HB LYS 129 1HB LYS 129 -5.173 2.462 -6.892 976 2HB LYS 129 2HB LYS 129 -3.430 2.663 -7.065 977 1HG LYS 129 1HG LYS 129 -3.610 -0.013 -6.484 978 2HG LYS 129 2HG LYS 129 -5.089 0.245 -7.410 979 1HD LYS 129 1HD LYS 129 -3.582 1.502 -9.095 980 2HD LYS 129 2HD LYS 129 -2.236 0.721 -8.265 981 1HE LYS 129 1HE LYS 129 -3.105 -1.473 -8.767 982 2HE LYS 129 2HE LYS 129 -4.608 -0.791 -9.389 983 1HZ LYS 129 1HZ LYS 129 -3.240 0.366 -11.089 984 2HZ LYS 129 2HZ LYS 129 -1.892 -0.518 -10.554 985 3HZ LYS 129 3HZ LYS 129 -3.226 -1.324 -11.230 986 H ILE 130 H ILE 130 -3.380 0.283 -3.371 987 HA ILE 130 HA ILE 130 -0.453 0.736 -3.707 988 HB ILE 130 HB ILE 130 -1.998 -0.781 -1.574 989 1HG1 ILE 130 1HG1 ILE 130 -2.415 1.655 -1.529 990 2HG1 ILE 130 2HG1 ILE 130 -1.461 1.152 -0.135 991 1HG2 ILE 130 1HG2 ILE 130 0.690 -1.030 -2.268 992 2HG2 ILE 130 2HG2 ILE 130 0.715 0.111 -0.924 993 3HG2 ILE 130 3HG2 ILE 130 -0.027 -1.476 -0.720 994 1HD1 ILE 130 1HD1 ILE 130 0.609 1.847 -1.347 995 2HD1 ILE 130 2HD1 ILE 130 -0.397 2.439 -2.669 996 3HD1 ILE 130 3HD1 ILE 130 -0.500 3.192 -1.078 997 H VAL 131 H VAL 131 0.801 -0.841 -4.695 998 HA VAL 131 HA VAL 131 -0.365 -3.554 -5.000 999 HB VAL 131 HB VAL 131 1.050 -1.946 -7.148 1000 1HG1 VAL 131 1HG1 VAL 131 -0.235 -4.683 -7.159 1001 2HG1 VAL 131 2HG1 VAL 131 0.399 -3.853 -8.581 1002 3HG1 VAL 131 3HG1 VAL 131 1.491 -4.346 -7.284 1003 1HG2 VAL 131 1HG2 VAL 131 -1.819 -2.459 -6.472 1004 2HG2 VAL 131 2HG2 VAL 131 -1.071 -1.020 -7.165 1005 3HG2 VAL 131 3HG2 VAL 131 -1.365 -2.435 -8.176 1006 H CYS 132 H CYS 132 1.042 -5.018 -4.190 1007 HA CYS 132 HA CYS 132 3.915 -4.274 -3.953 1008 1HB CYS 132 1HB CYS 132 3.723 -5.141 -1.870 1009 2HB CYS 132 2HB CYS 132 2.040 -5.511 -2.180 1010 HG CYS 132 HG CYS 132 3.225 -7.853 -3.259 1011 H SER 133 H SER 133 5.406 -5.296 -5.263 1012 HA SER 133 HA SER 133 4.512 -7.742 -6.728 1013 1HB SER 133 1HB SER 133 4.910 -5.124 -7.796 1014 2HB SER 133 2HB SER 133 6.236 -6.114 -8.388 1015 HG SER 133 HG SER 133 4.343 -6.217 -9.711 1016 H GLN 134 H GLN 134 5.906 -9.349 -6.572 1017 HA GLN 134 HA GLN 134 8.647 -9.356 -7.034 1018 1HB GLN 134 1HB GLN 134 9.660 -9.439 -4.813 1019 2HB GLN 134 2HB GLN 134 8.813 -7.914 -4.975 1020 1HG GLN 134 1HG GLN 134 7.620 -10.356 -3.693 1021 2HG GLN 134 2HG GLN 134 8.431 -9.104 -2.783 1022 1HE2 GLN 134 2HE2 GLN 134 7.411 -6.727 -3.666 1023 2HE2 GLN 134 1HE2 GLN 134 5.725 -6.713 -3.583 1024 HA PRO 135 HA PRO 135 7.309 -13.631 -6.424 1025 1HB PRO 135 1HB PRO 135 9.519 -14.829 -7.481 1026 2HB PRO 135 2HB PRO 135 8.295 -14.023 -8.473 1027 1HG PRO 135 1HG PRO 135 11.047 -13.198 -7.891 1028 2HG PRO 135 2HG PRO 135 9.964 -12.664 -9.182 1029 1HD PRO 135 1HD PRO 135 10.591 -11.305 -6.704 1030 2HD PRO 135 2HD PRO 135 9.555 -10.748 -8.037 1031 H TYR 136 H TYR 136 7.431 -13.812 -4.032 1032 HA TYR 136 HA TYR 136 10.095 -14.777 -3.100 1033 1HB TYR 136 1HB TYR 136 9.361 -13.973 -0.781 1034 2HB TYR 136 2HB TYR 136 9.861 -12.755 -1.943 1035 HD1 TYR 136 HD1 TYR 136 6.620 -14.581 -1.242 1036 HD2 TYR 136 HD2 TYR 136 8.605 -10.827 -1.813 1037 HE1 TYR 136 HE1 TYR 136 4.482 -13.398 -0.952 1038 HE2 TYR 136 HE2 TYR 136 6.454 -9.650 -1.476 1039 HH TYR 136 HH TYR 136 4.259 -10.112 -0.355 1040 H SER 137 H SER 137 6.776 -15.607 -3.376 1041 HA SER 137 HA SER 137 7.387 -18.048 -1.772 1042 1HB SER 137 1HB SER 137 5.960 -16.297 -0.523 1043 2HB SER 137 2HB SER 137 4.674 -16.744 -1.642 1044 HG SER 137 HG SER 137 5.114 -17.942 0.520 1045 H LYS 138 H LYS 138 5.434 -19.641 -2.086 1046 HA LYS 138 HA LYS 138 4.299 -19.562 -4.812 1047 1HB LYS 138 1HB LYS 138 6.493 -21.376 -3.925 1048 2HB LYS 138 2HB LYS 138 5.194 -22.102 -4.872 1049 1HG LYS 138 1HG LYS 138 6.616 -19.572 -5.728 1050 2HG LYS 138 2HG LYS 138 7.152 -21.180 -6.220 1051 1HD LYS 138 1HD LYS 138 4.263 -20.564 -6.586 1052 2HD LYS 138 2HD LYS 138 5.393 -19.749 -7.669 1053 1HE LYS 138 1HE LYS 138 4.766 -21.822 -8.724 1054 2HE LYS 138 2HE LYS 138 6.422 -22.009 -8.148 1055 1HZ LYS 138 1HZ LYS 138 4.122 -22.805 -6.476 1056 2HZ LYS 138 2HZ LYS 138 4.763 -23.861 -7.643 1057 3HZ LYS 138 3HZ LYS 138 5.739 -23.311 -6.369 1058 H ASP 139 H ASP 139 4.776 -21.499 -1.851 1059 HA ASP 139 HA ASP 139 1.988 -22.480 -2.104 1060 1HB ASP 139 1HB ASP 139 2.708 -24.144 -0.369 1061 2HB ASP 139 2HB ASP 139 3.599 -24.269 -1.882 1062 H SER 140 H SER 140 3.971 -20.344 -0.287 1063 HA SER 140 HA SER 140 1.926 -20.178 1.866 1064 1HB SER 140 1HB SER 140 3.948 -18.763 2.862 1065 2HB SER 140 2HB SER 140 3.893 -20.513 3.007 1066 HG SER 140 HG SER 140 5.335 -20.698 1.385 1067 HA PRO 141 HA PRO 141 0.975 -16.055 0.379 1068 1HB PRO 141 1HB PRO 141 -0.323 -15.141 2.594 1069 2HB PRO 141 2HB PRO 141 -1.016 -16.332 1.483 1070 1HG PRO 141 1HG PRO 141 -0.016 -16.695 4.220 1071 2HG PRO 141 2HG PRO 141 -1.137 -17.693 3.286 1072 1HD PRO 141 1HD PRO 141 1.646 -18.188 3.776 1073 2HD PRO 141 2HD PRO 141 0.528 -19.146 2.783 1074 H PHE 142 H PHE 142 0.899 -13.712 1.609 1075 HA PHE 142 HA PHE 142 2.728 -12.917 3.566 1076 1HB PHE 142 1HB PHE 142 4.091 -13.875 1.229 1077 2HB PHE 142 2HB PHE 142 4.307 -12.130 1.282 1078 HD1 PHE 142 HD1 PHE 142 4.874 -11.164 3.713 1079 HD2 PHE 142 HD2 PHE 142 5.549 -15.212 2.447 1080 HE1 PHE 142 HE1 PHE 142 6.561 -11.443 5.506 1081 HE2 PHE 142 HE2 PHE 142 7.237 -15.492 4.241 1082 HZ PHE 142 HZ PHE 142 7.744 -13.607 5.771 1083 H GLY 143 H GLY 143 3.764 -10.524 2.198 1084 1HA GLY 143 1HA GLY 143 2.399 -9.005 0.522 1085 2HA GLY 143 2HA GLY 143 1.170 -9.149 1.774 1086 H LEU 144 H LEU 144 1.112 -7.408 3.062 1087 HA LEU 144 HA LEU 144 3.702 -6.047 3.689 1088 1HB LEU 144 1HB LEU 144 1.132 -4.975 2.711 1089 2HB LEU 144 2HB LEU 144 1.814 -4.084 4.066 1090 HG LEU 144 HG LEU 144 3.964 -3.915 2.838 1091 1HD1 LEU 144 1HD1 LEU 144 2.377 -5.463 0.802 1092 2HD1 LEU 144 2HD1 LEU 144 3.676 -4.390 0.282 1093 3HD1 LEU 144 3HD1 LEU 144 4.026 -5.739 1.361 1094 1HD2 LEU 144 1HD2 LEU 144 2.085 -2.198 2.680 1095 2HD2 LEU 144 2HD2 LEU 144 3.250 -2.173 1.356 1096 3HD2 LEU 144 3HD2 LEU 144 1.671 -2.926 1.128 1097 H SER 145 H SER 145 3.695 -4.850 5.755 1098 HA SER 145 HA SER 145 2.303 -6.419 7.848 1099 1HB SER 145 1HB SER 145 4.580 -4.440 7.876 1100 2HB SER 145 2HB SER 145 3.806 -4.983 9.362 1101 HG SER 145 HG SER 145 5.223 -6.546 9.145 1102 H PHE 146 H PHE 146 2.308 -3.231 6.392 1103 HA PHE 146 HA PHE 146 -0.252 -2.516 7.447 1104 1HB PHE 146 1HB PHE 146 0.432 -0.750 9.063 1105 2HB PHE 146 2HB PHE 146 0.970 -2.340 9.605 1106 HD1 PHE 146 HD1 PHE 146 3.330 -3.012 9.398 1107 HD2 PHE 146 HD2 PHE 146 2.002 0.910 8.274 1108 HE1 PHE 146 HE1 PHE 146 5.679 -2.259 9.262 1109 HE2 PHE 146 HE2 PHE 146 4.350 1.686 8.154 1110 HZ PHE 146 HZ PHE 146 6.208 0.085 8.631 1111 H VAL 147 H VAL 147 -0.725 -0.148 6.965 1112 HA VAL 147 HA VAL 147 1.204 1.065 5.074 1113 HB VAL 147 HB VAL 147 -0.580 1.522 3.433 1114 1HG1 VAL 147 1HG1 VAL 147 0.841 -0.625 3.455 1115 2HG1 VAL 147 2HG1 VAL 147 -0.609 -1.433 4.052 1116 3HG1 VAL 147 3HG1 VAL 147 -0.625 -0.646 2.473 1117 1HG2 VAL 147 1HG2 VAL 147 -2.233 0.361 5.600 1118 2HG2 VAL 147 2HG2 VAL 147 -2.676 1.522 4.349 1119 3HG2 VAL 147 3HG2 VAL 147 -2.640 -0.202 3.978 1120 H ARG 148 H ARG 148 1.096 3.333 5.020 1121 HA ARG 148 HA ARG 148 -0.989 4.712 6.609 1122 1HB ARG 148 1HB ARG 148 1.970 4.954 7.214 1123 2HB ARG 148 2HB ARG 148 0.676 5.810 8.037 1124 1HG ARG 148 1HG ARG 148 -0.268 3.459 8.550 1125 2HG ARG 148 2HG ARG 148 1.340 2.880 8.119 1126 1HD ARG 148 1HD ARG 148 0.695 4.925 10.262 1127 2HD ARG 148 2HD ARG 148 1.206 3.260 10.536 1128 HE ARG 148 HE ARG 148 3.108 4.711 8.902 1129 1HH1 ARG 148 1HH1 ARG 148 2.040 4.154 12.185 1130 2HH1 ARG 148 2HH1 ARG 148 3.582 4.549 12.860 1131 1HH2 ARG 148 1HH2 ARG 148 5.088 5.213 9.820 1132 2HH2 ARG 148 2HH2 ARG 148 5.289 5.141 11.538 1133 H PHE 149 H PHE 149 -0.908 7.057 6.304 1134 HA PHE 149 HA PHE 149 0.794 8.037 4.062 1135 1HB PHE 149 1HB PHE 149 -2.218 8.371 4.264 1136 2HB PHE 149 2HB PHE 149 -1.192 9.204 3.098 1137 HD1 PHE 149 HD1 PHE 149 0.564 7.429 1.915 1138 HD2 PHE 149 HD2 PHE 149 -3.361 6.543 3.406 1139 HE1 PHE 149 HE1 PHE 149 0.424 5.475 0.390 1140 HE2 PHE 149 HE2 PHE 149 -3.501 4.593 1.877 1141 HZ PHE 149 HZ PHE 149 -1.608 4.060 0.373 1142 H HIS 150 H HIS 150 1.006 10.435 4.111 1143 HA HIS 150 HA HIS 150 -0.194 11.826 6.412 1144 1HB HIS 150 1HB HIS 150 2.446 12.647 6.731 1145 2HB HIS 150 2HB HIS 150 1.555 11.585 7.810 1146 HD1 HIS 150 HD1 HIS 150 4.604 11.722 5.983 1147 HD2 HIS 150 HD2 HIS 150 1.895 8.681 6.852 1148 HE1 HIS 150 HE1 HIS 150 5.833 9.539 5.609 1149 H SER 151 H SER 151 -0.679 13.819 5.842 1150 HA SER 151 HA SER 151 0.107 14.849 3.233 1151 1HB SER 151 1HB SER 151 -2.110 15.136 4.840 1152 2HB SER 151 2HB SER 151 -1.300 16.683 5.055 1153 HG SER 151 HG SER 151 -2.818 16.228 3.140 Start of MODEL 12 1 H MET 1 H MET 1 -2.389 18.736 13.954 2 HA MET 1 HA MET 1 -0.457 18.470 12.920 3 1HB MET 1 1HB MET 1 -0.848 15.703 13.969 4 2HB MET 1 2HB MET 1 0.340 15.919 12.683 5 1HG MET 1 1HG MET 1 1.630 16.287 14.600 6 2HG MET 1 2HG MET 1 1.169 17.928 14.147 7 1HE MET 1 1HE MET 1 2.337 17.421 16.491 8 2HE MET 1 2HE MET 1 1.388 17.974 17.869 9 3HE MET 1 3HE MET 1 1.610 16.243 17.582 10 HA PRO 2 HA PRO 2 -1.684 17.384 8.775 11 1HB PRO 2 1HB PRO 2 0.744 17.478 7.532 12 2HB PRO 2 2HB PRO 2 -0.103 18.919 8.113 13 1HG PRO 2 1HG PRO 2 2.319 17.632 9.163 14 2HG PRO 2 2HG PRO 2 1.723 19.279 9.407 15 1HD PRO 2 1HD PRO 2 1.526 17.047 11.216 16 2HD PRO 2 2HD PRO 2 0.918 18.701 11.451 17 H GLU 3 H GLU 3 -2.368 15.183 8.889 18 HA GLU 3 HA GLU 3 -0.400 13.224 7.853 19 1HB GLU 3 1HB GLU 3 -1.907 12.963 10.460 20 2HB GLU 3 2HB GLU 3 -1.332 11.548 9.578 21 1HG GLU 3 1HG GLU 3 0.965 12.714 9.549 22 2HG GLU 3 2HG GLU 3 0.298 13.785 10.783 23 H ILE 4 H ILE 4 -1.687 11.051 7.483 24 HA ILE 4 HA ILE 4 -4.499 11.586 6.691 25 HB ILE 4 HB ILE 4 -2.311 10.600 4.832 26 1HG1 ILE 4 1HG1 ILE 4 -4.167 12.990 4.659 27 2HG1 ILE 4 2HG1 ILE 4 -2.484 13.063 5.177 28 1HG2 ILE 4 1HG2 ILE 4 -5.313 10.702 4.464 29 2HG2 ILE 4 2HG2 ILE 4 -4.173 10.543 3.127 30 3HG2 ILE 4 3HG2 ILE 4 -4.270 9.284 4.357 31 1HD1 ILE 4 1HD1 ILE 4 -2.649 11.628 2.679 32 2HD1 ILE 4 2HD1 ILE 4 -3.473 13.179 2.525 33 3HD1 ILE 4 3HD1 ILE 4 -1.787 13.124 3.039 34 H ARG 5 H ARG 5 -5.742 9.616 6.487 35 HA ARG 5 HA ARG 5 -4.367 7.112 7.329 36 1HB ARG 5 1HB ARG 5 -6.232 6.677 8.947 37 2HB ARG 5 2HB ARG 5 -5.228 8.053 9.398 38 1HG ARG 5 1HG ARG 5 -7.007 9.430 9.337 39 2HG ARG 5 2HG ARG 5 -7.341 8.976 7.668 40 1HD ARG 5 1HD ARG 5 -9.128 7.773 8.313 41 2HD ARG 5 2HD ARG 5 -8.140 6.824 9.421 42 HE ARG 5 HE ARG 5 -9.851 9.066 10.144 43 1HH1 ARG 5 1HH1 ARG 5 -6.989 7.247 11.002 44 2HH1 ARG 5 2HH1 ARG 5 -7.084 7.693 12.670 45 1HH2 ARG 5 1HH2 ARG 5 -9.935 9.618 12.311 46 2HH2 ARG 5 2HH2 ARG 5 -8.732 9.020 13.406 47 H LEU 6 H LEU 6 -6.429 5.383 7.441 48 HA LEU 6 HA LEU 6 -7.807 5.706 4.806 49 1HB LEU 6 1HB LEU 6 -6.546 3.294 6.104 50 2HB LEU 6 2HB LEU 6 -7.805 3.106 4.889 51 HG LEU 6 HG LEU 6 -5.558 2.983 3.879 52 1HD1 LEU 6 1HD1 LEU 6 -7.493 3.975 2.626 53 2HD1 LEU 6 2HD1 LEU 6 -6.925 5.573 3.108 54 3HD1 LEU 6 3HD1 LEU 6 -5.918 4.554 2.087 55 1HD2 LEU 6 1HD2 LEU 6 -4.786 4.777 5.717 56 2HD2 LEU 6 2HD2 LEU 6 -3.928 4.575 4.190 57 3HD2 LEU 6 3HD2 LEU 6 -5.094 5.884 4.380 58 H ARG 7 H ARG 7 -9.846 4.487 4.652 59 HA ARG 7 HA ARG 7 -11.272 4.405 7.283 60 1HB ARG 7 1HB ARG 7 -12.063 6.173 5.692 61 2HB ARG 7 2HB ARG 7 -12.453 4.901 4.534 62 1HG ARG 7 1HG ARG 7 -13.926 3.863 6.312 63 2HG ARG 7 2HG ARG 7 -13.669 5.317 7.277 64 1HD ARG 7 1HD ARG 7 -14.377 6.457 4.929 65 2HD ARG 7 2HD ARG 7 -15.278 4.946 4.807 66 HE ARG 7 HE ARG 7 -15.834 7.130 6.656 67 1HH1 ARG 7 1HH1 ARG 7 -16.115 3.686 6.111 68 2HH1 ARG 7 2HH1 ARG 7 -17.473 3.529 7.170 69 1HH2 ARG 7 1HH2 ARG 7 -17.590 6.879 8.019 70 2HH2 ARG 7 2HH2 ARG 7 -18.300 5.315 8.239 71 H HIS 8 H HIS 8 -11.144 2.966 4.048 72 HA HIS 8 HA HIS 8 -11.421 0.278 5.137 73 1HB HIS 8 1HB HIS 8 -13.490 -0.245 3.831 74 2HB HIS 8 2HB HIS 8 -13.777 0.907 5.134 75 HD1 HIS 8 HD1 HIS 8 -14.971 2.987 4.457 76 HD2 HIS 8 HD2 HIS 8 -13.023 1.222 1.222 77 HE1 HIS 8 HE1 HIS 8 -15.572 4.367 2.420 78 H VAL 9 H VAL 9 -11.270 -1.350 3.331 79 HA VAL 9 HA VAL 9 -9.381 -0.412 1.312 80 HB VAL 9 HB VAL 9 -9.061 -2.606 2.387 81 1HG1 VAL 9 1HG1 VAL 9 -11.810 -2.853 2.151 82 2HG1 VAL 9 2HG1 VAL 9 -11.210 -3.986 0.941 83 3HG1 VAL 9 3HG1 VAL 9 -10.702 -4.141 2.623 84 1HG2 VAL 9 1HG2 VAL 9 -8.707 -2.058 -0.246 85 2HG2 VAL 9 2HG2 VAL 9 -8.249 -3.595 0.489 86 3HG2 VAL 9 3HG2 VAL 9 -9.784 -3.450 -0.369 87 H VAL 10 H VAL 10 -10.615 0.987 -0.029 88 HA VAL 10 HA VAL 10 -13.162 0.534 -1.113 89 HB VAL 10 HB VAL 10 -12.177 2.682 -1.494 90 1HG1 VAL 10 1HG1 VAL 10 -9.779 1.545 -1.655 91 2HG1 VAL 10 2HG1 VAL 10 -10.102 1.644 -3.381 92 3HG1 VAL 10 3HG1 VAL 10 -10.092 3.107 -2.399 93 1HG2 VAL 10 1HG2 VAL 10 -13.648 1.871 -3.333 94 2HG2 VAL 10 2HG2 VAL 10 -12.409 2.974 -3.925 95 3HG2 VAL 10 3HG2 VAL 10 -12.229 1.239 -4.168 96 H SER 11 H SER 11 -10.049 -0.358 -2.692 97 HA SER 11 HA SER 11 -11.613 -2.442 -4.142 98 1HB SER 11 1HB SER 11 -10.161 -0.272 -5.262 99 2HB SER 11 2HB SER 11 -9.250 -1.735 -5.623 100 HG SER 11 HG SER 11 -11.408 -0.868 -6.818 101 H CYS 12 H CYS 12 -10.156 -4.335 -4.811 102 HA CYS 12 HA CYS 12 -7.621 -4.593 -3.372 103 1HB CYS 12 1HB CYS 12 -8.378 -6.564 -2.038 104 2HB CYS 12 2HB CYS 12 -9.140 -5.056 -1.538 105 HG CYS 12 HG CYS 12 -11.359 -5.896 -2.316 106 H SER 13 H SER 13 -6.382 -6.314 -4.118 107 HA SER 13 HA SER 13 -7.597 -8.240 -6.000 108 1HB SER 13 1HB SER 13 -6.434 -5.971 -7.016 109 2HB SER 13 2HB SER 13 -5.072 -7.087 -7.001 110 HG SER 13 HG SER 13 -6.339 -7.210 -8.928 111 H SER 14 H SER 14 -6.764 -8.862 -3.507 112 HA SER 14 HA SER 14 -5.299 -11.097 -3.496 113 1HB SER 14 1HB SER 14 -3.403 -8.809 -3.754 114 2HB SER 14 2HB SER 14 -2.962 -10.141 -2.695 115 HG SER 14 HG SER 14 -3.477 -10.138 -5.466 116 H GLN 15 H GLN 15 -6.753 -11.174 -1.661 117 HA GLN 15 HA GLN 15 -5.432 -10.321 0.821 118 1HB GLN 15 1HB GLN 15 -8.012 -9.486 1.431 119 2HB GLN 15 2HB GLN 15 -6.628 -8.452 1.130 120 1HG GLN 15 1HG GLN 15 -8.156 -7.541 -0.338 121 2HG GLN 15 2HG GLN 15 -7.382 -8.703 -1.405 122 1HE2 GLN 15 2HE2 GLN 15 -8.534 -11.070 -0.999 123 2HE2 GLN 15 1HE2 GLN 15 -10.228 -11.010 -1.108 124 H ASP 16 H ASP 16 -5.777 -11.764 2.433 125 HA ASP 16 HA ASP 16 -7.357 -14.149 1.847 126 1HB ASP 16 1HB ASP 16 -5.124 -13.621 3.398 127 2HB ASP 16 2HB ASP 16 -6.384 -13.847 4.608 128 H SER 17 H SER 17 -8.583 -14.940 4.077 129 HA SER 17 HA SER 17 -10.822 -13.056 4.324 130 1HB SER 17 1HB SER 17 -11.131 -15.550 4.058 131 2HB SER 17 2HB SER 17 -10.459 -15.744 5.675 132 HG SER 17 HG SER 17 -12.885 -15.483 5.300 133 H THR 18 H THR 18 -8.934 -14.913 6.744 134 HA THR 18 HA THR 18 -9.647 -13.200 8.928 135 HB THR 18 HB THR 18 -7.291 -14.296 9.743 136 HG1 THR 18 HG1 THR 18 -6.716 -15.386 7.986 137 1HG2 THR 18 1HG2 THR 18 -10.081 -15.405 9.586 138 2HG2 THR 18 2HG2 THR 18 -8.788 -16.340 10.338 139 3HG2 THR 18 3HG2 THR 18 -9.224 -14.759 10.985 140 H HIS 19 H HIS 19 -6.482 -13.530 7.281 141 HA HIS 19 HA HIS 19 -5.722 -10.835 8.228 142 1HB HIS 19 1HB HIS 19 -4.198 -12.888 6.589 143 2HB HIS 19 2HB HIS 19 -3.526 -11.375 7.196 144 HD1 HIS 19 HD1 HIS 19 -2.715 -11.345 9.587 145 HD2 HIS 19 HD2 HIS 19 -4.979 -14.739 8.734 146 HE1 HIS 19 HE1 HIS 19 -2.529 -12.856 11.611 147 H CYS 20 H CYS 20 -7.652 -10.093 6.803 148 HA CYS 20 HA CYS 20 -7.104 -10.021 3.918 149 1HB CYS 20 1HB CYS 20 -9.213 -8.709 3.804 150 2HB CYS 20 2HB CYS 20 -9.427 -10.227 4.671 151 HG CYS 20 HG CYS 20 -10.448 -8.620 6.328 152 H ALA 21 H ALA 21 -7.242 -7.834 2.820 153 HA ALA 21 HA ALA 21 -5.118 -6.151 3.739 154 1HB ALA 21 1HB ALA 21 -6.608 -6.478 1.378 155 2HB ALA 21 2HB ALA 21 -6.917 -4.818 1.883 156 3HB ALA 21 3HB ALA 21 -5.262 -5.369 1.627 157 H GLU 22 H GLU 22 -8.538 -6.206 4.393 158 HA GLU 22 HA GLU 22 -8.914 -3.471 5.129 159 1HB GLU 22 1HB GLU 22 -10.571 -5.599 4.927 160 2HB GLU 22 2HB GLU 22 -10.358 -5.557 6.678 161 1HG GLU 22 1HG GLU 22 -10.826 -3.003 6.439 162 2HG GLU 22 2HG GLU 22 -11.504 -3.440 4.870 163 H ASN 23 H ASN 23 -7.212 -6.085 6.687 164 HA ASN 23 HA ASN 23 -7.370 -5.135 9.398 165 1HB ASN 23 1HB ASN 23 -5.385 -6.838 7.906 166 2HB ASN 23 2HB ASN 23 -5.149 -6.418 9.601 167 1HD2 ASN 23 2HD2 ASN 23 -6.207 -8.935 7.846 168 2HD2 ASN 23 1HD2 ASN 23 -7.453 -9.520 8.840 169 H LEU 24 H LEU 24 -5.739 -3.987 6.607 170 HA LEU 24 HA LEU 24 -3.521 -2.654 7.817 171 1HB LEU 24 1HB LEU 24 -5.048 -1.920 5.300 172 2HB LEU 24 2HB LEU 24 -3.406 -1.428 5.714 173 HG LEU 24 HG LEU 24 -4.086 -4.352 5.640 174 1HD1 LEU 24 1HD1 LEU 24 -4.724 -2.899 3.476 175 2HD1 LEU 24 2HD1 LEU 24 -2.999 -3.103 3.172 176 3HD1 LEU 24 3HD1 LEU 24 -4.035 -4.518 3.359 177 1HD2 LEU 24 1HD2 LEU 24 -1.829 -2.951 6.295 178 2HD2 LEU 24 2HD2 LEU 24 -1.832 -4.613 5.708 179 3HD2 LEU 24 3HD2 LEU 24 -1.545 -3.283 4.586 180 H LEU 25 H LEU 25 -6.939 -1.914 7.521 181 HA LEU 25 HA LEU 25 -6.836 0.897 8.016 182 1HB LEU 25 1HB LEU 25 -8.873 -1.282 8.497 183 2HB LEU 25 2HB LEU 25 -9.170 0.358 9.045 184 HG LEU 25 HG LEU 25 -10.160 -0.005 6.823 185 1HD1 LEU 25 1HD1 LEU 25 -9.095 2.218 7.493 186 2HD1 LEU 25 2HD1 LEU 25 -7.722 1.742 6.495 187 3HD1 LEU 25 3HD1 LEU 25 -9.308 1.952 5.762 188 1HD2 LEU 25 1HD2 LEU 25 -8.470 -1.755 6.142 189 2HD2 LEU 25 2HD2 LEU 25 -8.806 -0.548 4.900 190 3HD2 LEU 25 3HD2 LEU 25 -7.324 -0.446 5.851 191 H LYS 26 H LYS 26 -6.183 -1.863 10.018 192 HA LYS 26 HA LYS 26 -6.057 -0.097 12.419 193 1HB LYS 26 1HB LYS 26 -6.544 -3.093 12.436 194 2HB LYS 26 2HB LYS 26 -6.629 -1.990 13.809 195 1HG LYS 26 1HG LYS 26 -8.425 -1.764 11.383 196 2HG LYS 26 2HG LYS 26 -8.874 -2.646 12.844 197 1HD LYS 26 1HD LYS 26 -9.153 -0.738 14.079 198 2HD LYS 26 2HD LYS 26 -7.859 0.119 13.241 199 1HE LYS 26 1HE LYS 26 -9.413 0.166 11.204 200 2HE LYS 26 2HE LYS 26 -10.696 -0.335 12.305 201 1HZ LYS 26 1HZ LYS 26 -8.988 1.972 12.964 202 2HZ LYS 26 2HZ LYS 26 -10.302 2.159 11.903 203 3HZ LYS 26 3HZ LYS 26 -10.561 1.621 13.493 204 H ALA 27 H ALA 27 -3.881 0.293 11.500 205 HA ALA 27 HA ALA 27 -1.817 -1.451 10.930 206 1HB ALA 27 1HB ALA 27 -1.804 1.132 11.147 207 2HB ALA 27 2HB ALA 27 -1.347 0.840 12.826 208 3HB ALA 27 3HB ALA 27 -0.313 0.264 11.520 209 H ASP 28 H ASP 28 -2.401 -0.202 14.213 210 HA ASP 28 HA ASP 28 -0.658 -2.121 15.463 211 1HB ASP 28 1HB ASP 28 -1.819 -1.333 17.590 212 2HB ASP 28 2HB ASP 28 -1.054 -0.068 16.633 213 H THR 29 H THR 29 -3.465 -2.396 17.262 214 HA THR 29 HA THR 29 -4.802 -4.220 17.748 215 HB THR 29 HB THR 29 -5.836 -5.236 15.531 216 HG1 THR 29 HG1 THR 29 -5.225 -4.290 13.779 217 1HG2 THR 29 1HG2 THR 29 -6.834 -3.623 17.247 218 2HG2 THR 29 2HG2 THR 29 -6.344 -2.328 16.154 219 3HG2 THR 29 3HG2 THR 29 -7.500 -3.546 15.615 220 H TYR 30 H TYR 30 -4.155 -6.062 14.849 221 HA TYR 30 HA TYR 30 -1.749 -7.355 15.643 222 1HB TYR 30 1HB TYR 30 -2.668 -9.451 16.596 223 2HB TYR 30 2HB TYR 30 -3.052 -8.054 17.603 224 HD1 TYR 30 HD1 TYR 30 -5.339 -7.059 17.555 225 HD2 TYR 30 HD2 TYR 30 -4.396 -10.696 15.472 226 HE1 TYR 30 HE1 TYR 30 -7.757 -7.568 17.348 227 HE2 TYR 30 HE2 TYR 30 -6.814 -11.204 15.266 228 HH TYR 30 HH TYR 30 -9.064 -9.472 15.289 229 H ARG 31 H ARG 31 -2.947 -6.531 13.191 230 HA ARG 31 HA ARG 31 -2.771 -9.071 11.711 231 1HB ARG 31 1HB ARG 31 -5.252 -7.332 11.637 232 2HB ARG 31 2HB ARG 31 -4.897 -8.597 10.460 233 1HG ARG 31 1HG ARG 31 -4.618 -10.136 12.540 234 2HG ARG 31 2HG ARG 31 -5.511 -8.877 13.394 235 1HD ARG 31 1HD ARG 31 -7.406 -9.114 11.950 236 2HD ARG 31 2HD ARG 31 -6.498 -10.117 10.817 237 HE ARG 31 HE ARG 31 -6.452 -11.442 13.314 238 1HH1 ARG 31 1HH1 ARG 31 -8.787 -10.463 10.901 239 2HH1 ARG 31 2HH1 ARG 31 -9.865 -11.762 11.272 240 1HH2 ARG 31 1HH2 ARG 31 -7.877 -13.109 13.760 241 2HH2 ARG 31 2HH2 ARG 31 -9.357 -13.246 12.871 242 H LYS 32 H LYS 32 -2.201 -8.746 9.514 243 HA LYS 32 HA LYS 32 -1.794 -5.909 8.665 244 1HB LYS 32 1HB LYS 32 0.236 -7.926 7.809 245 2HB LYS 32 2HB LYS 32 0.423 -6.206 8.123 246 1HG LYS 32 1HG LYS 32 0.033 -8.308 10.279 247 2HG LYS 32 2HG LYS 32 1.596 -7.645 9.807 248 1HD LYS 32 1HD LYS 32 1.241 -5.691 10.911 249 2HD LYS 32 2HD LYS 32 -0.447 -5.604 10.411 250 1HE LYS 32 1HE LYS 32 -1.088 -6.331 12.441 251 2HE LYS 32 2HE LYS 32 -0.169 -7.818 12.211 252 1HZ LYS 32 1HZ LYS 32 1.833 -6.369 12.835 253 2HZ LYS 32 2HZ LYS 32 0.683 -5.294 13.474 254 3HZ LYS 32 3HZ LYS 32 0.788 -6.877 14.075 255 H TRP 33 H TRP 33 -0.609 -6.634 6.109 256 HA TRP 33 HA TRP 33 -3.062 -7.733 4.818 257 1HB TRP 33 1HB TRP 33 -2.019 -5.561 3.971 258 2HB TRP 33 2HB TRP 33 -0.659 -6.533 3.447 259 HD1 TRP 33 HD1 TRP 33 -4.165 -7.965 3.129 260 HE1 TRP 33 HE1 TRP 33 -4.747 -8.163 0.614 261 HE3 TRP 33 HE3 TRP 33 -0.218 -5.470 1.134 262 HZ2 TRP 33 HZ2 TRP 33 -3.652 -7.345 -1.911 263 HZ3 TRP 33 HZ3 TRP 33 0.005 -5.196 -1.322 264 HH2 TRP 33 HH2 TRP 33 -1.713 -6.120 -2.835 265 H ARG 34 H ARG 34 -3.022 -9.596 3.637 266 HA ARG 34 HA ARG 34 -0.451 -10.901 3.040 267 1HB ARG 34 1HB ARG 34 -2.527 -12.001 4.942 268 2HB ARG 34 2HB ARG 34 -1.501 -13.090 4.009 269 1HG ARG 34 1HG ARG 34 0.504 -12.104 4.953 270 2HG ARG 34 2HG ARG 34 -0.444 -10.862 5.771 271 1HD ARG 34 1HD ARG 34 -1.256 -12.333 7.367 272 2HD ARG 34 2HD ARG 34 -1.104 -13.732 6.304 273 HE ARG 34 HE ARG 34 1.516 -12.932 6.733 274 1HH1 ARG 34 1HH1 ARG 34 -1.180 -13.780 8.793 275 2HH1 ARG 34 2HH1 ARG 34 -0.160 -14.384 10.051 276 1HH2 ARG 34 1HH2 ARG 34 2.799 -13.724 8.387 277 2HH2 ARG 34 2HH2 ARG 34 2.068 -14.354 9.826 278 H ALA 35 H ALA 35 -0.652 -11.723 0.996 279 HA ALA 35 HA ALA 35 -2.918 -11.426 -0.631 280 1HB ALA 35 1HB ALA 35 -0.429 -12.198 -1.154 281 2HB ALA 35 2HB ALA 35 -1.151 -13.806 -1.096 282 3HB ALA 35 3HB ALA 35 -1.749 -12.614 -2.249 283 H ALA 36 H ALA 36 -4.680 -12.690 -1.166 284 HA ALA 36 HA ALA 36 -5.713 -14.513 0.777 285 1HB ALA 36 1HB ALA 36 -6.786 -13.111 -1.292 286 2HB ALA 36 2HB ALA 36 -6.755 -14.731 -1.984 287 3HB ALA 36 3HB ALA 36 -7.619 -14.431 -0.476 288 H LYS 37 H LYS 37 -4.463 -15.086 -2.498 289 HA LYS 37 HA LYS 37 -4.409 -17.980 -2.057 290 1HB LYS 37 1HB LYS 37 -3.574 -18.073 -4.373 291 2HB LYS 37 2HB LYS 37 -4.977 -17.014 -4.280 292 1HG LYS 37 1HG LYS 37 -2.960 -15.233 -3.796 293 2HG LYS 37 2HG LYS 37 -2.160 -16.355 -4.895 294 1HD LYS 37 1HD LYS 37 -3.140 -14.910 -6.423 295 2HD LYS 37 2HD LYS 37 -4.417 -16.115 -6.263 296 1HE LYS 37 1HE LYS 37 -5.454 -14.694 -4.474 297 2HE LYS 37 2HE LYS 37 -4.245 -13.457 -4.819 298 1HZ LYS 37 1HZ LYS 37 -5.061 -13.702 -7.222 299 2HZ LYS 37 2HZ LYS 37 -6.430 -14.440 -6.538 300 3HZ LYS 37 3HZ LYS 37 -6.030 -12.840 -6.129 301 H ALA 38 H ALA 38 -1.845 -18.342 -3.518 302 HA ALA 38 HA ALA 38 0.083 -17.257 -1.529 303 1HB ALA 38 1HB ALA 38 -0.817 -19.913 -1.558 304 2HB ALA 38 2HB ALA 38 0.779 -19.966 -2.305 305 3HB ALA 38 3HB ALA 38 0.582 -19.279 -0.692 306 H GLY 39 H GLY 39 2.422 -18.050 -2.368 307 1HA GLY 39 1HA GLY 39 3.893 -18.294 -4.268 308 2HA GLY 39 2HA GLY 39 2.563 -17.848 -5.332 309 H GLU 40 H GLU 40 1.907 -15.600 -3.403 310 HA GLU 40 HA GLU 40 2.222 -13.306 -3.421 311 1HB GLU 40 1HB GLU 40 5.040 -14.236 -2.883 312 2HB GLU 40 2HB GLU 40 4.354 -12.661 -2.485 313 1HG GLU 40 1HG GLU 40 3.222 -13.453 -0.684 314 2HG GLU 40 2HG GLU 40 2.795 -14.959 -1.485 315 H LYS 41 H LYS 41 2.286 -14.271 -6.090 316 HA LYS 41 HA LYS 41 4.574 -13.424 -7.580 317 1HB LYS 41 1HB LYS 41 2.456 -14.730 -8.372 318 2HB LYS 41 2HB LYS 41 1.766 -13.129 -8.637 319 1HG LYS 41 1HG LYS 41 3.831 -12.574 -9.998 320 2HG LYS 41 2HG LYS 41 4.270 -14.279 -9.892 321 1HD LYS 41 1HD LYS 41 1.504 -13.586 -10.800 322 2HD LYS 41 2HD LYS 41 2.836 -13.368 -11.936 323 1HE LYS 41 1HE LYS 41 3.533 -15.714 -11.555 324 2HE LYS 41 2HE LYS 41 2.171 -15.929 -10.455 325 1HZ LYS 41 1HZ LYS 41 1.929 -15.134 -13.305 326 2HZ LYS 41 2HZ LYS 41 1.711 -16.713 -12.724 327 3HZ LYS 41 3HZ LYS 41 0.652 -15.477 -12.237 328 H THR 42 H THR 42 1.464 -11.711 -7.288 329 HA THR 42 HA THR 42 2.769 -9.177 -6.620 330 HB THR 42 HB THR 42 1.827 -7.970 -8.598 331 HG1 THR 42 HG1 THR 42 0.549 -8.988 -9.891 332 1HG2 THR 42 1HG2 THR 42 4.193 -8.913 -8.554 333 2HG2 THR 42 2HG2 THR 42 3.582 -10.244 -9.537 334 3HG2 THR 42 3HG2 THR 42 3.527 -8.593 -10.155 335 H ILE 43 H ILE 43 1.345 -8.262 -5.183 336 HA ILE 43 HA ILE 43 -1.532 -9.056 -5.421 337 HB ILE 43 HB ILE 43 -1.628 -8.452 -2.964 338 1HG1 ILE 43 1HG1 ILE 43 1.392 -8.536 -3.204 339 2HG1 ILE 43 2HG1 ILE 43 0.451 -7.059 -2.967 340 1HG2 ILE 43 1HG2 ILE 43 -1.079 -10.781 -4.146 341 2HG2 ILE 43 2HG2 ILE 43 0.434 -10.573 -3.270 342 3HG2 ILE 43 3HG2 ILE 43 -1.092 -10.601 -2.394 343 1HD1 ILE 43 1HD1 ILE 43 -0.588 -8.283 -0.934 344 2HD1 ILE 43 2HD1 ILE 43 0.766 -9.401 -1.087 345 3HD1 ILE 43 3HD1 ILE 43 1.066 -7.693 -0.767 346 H SER 44 H SER 44 -3.157 -7.446 -5.159 347 HA SER 44 HA SER 44 -2.106 -4.644 -5.175 348 1HB SER 44 1HB SER 44 -4.662 -5.082 -6.567 349 2HB SER 44 2HB SER 44 -3.298 -4.077 -7.020 350 HG SER 44 HG SER 44 -3.758 -6.039 -8.326 351 H VAL 45 H VAL 45 -3.340 -3.100 -4.042 352 HA VAL 45 HA VAL 45 -5.865 -3.903 -2.782 353 HB VAL 45 HB VAL 45 -4.214 -4.853 -1.217 354 1HG1 VAL 45 1HG1 VAL 45 -2.450 -3.067 -1.820 355 2HG1 VAL 45 2HG1 VAL 45 -3.272 -2.049 -0.641 356 3HG1 VAL 45 3HG1 VAL 45 -2.549 -3.574 -0.137 357 1HG2 VAL 45 1HG2 VAL 45 -5.694 -2.393 -0.267 358 2HG2 VAL 45 2HG2 VAL 45 -6.267 -4.061 -0.241 359 3HG2 VAL 45 3HG2 VAL 45 -4.952 -3.563 0.824 360 H VAL 46 H VAL 46 -7.057 -2.126 -3.276 361 HA VAL 46 HA VAL 46 -5.772 0.549 -3.192 362 HB VAL 46 HB VAL 46 -8.605 -0.085 -4.024 363 1HG1 VAL 46 1HG1 VAL 46 -7.765 2.293 -3.516 364 2HG1 VAL 46 2HG1 VAL 46 -6.803 2.128 -4.984 365 3HG1 VAL 46 3HG1 VAL 46 -8.562 2.033 -5.068 366 1HG2 VAL 46 1HG2 VAL 46 -6.041 -0.200 -5.625 367 2HG2 VAL 46 2HG2 VAL 46 -7.279 -1.448 -5.476 368 3HG2 VAL 46 3HG2 VAL 46 -7.616 0.024 -6.388 369 H LEU 47 H LEU 47 -5.940 1.671 -1.335 370 HA LEU 47 HA LEU 47 -8.033 0.882 0.620 371 1HB LEU 47 1HB LEU 47 -5.794 2.831 1.134 372 2HB LEU 47 2HB LEU 47 -6.697 1.867 2.300 373 HG LEU 47 HG LEU 47 -5.654 -0.096 0.694 374 1HD1 LEU 47 1HD1 LEU 47 -3.923 2.330 0.519 375 2HD1 LEU 47 2HD1 LEU 47 -3.118 0.778 0.753 376 3HD1 LEU 47 3HD1 LEU 47 -4.159 1.030 -0.649 377 1HD2 LEU 47 1HD2 LEU 47 -4.507 1.230 3.169 378 2HD2 LEU 47 2HD2 LEU 47 -5.553 -0.189 3.097 379 3HD2 LEU 47 3HD2 LEU 47 -3.889 -0.290 2.520 380 H GLN 48 H GLN 48 -9.173 2.612 1.795 381 HA GLN 48 HA GLN 48 -9.811 4.883 -0.031 382 1HB GLN 48 1HB GLN 48 -11.690 3.368 0.504 383 2HB GLN 48 2HB GLN 48 -11.440 3.662 2.223 384 1HG GLN 48 1HG GLN 48 -13.269 5.070 1.374 385 2HG GLN 48 2HG GLN 48 -11.905 6.073 1.869 386 1HE2 GLN 48 2HE2 GLN 48 -12.891 7.702 0.301 387 2HE2 GLN 48 1HE2 GLN 48 -12.508 7.561 -1.347 388 H LEU 49 H LEU 49 -9.316 6.916 0.635 389 HA LEU 49 HA LEU 49 -8.042 7.345 3.223 390 1HB LEU 49 1HB LEU 49 -8.649 9.081 0.820 391 2HB LEU 49 2HB LEU 49 -8.072 9.784 2.327 392 HG LEU 49 HG LEU 49 -6.198 9.353 0.790 393 1HD1 LEU 49 1HD1 LEU 49 -6.237 8.817 3.424 394 2HD1 LEU 49 2HD1 LEU 49 -5.823 7.211 2.823 395 3HD1 LEU 49 3HD1 LEU 49 -4.795 8.591 2.434 396 1HD2 LEU 49 1HD2 LEU 49 -7.486 7.304 -0.212 397 2HD2 LEU 49 2HD2 LEU 49 -5.726 7.251 -0.132 398 3HD2 LEU 49 3HD2 LEU 49 -6.689 6.396 1.074 399 H GLU 50 H GLU 50 -9.089 8.175 4.961 400 HA GLU 50 HA GLU 50 -11.995 8.504 4.858 401 1HB GLU 50 1HB GLU 50 -10.503 7.539 6.793 402 2HB GLU 50 2HB GLU 50 -10.335 9.235 7.254 403 1HG GLU 50 1HG GLU 50 -12.925 9.320 7.030 404 2HG GLU 50 2HG GLU 50 -12.836 7.560 7.122 405 H LYS 51 H LYS 51 -10.571 10.471 3.272 406 HA LYS 51 HA LYS 51 -11.908 12.834 3.723 407 1HB LYS 51 1HB LYS 51 -10.099 14.293 4.737 408 2HB LYS 51 2HB LYS 51 -10.832 13.175 5.875 409 1HG LYS 51 1HG LYS 51 -8.954 11.587 5.490 410 2HG LYS 51 2HG LYS 51 -8.203 12.770 4.420 411 1HD LYS 51 1HD LYS 51 -8.622 14.332 6.586 412 2HD LYS 51 2HD LYS 51 -8.419 12.770 7.381 413 1HE LYS 51 1HE LYS 51 -6.373 12.718 5.550 414 2HE LYS 51 2HE LYS 51 -6.432 14.431 5.965 415 1HZ LYS 51 1HZ LYS 51 -6.449 13.704 8.343 416 2HZ LYS 51 2HZ LYS 51 -6.098 12.134 7.806 417 3HZ LYS 51 3HZ LYS 51 -5.001 13.397 7.509 418 H GLU 52 H GLU 52 -11.633 13.854 1.767 419 HA GLU 52 HA GLU 52 -9.513 12.990 -0.024 420 1HB GLU 52 1HB GLU 52 -11.919 13.732 -0.649 421 2HB GLU 52 2HB GLU 52 -11.283 15.367 -0.492 422 1HG GLU 52 1HG GLU 52 -9.422 14.685 -2.079 423 2HG GLU 52 2HG GLU 52 -10.343 13.215 -2.390 424 H GLU 53 H GLU 53 -7.518 13.715 0.368 425 HA GLU 53 HA GLU 53 -7.072 16.632 0.516 426 1HB GLU 53 1HB GLU 53 -5.136 15.481 2.295 427 2HB GLU 53 2HB GLU 53 -6.340 16.708 2.643 428 1HG GLU 53 1HG GLU 53 -7.304 13.881 2.611 429 2HG GLU 53 2HG GLU 53 -6.242 14.349 3.934 430 H GLN 54 H GLN 54 -4.487 16.880 0.599 431 HA GLN 54 HA GLN 54 -3.559 15.474 -1.820 432 1HB GLN 54 1HB GLN 54 -2.484 17.785 -0.189 433 2HB GLN 54 2HB GLN 54 -1.554 17.044 -1.489 434 1HG GLN 54 1HG GLN 54 -3.146 17.645 -3.133 435 2HG GLN 54 2HG GLN 54 -4.372 18.008 -1.926 436 1HE2 GLN 54 2HE2 GLN 54 -0.945 19.048 -1.814 437 2HE2 GLN 54 1HE2 GLN 54 -1.284 20.709 -1.897 438 H ILE 55 H ILE 55 -1.007 14.945 -1.645 439 HA ILE 55 HA ILE 55 -0.467 13.616 0.969 440 HB ILE 55 HB ILE 55 -0.096 12.253 -1.712 441 1HG1 ILE 55 1HG1 ILE 55 -1.957 10.774 -0.366 442 2HG1 ILE 55 2HG1 ILE 55 -2.395 12.399 0.161 443 1HG2 ILE 55 1HG2 ILE 55 1.272 11.777 0.553 444 2HG2 ILE 55 2HG2 ILE 55 -0.164 10.812 0.895 445 3HG2 ILE 55 3HG2 ILE 55 0.797 10.484 -0.547 446 1HD1 ILE 55 1HD1 ILE 55 -1.855 11.960 -2.749 447 2HD1 ILE 55 2HD1 ILE 55 -3.381 11.376 -2.088 448 3HD1 ILE 55 3HD1 ILE 55 -2.968 13.086 -1.974 449 H HIS 56 H HIS 56 1.661 13.718 1.575 450 HA HIS 56 HA HIS 56 3.610 14.798 -0.424 451 1HB HIS 56 1HB HIS 56 2.862 16.439 1.360 452 2HB HIS 56 2HB HIS 56 3.634 15.386 2.545 453 HD1 HIS 56 HD1 HIS 56 4.394 17.762 -0.252 454 HD2 HIS 56 HD2 HIS 56 6.489 15.355 2.430 455 HE1 HIS 56 HE1 HIS 56 6.822 18.461 -0.409 456 H SER 57 H SER 57 3.099 12.715 2.392 457 HA SER 57 HA SER 57 5.583 11.238 1.653 458 1HB SER 57 1HB SER 57 4.897 12.506 4.269 459 2HB SER 57 2HB SER 57 5.666 10.921 4.315 460 HG SER 57 HG SER 57 7.436 12.000 3.983 461 H VAL 58 H VAL 58 5.547 9.005 2.590 462 HA VAL 58 HA VAL 58 2.817 8.027 3.270 463 HB VAL 58 HB VAL 58 4.549 7.081 0.965 464 1HG1 VAL 58 1HG1 VAL 58 2.060 5.853 2.173 465 2HG1 VAL 58 2HG1 VAL 58 2.664 5.446 0.567 466 3HG1 VAL 58 3HG1 VAL 58 3.645 5.107 1.993 467 1HG2 VAL 58 1HG2 VAL 58 2.005 8.614 1.260 468 2HG2 VAL 58 2HG2 VAL 58 3.299 8.802 0.077 469 3HG2 VAL 58 3HG2 VAL 58 2.129 7.495 -0.096 470 H ASP 59 H ASP 59 2.927 5.696 4.036 471 HA ASP 59 HA ASP 59 5.603 4.812 4.965 472 1HB ASP 59 1HB ASP 59 3.411 5.846 6.678 473 2HB ASP 59 2HB ASP 59 4.167 4.353 7.231 474 H ILE 60 H ILE 60 5.705 2.722 4.274 475 HA ILE 60 HA ILE 60 3.319 0.994 4.745 476 HB ILE 60 HB ILE 60 4.767 1.499 2.169 477 1HG1 ILE 60 1HG1 ILE 60 2.307 0.826 1.472 478 2HG1 ILE 60 2HG1 ILE 60 1.977 1.152 3.171 479 1HG2 ILE 60 1HG2 ILE 60 3.545 -1.185 2.879 480 2HG2 ILE 60 2HG2 ILE 60 3.975 -0.677 1.247 481 3HG2 ILE 60 3HG2 ILE 60 5.233 -0.885 2.464 482 1HD1 ILE 60 1HD1 ILE 60 3.603 3.153 1.682 483 2HD1 ILE 60 2HD1 ILE 60 1.878 3.083 1.330 484 3HD1 ILE 60 3HD1 ILE 60 2.429 3.397 2.974 485 H GLY 61 H GLY 61 3.921 -0.633 6.068 486 1HA GLY 61 1HA GLY 61 6.740 -1.192 6.529 487 2HA GLY 61 2HA GLY 61 5.422 -2.004 7.325 488 H ASN 62 H ASN 62 7.450 -1.978 4.548 489 HA ASN 62 HA ASN 62 6.155 -4.164 3.151 490 1HB ASN 62 1HB ASN 62 8.758 -2.719 2.931 491 2HB ASN 62 2HB ASN 62 8.575 -4.258 2.090 492 1HD2 ASN 62 2HD2 ASN 62 5.983 -4.227 1.169 493 2HD2 ASN 62 1HD2 ASN 62 5.709 -2.889 0.163 494 H ASP 63 H ASP 63 6.125 -6.286 3.822 495 HA ASP 63 HA ASP 63 7.934 -7.204 5.911 496 1HB ASP 63 1HB ASP 63 5.664 -8.296 4.381 497 2HB ASP 63 2HB ASP 63 6.885 -9.498 4.784 498 H GLY 64 H GLY 64 7.584 -9.109 2.958 499 1HA GLY 64 1HA GLY 64 10.532 -8.890 2.545 500 2HA GLY 64 2HA GLY 64 9.603 -10.351 2.184 501 H SER 65 H SER 65 8.155 -7.272 1.511 502 HA SER 65 HA SER 65 7.510 -7.794 -1.147 503 1HB SER 65 1HB SER 65 6.872 -5.518 -1.307 504 2HB SER 65 2HB SER 65 6.658 -5.935 0.387 505 HG SER 65 HG SER 65 8.269 -4.100 -0.738 506 H ALA 66 H ALA 66 8.219 -6.002 -2.865 507 HA ALA 66 HA ALA 66 11.135 -5.692 -3.019 508 1HB ALA 66 1HB ALA 66 10.434 -7.989 -3.980 509 2HB ALA 66 2HB ALA 66 9.682 -7.064 -5.280 510 3HB ALA 66 3HB ALA 66 11.421 -6.950 -5.008 511 H PHE 67 H PHE 67 8.127 -5.530 -4.942 512 HA PHE 67 HA PHE 67 8.900 -2.758 -5.780 513 1HB PHE 67 1HB PHE 67 7.125 -4.715 -7.270 514 2HB PHE 67 2HB PHE 67 7.647 -3.147 -7.845 515 HD1 PHE 67 HD1 PHE 67 10.348 -2.820 -7.569 516 HD2 PHE 67 HD2 PHE 67 8.266 -6.532 -8.121 517 HE1 PHE 67 HE1 PHE 67 12.421 -3.846 -8.453 518 HE2 PHE 67 HE2 PHE 67 10.333 -7.564 -9.005 519 HZ PHE 67 HZ PHE 67 12.418 -6.223 -9.175 520 H VAL 68 H VAL 68 7.593 -1.230 -4.924 521 HA VAL 68 HA VAL 68 4.790 -2.047 -4.225 522 HB VAL 68 HB VAL 68 6.434 0.102 -2.867 523 1HG1 VAL 68 1HG1 VAL 68 3.840 0.193 -2.943 524 2HG1 VAL 68 2HG1 VAL 68 3.908 -1.207 -1.872 525 3HG1 VAL 68 3HG1 VAL 68 4.624 0.324 -1.369 526 1HG2 VAL 68 1HG2 VAL 68 7.310 -2.184 -2.475 527 2HG2 VAL 68 2HG2 VAL 68 6.593 -1.503 -1.014 528 3HG2 VAL 68 3HG2 VAL 68 5.702 -2.696 -1.960 529 H GLU 69 H GLU 69 3.538 -1.266 -5.802 530 HA GLU 69 HA GLU 69 4.147 1.351 -7.054 531 1HB GLU 69 1HB GLU 69 3.437 -0.686 -8.404 532 2HB GLU 69 2HB GLU 69 1.841 -0.507 -7.679 533 1HG GLU 69 1HG GLU 69 1.344 1.361 -8.896 534 2HG GLU 69 2HG GLU 69 3.000 1.963 -8.842 535 H VAL 70 H VAL 70 2.849 3.166 -6.791 536 HA VAL 70 HA VAL 70 0.460 2.896 -5.033 537 HB VAL 70 HB VAL 70 2.685 4.930 -4.702 538 1HG1 VAL 70 1HG1 VAL 70 -0.058 4.636 -3.516 539 2HG1 VAL 70 2HG1 VAL 70 1.241 5.267 -2.503 540 3HG1 VAL 70 3HG1 VAL 70 0.799 6.102 -3.992 541 1HG2 VAL 70 1HG2 VAL 70 1.989 2.348 -3.384 542 2HG2 VAL 70 2HG2 VAL 70 3.569 3.083 -3.650 543 3HG2 VAL 70 3HG2 VAL 70 2.538 3.660 -2.341 544 H LEU 71 H LEU 71 -1.231 3.771 -6.086 545 HA LEU 71 HA LEU 71 -0.743 6.049 -7.952 546 1HB LEU 71 1HB LEU 71 -2.182 3.535 -8.288 547 2HB LEU 71 2HB LEU 71 -3.240 4.913 -8.581 548 HG LEU 71 HG LEU 71 -1.383 5.836 -10.074 549 1HD1 LEU 71 1HD1 LEU 71 -0.380 3.028 -9.578 550 2HD1 LEU 71 2HD1 LEU 71 0.093 3.963 -10.998 551 3HD1 LEU 71 3HD1 LEU 71 0.500 4.544 -9.383 552 1HD2 LEU 71 1HD2 LEU 71 -2.972 3.344 -10.656 553 2HD2 LEU 71 2HD2 LEU 71 -3.265 4.993 -11.208 554 3HD2 LEU 71 3HD2 LEU 71 -1.940 4.056 -11.897 555 H VAL 72 H VAL 72 -2.642 7.548 -8.074 556 HA VAL 72 HA VAL 72 -4.129 7.665 -5.483 557 HB VAL 72 HB VAL 72 -3.962 10.170 -5.794 558 1HG1 VAL 72 1HG1 VAL 72 -1.557 8.449 -5.203 559 2HG1 VAL 72 2HG1 VAL 72 -1.556 10.192 -4.932 560 3HG1 VAL 72 3HG1 VAL 72 -2.685 9.163 -4.050 561 1HG2 VAL 72 1HG2 VAL 72 -1.798 9.294 -7.715 562 2HG2 VAL 72 2HG2 VAL 72 -3.252 10.198 -8.131 563 3HG2 VAL 72 3HG2 VAL 72 -2.007 10.941 -7.128 564 H GLY 73 H GLY 73 -6.088 9.162 -5.670 565 1HA GLY 73 1HA GLY 73 -7.259 10.020 -8.035 566 2HA GLY 73 2HA GLY 73 -7.708 8.323 -7.896 567 H SER 74 H SER 74 -9.709 10.022 -7.849 568 HA SER 74 HA SER 74 -10.454 10.408 -5.010 569 1HB SER 74 1HB SER 74 -10.633 12.488 -6.167 570 2HB SER 74 2HB SER 74 -11.399 11.729 -7.554 571 HG SER 74 HG SER 74 -12.821 12.856 -6.033 572 H SER 75 H SER 75 -12.721 9.947 -4.522 573 HA SER 75 HA SER 75 -13.608 7.446 -5.770 574 1HB SER 75 1HB SER 75 -15.111 7.257 -3.914 575 2HB SER 75 2HB SER 75 -13.606 7.893 -3.253 576 HG SER 75 HG SER 75 -14.524 9.808 -2.972 577 H ALA 76 H ALA 76 -13.902 10.504 -6.779 578 HA ALA 76 HA ALA 76 -16.607 11.154 -7.018 579 1HB ALA 76 1HB ALA 76 -14.191 11.644 -8.689 580 2HB ALA 76 2HB ALA 76 -15.761 11.986 -9.416 581 3HB ALA 76 3HB ALA 76 -15.281 12.800 -7.926 582 H GLY 77 H GLY 77 -18.310 10.133 -7.938 583 1HA GLY 77 1HA GLY 77 -18.104 7.621 -9.266 584 2HA GLY 77 2HA GLY 77 -19.546 8.637 -9.255 585 H GLY 78 H GLY 78 -16.925 7.511 -11.139 586 1HA GLY 78 1HA GLY 78 -17.625 7.845 -13.645 587 2HA GLY 78 2HA GLY 78 -17.407 9.552 -13.254 588 H ALA 79 H ALA 79 -15.673 6.436 -13.152 589 HA ALA 79 HA ALA 79 -13.355 7.450 -14.479 590 1HB ALA 79 1HB ALA 79 -13.509 8.127 -11.709 591 2HB ALA 79 2HB ALA 79 -12.247 6.908 -11.886 592 3HB ALA 79 3HB ALA 79 -12.167 8.402 -12.818 593 H GLY 80 H GLY 80 -14.349 5.183 -11.901 594 1HA GLY 80 1HA GLY 80 -14.440 2.792 -12.170 595 2HA GLY 80 2HA GLY 80 -13.413 2.937 -13.596 596 H GLU 81 H GLU 81 -11.743 1.570 -12.996 597 HA GLU 81 HA GLU 81 -10.344 2.178 -10.425 598 1HB GLU 81 1HB GLU 81 -10.171 -0.320 -12.135 599 2HB GLU 81 2HB GLU 81 -9.428 -0.083 -10.553 600 1HG GLU 81 1HG GLU 81 -11.645 0.176 -9.530 601 2HG GLU 81 2HG GLU 81 -12.409 -0.012 -11.108 602 H GLN 82 H GLN 82 -10.013 2.124 -13.898 603 HA GLN 82 HA GLN 82 -7.070 2.465 -13.709 604 1HB GLN 82 1HB GLN 82 -8.997 1.738 -15.853 605 2HB GLN 82 2HB GLN 82 -7.586 2.670 -16.354 606 1HG GLN 82 1HG GLN 82 -7.070 0.408 -14.496 607 2HG GLN 82 2HG GLN 82 -7.559 -0.026 -16.134 608 1HE2 GLN 82 2HE2 GLN 82 -5.549 2.736 -14.976 609 2HE2 GLN 82 1HE2 GLN 82 -4.199 2.341 -15.926 610 H ASP 83 H ASP 83 -9.002 4.532 -12.758 611 HA ASP 83 HA ASP 83 -8.275 6.736 -14.646 612 1HB ASP 83 1HB ASP 83 -10.791 6.077 -13.938 613 2HB ASP 83 2HB ASP 83 -10.396 7.156 -12.601 614 H TYR 84 H TYR 84 -6.523 5.681 -12.589 615 HA TYR 84 HA TYR 84 -6.546 7.839 -10.549 616 1HB TYR 84 1HB TYR 84 -5.348 5.081 -10.686 617 2HB TYR 84 2HB TYR 84 -4.649 6.284 -9.605 618 HD1 TYR 84 HD1 TYR 84 -8.191 5.487 -10.601 619 HD2 TYR 84 HD2 TYR 84 -5.337 5.883 -7.415 620 HE1 TYR 84 HE1 TYR 84 -9.979 5.042 -8.948 621 HE2 TYR 84 HE2 TYR 84 -7.129 5.438 -5.759 622 HH TYR 84 HH TYR 84 -10.234 5.738 -6.288 623 H GLU 85 H GLU 85 -3.981 8.139 -9.938 624 HA GLU 85 HA GLU 85 -2.537 8.602 -12.500 625 1HB GLU 85 1HB GLU 85 -2.736 10.838 -12.274 626 2HB GLU 85 2HB GLU 85 -3.684 10.613 -10.817 627 1HG GLU 85 1HG GLU 85 -1.911 12.014 -10.149 628 2HG GLU 85 2HG GLU 85 -1.397 10.419 -9.599 629 H VAL 86 H VAL 86 -0.386 8.037 -12.409 630 HA VAL 86 HA VAL 86 0.508 6.393 -10.248 631 HB VAL 86 HB VAL 86 2.178 7.707 -12.412 632 1HG1 VAL 86 1HG1 VAL 86 2.625 5.241 -10.699 633 2HG1 VAL 86 2HG1 VAL 86 3.663 5.749 -12.031 634 3HG1 VAL 86 3HG1 VAL 86 3.522 6.756 -10.590 635 1HG2 VAL 86 1HG2 VAL 86 0.059 6.159 -12.935 636 2HG2 VAL 86 2HG2 VAL 86 1.554 6.008 -13.856 637 3HG2 VAL 86 3HG2 VAL 86 1.208 4.881 -12.545 638 H LEU 87 H LEU 87 0.279 7.737 -8.359 639 HA LEU 87 HA LEU 87 1.728 10.217 -8.013 640 1HB LEU 87 1HB LEU 87 -0.205 9.526 -6.593 641 2HB LEU 87 2HB LEU 87 0.769 8.221 -5.928 642 HG LEU 87 HG LEU 87 2.441 10.301 -5.483 643 1HD1 LEU 87 1HD1 LEU 87 -0.272 11.421 -5.902 644 2HD1 LEU 87 2HD1 LEU 87 0.553 11.965 -4.442 645 3HD1 LEU 87 3HD1 LEU 87 1.302 12.206 -6.019 646 1HD2 LEU 87 1HD2 LEU 87 0.095 9.489 -3.732 647 2HD2 LEU 87 2HD2 LEU 87 1.652 8.666 -3.810 648 3HD2 LEU 87 3HD2 LEU 87 1.554 10.306 -3.169 649 H LEU 88 H LEU 88 2.312 7.034 -6.481 650 HA LEU 88 HA LEU 88 5.214 7.670 -6.564 651 1HB LEU 88 1HB LEU 88 5.035 7.451 -4.341 652 2HB LEU 88 2HB LEU 88 3.465 6.708 -4.473 653 HG LEU 88 HG LEU 88 4.617 4.525 -5.007 654 1HD1 LEU 88 1HD1 LEU 88 7.037 6.201 -4.312 655 2HD1 LEU 88 2HD1 LEU 88 7.047 4.439 -4.383 656 3HD1 LEU 88 3HD1 LEU 88 6.723 5.380 -5.839 657 1HD2 LEU 88 1HD2 LEU 88 3.881 5.280 -2.680 658 2HD2 LEU 88 2HD2 LEU 88 5.140 4.047 -2.717 659 3HD2 LEU 88 3HD2 LEU 88 5.563 5.728 -2.395 660 H VAL 89 H VAL 89 6.186 6.568 -8.170 661 HA VAL 89 HA VAL 89 5.021 4.375 -9.581 662 HB VAL 89 HB VAL 89 8.006 4.833 -9.481 663 1HG1 VAL 89 1HG1 VAL 89 6.000 3.737 -11.415 664 2HG1 VAL 89 2HG1 VAL 89 7.467 4.483 -12.048 665 3HG1 VAL 89 3HG1 VAL 89 7.580 3.100 -10.960 666 1HG2 VAL 89 1HG2 VAL 89 5.878 6.595 -10.697 667 2HG2 VAL 89 2HG2 VAL 89 7.294 7.070 -9.761 668 3HG2 VAL 89 3HG2 VAL 89 7.484 6.496 -11.418 669 H THR 90 H THR 90 6.264 2.174 -9.768 670 HA THR 90 HA THR 90 6.026 0.769 -7.340 671 HB THR 90 HB THR 90 6.621 0.165 -10.055 672 HG1 THR 90 HG1 THR 90 6.168 -1.478 -7.798 673 1HG2 THR 90 1HG2 THR 90 9.013 -0.095 -9.430 674 2HG2 THR 90 2HG2 THR 90 8.548 -1.244 -8.176 675 3HG2 THR 90 3HG2 THR 90 8.282 -1.638 -9.875 676 H SER 91 H SER 91 7.313 0.621 -5.603 677 HA SER 91 HA SER 91 9.966 1.912 -5.677 678 1HB SER 91 1HB SER 91 9.754 2.200 -3.360 679 2HB SER 91 2HB SER 91 8.087 2.337 -3.905 680 HG SER 91 HG SER 91 9.291 0.447 -2.338 681 H SER 92 H SER 92 11.635 0.619 -6.110 682 HA SER 92 HA SER 92 11.532 -2.273 -5.733 683 1HB SER 92 1HB SER 92 14.107 -1.927 -6.211 684 2HB SER 92 2HB SER 92 12.944 -1.691 -7.513 685 HG SER 92 HG SER 92 14.639 0.068 -6.418 686 H PHE 93 H PHE 93 10.878 -1.821 -3.408 687 HA PHE 93 HA PHE 93 12.694 -0.783 -1.481 688 1HB PHE 93 1HB PHE 93 10.329 -1.101 -0.989 689 2HB PHE 93 2HB PHE 93 10.492 -2.836 -1.211 690 HD1 PHE 93 HD1 PHE 93 12.736 -0.429 0.576 691 HD2 PHE 93 HD2 PHE 93 10.077 -3.784 0.890 692 HE1 PHE 93 HE1 PHE 93 13.387 -0.722 2.952 693 HE2 PHE 93 HE2 PHE 93 10.720 -4.068 3.270 694 HZ PHE 93 HZ PHE 93 12.378 -2.538 4.291 695 H MET 94 H MET 94 11.944 -4.226 -2.107 696 HA MET 94 HA MET 94 14.771 -4.845 -1.334 697 1HB MET 94 1HB MET 94 12.723 -6.987 -0.992 698 2HB MET 94 2HB MET 94 14.152 -6.638 -0.026 699 1HG MET 94 1HG MET 94 12.681 -4.432 0.501 700 2HG MET 94 2HG MET 94 11.386 -5.595 0.234 701 1HE MET 94 1HE MET 94 12.090 -8.155 0.994 702 2HE MET 94 2HE MET 94 13.790 -8.176 1.490 703 3HE MET 94 3HE MET 94 12.519 -8.491 2.669 704 H SER 95 H SER 95 14.884 -7.478 -2.008 705 HA SER 95 HA SER 95 14.301 -7.485 -4.942 706 1HB SER 95 1HB SER 95 16.360 -8.572 -5.329 707 2HB SER 95 2HB SER 95 16.769 -7.412 -4.074 708 HG SER 95 HG SER 95 17.367 -9.084 -2.962 709 HA PRO 96 HA PRO 96 12.243 -11.372 -4.175 710 1HB PRO 96 1HB PRO 96 12.894 -12.862 -6.365 711 2HB PRO 96 2HB PRO 96 11.824 -11.456 -6.429 712 1HG PRO 96 1HG PRO 96 14.560 -11.758 -7.447 713 2HG PRO 96 2HG PRO 96 13.323 -10.571 -7.879 714 1HD PRO 96 1HD PRO 96 15.585 -10.211 -6.130 715 2HD PRO 96 2HD PRO 96 14.341 -9.018 -6.568 716 H SER 97 H SER 97 15.418 -11.263 -3.524 717 HA SER 97 HA SER 97 15.620 -14.211 -3.065 718 1HB SER 97 1HB SER 97 17.266 -12.963 -4.719 719 2HB SER 97 2HB SER 97 18.060 -12.480 -3.223 720 HG SER 97 HG SER 97 18.347 -14.735 -4.468 721 H GLU 98 H GLU 98 16.318 -10.975 -1.775 722 HA GLU 98 HA GLU 98 17.293 -12.059 0.758 723 1HB GLU 98 1HB GLU 98 17.642 -9.772 1.389 724 2HB GLU 98 2HB GLU 98 18.083 -9.897 -0.306 725 1HG GLU 98 1HG GLU 98 15.495 -9.249 -0.619 726 2HG GLU 98 2HG GLU 98 15.774 -8.488 0.947 727 H SER 99 H SER 99 14.221 -11.126 -0.559 728 HA SER 99 HA SER 99 12.797 -10.417 1.780 729 1HB SER 99 1HB SER 99 10.787 -11.133 0.532 730 2HB SER 99 2HB SER 99 11.866 -10.173 -0.476 731 HG SER 99 HG SER 99 11.384 -12.950 -0.480 732 H ARG 100 H ARG 100 14.019 -13.529 0.790 733 HA ARG 100 HA ARG 100 12.152 -15.137 2.292 734 1HB ARG 100 1HB ARG 100 14.906 -15.627 1.158 735 2HB ARG 100 2HB ARG 100 14.103 -16.844 2.152 736 1HG ARG 100 1HG ARG 100 12.827 -15.575 -0.285 737 2HG ARG 100 2HG ARG 100 13.715 -17.099 -0.335 738 1HD ARG 100 1HD ARG 100 12.029 -17.556 1.766 739 2HD ARG 100 2HD ARG 100 11.026 -16.519 0.751 740 HE ARG 100 HE ARG 100 10.827 -18.312 -0.748 741 1HH1 ARG 100 1HH1 ARG 100 13.675 -18.750 1.234 742 2HH1 ARG 100 2HH1 ARG 100 14.026 -20.305 0.562 743 1HH2 ARG 100 1HH2 ARG 100 11.319 -20.326 -1.589 744 2HH2 ARG 100 2HH2 ARG 100 12.708 -21.189 -1.018 745 H SER 101 H SER 101 15.605 -15.209 3.129 746 HA SER 101 HA SER 101 15.205 -13.964 5.729 747 1HB SER 101 1HB SER 101 14.313 -16.469 5.770 748 2HB SER 101 2HB SER 101 16.029 -16.841 5.901 749 HG SER 101 HG SER 101 14.934 -16.509 7.937 750 H GLY 102 H GLY 102 16.942 -13.552 3.506 751 1HA GLY 102 1HA GLY 102 19.571 -14.411 4.645 752 2HA GLY 102 2HA GLY 102 19.305 -14.120 2.929 753 H SER 103 H SER 103 17.555 -11.689 3.942 754 HA SER 103 HA SER 103 19.348 -9.851 5.188 755 1HB SER 103 1HB SER 103 19.785 -10.315 2.350 756 2HB SER 103 2HB SER 103 19.361 -8.634 2.657 757 HG SER 103 HG SER 103 21.589 -10.092 3.406 758 H ASN 104 H ASN 104 17.976 -8.433 6.033 759 HA ASN 104 HA ASN 104 15.984 -7.287 6.486 760 1HB ASN 104 1HB ASN 104 15.537 -5.543 4.821 761 2HB ASN 104 2HB ASN 104 17.271 -5.732 5.052 762 1HD2 ASN 104 2HD2 ASN 104 18.491 -6.840 3.303 763 2HD2 ASN 104 1HD2 ASN 104 17.832 -6.965 1.742 764 HA PRO 105 HA PRO 105 13.314 -10.274 4.007 765 1HB PRO 105 1HB PRO 105 12.625 -11.927 6.069 766 2HB PRO 105 2HB PRO 105 14.043 -12.179 5.044 767 1HG PRO 105 1HG PRO 105 13.886 -11.165 7.825 768 2HG PRO 105 2HG PRO 105 15.165 -12.098 7.032 769 1HD PRO 105 1HD PRO 105 15.234 -9.342 7.514 770 2HD PRO 105 2HD PRO 105 16.268 -10.213 6.362 771 H ASN 106 H ASN 106 12.897 -8.785 7.203 772 HA ASN 106 HA ASN 106 10.138 -8.040 6.408 773 1HB ASN 106 1HB ASN 106 10.786 -10.082 8.367 774 2HB ASN 106 2HB ASN 106 9.887 -8.766 9.119 775 1HD2 ASN 106 2HD2 ASN 106 9.688 -10.297 5.846 776 2HD2 ASN 106 1HD2 ASN 106 8.025 -10.605 5.937 777 H ARG 107 H ARG 107 10.173 -5.876 6.595 778 HA ARG 107 HA ARG 107 10.686 -4.630 9.167 779 1HB ARG 107 1HB ARG 107 12.502 -3.158 8.490 780 2HB ARG 107 2HB ARG 107 13.005 -4.828 8.249 781 1HG ARG 107 1HG ARG 107 11.994 -4.400 5.819 782 2HG ARG 107 2HG ARG 107 12.375 -2.727 6.232 783 1HD ARG 107 1HD ARG 107 14.305 -5.061 6.299 784 2HD ARG 107 2HD ARG 107 14.294 -3.759 5.109 785 HE ARG 107 HE ARG 107 15.345 -3.599 7.829 786 1HH1 ARG 107 1HH1 ARG 107 14.028 -1.794 5.136 787 2HH1 ARG 107 2HH1 ARG 107 14.785 -0.320 5.628 788 1HH2 ARG 107 1HH2 ARG 107 16.300 -1.669 8.427 789 2HH2 ARG 107 2HH2 ARG 107 16.055 -0.245 7.471 790 H VAL 108 H VAL 108 10.991 -1.937 8.060 791 HA VAL 108 HA VAL 108 8.431 -1.735 6.541 792 HB VAL 108 HB VAL 108 7.465 -0.653 8.251 793 1HG1 VAL 108 1HG1 VAL 108 10.173 -0.710 9.565 794 2HG1 VAL 108 2HG1 VAL 108 8.711 -0.125 10.359 795 3HG1 VAL 108 3HG1 VAL 108 8.816 -1.805 9.834 796 1HG2 VAL 108 1HG2 VAL 108 9.692 1.376 7.939 797 2HG2 VAL 108 2HG2 VAL 108 8.089 1.434 7.204 798 3HG2 VAL 108 3HG2 VAL 108 8.266 1.616 8.950 799 H ARG 109 H ARG 109 8.210 0.282 5.265 800 HA ARG 109 HA ARG 109 10.780 1.585 4.533 801 1HB ARG 109 1HB ARG 109 10.539 -0.230 2.918 802 2HB ARG 109 2HB ARG 109 8.876 0.220 2.595 803 1HG ARG 109 1HG ARG 109 10.209 1.088 0.788 804 2HG ARG 109 2HG ARG 109 9.729 2.458 1.780 805 1HD ARG 109 1HD ARG 109 11.879 2.628 2.775 806 2HD ARG 109 2HD ARG 109 12.358 1.037 2.195 807 HE ARG 109 HE ARG 109 11.835 2.449 -0.125 808 1HH1 ARG 109 1HH1 ARG 109 13.870 2.973 2.672 809 2HH1 ARG 109 2HH1 ARG 109 15.047 3.865 1.773 810 1HH2 ARG 109 1HH2 ARG 109 13.384 3.608 -1.249 811 2HH2 ARG 109 2HH2 ARG 109 14.779 4.220 -0.423 812 H MET 110 H MET 110 10.473 3.764 4.277 813 HA MET 110 HA MET 110 7.649 4.744 4.177 814 1HB MET 110 1HB MET 110 10.116 6.162 5.223 815 2HB MET 110 2HB MET 110 8.459 6.760 5.304 816 1HG MET 110 1HG MET 110 7.890 5.359 7.020 817 2HG MET 110 2HG MET 110 8.901 4.047 6.423 818 1HE MET 110 1HE MET 110 8.372 7.161 7.994 819 2HE MET 110 2HE MET 110 9.198 6.932 9.533 820 3HE MET 110 3HE MET 110 9.956 7.900 8.271 821 H PHE 111 H PHE 111 7.412 6.912 3.084 822 HA PHE 111 HA PHE 111 9.389 7.365 0.903 823 1HB PHE 111 1HB PHE 111 6.412 7.350 0.368 824 2HB PHE 111 2HB PHE 111 7.726 7.394 -0.806 825 HD1 PHE 111 HD1 PHE 111 6.124 5.275 1.806 826 HD2 PHE 111 HD2 PHE 111 8.701 5.394 -1.625 827 HE1 PHE 111 HE1 PHE 111 6.128 2.807 1.721 828 HE2 PHE 111 HE2 PHE 111 8.706 2.920 -1.705 829 HZ PHE 111 HZ PHE 111 7.416 1.617 -0.038 830 H GLY 112 H GLY 112 8.934 9.517 -0.176 831 1HA GLY 112 1HA GLY 112 7.518 11.435 1.587 832 2HA GLY 112 2HA GLY 112 9.182 11.730 1.149 833 HA PRO 113 HA PRO 113 6.795 13.876 -2.146 834 1HB PRO 113 1HB PRO 113 8.640 15.865 -2.462 835 2HB PRO 113 2HB PRO 113 7.365 15.900 -1.234 836 1HG PRO 113 1HG PRO 113 10.264 15.308 -0.933 837 2HG PRO 113 2HG PRO 113 9.151 16.106 0.190 838 1HD PRO 113 1HD PRO 113 9.983 13.458 0.416 839 2HD PRO 113 2HD PRO 113 8.517 14.115 1.151 840 H ASP 114 H ASP 114 10.252 13.114 -2.042 841 HA ASP 114 HA ASP 114 10.761 13.310 -4.850 842 1HB ASP 114 1HB ASP 114 12.122 12.051 -2.508 843 2HB ASP 114 2HB ASP 114 12.604 11.516 -4.118 844 H LYS 115 H LYS 115 9.323 10.828 -2.847 845 HA LYS 115 HA LYS 115 9.467 8.833 -5.010 846 1HB LYS 115 1HB LYS 115 8.572 8.818 -2.147 847 2HB LYS 115 2HB LYS 115 8.027 7.539 -3.233 848 1HG LYS 115 1HG LYS 115 9.994 6.560 -2.574 849 2HG LYS 115 2HG LYS 115 10.651 7.563 -3.868 850 1HD LYS 115 1HD LYS 115 10.891 9.391 -2.043 851 2HD LYS 115 2HD LYS 115 10.699 8.063 -0.896 852 1HE LYS 115 1HE LYS 115 12.547 6.893 -2.331 853 2HE LYS 115 2HE LYS 115 12.899 8.526 -2.896 854 1HZ LYS 115 1HZ LYS 115 13.012 9.176 -0.498 855 2HZ LYS 115 2HZ LYS 115 12.956 7.523 -0.107 856 3HZ LYS 115 3HZ LYS 115 14.251 8.140 -1.016 857 H LEU 116 H LEU 116 7.501 11.457 -4.474 858 HA LEU 116 HA LEU 116 5.233 10.073 -5.842 859 1HB LEU 116 1HB LEU 116 3.693 11.692 -4.646 860 2HB LEU 116 2HB LEU 116 4.401 10.435 -3.635 861 HG LEU 116 HG LEU 116 6.248 12.169 -3.122 862 1HD1 LEU 116 1HD1 LEU 116 4.497 13.705 -4.854 863 2HD1 LEU 116 2HD1 LEU 116 4.653 14.472 -3.276 864 3HD1 LEU 116 3HD1 LEU 116 6.088 14.123 -4.232 865 1HD2 LEU 116 1HD2 LEU 116 3.432 12.075 -2.145 866 2HD2 LEU 116 2HD2 LEU 116 4.929 11.716 -1.284 867 3HD2 LEU 116 3HD2 LEU 116 4.450 13.391 -1.562 868 H VAL 117 H VAL 117 4.182 11.277 -7.418 869 HA VAL 117 HA VAL 117 5.796 13.296 -8.726 870 HB VAL 117 HB VAL 117 4.327 11.726 -9.985 871 1HG1 VAL 117 1HG1 VAL 117 2.436 12.398 -8.074 872 2HG1 VAL 117 2HG1 VAL 117 1.863 13.167 -9.552 873 3HG1 VAL 117 3HG1 VAL 117 2.169 11.434 -9.526 874 1HG2 VAL 117 1HG2 VAL 117 4.848 14.327 -10.566 875 2HG2 VAL 117 2HG2 VAL 117 3.958 13.259 -11.651 876 3HG2 VAL 117 3HG2 VAL 117 3.085 14.352 -10.578 877 H ARG 118 H ARG 118 5.530 15.520 -8.710 878 HA ARG 118 HA ARG 118 4.043 16.695 -6.516 879 1HB ARG 118 1HB ARG 118 5.582 17.822 -8.861 880 2HB ARG 118 2HB ARG 118 4.686 18.870 -7.763 881 1HG ARG 118 1HG ARG 118 6.255 18.683 -6.148 882 2HG ARG 118 2HG ARG 118 6.318 16.928 -6.310 883 1HD ARG 118 1HD ARG 118 7.858 17.083 -8.161 884 2HD ARG 118 2HD ARG 118 7.665 18.834 -8.242 885 HE ARG 118 HE ARG 118 8.575 18.423 -5.672 886 1HH1 ARG 118 1HH1 ARG 118 9.701 17.439 -8.834 887 2HH1 ARG 118 2HH1 ARG 118 11.359 17.412 -8.346 888 1HH2 ARG 118 1HH2 ARG 118 10.732 18.378 -5.085 889 2HH2 ARG 118 2HH2 ARG 118 11.940 17.940 -6.247 890 H ALA 119 H ALA 119 3.490 16.205 -9.957 891 HA ALA 119 HA ALA 119 1.273 17.970 -10.273 892 1HB ALA 119 1HB ALA 119 2.674 16.602 -12.033 893 2HB ALA 119 2HB ALA 119 1.430 15.379 -11.773 894 3HB ALA 119 3HB ALA 119 0.983 16.981 -12.359 895 H ALA 120 H ALA 120 1.527 14.903 -8.665 896 HA ALA 120 HA ALA 120 -1.454 14.714 -8.554 897 1HB ALA 120 1HB ALA 120 -0.023 12.752 -9.480 898 2HB ALA 120 2HB ALA 120 0.435 12.487 -7.798 899 3HB ALA 120 3HB ALA 120 -1.256 12.376 -8.281 900 H ALA 121 H ALA 121 1.501 14.212 -6.584 901 HA ALA 121 HA ALA 121 0.318 13.879 -4.068 902 1HB ALA 121 1HB ALA 121 2.897 15.068 -4.994 903 2HB ALA 121 2HB ALA 121 2.445 15.261 -3.302 904 3HB ALA 121 3HB ALA 121 2.614 13.647 -3.990 905 H GLU 122 H GLU 122 0.592 16.845 -5.952 906 HA GLU 122 HA GLU 122 -0.343 18.399 -3.602 907 1HB GLU 122 1HB GLU 122 0.116 20.392 -4.873 908 2HB GLU 122 2HB GLU 122 1.478 19.302 -5.110 909 1HG GLU 122 1HG GLU 122 1.140 19.758 -7.320 910 2HG GLU 122 2HG GLU 122 -0.132 18.544 -7.179 911 H LYS 123 H LYS 123 -1.996 16.395 -5.252 912 HA LYS 123 HA LYS 123 -4.250 18.253 -5.826 913 1HB LYS 123 1HB LYS 123 -3.755 15.525 -7.033 914 2HB LYS 123 2HB LYS 123 -5.073 16.619 -7.445 915 1HG LYS 123 1HG LYS 123 -3.092 18.305 -7.900 916 2HG LYS 123 2HG LYS 123 -2.160 16.822 -8.086 917 1HD LYS 123 1HD LYS 123 -3.024 17.463 -10.266 918 2HD LYS 123 2HD LYS 123 -3.875 16.015 -9.728 919 1HE LYS 123 1HE LYS 123 -5.863 17.119 -9.459 920 2HE LYS 123 2HE LYS 123 -5.083 18.609 -8.930 921 1HZ LYS 123 1HZ LYS 123 -4.410 19.022 -11.216 922 2HZ LYS 123 2HZ LYS 123 -5.177 17.595 -11.720 923 3HZ LYS 123 3HZ LYS 123 -6.099 18.879 -11.098 924 H ARG 124 H ARG 124 -6.086 17.894 -4.658 925 HA ARG 124 HA ARG 124 -6.009 16.161 -2.389 926 1HB ARG 124 1HB ARG 124 -8.299 17.660 -3.673 927 2HB ARG 124 2HB ARG 124 -8.423 16.809 -2.133 928 1HG ARG 124 1HG ARG 124 -6.651 18.190 -1.179 929 2HG ARG 124 2HG ARG 124 -6.409 18.997 -2.729 930 1HD ARG 124 1HD ARG 124 -9.097 19.366 -2.359 931 2HD ARG 124 2HD ARG 124 -8.512 19.417 -0.695 932 HE ARG 124 HE ARG 124 -8.083 21.455 -2.693 933 1HH1 ARG 124 1HH1 ARG 124 -6.581 19.846 0.024 934 2HH1 ARG 124 2HH1 ARG 124 -5.576 21.201 0.399 935 1HH2 ARG 124 1HH2 ARG 124 -6.765 23.185 -2.172 936 2HH2 ARG 124 2HH2 ARG 124 -5.677 23.072 -0.828 937 H TRP 125 H TRP 125 -6.097 14.011 -2.530 938 HA TRP 125 HA TRP 125 -8.068 12.738 -4.408 939 1HB TRP 125 1HB TRP 125 -5.540 11.510 -3.247 940 2HB TRP 125 2HB TRP 125 -6.606 10.788 -4.447 941 HD1 TRP 125 HD1 TRP 125 -3.552 12.799 -4.133 942 HE1 TRP 125 HE1 TRP 125 -2.854 13.770 -6.418 943 HE3 TRP 125 HE3 TRP 125 -7.801 11.898 -6.813 944 HZ2 TRP 125 HZ2 TRP 125 -3.941 14.101 -9.037 945 HZ3 TRP 125 HZ3 TRP 125 -7.943 12.537 -9.200 946 HH2 TRP 125 HH2 TRP 125 -6.021 13.643 -10.316 947 H ASP 126 H ASP 126 -8.949 10.647 -3.483 948 HA ASP 126 HA ASP 126 -8.846 10.543 -0.516 949 1HB ASP 126 1HB ASP 126 -11.301 10.300 -0.370 950 2HB ASP 126 2HB ASP 126 -10.830 11.873 -1.003 951 H ARG 127 H ARG 127 -8.119 8.906 -3.112 952 HA ARG 127 HA ARG 127 -8.805 6.289 -1.913 953 1HB ARG 127 1HB ARG 127 -9.222 6.976 -4.844 954 2HB ARG 127 2HB ARG 127 -9.366 5.368 -4.146 955 1HG ARG 127 1HG ARG 127 -11.035 6.883 -2.532 956 2HG ARG 127 2HG ARG 127 -11.288 7.588 -4.127 957 1HD ARG 127 1HD ARG 127 -11.960 5.510 -5.065 958 2HD ARG 127 2HD ARG 127 -11.321 4.605 -3.702 959 HE ARG 127 HE ARG 127 -13.241 6.120 -2.500 960 1HH1 ARG 127 1HH1 ARG 127 -13.286 4.119 -5.375 961 2HH1 ARG 127 2HH1 ARG 127 -14.964 3.743 -5.201 962 1HH2 ARG 127 1HH2 ARG 127 -15.402 5.596 -2.318 963 2HH2 ARG 127 2HH2 ARG 127 -16.150 4.566 -3.493 964 H VAL 128 H VAL 128 -7.083 4.790 -2.287 965 HA VAL 128 HA VAL 128 -4.901 5.752 -4.058 966 HB VAL 128 HB VAL 128 -4.516 6.457 -1.657 967 1HG1 VAL 128 1HG1 VAL 128 -5.237 3.835 -1.081 968 2HG1 VAL 128 2HG1 VAL 128 -3.486 3.834 -0.873 969 3HG1 VAL 128 3HG1 VAL 128 -4.484 4.968 0.036 970 1HG2 VAL 128 1HG2 VAL 128 -2.670 4.848 -3.353 971 2HG2 VAL 128 2HG2 VAL 128 -2.568 6.541 -2.865 972 3HG2 VAL 128 3HG2 VAL 128 -2.128 5.267 -1.727 973 H LYS 129 H LYS 129 -3.801 4.156 -5.105 974 HA LYS 129 HA LYS 129 -4.783 1.372 -4.675 975 1HB LYS 129 1HB LYS 129 -5.131 2.372 -6.933 976 2HB LYS 129 2HB LYS 129 -3.386 2.566 -7.083 977 1HG LYS 129 1HG LYS 129 -3.548 -0.071 -6.383 978 2HG LYS 129 2HG LYS 129 -5.035 0.123 -7.313 979 1HD LYS 129 1HD LYS 129 -3.418 1.403 -8.987 980 2HD LYS 129 2HD LYS 129 -2.193 0.405 -8.203 981 1HE LYS 129 1HE LYS 129 -3.110 -1.580 -8.982 982 2HE LYS 129 2HE LYS 129 -4.732 -0.898 -9.115 983 1HZ LYS 129 1HZ LYS 129 -3.911 0.468 -10.975 984 2HZ LYS 129 2HZ LYS 129 -2.416 -0.334 -10.886 985 3HZ LYS 129 3HZ LYS 129 -3.823 -1.195 -11.294 986 H ILE 130 H ILE 130 -3.378 -0.028 -3.752 987 HA ILE 130 HA ILE 130 -0.457 0.616 -3.884 988 HB ILE 130 HB ILE 130 -1.995 -0.794 -1.671 989 1HG1 ILE 130 1HG1 ILE 130 -2.466 1.630 -1.774 990 2HG1 ILE 130 2HG1 ILE 130 -1.499 1.239 -0.354 991 1HG2 ILE 130 1HG2 ILE 130 0.916 0.063 -1.852 992 2HG2 ILE 130 2HG2 ILE 130 0.142 -0.641 -0.432 993 3HG2 ILE 130 3HG2 ILE 130 0.327 -1.599 -1.901 994 1HD1 ILE 130 1HD1 ILE 130 0.414 1.741 -2.314 995 2HD1 ILE 130 2HD1 ILE 130 -0.835 2.942 -2.641 996 3HD1 ILE 130 3HD1 ILE 130 -0.082 2.864 -1.049 997 H VAL 131 H VAL 131 0.477 -0.834 -5.300 998 HA VAL 131 HA VAL 131 -0.518 -3.631 -5.224 999 HB VAL 131 HB VAL 131 0.944 -2.250 -7.481 1000 1HG1 VAL 131 1HG1 VAL 131 -0.387 -4.933 -7.117 1001 2HG1 VAL 131 2HG1 VAL 131 -0.006 -4.269 -8.706 1002 3HG1 VAL 131 3HG1 VAL 131 1.289 -4.607 -7.558 1003 1HG2 VAL 131 1HG2 VAL 131 -1.952 -2.528 -6.778 1004 2HG2 VAL 131 2HG2 VAL 131 -1.121 -1.200 -7.589 1005 3HG2 VAL 131 3HG2 VAL 131 -1.497 -2.678 -8.475 1006 H CYS 132 H CYS 132 0.822 -4.971 -4.228 1007 HA CYS 132 HA CYS 132 3.680 -4.240 -3.929 1008 1HB CYS 132 1HB CYS 132 1.720 -5.653 -2.321 1009 2HB CYS 132 2HB CYS 132 3.127 -6.681 -2.584 1010 HG CYS 132 HG CYS 132 3.622 -3.778 -1.574 1011 H SER 133 H SER 133 4.522 -4.761 -5.969 1012 HA SER 133 HA SER 133 4.142 -7.532 -6.998 1013 1HB SER 133 1HB SER 133 4.766 -4.927 -8.179 1014 2HB SER 133 2HB SER 133 6.020 -6.083 -8.600 1015 HG SER 133 HG SER 133 3.212 -6.372 -8.963 1016 H GLN 134 H GLN 134 5.549 -9.031 -6.648 1017 HA GLN 134 HA GLN 134 8.341 -8.750 -6.290 1018 1HB GLN 134 1HB GLN 134 8.243 -9.049 -3.733 1019 2HB GLN 134 2HB GLN 134 7.914 -7.439 -4.314 1020 1HG GLN 134 1HG GLN 134 5.380 -8.595 -4.375 1021 2HG GLN 134 2HG GLN 134 6.060 -9.302 -2.951 1022 1HE2 GLN 134 2HE2 GLN 134 6.305 -5.963 -4.338 1023 2HE2 GLN 134 1HE2 GLN 134 5.798 -5.199 -2.923 1024 HA PRO 135 HA PRO 135 6.187 -12.954 -6.534 1025 1HB PRO 135 1HB PRO 135 7.563 -13.800 -8.752 1026 2HB PRO 135 2HB PRO 135 6.031 -12.914 -8.834 1027 1HG PRO 135 1HG PRO 135 8.814 -11.920 -9.254 1028 2HG PRO 135 2HG PRO 135 7.321 -11.485 -10.102 1029 1HD PRO 135 1HD PRO 135 8.453 -9.905 -8.169 1030 2HD PRO 135 2HD PRO 135 6.706 -9.931 -8.501 1031 H TYR 136 H TYR 136 7.338 -13.472 -4.605 1032 HA TYR 136 HA TYR 136 10.104 -14.455 -5.079 1033 1HB TYR 136 1HB TYR 136 10.238 -14.011 -2.472 1034 2HB TYR 136 2HB TYR 136 10.555 -12.744 -3.644 1035 HD1 TYR 136 HD1 TYR 136 7.384 -14.229 -2.179 1036 HD2 TYR 136 HD2 TYR 136 9.668 -10.671 -2.983 1037 HE1 TYR 136 HE1 TYR 136 5.678 -12.811 -1.055 1038 HE2 TYR 136 HE2 TYR 136 7.957 -9.338 -1.874 1039 HH TYR 136 HH TYR 136 5.644 -10.574 0.139 1040 H SER 137 H SER 137 6.995 -15.512 -4.176 1041 HA SER 137 HA SER 137 8.262 -18.009 -3.103 1042 1HB SER 137 1HB SER 137 7.148 -16.765 -1.273 1043 2HB SER 137 2HB SER 137 5.633 -16.844 -2.168 1044 HG SER 137 HG SER 137 6.987 -18.792 -0.756 1045 H LYS 138 H LYS 138 6.278 -19.746 -3.014 1046 HA LYS 138 HA LYS 138 4.911 -19.645 -5.664 1047 1HB LYS 138 1HB LYS 138 7.109 -21.095 -5.445 1048 2HB LYS 138 2HB LYS 138 6.020 -22.241 -4.665 1049 1HG LYS 138 1HG LYS 138 4.478 -21.782 -6.732 1050 2HG LYS 138 2HG LYS 138 5.966 -21.209 -7.487 1051 1HD LYS 138 1HD LYS 138 7.020 -23.420 -6.734 1052 2HD LYS 138 2HD LYS 138 5.378 -23.965 -6.396 1053 1HE LYS 138 1HE LYS 138 6.005 -22.744 -9.067 1054 2HE LYS 138 2HE LYS 138 6.435 -24.427 -8.760 1055 1HZ LYS 138 1HZ LYS 138 4.079 -24.720 -7.994 1056 2HZ LYS 138 2HZ LYS 138 3.749 -23.184 -8.639 1057 3HZ LYS 138 3HZ LYS 138 4.274 -24.441 -9.655 1058 H ASP 139 H ASP 139 4.940 -20.993 -2.353 1059 HA ASP 139 HA ASP 139 2.075 -21.694 -2.765 1060 1HB ASP 139 1HB ASP 139 2.523 -23.458 -0.976 1061 2HB ASP 139 2HB ASP 139 3.184 -23.775 -2.575 1062 H SER 140 H SER 140 4.135 -19.696 -0.997 1063 HA SER 140 HA SER 140 2.257 -19.630 1.310 1064 1HB SER 140 1HB SER 140 4.300 -18.158 2.177 1065 2HB SER 140 2HB SER 140 4.300 -19.910 2.300 1066 HG SER 140 HG SER 140 6.099 -18.517 1.154 1067 HA PRO 141 HA PRO 141 1.140 -15.454 0.020 1068 1HB PRO 141 1HB PRO 141 -0.342 -14.820 2.217 1069 2HB PRO 141 2HB PRO 141 -0.892 -15.969 0.989 1070 1HG PRO 141 1HG PRO 141 -0.040 -16.470 3.748 1071 2HG PRO 141 2HG PRO 141 -0.973 -17.500 2.656 1072 1HD PRO 141 1HD PRO 141 1.846 -17.680 3.303 1073 2HD PRO 141 2HD PRO 141 0.874 -18.751 2.276 1074 H PHE 142 H PHE 142 1.192 -13.123 1.035 1075 HA PHE 142 HA PHE 142 2.641 -12.522 3.409 1076 1HB PHE 142 1HB PHE 142 4.297 -13.349 1.215 1077 2HB PHE 142 2HB PHE 142 4.606 -11.651 1.521 1078 HD1 PHE 142 HD1 PHE 142 4.898 -10.996 4.069 1079 HD2 PHE 142 HD2 PHE 142 5.373 -14.967 2.503 1080 HE1 PHE 142 HE1 PHE 142 6.249 -11.617 6.053 1081 HE2 PHE 142 HE2 PHE 142 6.725 -15.588 4.486 1082 HZ PHE 142 HZ PHE 142 7.163 -13.913 6.262 1083 H GLY 143 H GLY 143 3.984 -10.133 2.529 1084 1HA GLY 143 1HA GLY 143 2.943 -8.373 0.780 1085 2HA GLY 143 2HA GLY 143 1.608 -8.483 1.924 1086 H LEU 144 H LEU 144 1.655 -7.074 3.612 1087 HA LEU 144 HA LEU 144 4.290 -6.168 4.610 1088 1HB LEU 144 1HB LEU 144 3.187 -3.753 4.727 1089 2HB LEU 144 2HB LEU 144 4.119 -4.285 3.341 1090 HG LEU 144 HG LEU 144 1.995 -3.106 2.789 1091 1HD1 LEU 144 1HD1 LEU 144 3.175 -5.110 1.469 1092 2HD1 LEU 144 2HD1 LEU 144 1.610 -5.869 1.755 1093 3HD1 LEU 144 3HD1 LEU 144 1.701 -4.338 0.885 1094 1HD2 LEU 144 1HD2 LEU 144 0.812 -5.466 4.223 1095 2HD2 LEU 144 2HD2 LEU 144 0.449 -3.758 4.422 1096 3HD2 LEU 144 3HD2 LEU 144 -0.091 -4.615 2.980 1097 H SER 145 H SER 145 4.183 -4.951 6.614 1098 HA SER 145 HA SER 145 2.300 -6.208 8.457 1099 1HB SER 145 1HB SER 145 4.715 -4.448 8.742 1100 2HB SER 145 2HB SER 145 3.654 -4.732 10.119 1101 HG SER 145 HG SER 145 5.055 -6.639 8.552 1102 H PHE 146 H PHE 146 2.466 -3.173 6.756 1103 HA PHE 146 HA PHE 146 -0.070 -2.316 7.792 1104 1HB PHE 146 1HB PHE 146 0.605 -0.431 9.189 1105 2HB PHE 146 2HB PHE 146 1.340 -1.896 9.832 1106 HD1 PHE 146 HD1 PHE 146 1.959 1.184 7.873 1107 HD2 PHE 146 HD2 PHE 146 3.747 -2.215 9.796 1108 HE1 PHE 146 HE1 PHE 146 4.197 2.203 7.579 1109 HE2 PHE 146 HE2 PHE 146 5.994 -1.202 9.483 1110 HZ PHE 146 HZ PHE 146 6.221 0.993 8.381 1111 H VAL 147 H VAL 147 -0.588 -0.051 7.062 1112 HA VAL 147 HA VAL 147 1.196 1.029 4.977 1113 HB VAL 147 HB VAL 147 -0.554 1.098 3.276 1114 1HG1 VAL 147 1HG1 VAL 147 0.902 -0.902 3.406 1115 2HG1 VAL 147 2HG1 VAL 147 -0.282 -1.682 4.454 1116 3HG1 VAL 147 3HG1 VAL 147 -0.699 -1.301 2.784 1117 1HG2 VAL 147 1HG2 VAL 147 -2.220 0.173 5.556 1118 2HG2 VAL 147 2HG2 VAL 147 -2.661 1.181 4.177 1119 3HG2 VAL 147 3HG2 VAL 147 -2.577 -0.571 3.998 1120 H ARG 148 H ARG 148 1.045 3.257 4.892 1121 HA ARG 148 HA ARG 148 -1.259 4.610 6.166 1122 1HB ARG 148 1HB ARG 148 1.571 5.192 7.069 1123 2HB ARG 148 2HB ARG 148 0.078 5.805 7.766 1124 1HG ARG 148 1HG ARG 148 -0.539 3.485 8.419 1125 2HG ARG 148 2HG ARG 148 1.006 2.923 7.786 1126 1HD ARG 148 1HD ARG 148 1.938 3.383 9.781 1127 2HD ARG 148 2HD ARG 148 1.607 5.092 9.506 1128 HE ARG 148 HE ARG 148 -0.803 4.085 10.436 1129 1HH1 ARG 148 1HH1 ARG 148 2.494 4.085 11.603 1130 2HH1 ARG 148 2HH1 ARG 148 2.012 4.059 13.263 1131 1HH2 ARG 148 1HH2 ARG 148 -1.381 4.052 12.597 1132 2HH2 ARG 148 2HH2 ARG 148 -0.157 4.040 13.823 1133 H PHE 149 H PHE 149 -1.136 6.971 5.847 1134 HA PHE 149 HA PHE 149 0.708 7.876 3.701 1135 1HB PHE 149 1HB PHE 149 -2.312 8.212 3.633 1136 2HB PHE 149 2HB PHE 149 -1.179 8.920 2.484 1137 HD1 PHE 149 HD1 PHE 149 0.603 7.077 1.548 1138 HD2 PHE 149 HD2 PHE 149 -3.381 6.270 2.932 1139 HE1 PHE 149 HE1 PHE 149 0.562 4.988 0.213 1140 HE2 PHE 149 HE2 PHE 149 -3.422 4.182 1.594 1141 HZ PHE 149 HZ PHE 149 -1.451 3.540 0.237 1142 H HIS 150 H HIS 150 0.967 10.224 3.742 1143 HA HIS 150 HA HIS 150 -0.478 11.705 5.843 1144 1HB HIS 150 1HB HIS 150 2.125 12.488 6.454 1145 2HB HIS 150 2HB HIS 150 1.096 11.462 7.440 1146 HD1 HIS 150 HD1 HIS 150 4.323 11.499 5.881 1147 HD2 HIS 150 HD2 HIS 150 1.485 8.543 6.630 1148 HE1 HIS 150 HE1 HIS 150 5.534 9.281 5.700 1149 H SER 151 H SER 151 -0.604 13.866 5.417 1150 HA SER 151 HA SER 151 0.536 14.762 2.833 1151 1HB SER 151 1HB SER 151 -1.213 16.310 2.757 1152 2HB SER 151 2HB SER 151 -1.956 15.007 3.671 1153 HG SER 151 HG SER 151 -1.548 16.124 5.555 Start of MODEL 13 1 H MET 1 H MET 1 -6.412 16.214 9.427 2 HA MET 1 HA MET 1 -5.881 17.596 7.807 3 1HB MET 1 1HB MET 1 -5.752 19.035 10.186 4 2HB MET 1 2HB MET 1 -4.266 19.491 9.354 5 1HG MET 1 1HG MET 1 -6.963 19.505 7.985 6 2HG MET 1 2HG MET 1 -6.317 20.916 8.821 7 1HE MET 1 1HE MET 1 -6.972 19.250 5.983 8 2HE MET 1 2HE MET 1 -5.919 19.826 4.684 9 3HE MET 1 3HE MET 1 -5.476 18.397 5.612 10 HA PRO 2 HA PRO 2 -1.089 17.642 7.684 11 1HB PRO 2 1HB PRO 2 0.310 16.941 9.919 12 2HB PRO 2 2HB PRO 2 -0.244 18.591 9.600 13 1HG PRO 2 1HG PRO 2 -1.236 16.629 11.560 14 2HG PRO 2 2HG PRO 2 -1.361 18.393 11.567 15 1HD PRO 2 1HD PRO 2 -3.396 16.524 10.850 16 2HD PRO 2 2HD PRO 2 -3.464 18.293 10.724 17 H GLU 3 H GLU 3 -2.586 15.065 9.549 18 HA GLU 3 HA GLU 3 -0.764 13.071 8.267 19 1HB GLU 3 1HB GLU 3 -2.593 12.805 10.676 20 2HB GLU 3 2HB GLU 3 -1.595 11.510 10.016 21 1HG GLU 3 1HG GLU 3 0.387 13.136 10.315 22 2HG GLU 3 2HG GLU 3 -0.701 14.069 11.343 23 H ILE 4 H ILE 4 -1.977 10.923 7.820 24 HA ILE 4 HA ILE 4 -4.761 11.376 6.887 25 HB ILE 4 HB ILE 4 -2.412 10.541 5.159 26 1HG1 ILE 4 1HG1 ILE 4 -4.526 12.676 4.788 27 2HG1 ILE 4 2HG1 ILE 4 -2.932 12.974 5.476 28 1HG2 ILE 4 1HG2 ILE 4 -4.321 9.020 4.723 29 2HG2 ILE 4 2HG2 ILE 4 -5.361 10.422 4.460 30 3HG2 ILE 4 3HG2 ILE 4 -4.020 10.098 3.359 31 1HD1 ILE 4 1HD1 ILE 4 -3.362 11.740 2.747 32 2HD1 ILE 4 2HD1 ILE 4 -3.107 13.465 3.008 33 3HD1 ILE 4 3HD1 ILE 4 -1.842 12.313 3.434 34 H ARG 5 H ARG 5 -5.989 9.640 7.433 35 HA ARG 5 HA ARG 5 -4.574 7.110 8.161 36 1HB ARG 5 1HB ARG 5 -6.427 8.679 9.599 37 2HB ARG 5 2HB ARG 5 -7.325 7.251 9.089 38 1HG ARG 5 1HG ARG 5 -6.394 6.348 10.975 39 2HG ARG 5 2HG ARG 5 -5.026 6.074 9.897 40 1HD ARG 5 1HD ARG 5 -3.756 7.374 11.223 41 2HD ARG 5 2HD ARG 5 -4.796 8.747 10.845 42 HE ARG 5 HE ARG 5 -6.004 7.103 12.879 43 1HH1 ARG 5 1HH1 ARG 5 -3.476 9.462 12.348 44 2HH1 ARG 5 2HH1 ARG 5 -3.518 10.023 13.983 45 1HH2 ARG 5 1HH2 ARG 5 -6.022 7.860 14.986 46 2HH2 ARG 5 2HH2 ARG 5 -4.942 9.127 15.462 47 H LEU 6 H LEU 6 -6.102 5.129 7.884 48 HA LEU 6 HA LEU 6 -7.199 5.239 5.138 49 1HB LEU 6 1HB LEU 6 -5.432 3.502 6.212 50 2HB LEU 6 2HB LEU 6 -6.927 2.668 6.626 51 HG LEU 6 HG LEU 6 -6.092 1.899 4.445 52 1HD1 LEU 6 1HD1 LEU 6 -8.639 2.548 5.044 53 2HD1 LEU 6 2HD1 LEU 6 -8.398 3.580 3.636 54 3HD1 LEU 6 3HD1 LEU 6 -8.171 1.839 3.500 55 1HD2 LEU 6 1HD2 LEU 6 -5.309 4.554 4.115 56 2HD2 LEU 6 2HD2 LEU 6 -5.269 3.307 2.871 57 3HD2 LEU 6 3HD2 LEU 6 -6.658 4.384 2.992 58 H ARG 7 H ARG 7 -9.363 4.913 4.769 59 HA ARG 7 HA ARG 7 -11.144 4.720 7.114 60 1HB ARG 7 1HB ARG 7 -11.595 6.354 5.271 61 2HB ARG 7 2HB ARG 7 -11.849 4.992 4.178 62 1HG ARG 7 1HG ARG 7 -14.029 5.562 4.907 63 2HG ARG 7 2HG ARG 7 -13.589 4.172 5.897 64 1HD ARG 7 1HD ARG 7 -13.581 5.392 7.810 65 2HD ARG 7 2HD ARG 7 -12.765 6.753 7.047 66 HE ARG 7 HE ARG 7 -14.864 7.747 6.742 67 1HH1 ARG 7 1HH1 ARG 7 -15.246 4.295 7.163 68 2HH1 ARG 7 2HH1 ARG 7 -16.973 4.385 7.156 69 1HH2 ARG 7 1HH2 ARG 7 -17.099 7.817 6.738 70 2HH2 ARG 7 2HH2 ARG 7 -18.014 6.356 6.915 71 H HIS 8 H HIS 8 -10.998 3.103 3.945 72 HA HIS 8 HA HIS 8 -11.188 0.462 5.167 73 1HB HIS 8 1HB HIS 8 -13.340 -0.124 4.042 74 2HB HIS 8 2HB HIS 8 -13.541 1.089 5.304 75 HD1 HIS 8 HD1 HIS 8 -14.981 2.983 4.584 76 HD2 HIS 8 HD2 HIS 8 -12.881 1.360 1.369 77 HE1 HIS 8 HE1 HIS 8 -15.682 4.294 2.533 78 H VAL 9 H VAL 9 -11.170 -1.244 3.427 79 HA VAL 9 HA VAL 9 -9.418 -0.390 1.252 80 HB VAL 9 HB VAL 9 -9.023 -2.529 2.410 81 1HG1 VAL 9 1HG1 VAL 9 -11.760 -2.810 2.370 82 2HG1 VAL 9 2HG1 VAL 9 -11.257 -3.952 1.126 83 3HG1 VAL 9 3HG1 VAL 9 -10.619 -4.095 2.763 84 1HG2 VAL 9 1HG2 VAL 9 -8.591 -2.132 -0.137 85 2HG2 VAL 9 2HG2 VAL 9 -8.476 -3.774 0.498 86 3HG2 VAL 9 3HG2 VAL 9 -9.924 -3.263 -0.369 87 H VAL 10 H VAL 10 -10.768 0.959 -0.048 88 HA VAL 10 HA VAL 10 -13.361 0.381 -0.976 89 HB VAL 10 HB VAL 10 -12.529 2.561 -1.456 90 1HG1 VAL 10 1HG1 VAL 10 -10.066 1.369 -1.808 91 2HG1 VAL 10 2HG1 VAL 10 -10.475 1.867 -3.442 92 3HG1 VAL 10 3HG1 VAL 10 -10.431 3.056 -2.143 93 1HG2 VAL 10 1HG2 VAL 10 -13.808 1.176 -3.354 94 2HG2 VAL 10 2HG2 VAL 10 -13.253 2.826 -3.640 95 3HG2 VAL 10 3HG2 VAL 10 -12.304 1.460 -4.229 96 H SER 11 H SER 11 -10.294 -0.386 -2.706 97 HA SER 11 HA SER 11 -11.827 -2.578 -4.032 98 1HB SER 11 1HB SER 11 -10.448 -0.386 -5.249 99 2HB SER 11 2HB SER 11 -9.581 -1.866 -5.648 100 HG SER 11 HG SER 11 -11.725 -1.008 -6.788 101 H CYS 12 H CYS 12 -10.398 -4.465 -4.642 102 HA CYS 12 HA CYS 12 -7.786 -4.590 -3.288 103 1HB CYS 12 1HB CYS 12 -8.446 -6.605 -1.965 104 2HB CYS 12 2HB CYS 12 -9.255 -5.132 -1.437 105 HG CYS 12 HG CYS 12 -10.617 -7.497 -2.915 106 H SER 13 H SER 13 -6.466 -6.203 -4.110 107 HA SER 13 HA SER 13 -7.646 -8.165 -5.995 108 1HB SER 13 1HB SER 13 -6.502 -5.871 -6.962 109 2HB SER 13 2HB SER 13 -5.121 -6.962 -6.936 110 HG SER 13 HG SER 13 -6.965 -6.862 -8.745 111 H SER 14 H SER 14 -6.783 -8.750 -3.454 112 HA SER 14 HA SER 14 -5.321 -10.994 -3.457 113 1HB SER 14 1HB SER 14 -3.432 -8.708 -3.767 114 2HB SER 14 2HB SER 14 -2.969 -10.026 -2.701 115 HG SER 14 HG SER 14 -3.185 -11.448 -4.397 116 H GLN 15 H GLN 15 -6.718 -11.092 -1.602 117 HA GLN 15 HA GLN 15 -5.370 -10.263 0.864 118 1HB GLN 15 1HB GLN 15 -7.895 -9.377 1.545 119 2HB GLN 15 2HB GLN 15 -6.519 -8.357 1.168 120 1HG GLN 15 1HG GLN 15 -8.122 -7.460 -0.233 121 2HG GLN 15 2HG GLN 15 -7.385 -8.624 -1.324 122 1HE2 GLN 15 2HE2 GLN 15 -8.504 -10.970 -0.995 123 2HE2 GLN 15 1HE2 GLN 15 -10.203 -10.930 -0.981 124 H ASP 16 H ASP 16 -5.874 -11.614 2.574 125 HA ASP 16 HA ASP 16 -7.405 -14.025 1.919 126 1HB ASP 16 1HB ASP 16 -5.229 -13.566 3.494 127 2HB ASP 16 2HB ASP 16 -6.506 -13.603 4.704 128 H SER 17 H SER 17 -8.513 -14.635 4.444 129 HA SER 17 HA SER 17 -10.896 -12.892 4.357 130 1HB SER 17 1HB SER 17 -10.681 -15.593 4.508 131 2HB SER 17 2HB SER 17 -10.819 -15.198 6.219 132 HG SER 17 HG SER 17 -12.811 -15.490 4.796 133 H THR 18 H THR 18 -9.157 -14.480 7.061 134 HA THR 18 HA THR 18 -10.009 -12.511 8.978 135 HB THR 18 HB THR 18 -7.767 -13.624 10.109 136 HG1 THR 18 HG1 THR 18 -7.508 -15.639 9.331 137 1HG2 THR 18 1HG2 THR 18 -10.601 -14.643 9.895 138 2HG2 THR 18 2HG2 THR 18 -9.408 -15.391 10.956 139 3HG2 THR 18 3HG2 THR 18 -9.876 -13.710 11.204 140 H HIS 19 H HIS 19 -6.696 -13.172 7.794 141 HA HIS 19 HA HIS 19 -5.875 -10.444 8.527 142 1HB HIS 19 1HB HIS 19 -4.393 -12.756 7.237 143 2HB HIS 19 2HB HIS 19 -3.649 -11.202 7.618 144 HD1 HIS 19 HD1 HIS 19 -3.285 -10.627 10.123 145 HD2 HIS 19 HD2 HIS 19 -4.977 -14.385 9.500 146 HE1 HIS 19 HE1 HIS 19 -3.153 -11.849 12.338 147 H CYS 20 H CYS 20 -7.783 -9.961 6.799 148 HA CYS 20 HA CYS 20 -6.884 -10.022 4.020 149 1HB CYS 20 1HB CYS 20 -8.961 -8.732 3.574 150 2HB CYS 20 2HB CYS 20 -9.279 -10.188 4.512 151 HG CYS 20 HG CYS 20 -10.469 -8.016 5.572 152 H ALA 21 H ALA 21 -7.210 -7.741 2.860 153 HA ALA 21 HA ALA 21 -5.014 -6.100 3.694 154 1HB ALA 21 1HB ALA 21 -7.050 -6.103 1.548 155 2HB ALA 21 2HB ALA 21 -6.430 -4.508 1.978 156 3HB ALA 21 3HB ALA 21 -5.319 -5.776 1.458 157 H GLU 22 H GLU 22 -8.438 -6.072 4.427 158 HA GLU 22 HA GLU 22 -8.663 -3.355 5.307 159 1HB GLU 22 1HB GLU 22 -10.427 -5.407 5.020 160 2HB GLU 22 2HB GLU 22 -10.229 -5.405 6.773 161 1HG GLU 22 1HG GLU 22 -10.587 -2.853 6.628 162 2HG GLU 22 2HG GLU 22 -11.187 -3.158 4.997 163 H ASN 23 H ASN 23 -6.953 -6.042 6.660 164 HA ASN 23 HA ASN 23 -7.114 -5.331 9.443 165 1HB ASN 23 1HB ASN 23 -5.180 -6.907 7.774 166 2HB ASN 23 2HB ASN 23 -4.800 -6.540 9.455 167 1HD2 ASN 23 2HD2 ASN 23 -7.746 -7.592 7.661 168 2HD2 ASN 23 1HD2 ASN 23 -8.158 -8.820 8.757 169 H LEU 24 H LEU 24 -5.563 -3.883 6.757 170 HA LEU 24 HA LEU 24 -3.347 -2.609 8.021 171 1HB LEU 24 1HB LEU 24 -4.995 -1.638 5.664 172 2HB LEU 24 2HB LEU 24 -3.344 -1.163 6.059 173 HG LEU 24 HG LEU 24 -3.999 -4.073 5.650 174 1HD1 LEU 24 1HD1 LEU 24 -4.785 -2.486 3.709 175 2HD1 LEU 24 2HD1 LEU 24 -3.059 -2.378 3.364 176 3HD1 LEU 24 3HD1 LEU 24 -3.869 -3.945 3.336 177 1HD2 LEU 24 1HD2 LEU 24 -1.729 -2.755 6.412 178 2HD2 LEU 24 2HD2 LEU 24 -1.741 -4.323 5.609 179 3HD2 LEU 24 3HD2 LEU 24 -1.495 -2.853 4.666 180 H LEU 25 H LEU 25 -6.792 -2.021 8.000 181 HA LEU 25 HA LEU 25 -6.917 0.713 8.671 182 1HB LEU 25 1HB LEU 25 -8.599 -1.708 9.169 183 2HB LEU 25 2HB LEU 25 -8.947 -0.274 10.115 184 HG LEU 25 HG LEU 25 -10.303 -0.371 8.043 185 1HD1 LEU 25 1HD1 LEU 25 -8.504 1.818 8.789 186 2HD1 LEU 25 2HD1 LEU 25 -9.039 1.909 7.112 187 3HD1 LEU 25 3HD1 LEU 25 -10.223 1.850 8.416 188 1HD2 LEU 25 1HD2 LEU 25 -8.559 -1.573 6.689 189 2HD2 LEU 25 2HD2 LEU 25 -9.255 -0.179 5.862 190 3HD2 LEU 25 3HD2 LEU 25 -7.656 -0.062 6.595 191 H LYS 26 H LYS 26 -5.813 -2.058 10.497 192 HA LYS 26 HA LYS 26 -5.656 -0.357 12.957 193 1HB LYS 26 1HB LYS 26 -5.171 -3.340 12.945 194 2HB LYS 26 2HB LYS 26 -5.668 -2.306 14.279 195 1HG LYS 26 1HG LYS 26 -7.402 -2.861 11.857 196 2HG LYS 26 2HG LYS 26 -7.524 -3.745 13.380 197 1HD LYS 26 1HD LYS 26 -8.070 -1.705 14.581 198 2HD LYS 26 2HD LYS 26 -7.800 -0.736 13.133 199 1HE LYS 26 1HE LYS 26 -9.756 -1.460 12.115 200 2HE LYS 26 2HE LYS 26 -9.783 -2.978 13.012 201 1HZ LYS 26 1HZ LYS 26 -10.088 -0.418 14.432 202 2HZ LYS 26 2HZ LYS 26 -11.423 -1.113 13.644 203 3HZ LYS 26 3HZ LYS 26 -10.627 -1.962 14.881 204 H ALA 27 H ALA 27 -3.829 0.506 11.370 205 HA ALA 27 HA ALA 27 -1.416 -0.939 10.989 206 1HB ALA 27 1HB ALA 27 -2.236 1.492 10.220 207 2HB ALA 27 2HB ALA 27 -1.250 1.977 11.600 208 3HB ALA 27 3HB ALA 27 -0.527 1.062 10.276 209 H ASP 28 H ASP 28 -2.700 0.656 13.835 210 HA ASP 28 HA ASP 28 -0.138 0.127 15.274 211 1HB ASP 28 1HB ASP 28 -1.476 2.452 15.209 212 2HB ASP 28 2HB ASP 28 -2.335 1.691 16.549 213 H THR 29 H THR 29 -1.142 -2.214 15.050 214 HA THR 29 HA THR 29 -2.324 -2.834 17.671 215 HB THR 29 HB THR 29 -4.141 -4.232 16.604 216 HG1 THR 29 HG1 THR 29 -3.405 -2.706 14.337 217 1HG2 THR 29 1HG2 THR 29 -4.373 -1.831 17.520 218 2HG2 THR 29 2HG2 THR 29 -4.408 -1.333 15.829 219 3HG2 THR 29 3HG2 THR 29 -5.648 -2.419 16.454 220 H TYR 30 H TYR 30 -2.488 -5.029 14.889 221 HA TYR 30 HA TYR 30 0.090 -6.218 15.183 222 1HB TYR 30 1HB TYR 30 -0.575 -8.284 16.422 223 2HB TYR 30 2HB TYR 30 -0.668 -6.833 17.422 224 HD1 TYR 30 HD1 TYR 30 -2.852 -5.822 17.986 225 HD2 TYR 30 HD2 TYR 30 -2.572 -9.479 15.747 226 HE1 TYR 30 HE1 TYR 30 -5.252 -6.272 18.418 227 HE2 TYR 30 HE2 TYR 30 -4.973 -9.927 16.180 228 HH TYR 30 HH TYR 30 -6.664 -9.151 18.133 229 H ARG 31 H ARG 31 -1.898 -5.583 13.109 230 HA ARG 31 HA ARG 31 -2.169 -8.318 11.928 231 1HB ARG 31 1HB ARG 31 -4.119 -6.051 11.444 232 2HB ARG 31 2HB ARG 31 -4.287 -7.736 10.960 233 1HG ARG 31 1HG ARG 31 -3.867 -7.630 13.808 234 2HG ARG 31 2HG ARG 31 -5.169 -6.523 13.382 235 1HD ARG 31 1HD ARG 31 -5.251 -9.171 12.049 236 2HD ARG 31 2HD ARG 31 -5.542 -9.180 13.787 237 HE ARG 31 HE ARG 31 -7.096 -7.104 12.563 238 1HH1 ARG 31 1HH1 ARG 31 -6.928 -10.584 12.883 239 2HH1 ARG 31 2HH1 ARG 31 -8.630 -10.787 12.665 240 1HH2 ARG 31 1HH2 ARG 31 -9.291 -7.413 12.279 241 2HH2 ARG 31 2HH2 ARG 31 -9.958 -9.010 12.327 242 H LYS 32 H LYS 32 -1.734 -8.427 9.672 243 HA LYS 32 HA LYS 32 -0.707 -5.910 8.423 244 1HB LYS 32 1HB LYS 32 0.586 -8.642 8.202 245 2HB LYS 32 2HB LYS 32 1.199 -7.129 7.549 246 1HG LYS 32 1HG LYS 32 1.744 -6.283 9.680 247 2HG LYS 32 2HG LYS 32 0.679 -7.420 10.503 248 1HD LYS 32 1HD LYS 32 2.203 -9.263 9.553 249 2HD LYS 32 2HD LYS 32 3.345 -7.965 9.212 250 1HE LYS 32 1HE LYS 32 4.047 -8.488 11.341 251 2HE LYS 32 2HE LYS 32 2.783 -7.329 11.752 252 1HZ LYS 32 1HZ LYS 32 1.275 -9.409 11.689 253 2HZ LYS 32 2HZ LYS 32 2.727 -10.267 11.897 254 3HZ LYS 32 3HZ LYS 32 2.244 -9.126 13.056 255 H TRP 33 H TRP 33 -0.280 -6.421 5.935 256 HA TRP 33 HA TRP 33 -2.801 -7.572 4.893 257 1HB TRP 33 1HB TRP 33 -1.924 -5.406 3.947 258 2HB TRP 33 2HB TRP 33 -0.513 -6.274 3.383 259 HD1 TRP 33 HD1 TRP 33 -3.995 -7.825 3.160 260 HE1 TRP 33 HE1 TRP 33 -4.627 -8.083 0.656 261 HE3 TRP 33 HE3 TRP 33 -0.102 -5.359 1.052 262 HZ2 TRP 33 HZ2 TRP 33 -3.575 -7.298 -1.908 263 HZ3 TRP 33 HZ3 TRP 33 0.085 -5.135 -1.414 264 HH2 TRP 33 HH2 TRP 33 -1.651 -6.094 -2.883 265 H ARG 34 H ARG 34 -2.881 -9.458 3.711 266 HA ARG 34 HA ARG 34 -0.342 -10.774 2.953 267 1HB ARG 34 1HB ARG 34 -2.473 -12.085 4.680 268 2HB ARG 34 2HB ARG 34 -1.084 -12.917 3.980 269 1HG ARG 34 1HG ARG 34 0.449 -11.473 5.237 270 2HG ARG 34 2HG ARG 34 -0.916 -10.572 5.898 271 1HD ARG 34 1HD ARG 34 -0.669 -12.049 7.630 272 2HD ARG 34 2HD ARG 34 -1.660 -13.073 6.592 273 HE ARG 34 HE ARG 34 0.953 -13.579 5.778 274 1HH1 ARG 34 1HH1 ARG 34 -0.805 -13.742 8.798 275 2HH1 ARG 34 2HH1 ARG 34 0.173 -15.028 9.414 276 1HH2 ARG 34 1HH2 ARG 34 2.193 -15.243 6.614 277 2HH2 ARG 34 2HH2 ARG 34 1.854 -15.870 8.193 278 H ALA 35 H ALA 35 -0.591 -11.678 0.947 279 HA ALA 35 HA ALA 35 -2.867 -11.278 -0.655 280 1HB ALA 35 1HB ALA 35 -0.473 -12.055 -1.315 281 2HB ALA 35 2HB ALA 35 -1.081 -13.687 -1.035 282 3HB ALA 35 3HB ALA 35 -1.829 -12.667 -2.264 283 H ALA 36 H ALA 36 -4.627 -12.573 -1.235 284 HA ALA 36 HA ALA 36 -5.835 -14.145 0.779 285 1HB ALA 36 1HB ALA 36 -6.634 -13.061 -1.604 286 2HB ALA 36 2HB ALA 36 -6.647 -14.781 -1.983 287 3HB ALA 36 3HB ALA 36 -7.609 -14.166 -0.638 288 H LYS 37 H LYS 37 -3.487 -15.047 -1.623 289 HA LYS 37 HA LYS 37 -3.603 -17.828 -0.614 290 1HB LYS 37 1HB LYS 37 -3.172 -18.620 -2.965 291 2HB LYS 37 2HB LYS 37 -4.777 -17.931 -2.732 292 1HG LYS 37 1HG LYS 37 -2.630 -16.039 -3.539 293 2HG LYS 37 2HG LYS 37 -3.159 -17.194 -4.763 294 1HD LYS 37 1HD LYS 37 -5.213 -15.687 -3.171 295 2HD LYS 37 2HD LYS 37 -4.412 -14.894 -4.528 296 1HE LYS 37 1HE LYS 37 -5.219 -16.492 -6.084 297 2HE LYS 37 2HE LYS 37 -5.662 -17.628 -4.810 298 1HZ LYS 37 1HZ LYS 37 -7.205 -15.739 -4.042 299 2HZ LYS 37 2HZ LYS 37 -7.007 -15.134 -5.617 300 3HZ LYS 37 3HZ LYS 37 -7.669 -16.677 -5.380 301 H ALA 38 H ALA 38 -1.553 -18.975 -1.532 302 HA ALA 38 HA ALA 38 0.753 -17.318 -0.768 303 1HB ALA 38 1HB ALA 38 0.462 -19.711 -0.019 304 2HB ALA 38 2HB ALA 38 0.722 -20.207 -1.690 305 3HB ALA 38 3HB ALA 38 2.008 -19.387 -0.804 306 H GLY 39 H GLY 39 2.774 -18.358 -2.342 307 1HA GLY 39 1HA GLY 39 3.799 -18.121 -4.450 308 2HA GLY 39 2HA GLY 39 2.191 -18.255 -5.170 309 H GLU 40 H GLU 40 3.425 -15.931 -2.826 310 HA GLU 40 HA GLU 40 2.165 -13.641 -3.717 311 1HB GLU 40 1HB GLU 40 4.734 -14.148 -2.281 312 2HB GLU 40 2HB GLU 40 4.389 -12.508 -2.829 313 1HG GLU 40 1HG GLU 40 3.445 -12.567 -0.684 314 2HG GLU 40 2HG GLU 40 2.067 -12.866 -1.740 315 H LYS 41 H LYS 41 2.132 -13.594 -5.977 316 HA LYS 41 HA LYS 41 4.708 -13.127 -7.396 317 1HB LYS 41 1HB LYS 41 2.811 -14.699 -8.254 318 2HB LYS 41 2HB LYS 41 1.988 -13.205 -8.701 319 1HG LYS 41 1HG LYS 41 3.933 -12.521 -10.047 320 2HG LYS 41 2HG LYS 41 4.776 -14.002 -9.590 321 1HD LYS 41 1HD LYS 41 2.095 -13.983 -11.000 322 2HD LYS 41 2HD LYS 41 3.636 -14.096 -11.849 323 1HE LYS 41 1HE LYS 41 4.141 -16.081 -10.270 324 2HE LYS 41 2HE LYS 41 2.412 -16.068 -9.924 325 1HZ LYS 41 1HZ LYS 41 2.212 -16.032 -12.489 326 2HZ LYS 41 2HZ LYS 41 3.796 -16.646 -12.453 327 3HZ LYS 41 3HZ LYS 41 2.535 -17.498 -11.698 328 H THR 42 H THR 42 1.440 -11.698 -7.297 329 HA THR 42 HA THR 42 2.554 -9.000 -6.991 330 HB THR 42 HB THR 42 1.320 -8.157 -9.026 331 HG1 THR 42 HG1 THR 42 -0.058 -9.796 -9.466 332 1HG2 THR 42 1HG2 THR 42 3.836 -8.885 -8.877 333 2HG2 THR 42 2HG2 THR 42 3.323 -10.204 -9.926 334 3HG2 THR 42 3HG2 THR 42 3.127 -8.533 -10.452 335 H ILE 43 H ILE 43 1.221 -8.160 -5.456 336 HA ILE 43 HA ILE 43 -1.657 -8.989 -5.510 337 HB ILE 43 HB ILE 43 -1.616 -8.381 -3.049 338 1HG1 ILE 43 1HG1 ILE 43 1.385 -8.490 -3.444 339 2HG1 ILE 43 2HG1 ILE 43 0.471 -7.002 -3.180 340 1HG2 ILE 43 1HG2 ILE 43 -1.110 -10.722 -4.269 341 2HG2 ILE 43 2HG2 ILE 43 0.411 -10.516 -3.408 342 3HG2 ILE 43 3HG2 ILE 43 -1.105 -10.540 -2.516 343 1HD1 ILE 43 1HD1 ILE 43 -0.497 -8.395 -1.117 344 2HD1 ILE 43 2HD1 ILE 43 1.045 -9.237 -1.274 345 3HD1 ILE 43 3HD1 ILE 43 1.017 -7.498 -0.983 346 H SER 44 H SER 44 -3.250 -7.369 -5.206 347 HA SER 44 HA SER 44 -2.186 -4.575 -5.172 348 1HB SER 44 1HB SER 44 -4.736 -4.946 -6.591 349 2HB SER 44 2HB SER 44 -3.352 -3.958 -7.014 350 HG SER 44 HG SER 44 -3.463 -5.606 -8.491 351 H VAL 45 H VAL 45 -3.491 -3.042 -4.071 352 HA VAL 45 HA VAL 45 -5.979 -3.929 -2.789 353 HB VAL 45 HB VAL 45 -4.268 -4.810 -1.236 354 1HG1 VAL 45 1HG1 VAL 45 -2.598 -2.937 -1.892 355 2HG1 VAL 45 2HG1 VAL 45 -3.424 -1.974 -0.669 356 3HG1 VAL 45 3HG1 VAL 45 -2.621 -3.476 -0.217 357 1HG2 VAL 45 1HG2 VAL 45 -5.776 -2.375 -0.241 358 2HG2 VAL 45 2HG2 VAL 45 -6.369 -4.035 -0.281 359 3HG2 VAL 45 3HG2 VAL 45 -5.051 -3.595 0.805 360 H VAL 46 H VAL 46 -7.196 -2.191 -3.411 361 HA VAL 46 HA VAL 46 -6.007 0.520 -3.381 362 HB VAL 46 HB VAL 46 -8.868 -0.144 -4.071 363 1HG1 VAL 46 1HG1 VAL 46 -8.178 2.225 -3.793 364 2HG1 VAL 46 2HG1 VAL 46 -6.955 1.993 -5.042 365 3HG1 VAL 46 3HG1 VAL 46 -8.666 1.863 -5.450 366 1HG2 VAL 46 1HG2 VAL 46 -6.403 -0.387 -5.819 367 2HG2 VAL 46 2HG2 VAL 46 -7.586 -1.644 -5.464 368 3HG2 VAL 46 3HG2 VAL 46 -8.037 -0.267 -6.469 369 H LEU 47 H LEU 47 -6.165 1.723 -1.574 370 HA LEU 47 HA LEU 47 -8.185 0.965 0.472 371 1HB LEU 47 1HB LEU 47 -5.916 2.928 0.819 372 2HB LEU 47 2HB LEU 47 -6.817 2.074 2.068 373 HG LEU 47 HG LEU 47 -5.835 -0.010 0.535 374 1HD1 LEU 47 1HD1 LEU 47 -4.450 1.927 -0.576 375 2HD1 LEU 47 2HD1 LEU 47 -3.484 1.827 0.896 376 3HD1 LEU 47 3HD1 LEU 47 -3.645 0.417 -0.150 377 1HD2 LEU 47 1HD2 LEU 47 -5.860 0.247 3.033 378 2HD2 LEU 47 2HD2 LEU 47 -4.341 -0.407 2.418 379 3HD2 LEU 47 3HD2 LEU 47 -4.441 1.287 2.901 380 H GLN 48 H GLN 48 -9.250 2.766 1.655 381 HA GLN 48 HA GLN 48 -9.875 5.051 -0.174 382 1HB GLN 48 1HB GLN 48 -11.793 3.549 0.102 383 2HB GLN 48 2HB GLN 48 -11.637 3.627 1.854 384 1HG GLN 48 1HG GLN 48 -13.407 5.137 1.252 385 2HG GLN 48 2HG GLN 48 -12.017 6.137 1.667 386 1HE2 GLN 48 2HE2 GLN 48 -12.280 7.912 0.263 387 2HE2 GLN 48 1HE2 GLN 48 -12.387 7.776 -1.425 388 H LEU 49 H LEU 49 -9.053 6.930 0.628 389 HA LEU 49 HA LEU 49 -8.142 7.210 3.345 390 1HB LEU 49 1HB LEU 49 -8.636 9.368 1.266 391 2HB LEU 49 2HB LEU 49 -7.629 9.507 2.708 392 HG LEU 49 HG LEU 49 -7.121 7.447 0.551 393 1HD1 LEU 49 1HD1 LEU 49 -6.967 10.077 0.021 394 2HD1 LEU 49 2HD1 LEU 49 -5.404 9.869 0.812 395 3HD1 LEU 49 3HD1 LEU 49 -5.801 8.920 -0.621 396 1HD2 LEU 49 1HD2 LEU 49 -5.703 8.440 3.011 397 2HD2 LEU 49 2HD2 LEU 49 -5.974 6.781 2.479 398 3HD2 LEU 49 3HD2 LEU 49 -4.764 7.779 1.672 399 H GLU 50 H GLU 50 -9.159 8.307 4.978 400 HA GLU 50 HA GLU 50 -12.074 8.479 4.846 401 1HB GLU 50 1HB GLU 50 -11.865 9.146 7.245 402 2HB GLU 50 2HB GLU 50 -11.020 7.643 6.873 403 1HG GLU 50 1HG GLU 50 -8.925 8.602 7.075 404 2HG GLU 50 2HG GLU 50 -9.505 10.212 6.644 405 H LYS 51 H LYS 51 -10.740 10.394 3.101 406 HA LYS 51 HA LYS 51 -12.221 12.689 3.288 407 1HB LYS 51 1HB LYS 51 -10.520 14.346 4.270 408 2HB LYS 51 2HB LYS 51 -11.382 13.349 5.438 409 1HG LYS 51 1HG LYS 51 -9.504 12.180 6.024 410 2HG LYS 51 2HG LYS 51 -8.867 12.186 4.379 411 1HD LYS 51 1HD LYS 51 -8.158 14.505 4.615 412 2HD LYS 51 2HD LYS 51 -8.897 14.600 6.214 413 1HE LYS 51 1HE LYS 51 -6.825 12.498 5.628 414 2HE LYS 51 2HE LYS 51 -6.332 14.140 6.044 415 1HZ LYS 51 1HZ LYS 51 -7.844 13.917 8.020 416 2HZ LYS 51 2HZ LYS 51 -7.944 12.259 7.666 417 3HZ LYS 51 3HZ LYS 51 -6.446 12.958 8.057 418 H GLU 52 H GLU 52 -11.752 13.915 1.457 419 HA GLU 52 HA GLU 52 -9.586 12.984 -0.262 420 1HB GLU 52 1HB GLU 52 -11.964 13.963 -0.908 421 2HB GLU 52 2HB GLU 52 -11.105 15.497 -0.805 422 1HG GLU 52 1HG GLU 52 -9.307 14.220 -2.270 423 2HG GLU 52 2HG GLU 52 -10.700 13.239 -2.718 424 H GLU 53 H GLU 53 -7.593 13.578 0.318 425 HA GLU 53 HA GLU 53 -7.057 16.463 0.787 426 1HB GLU 53 1HB GLU 53 -5.189 15.412 2.436 427 2HB GLU 53 2HB GLU 53 -6.775 15.923 3.003 428 1HG GLU 53 1HG GLU 53 -6.163 13.667 3.846 429 2HG GLU 53 2HG GLU 53 -7.605 13.619 2.834 430 H GLN 54 H GLN 54 -4.529 16.707 0.820 431 HA GLN 54 HA GLN 54 -3.585 15.523 -1.704 432 1HB GLN 54 1HB GLN 54 -2.178 17.499 0.123 433 2HB GLN 54 2HB GLN 54 -1.758 17.125 -1.547 434 1HG GLN 54 1HG GLN 54 -3.593 18.263 -2.411 435 2HG GLN 54 2HG GLN 54 -4.533 18.085 -0.931 436 1HE2 GLN 54 2HE2 GLN 54 -1.162 19.287 -1.198 437 2HE2 GLN 54 1HE2 GLN 54 -1.502 20.833 -0.589 438 H ILE 55 H ILE 55 -0.996 15.002 -1.512 439 HA ILE 55 HA ILE 55 -0.499 13.476 0.995 440 HB ILE 55 HB ILE 55 -0.166 12.284 -1.773 441 1HG1 ILE 55 1HG1 ILE 55 -1.975 10.700 -0.564 442 2HG1 ILE 55 2HG1 ILE 55 -2.375 12.223 0.229 443 1HG2 ILE 55 1HG2 ILE 55 0.487 11.404 1.017 444 2HG2 ILE 55 2HG2 ILE 55 -0.015 10.188 -0.157 445 3HG2 ILE 55 3HG2 ILE 55 1.409 11.181 -0.469 446 1HD1 ILE 55 1HD1 ILE 55 -2.215 13.132 -2.279 447 2HD1 ILE 55 2HD1 ILE 55 -2.630 11.458 -2.643 448 3HD1 ILE 55 3HD1 ILE 55 -3.704 12.435 -1.641 449 H HIS 56 H HIS 56 1.576 13.665 1.665 450 HA HIS 56 HA HIS 56 3.577 14.771 -0.269 451 1HB HIS 56 1HB HIS 56 2.732 16.251 1.699 452 2HB HIS 56 2HB HIS 56 3.722 15.200 2.710 453 HD1 HIS 56 HD1 HIS 56 5.306 17.288 3.150 454 HD2 HIS 56 HD2 HIS 56 5.185 15.978 -0.806 455 HE1 HIS 56 HE1 HIS 56 7.278 18.364 1.979 456 H SER 57 H SER 57 2.968 12.535 2.394 457 HA SER 57 HA SER 57 5.417 11.031 1.625 458 1HB SER 57 1HB SER 57 4.868 12.332 4.255 459 2HB SER 57 2HB SER 57 5.573 10.719 4.288 460 HG SER 57 HG SER 57 6.620 13.127 3.379 461 H VAL 58 H VAL 58 5.359 8.808 2.560 462 HA VAL 58 HA VAL 58 2.653 7.886 3.384 463 HB VAL 58 HB VAL 58 4.215 6.890 0.982 464 1HG1 VAL 58 1HG1 VAL 58 1.745 5.778 2.324 465 2HG1 VAL 58 2HG1 VAL 58 2.207 5.373 0.673 466 3HG1 VAL 58 3HG1 VAL 58 3.267 4.945 2.015 467 1HG2 VAL 58 1HG2 VAL 58 1.776 8.549 1.401 468 2HG2 VAL 58 2HG2 VAL 58 3.023 8.678 0.161 469 3HG2 VAL 58 3HG2 VAL 58 1.780 7.433 0.035 470 H ASP 59 H ASP 59 2.783 5.518 4.107 471 HA ASP 59 HA ASP 59 5.519 4.736 5.008 472 1HB ASP 59 1HB ASP 59 3.864 5.956 6.742 473 2HB ASP 59 2HB ASP 59 3.250 4.311 6.896 474 H ILE 60 H ILE 60 5.673 2.849 3.762 475 HA ILE 60 HA ILE 60 3.467 0.863 4.111 476 HB ILE 60 HB ILE 60 5.459 1.028 1.813 477 1HG1 ILE 60 1HG1 ILE 60 4.005 2.617 0.993 478 2HG1 ILE 60 2HG1 ILE 60 3.031 1.227 0.586 479 1HG2 ILE 60 1HG2 ILE 60 3.563 -1.026 2.735 480 2HG2 ILE 60 2HG2 ILE 60 3.430 -0.648 1.018 481 3HG2 ILE 60 3HG2 ILE 60 4.973 -1.175 1.687 482 1HD1 ILE 60 1HD1 ILE 60 2.062 1.597 3.019 483 2HD1 ILE 60 2HD1 ILE 60 2.661 3.234 2.767 484 3HD1 ILE 60 3HD1 ILE 60 1.478 2.550 1.661 485 H GLY 61 H GLY 61 4.057 -0.708 5.470 486 1HA GLY 61 1HA GLY 61 6.887 -1.134 6.092 487 2HA GLY 61 2HA GLY 61 5.550 -1.918 6.901 488 H ASN 62 H ASN 62 8.045 -2.424 4.809 489 HA ASN 62 HA ASN 62 6.786 -4.352 3.016 490 1HB ASN 62 1HB ASN 62 8.926 -3.032 2.571 491 2HB ASN 62 2HB ASN 62 9.734 -4.169 3.651 492 1HD2 ASN 62 2HD2 ASN 62 9.727 -6.484 2.995 493 2HD2 ASN 62 1HD2 ASN 62 9.532 -6.901 1.362 494 H ASP 63 H ASP 63 6.335 -6.478 3.432 495 HA ASP 63 HA ASP 63 7.786 -7.780 5.711 496 1HB ASP 63 1HB ASP 63 4.880 -7.539 5.160 497 2HB ASP 63 2HB ASP 63 5.429 -9.146 5.632 498 H GLY 64 H GLY 64 9.122 -8.258 3.642 499 1HA GLY 64 1HA GLY 64 9.887 -10.295 2.568 500 2HA GLY 64 2HA GLY 64 8.222 -10.879 2.561 501 H SER 65 H SER 65 7.180 -8.264 1.632 502 HA SER 65 HA SER 65 7.153 -8.672 -1.181 503 1HB SER 65 1HB SER 65 6.490 -6.097 -1.050 504 2HB SER 65 2HB SER 65 5.391 -7.351 -0.485 505 HG SER 65 HG SER 65 5.509 -6.292 1.330 506 H ALA 66 H ALA 66 7.771 -6.446 -2.515 507 HA ALA 66 HA ALA 66 10.468 -5.528 -1.796 508 1HB ALA 66 1HB ALA 66 10.112 -7.809 -3.426 509 2HB ALA 66 2HB ALA 66 10.587 -6.504 -4.513 510 3HB ALA 66 3HB ALA 66 11.609 -6.927 -3.140 511 H PHE 67 H PHE 67 8.154 -5.750 -4.524 512 HA PHE 67 HA PHE 67 8.804 -2.910 -5.167 513 1HB PHE 67 1HB PHE 67 7.156 -4.886 -6.775 514 2HB PHE 67 2HB PHE 67 7.685 -3.305 -7.305 515 HD1 PHE 67 HD1 PHE 67 10.452 -3.129 -6.421 516 HD2 PHE 67 HD2 PHE 67 8.314 -6.480 -8.045 517 HE1 PHE 67 HE1 PHE 67 12.584 -4.100 -7.219 518 HE2 PHE 67 HE2 PHE 67 10.444 -7.453 -8.839 519 HZ PHE 67 HZ PHE 67 12.584 -6.265 -8.431 520 H VAL 68 H VAL 68 7.453 -1.350 -4.482 521 HA VAL 68 HA VAL 68 4.581 -2.081 -4.027 522 HB VAL 68 HB VAL 68 6.247 -0.229 -2.300 523 1HG1 VAL 68 1HG1 VAL 68 3.350 -0.856 -2.508 524 2HG1 VAL 68 2HG1 VAL 68 4.014 -0.810 -0.875 525 3HG1 VAL 68 3HG1 VAL 68 4.144 0.604 -1.920 526 1HG2 VAL 68 1HG2 VAL 68 5.499 -3.115 -2.154 527 2HG2 VAL 68 2HG2 VAL 68 6.972 -2.312 -1.615 528 3HG2 VAL 68 3HG2 VAL 68 5.499 -2.193 -0.652 529 H GLU 69 H GLU 69 3.459 -1.022 -5.541 530 HA GLU 69 HA GLU 69 4.339 1.701 -6.390 531 1HB GLU 69 1HB GLU 69 4.026 0.021 -8.182 532 2HB GLU 69 2HB GLU 69 2.357 -0.216 -7.666 533 1HG GLU 69 1HG GLU 69 1.644 1.694 -8.674 534 2HG GLU 69 2HG GLU 69 3.066 2.605 -8.170 535 H VAL 70 H VAL 70 2.914 3.471 -6.218 536 HA VAL 70 HA VAL 70 0.294 2.924 -4.900 537 HB VAL 70 HB VAL 70 2.123 5.197 -4.107 538 1HG1 VAL 70 1HG1 VAL 70 -0.617 4.303 -3.406 539 2HG1 VAL 70 2HG1 VAL 70 0.397 4.820 -2.058 540 3HG1 VAL 70 3HG1 VAL 70 0.076 5.924 -3.395 541 1HG2 VAL 70 1HG2 VAL 70 1.710 2.446 -2.924 542 2HG2 VAL 70 2HG2 VAL 70 3.232 3.237 -3.334 543 3HG2 VAL 70 3HG2 VAL 70 2.292 3.797 -1.950 544 H LEU 71 H LEU 71 -1.316 3.830 -6.017 545 HA LEU 71 HA LEU 71 -0.715 6.135 -7.811 546 1HB LEU 71 1HB LEU 71 -2.206 3.659 -8.192 547 2HB LEU 71 2HB LEU 71 -3.214 5.062 -8.532 548 HG LEU 71 HG LEU 71 -1.303 5.928 -9.973 549 1HD1 LEU 71 1HD1 LEU 71 -0.353 3.088 -9.497 550 2HD1 LEU 71 2HD1 LEU 71 0.267 4.137 -10.772 551 3HD1 LEU 71 3HD1 LEU 71 0.504 4.572 -9.079 552 1HD2 LEU 71 1HD2 LEU 71 -2.938 3.477 -10.544 553 2HD2 LEU 71 2HD2 LEU 71 -3.080 5.096 -11.228 554 3HD2 LEU 71 3HD2 LEU 71 -1.775 4.030 -11.749 555 H VAL 72 H VAL 72 -2.451 7.749 -7.947 556 HA VAL 72 HA VAL 72 -4.052 7.910 -5.424 557 HB VAL 72 HB VAL 72 -3.836 10.417 -5.832 558 1HG1 VAL 72 1HG1 VAL 72 -1.498 8.676 -5.050 559 2HG1 VAL 72 2HG1 VAL 72 -1.514 10.422 -4.809 560 3HG1 VAL 72 3HG1 VAL 72 -2.697 9.408 -3.984 561 1HG2 VAL 72 1HG2 VAL 72 -2.954 10.148 -8.170 562 2HG2 VAL 72 2HG2 VAL 72 -1.934 11.158 -7.146 563 3HG2 VAL 72 3HG2 VAL 72 -1.473 9.489 -7.479 564 H GLY 73 H GLY 73 -6.097 9.102 -5.610 565 1HA GLY 73 1HA GLY 73 -7.191 10.055 -8.028 566 2HA GLY 73 2HA GLY 73 -7.644 8.361 -7.872 567 H SER 74 H SER 74 -9.663 10.011 -7.876 568 HA SER 74 HA SER 74 -10.442 10.422 -5.046 569 1HB SER 74 1HB SER 74 -10.475 12.527 -6.187 570 2HB SER 74 2HB SER 74 -11.302 11.832 -7.571 571 HG SER 74 HG SER 74 -12.314 12.072 -4.926 572 H SER 75 H SER 75 -12.685 10.000 -4.570 573 HA SER 75 HA SER 75 -13.667 7.554 -5.759 574 1HB SER 75 1HB SER 75 -15.515 7.805 -4.127 575 2HB SER 75 2HB SER 75 -13.949 8.020 -3.348 576 HG SER 75 HG SER 75 -14.311 10.137 -3.174 577 H ALA 76 H ALA 76 -13.880 10.773 -6.685 578 HA ALA 76 HA ALA 76 -16.590 11.062 -7.450 579 1HB ALA 76 1HB ALA 76 -14.013 12.338 -8.185 580 2HB ALA 76 2HB ALA 76 -15.341 12.540 -9.329 581 3HB ALA 76 3HB ALA 76 -15.524 13.079 -7.659 582 H GLY 77 H GLY 77 -13.933 10.562 -9.778 583 1HA GLY 77 1HA GLY 77 -15.576 9.618 -11.880 584 2HA GLY 77 2HA GLY 77 -13.848 9.290 -11.747 585 H GLY 78 H GLY 78 -13.299 7.510 -10.093 586 1HA GLY 78 1HA GLY 78 -13.487 5.255 -9.469 587 2HA GLY 78 2HA GLY 78 -15.212 5.568 -9.269 588 H ALA 79 H ALA 79 -13.587 6.073 -12.334 589 HA ALA 79 HA ALA 79 -15.458 4.503 -13.804 590 1HB ALA 79 1HB ALA 79 -13.659 6.338 -14.533 591 2HB ALA 79 2HB ALA 79 -12.702 4.899 -14.884 592 3HB ALA 79 3HB ALA 79 -14.261 5.136 -15.674 593 H GLY 80 H GLY 80 -12.324 3.711 -12.377 594 1HA GLY 80 1HA GLY 80 -12.797 0.973 -12.060 595 2HA GLY 80 2HA GLY 80 -12.062 1.134 -13.655 596 H GLU 81 H GLU 81 -10.147 0.051 -12.974 597 HA GLU 81 HA GLU 81 -8.537 1.372 -10.854 598 1HB GLU 81 1HB GLU 81 -7.991 -1.190 -12.387 599 2HB GLU 81 2HB GLU 81 -7.108 -0.608 -10.976 600 1HG GLU 81 1HG GLU 81 -8.779 -1.196 -9.515 601 2HG GLU 81 2HG GLU 81 -10.058 -0.864 -10.682 602 H GLN 82 H GLN 82 -9.002 2.551 -13.565 603 HA GLN 82 HA GLN 82 -6.133 2.848 -14.310 604 1HB GLN 82 1HB GLN 82 -8.455 2.228 -16.135 605 2HB GLN 82 2HB GLN 82 -6.997 3.016 -16.737 606 1HG GLN 82 1HG GLN 82 -6.646 0.574 -15.058 607 2HG GLN 82 2HG GLN 82 -7.237 0.352 -16.706 608 1HE2 GLN 82 2HE2 GLN 82 -5.597 0.131 -18.226 609 2HE2 GLN 82 1HE2 GLN 82 -4.033 0.773 -18.077 610 H ASP 83 H ASP 83 -8.462 4.468 -12.929 611 HA ASP 83 HA ASP 83 -8.194 6.906 -14.641 612 1HB ASP 83 1HB ASP 83 -10.529 6.055 -14.200 613 2HB ASP 83 2HB ASP 83 -10.261 6.380 -12.487 614 H TYR 84 H TYR 84 -6.246 5.866 -12.631 615 HA TYR 84 HA TYR 84 -6.379 8.041 -10.601 616 1HB TYR 84 1HB TYR 84 -5.070 5.320 -10.630 617 2HB TYR 84 2HB TYR 84 -4.517 6.574 -9.525 618 HD1 TYR 84 HD1 TYR 84 -7.943 5.547 -10.715 619 HD2 TYR 84 HD2 TYR 84 -5.304 6.146 -7.381 620 HE1 TYR 84 HE1 TYR 84 -9.786 5.001 -9.166 621 HE2 TYR 84 HE2 TYR 84 -7.159 5.603 -5.826 622 HH TYR 84 HH TYR 84 -9.364 4.184 -6.035 623 H GLU 85 H GLU 85 -3.846 8.398 -9.938 624 HA GLU 85 HA GLU 85 -2.341 8.811 -12.472 625 1HB GLU 85 1HB GLU 85 -2.511 11.051 -12.254 626 2HB GLU 85 2HB GLU 85 -3.488 10.843 -10.811 627 1HG GLU 85 1HG GLU 85 -1.672 12.229 -10.167 628 2HG GLU 85 2HG GLU 85 -1.272 10.637 -9.525 629 H VAL 86 H VAL 86 -0.300 8.041 -12.357 630 HA VAL 86 HA VAL 86 0.568 6.448 -10.190 631 HB VAL 86 HB VAL 86 2.295 7.737 -12.315 632 1HG1 VAL 86 1HG1 VAL 86 2.668 5.534 -10.317 633 2HG1 VAL 86 2HG1 VAL 86 3.437 5.376 -11.896 634 3HG1 VAL 86 3HG1 VAL 86 3.820 6.752 -10.863 635 1HG2 VAL 86 1HG2 VAL 86 0.348 5.474 -12.326 636 2HG2 VAL 86 2HG2 VAL 86 0.777 6.592 -13.622 637 3HG2 VAL 86 3HG2 VAL 86 1.851 5.252 -13.222 638 H LEU 87 H LEU 87 0.398 7.721 -8.260 639 HA LEU 87 HA LEU 87 1.771 10.191 -7.798 640 1HB LEU 87 1HB LEU 87 0.017 8.851 -6.339 641 2HB LEU 87 2HB LEU 87 1.457 8.110 -5.645 642 HG LEU 87 HG LEU 87 2.343 10.435 -5.214 643 1HD1 LEU 87 1HD1 LEU 87 0.015 11.124 -6.761 644 2HD1 LEU 87 2HD1 LEU 87 -0.143 11.833 -5.155 645 3HD1 LEU 87 3HD1 LEU 87 1.275 12.189 -6.139 646 1HD2 LEU 87 1HD2 LEU 87 0.100 9.075 -3.877 647 2HD2 LEU 87 2HD2 LEU 87 1.571 9.756 -3.186 648 3HD2 LEU 87 3HD2 LEU 87 0.187 10.798 -3.507 649 H LEU 88 H LEU 88 2.751 6.870 -6.827 650 HA LEU 88 HA LEU 88 5.553 7.658 -7.419 651 1HB LEU 88 1HB LEU 88 6.352 6.569 -5.362 652 2HB LEU 88 2HB LEU 88 5.328 7.960 -5.021 653 HG LEU 88 HG LEU 88 3.601 5.714 -5.244 654 1HD1 LEU 88 1HD1 LEU 88 6.214 5.144 -3.928 655 2HD1 LEU 88 2HD1 LEU 88 4.760 4.575 -3.107 656 3HD1 LEU 88 3HD1 LEU 88 5.108 4.047 -4.754 657 1HD2 LEU 88 1HD2 LEU 88 4.543 7.608 -3.122 658 2HD2 LEU 88 2HD2 LEU 88 2.923 7.385 -3.782 659 3HD2 LEU 88 3HD2 LEU 88 3.575 6.217 -2.632 660 H VAL 89 H VAL 89 6.444 6.185 -8.740 661 HA VAL 89 HA VAL 89 5.143 3.870 -9.683 662 HB VAL 89 HB VAL 89 7.400 3.189 -10.529 663 1HG1 VAL 89 1HG1 VAL 89 5.837 5.160 -11.418 664 2HG1 VAL 89 2HG1 VAL 89 7.226 6.143 -10.956 665 3HG1 VAL 89 3HG1 VAL 89 7.416 4.849 -12.139 666 1HG2 VAL 89 1HG2 VAL 89 8.593 4.067 -8.460 667 2HG2 VAL 89 2HG2 VAL 89 9.341 4.506 -9.996 668 3HG2 VAL 89 3HG2 VAL 89 8.372 5.689 -9.118 669 H THR 90 H THR 90 6.518 1.616 -9.504 670 HA THR 90 HA THR 90 6.001 0.713 -6.831 671 HB THR 90 HB THR 90 6.012 -0.585 -9.143 672 HG1 THR 90 HG1 THR 90 5.955 -2.420 -7.933 673 1HG2 THR 90 1HG2 THR 90 8.491 -0.317 -9.474 674 2HG2 THR 90 2HG2 THR 90 8.740 -1.326 -8.048 675 3HG2 THR 90 3HG2 THR 90 7.952 -1.995 -9.477 676 H SER 91 H SER 91 7.337 0.535 -5.122 677 HA SER 91 HA SER 91 10.085 1.596 -5.393 678 1HB SER 91 1HB SER 91 9.935 1.758 -2.885 679 2HB SER 91 2HB SER 91 8.712 2.704 -3.722 680 HG SER 91 HG SER 91 7.210 1.411 -2.990 681 H SER 92 H SER 92 11.691 0.160 -5.461 682 HA SER 92 HA SER 92 11.272 -2.645 -4.680 683 1HB SER 92 1HB SER 92 12.511 -2.173 -6.732 684 2HB SER 92 2HB SER 92 13.667 -1.223 -5.816 685 HG SER 92 HG SER 92 14.636 -3.125 -5.793 686 H PHE 93 H PHE 93 11.749 -3.370 -2.672 687 HA PHE 93 HA PHE 93 13.641 -1.748 -1.017 688 1HB PHE 93 1HB PHE 93 11.292 -3.420 -0.128 689 2HB PHE 93 2HB PHE 93 12.378 -2.549 0.945 690 HD1 PHE 93 HD1 PHE 93 12.797 0.014 -0.240 691 HD2 PHE 93 HD2 PHE 93 9.219 -2.360 -0.222 692 HE1 PHE 93 HE1 PHE 93 11.438 2.066 -0.527 693 HE2 PHE 93 HE2 PHE 93 7.858 -0.306 -0.508 694 HZ PHE 93 HZ PHE 93 8.971 1.904 -0.661 695 H MET 94 H MET 94 12.387 -5.050 -1.530 696 HA MET 94 HA MET 94 15.038 -6.066 -0.556 697 1HB MET 94 1HB MET 94 12.248 -7.147 -0.161 698 2HB MET 94 2HB MET 94 13.675 -8.157 0.061 699 1HG MET 94 1HG MET 94 14.492 -6.806 1.833 700 2HG MET 94 2HG MET 94 13.394 -5.485 1.435 701 1HE MET 94 1HE MET 94 13.733 -9.135 2.419 702 2HE MET 94 2HE MET 94 12.179 -9.587 3.116 703 3HE MET 94 3HE MET 94 12.323 -9.305 1.375 704 H SER 95 H SER 95 15.046 -8.608 -1.281 705 HA SER 95 HA SER 95 14.561 -8.603 -4.233 706 1HB SER 95 1HB SER 95 16.591 -9.747 -4.561 707 2HB SER 95 2HB SER 95 17.001 -8.623 -3.273 708 HG SER 95 HG SER 95 17.654 -10.819 -2.875 709 HA PRO 96 HA PRO 96 12.284 -12.385 -3.596 710 1HB PRO 96 1HB PRO 96 12.976 -13.901 -5.752 711 2HB PRO 96 2HB PRO 96 11.989 -12.446 -5.875 712 1HG PRO 96 1HG PRO 96 14.770 -12.880 -6.713 713 2HG PRO 96 2HG PRO 96 13.604 -11.669 -7.259 714 1HD PRO 96 1HD PRO 96 15.756 -11.303 -5.409 715 2HD PRO 96 2HD PRO 96 14.531 -10.109 -5.889 716 H SER 97 H SER 97 15.429 -12.438 -2.779 717 HA SER 97 HA SER 97 15.465 -15.395 -2.338 718 1HB SER 97 1HB SER 97 18.038 -14.904 -2.116 719 2HB SER 97 2HB SER 97 17.318 -15.058 -3.716 720 HG SER 97 HG SER 97 18.569 -12.967 -2.638 721 H GLU 98 H GLU 98 16.274 -12.207 -0.979 722 HA GLU 98 HA GLU 98 16.952 -13.347 1.622 723 1HB GLU 98 1HB GLU 98 17.349 -11.074 2.303 724 2HB GLU 98 2HB GLU 98 17.968 -11.239 0.668 725 1HG GLU 98 1HG GLU 98 15.491 -10.442 0.046 726 2HG GLU 98 2HG GLU 98 15.593 -9.713 1.649 727 H SER 99 H SER 99 14.054 -12.289 0.044 728 HA SER 99 HA SER 99 12.473 -11.467 2.240 729 1HB SER 99 1HB SER 99 10.542 -12.091 0.848 730 2HB SER 99 2HB SER 99 11.759 -11.256 -0.113 731 HG SER 99 HG SER 99 12.534 -13.404 -0.673 732 H ARG 100 H ARG 100 13.603 -14.657 1.383 733 HA ARG 100 HA ARG 100 11.576 -16.140 2.800 734 1HB ARG 100 1HB ARG 100 14.421 -16.832 2.014 735 2HB ARG 100 2HB ARG 100 13.327 -17.979 2.786 736 1HG ARG 100 1HG ARG 100 11.794 -17.892 0.948 737 2HG ARG 100 2HG ARG 100 12.616 -16.500 0.244 738 1HD ARG 100 1HD ARG 100 14.301 -17.773 -0.647 739 2HD ARG 100 2HD ARG 100 14.288 -18.915 0.697 740 HE ARG 100 HE ARG 100 12.785 -19.174 -1.772 741 1HH1 ARG 100 1HH1 ARG 100 12.776 -19.913 1.648 742 2HH1 ARG 100 2HH1 ARG 100 11.755 -21.294 1.448 743 1HH2 ARG 100 1HH2 ARG 100 11.467 -20.968 -1.981 744 2HH2 ARG 100 2HH2 ARG 100 11.022 -21.886 -0.581 745 H SER 101 H SER 101 14.965 -16.308 3.864 746 HA SER 101 HA SER 101 14.453 -14.974 6.397 747 1HB SER 101 1HB SER 101 13.341 -17.211 6.722 748 2HB SER 101 2HB SER 101 14.900 -17.975 6.434 749 HG SER 101 HG SER 101 14.173 -16.181 8.508 750 H GLY 102 H GLY 102 16.338 -14.705 4.274 751 1HA GLY 102 1HA GLY 102 18.852 -15.676 5.571 752 2HA GLY 102 2HA GLY 102 18.698 -15.359 3.844 753 H SER 103 H SER 103 17.030 -12.842 4.724 754 HA SER 103 HA SER 103 18.874 -11.128 6.103 755 1HB SER 103 1HB SER 103 19.353 -11.567 3.259 756 2HB SER 103 2HB SER 103 19.089 -9.865 3.624 757 HG SER 103 HG SER 103 21.308 -10.864 3.866 758 H ASN 104 H ASN 104 17.491 -9.744 6.977 759 HA ASN 104 HA ASN 104 15.539 -8.504 7.362 760 1HB ASN 104 1HB ASN 104 15.310 -6.660 5.596 761 2HB ASN 104 2HB ASN 104 16.856 -6.777 6.429 762 1HD2 ASN 104 2HD2 ASN 104 15.233 -7.816 3.380 763 2HD2 ASN 104 1HD2 ASN 104 16.657 -7.844 2.455 764 HA PRO 105 HA PRO 105 12.714 -10.886 4.530 765 1HB PRO 105 1HB PRO 105 11.380 -12.216 6.513 766 2HB PRO 105 2HB PRO 105 12.857 -12.829 5.756 767 1HG PRO 105 1HG PRO 105 12.480 -11.606 8.430 768 2HG PRO 105 2HG PRO 105 13.649 -12.825 7.898 769 1HD PRO 105 1HD PRO 105 14.198 -10.103 8.287 770 2HD PRO 105 2HD PRO 105 15.212 -11.244 7.378 771 H ASN 106 H ASN 106 12.256 -9.127 7.540 772 HA ASN 106 HA ASN 106 9.699 -8.012 6.458 773 1HB ASN 106 1HB ASN 106 10.254 -9.324 9.039 774 2HB ASN 106 2HB ASN 106 9.466 -7.755 9.204 775 1HD2 ASN 106 2HD2 ASN 106 9.004 -9.983 6.441 776 2HD2 ASN 106 1HD2 ASN 106 7.365 -10.284 6.754 777 H ARG 107 H ARG 107 10.104 -5.892 5.995 778 HA ARG 107 HA ARG 107 11.771 -4.345 7.932 779 1HB ARG 107 1HB ARG 107 12.242 -4.847 5.095 780 2HB ARG 107 2HB ARG 107 12.158 -3.121 5.441 781 1HG ARG 107 1HG ARG 107 13.703 -3.851 7.502 782 2HG ARG 107 2HG ARG 107 14.128 -5.153 6.389 783 1HD ARG 107 1HD ARG 107 15.653 -3.601 5.656 784 2HD ARG 107 2HD ARG 107 14.279 -3.072 4.687 785 HE ARG 107 HE ARG 107 14.234 -1.099 5.958 786 1HH1 ARG 107 1HH1 ARG 107 15.924 -3.601 7.724 787 2HH1 ARG 107 2HH1 ARG 107 16.382 -2.528 9.000 788 1HH2 ARG 107 1HH2 ARG 107 14.846 0.251 7.630 789 2HH2 ARG 107 2HH2 ARG 107 15.780 -0.370 8.950 790 H VAL 108 H VAL 108 11.544 -1.861 6.858 791 HA VAL 108 HA VAL 108 8.658 -1.283 6.429 792 HB VAL 108 HB VAL 108 10.359 -0.314 8.725 793 1HG1 VAL 108 1HG1 VAL 108 8.064 1.009 7.384 794 2HG1 VAL 108 2HG1 VAL 108 8.027 0.972 9.147 795 3HG1 VAL 108 3HG1 VAL 108 9.386 1.720 8.309 796 1HG2 VAL 108 1HG2 VAL 108 7.874 -1.936 8.386 797 2HG2 VAL 108 2HG2 VAL 108 9.244 -2.202 9.464 798 3HG2 VAL 108 3HG2 VAL 108 8.050 -0.962 9.846 799 H ARG 109 H ARG 109 8.496 0.354 4.893 800 HA ARG 109 HA ARG 109 10.818 2.169 4.526 801 1HB ARG 109 1HB ARG 109 9.398 0.533 2.417 802 2HB ARG 109 2HB ARG 109 10.388 1.941 2.023 803 1HG ARG 109 1HG ARG 109 11.559 -0.110 3.851 804 2HG ARG 109 2HG ARG 109 11.448 -0.506 2.136 805 1HD ARG 109 1HD ARG 109 12.967 1.087 1.532 806 2HD ARG 109 2HD ARG 109 12.477 2.201 2.801 807 HE ARG 109 HE ARG 109 14.150 1.280 4.165 808 1HH1 ARG 109 1HH1 ARG 109 13.377 -0.947 1.582 809 2HH1 ARG 109 2HH1 ARG 109 14.649 -2.038 2.007 810 1HH2 ARG 109 1HH2 ARG 109 15.781 -0.160 4.681 811 2HH2 ARG 109 2HH2 ARG 109 15.996 -1.599 3.742 812 H MET 110 H MET 110 10.227 4.251 4.327 813 HA MET 110 HA MET 110 7.320 4.872 4.076 814 1HB MET 110 1HB MET 110 9.569 6.656 5.057 815 2HB MET 110 2HB MET 110 7.840 6.986 5.163 816 1HG MET 110 1HG MET 110 7.509 5.424 6.849 817 2HG MET 110 2HG MET 110 8.905 4.462 6.381 818 1HE MET 110 1HE MET 110 7.812 5.190 8.941 819 2HE MET 110 2HE MET 110 9.405 4.854 9.615 820 3HE MET 110 3HE MET 110 8.623 6.397 9.949 821 H PHE 111 H PHE 111 7.075 7.233 3.060 822 HA PHE 111 HA PHE 111 8.907 7.540 0.734 823 1HB PHE 111 1HB PHE 111 5.903 7.630 0.443 824 2HB PHE 111 2HB PHE 111 7.105 7.689 -0.838 825 HD1 PHE 111 HD1 PHE 111 5.816 5.487 1.906 826 HD2 PHE 111 HD2 PHE 111 7.859 5.733 -1.864 827 HE1 PHE 111 HE1 PHE 111 5.752 3.013 1.718 828 HE2 PHE 111 HE2 PHE 111 7.810 3.268 -2.050 829 HZ PHE 111 HZ PHE 111 6.772 1.904 -0.272 830 H GLY 112 H GLY 112 8.564 9.636 -0.349 831 1HA GLY 112 1HA GLY 112 7.200 11.724 1.225 832 2HA GLY 112 2HA GLY 112 8.919 11.907 0.935 833 HA PRO 113 HA PRO 113 6.869 13.797 -2.757 834 1HB PRO 113 1HB PRO 113 8.591 15.911 -2.900 835 2HB PRO 113 2HB PRO 113 7.137 15.902 -1.890 836 1HG PRO 113 1HG PRO 113 9.985 15.592 -1.104 837 2HG PRO 113 2HG PRO 113 8.637 16.308 -0.208 838 1HD PRO 113 1HD PRO 113 9.680 13.751 0.239 839 2HD PRO 113 2HD PRO 113 8.085 14.303 0.769 840 H ASP 114 H ASP 114 10.163 12.919 -2.030 841 HA ASP 114 HA ASP 114 11.531 13.294 -4.424 842 1HB ASP 114 1HB ASP 114 12.140 12.101 -2.110 843 2HB ASP 114 2HB ASP 114 11.856 10.656 -3.081 844 H LYS 115 H LYS 115 9.365 10.571 -3.614 845 HA LYS 115 HA LYS 115 9.489 9.764 -6.489 846 1HB LYS 115 1HB LYS 115 9.108 8.219 -3.945 847 2HB LYS 115 2HB LYS 115 8.444 7.588 -5.452 848 1HG LYS 115 1HG LYS 115 10.508 7.164 -6.345 849 2HG LYS 115 2HG LYS 115 11.245 8.569 -5.574 850 1HD LYS 115 1HD LYS 115 10.330 6.391 -3.766 851 2HD LYS 115 2HD LYS 115 11.741 6.043 -4.764 852 1HE LYS 115 1HE LYS 115 13.048 7.321 -3.450 853 2HE LYS 115 2HE LYS 115 11.965 8.700 -3.635 854 1HZ LYS 115 1HZ LYS 115 10.513 7.562 -1.941 855 2HZ LYS 115 2HZ LYS 115 11.821 6.521 -1.636 856 3HZ LYS 115 3HZ LYS 115 11.977 8.190 -1.360 857 H LEU 116 H LEU 116 7.598 11.715 -4.777 858 HA LEU 116 HA LEU 116 5.079 10.529 -5.869 859 1HB LEU 116 1HB LEU 116 4.224 10.712 -3.812 860 2HB LEU 116 2HB LEU 116 5.752 11.316 -3.237 861 HG LEU 116 HG LEU 116 4.697 13.610 -4.266 862 1HD1 LEU 116 1HD1 LEU 116 2.496 11.689 -3.676 863 2HD1 LEU 116 2HD1 LEU 116 2.283 13.341 -3.114 864 3HD1 LEU 116 3HD1 LEU 116 2.533 13.021 -4.830 865 1HD2 LEU 116 1HD2 LEU 116 5.478 12.717 -1.831 866 2HD2 LEU 116 2HD2 LEU 116 4.686 14.274 -2.070 867 3HD2 LEU 116 3HD2 LEU 116 3.746 12.876 -1.546 868 H VAL 117 H VAL 117 4.311 11.512 -7.573 869 HA VAL 117 HA VAL 117 5.483 13.650 -8.920 870 HB VAL 117 HB VAL 117 3.809 12.176 -9.927 871 1HG1 VAL 117 1HG1 VAL 117 2.415 11.999 -7.893 872 2HG1 VAL 117 2HG1 VAL 117 1.820 13.624 -8.190 873 3HG1 VAL 117 3HG1 VAL 117 1.463 12.337 -9.337 874 1HG2 VAL 117 1HG2 VAL 117 3.768 15.062 -10.166 875 2HG2 VAL 117 2HG2 VAL 117 3.510 13.848 -11.416 876 3HG2 VAL 117 3HG2 VAL 117 2.152 14.419 -10.448 877 H ARG 118 H ARG 118 5.533 15.845 -8.653 878 HA ARG 118 HA ARG 118 4.391 17.078 -6.315 879 1HB ARG 118 1HB ARG 118 6.311 17.778 -8.220 880 2HB ARG 118 2HB ARG 118 5.017 18.945 -8.484 881 1HG ARG 118 1HG ARG 118 5.016 19.366 -5.988 882 2HG ARG 118 2HG ARG 118 6.474 18.380 -5.887 883 1HD ARG 118 1HD ARG 118 7.689 19.891 -7.318 884 2HD ARG 118 2HD ARG 118 6.222 20.790 -7.704 885 HE ARG 118 HE ARG 118 6.705 20.789 -4.858 886 1HH1 ARG 118 1HH1 ARG 118 7.737 22.243 -7.867 887 2HH1 ARG 118 2HH1 ARG 118 8.264 23.700 -7.099 888 1HH2 ARG 118 1HH2 ARG 118 7.400 22.690 -3.906 889 2HH2 ARG 118 2HH2 ARG 118 8.078 23.951 -4.881 890 H ALA 119 H ALA 119 3.446 16.971 -9.728 891 HA ALA 119 HA ALA 119 1.342 18.857 -9.631 892 1HB ALA 119 1HB ALA 119 1.849 16.438 -11.355 893 2HB ALA 119 2HB ALA 119 0.400 17.420 -11.564 894 3HB ALA 119 3HB ALA 119 1.993 18.143 -11.783 895 H ALA 120 H ALA 120 1.313 15.365 -8.916 896 HA ALA 120 HA ALA 120 -1.564 15.517 -8.228 897 1HB ALA 120 1HB ALA 120 -0.139 13.516 -9.379 898 2HB ALA 120 2HB ALA 120 -0.067 13.019 -7.688 899 3HB ALA 120 3HB ALA 120 -1.628 13.251 -8.471 900 H ALA 121 H ALA 121 1.600 15.106 -6.668 901 HA ALA 121 HA ALA 121 0.945 14.342 -4.087 902 1HB ALA 121 1HB ALA 121 2.829 16.589 -4.862 903 2HB ALA 121 2HB ALA 121 2.835 15.746 -3.315 904 3HB ALA 121 3HB ALA 121 3.253 14.886 -4.791 905 H GLU 122 H GLU 122 0.357 17.511 -5.549 906 HA GLU 122 HA GLU 122 -0.752 18.435 -2.955 907 1HB GLU 122 1HB GLU 122 -0.771 20.690 -3.984 908 2HB GLU 122 2HB GLU 122 0.834 19.963 -4.041 909 1HG GLU 122 1HG GLU 122 0.602 19.408 -6.355 910 2HG GLU 122 2HG GLU 122 -1.124 19.758 -6.338 911 H LYS 123 H LYS 123 -1.993 16.664 -5.303 912 HA LYS 123 HA LYS 123 -4.451 18.227 -5.766 913 1HB LYS 123 1HB LYS 123 -3.247 15.749 -6.901 914 2HB LYS 123 2HB LYS 123 -5.000 15.910 -6.964 915 1HG LYS 123 1HG LYS 123 -3.726 18.389 -7.747 916 2HG LYS 123 2HG LYS 123 -3.097 17.052 -8.701 917 1HD LYS 123 1HD LYS 123 -5.696 16.419 -8.824 918 2HD LYS 123 2HD LYS 123 -5.864 18.160 -8.591 919 1HE LYS 123 1HE LYS 123 -3.920 18.141 -10.472 920 2HE LYS 123 2HE LYS 123 -4.769 16.658 -10.907 921 1HZ LYS 123 1HZ LYS 123 -6.860 18.010 -10.803 922 2HZ LYS 123 2HZ LYS 123 -5.886 19.394 -10.703 923 3HZ LYS 123 3HZ LYS 123 -5.806 18.400 -12.079 924 H ARG 124 H ARG 124 -6.307 17.830 -4.595 925 HA ARG 124 HA ARG 124 -6.130 16.143 -2.256 926 1HB ARG 124 1HB ARG 124 -8.400 17.686 -3.517 927 2HB ARG 124 2HB ARG 124 -8.610 16.723 -2.055 928 1HG ARG 124 1HG ARG 124 -6.697 18.001 -1.027 929 2HG ARG 124 2HG ARG 124 -6.714 19.055 -2.440 930 1HD ARG 124 1HD ARG 124 -9.391 18.965 -1.635 931 2HD ARG 124 2HD ARG 124 -8.488 19.045 -0.123 932 HE ARG 124 HE ARG 124 -7.839 21.241 -0.681 933 1HH1 ARG 124 1HH1 ARG 124 -9.093 19.599 -3.502 934 2HH1 ARG 124 2HH1 ARG 124 -9.093 21.036 -4.463 935 1HH2 ARG 124 1HH2 ARG 124 -7.852 23.075 -1.959 936 2HH2 ARG 124 2HH2 ARG 124 -8.398 22.984 -3.600 937 H TRP 125 H TRP 125 -6.031 13.989 -2.592 938 HA TRP 125 HA TRP 125 -8.051 12.714 -4.409 939 1HB TRP 125 1HB TRP 125 -5.493 11.513 -3.292 940 2HB TRP 125 2HB TRP 125 -6.535 10.820 -4.531 941 HD1 TRP 125 HD1 TRP 125 -3.563 12.971 -4.091 942 HE1 TRP 125 HE1 TRP 125 -2.861 14.016 -6.341 943 HE3 TRP 125 HE3 TRP 125 -7.698 11.904 -6.877 944 HZ2 TRP 125 HZ2 TRP 125 -3.923 14.349 -8.980 945 HZ3 TRP 125 HZ3 TRP 125 -7.830 12.579 -9.250 946 HH2 TRP 125 HH2 TRP 125 -5.950 13.807 -10.308 947 H ASP 126 H ASP 126 -9.072 10.735 -3.519 948 HA ASP 126 HA ASP 126 -8.880 10.552 -0.549 949 1HB ASP 126 1HB ASP 126 -11.279 10.361 -0.307 950 2HB ASP 126 2HB ASP 126 -10.915 11.850 -1.173 951 H ARG 127 H ARG 127 -8.356 8.926 -3.321 952 HA ARG 127 HA ARG 127 -8.935 6.297 -2.055 953 1HB ARG 127 1HB ARG 127 -9.331 7.087 -4.962 954 2HB ARG 127 2HB ARG 127 -9.308 5.422 -4.394 955 1HG ARG 127 1HG ARG 127 -11.128 6.671 -2.687 956 2HG ARG 127 2HG ARG 127 -11.464 7.395 -4.261 957 1HD ARG 127 1HD ARG 127 -11.205 4.809 -4.992 958 2HD ARG 127 2HD ARG 127 -11.802 4.594 -3.361 959 HE ARG 127 HE ARG 127 -13.674 6.210 -4.126 960 1HH1 ARG 127 1HH1 ARG 127 -12.095 3.885 -6.228 961 2HH1 ARG 127 2HH1 ARG 127 -13.440 3.815 -7.303 962 1HH2 ARG 127 1HH2 ARG 127 -15.388 6.045 -5.536 963 2HH2 ARG 127 2HH2 ARG 127 -15.279 5.009 -6.919 964 H VAL 128 H VAL 128 -7.250 4.728 -2.559 965 HA VAL 128 HA VAL 128 -4.987 5.757 -4.160 966 HB VAL 128 HB VAL 128 -4.749 6.417 -1.715 967 1HG1 VAL 128 1HG1 VAL 128 -5.350 3.739 -1.250 968 2HG1 VAL 128 2HG1 VAL 128 -3.615 3.839 -0.956 969 3HG1 VAL 128 3HG1 VAL 128 -4.723 4.886 -0.070 970 1HG2 VAL 128 1HG2 VAL 128 -2.659 4.732 -3.093 971 2HG2 VAL 128 2HG2 VAL 128 -2.864 6.482 -3.194 972 3HG2 VAL 128 3HG2 VAL 128 -2.333 5.741 -1.684 973 H LYS 129 H LYS 129 -3.801 4.159 -5.157 974 HA LYS 129 HA LYS 129 -4.833 1.377 -4.810 975 1HB LYS 129 1HB LYS 129 -4.976 2.647 -7.065 976 2HB LYS 129 2HB LYS 129 -3.240 2.371 -7.163 977 1HG LYS 129 1HG LYS 129 -3.559 0.250 -7.830 978 2HG LYS 129 2HG LYS 129 -4.535 -0.089 -6.402 979 1HD LYS 129 1HD LYS 129 -6.527 0.775 -7.504 980 2HD LYS 129 2HD LYS 129 -5.576 1.266 -8.905 981 1HE LYS 129 1HE LYS 129 -5.532 -1.601 -7.994 982 2HE LYS 129 2HE LYS 129 -6.865 -1.013 -8.986 983 1HZ LYS 129 1HZ LYS 129 -5.187 -0.192 -10.582 984 2HZ LYS 129 2HZ LYS 129 -3.974 -0.940 -9.656 985 3HZ LYS 129 3HZ LYS 129 -5.175 -1.878 -10.409 986 H ILE 130 H ILE 130 -3.476 0.223 -3.523 987 HA ILE 130 HA ILE 130 -0.536 0.704 -3.751 988 HB ILE 130 HB ILE 130 -2.137 -0.753 -1.616 989 1HG1 ILE 130 1HG1 ILE 130 -2.522 1.688 -1.627 990 2HG1 ILE 130 2HG1 ILE 130 -1.597 1.203 -0.209 991 1HG2 ILE 130 1HG2 ILE 130 0.779 -0.398 -2.123 992 2HG2 ILE 130 2HG2 ILE 130 0.235 -0.235 -0.454 993 3HG2 ILE 130 3HG2 ILE 130 -0.074 -1.729 -1.342 994 1HD1 ILE 130 1HD1 ILE 130 0.502 1.846 -1.404 995 2HD1 ILE 130 2HD1 ILE 130 -0.478 2.426 -2.751 996 3HD1 ILE 130 3HD1 ILE 130 -0.594 3.209 -1.175 997 H VAL 131 H VAL 131 0.522 -0.764 -5.044 998 HA VAL 131 HA VAL 131 -0.586 -3.518 -5.174 999 HB VAL 131 HB VAL 131 0.845 -2.001 -7.369 1000 1HG1 VAL 131 1HG1 VAL 131 -0.332 -4.746 -7.071 1001 2HG1 VAL 131 2HG1 VAL 131 -0.260 -3.978 -8.659 1002 3HG1 VAL 131 3HG1 VAL 131 1.225 -4.274 -7.753 1003 1HG2 VAL 131 1HG2 VAL 131 -2.047 -2.395 -6.669 1004 2HG2 VAL 131 2HG2 VAL 131 -1.243 -0.968 -7.323 1005 3HG2 VAL 131 3HG2 VAL 131 -1.585 -2.346 -8.370 1006 H CYS 132 H CYS 132 0.775 -4.988 -4.361 1007 HA CYS 132 HA CYS 132 3.642 -4.298 -4.035 1008 1HB CYS 132 1HB CYS 132 1.755 -5.647 -2.416 1009 2HB CYS 132 2HB CYS 132 2.870 -6.897 -2.969 1010 HG CYS 132 HG CYS 132 3.628 -4.474 -1.188 1011 H SER 133 H SER 133 5.296 -5.614 -4.986 1012 HA SER 133 HA SER 133 4.422 -7.831 -6.755 1013 1HB SER 133 1HB SER 133 4.929 -5.176 -7.674 1014 2HB SER 133 2HB SER 133 6.241 -6.190 -8.259 1015 HG SER 133 HG SER 133 4.743 -6.580 -9.734 1016 H GLN 134 H GLN 134 5.800 -9.451 -6.643 1017 HA GLN 134 HA GLN 134 8.477 -9.653 -7.069 1018 1HB GLN 134 1HB GLN 134 8.595 -8.093 -4.912 1019 2HB GLN 134 2HB GLN 134 8.396 -9.627 -4.084 1020 1HG GLN 134 1HG GLN 134 10.316 -9.834 -6.274 1021 2HG GLN 134 2HG GLN 134 10.793 -8.607 -5.117 1022 1HE2 GLN 134 2HE2 GLN 134 11.382 -9.278 -2.984 1023 2HE2 GLN 134 1HE2 GLN 134 11.507 -10.911 -2.549 1024 HA PRO 135 HA PRO 135 6.975 -13.785 -6.062 1025 1HB PRO 135 1HB PRO 135 9.015 -15.168 -7.226 1026 2HB PRO 135 2HB PRO 135 7.739 -14.368 -8.155 1027 1HG PRO 135 1HG PRO 135 10.568 -13.663 -7.910 1028 2HG PRO 135 2HG PRO 135 9.378 -13.133 -9.107 1029 1HD PRO 135 1HD PRO 135 10.338 -11.708 -6.773 1030 2HD PRO 135 2HD PRO 135 9.232 -11.135 -8.040 1031 H TYR 136 H TYR 136 7.208 -14.080 -3.787 1032 HA TYR 136 HA TYR 136 9.867 -15.104 -2.926 1033 1HB TYR 136 1HB TYR 136 9.388 -13.882 -0.679 1034 2HB TYR 136 2HB TYR 136 10.033 -12.956 -2.030 1035 HD1 TYR 136 HD1 TYR 136 8.582 -11.465 -3.340 1036 HD2 TYR 136 HD2 TYR 136 7.113 -13.538 0.116 1037 HE1 TYR 136 HE1 TYR 136 6.617 -9.943 -3.260 1038 HE2 TYR 136 HE2 TYR 136 5.152 -12.023 0.196 1039 HH TYR 136 HH TYR 136 4.370 -9.895 -2.380 1040 H SER 137 H SER 137 6.557 -15.732 -3.013 1041 HA SER 137 HA SER 137 6.911 -17.674 -0.770 1042 1HB SER 137 1HB SER 137 5.058 -15.525 -0.886 1043 2HB SER 137 2HB SER 137 4.135 -17.014 -1.042 1044 HG SER 137 HG SER 137 4.389 -17.027 1.058 1045 H LYS 138 H LYS 138 4.734 -19.183 -0.957 1046 HA LYS 138 HA LYS 138 3.874 -19.885 -3.608 1047 1HB LYS 138 1HB LYS 138 6.428 -20.619 -3.351 1048 2HB LYS 138 2HB LYS 138 5.691 -21.998 -2.534 1049 1HG LYS 138 1HG LYS 138 4.209 -22.329 -4.517 1050 2HG LYS 138 2HG LYS 138 5.068 -21.025 -5.338 1051 1HD LYS 138 1HD LYS 138 7.212 -22.351 -4.885 1052 2HD LYS 138 2HD LYS 138 6.161 -23.700 -4.453 1053 1HE LYS 138 1HE LYS 138 5.933 -22.221 -7.083 1054 2HE LYS 138 2HE LYS 138 6.931 -23.661 -6.877 1055 1HZ LYS 138 1HZ LYS 138 4.119 -23.696 -6.015 1056 2HZ LYS 138 2HZ LYS 138 4.493 -23.896 -7.660 1057 3HZ LYS 138 3HZ LYS 138 5.107 -24.985 -6.514 1058 H ASP 139 H ASP 139 4.560 -21.032 -0.316 1059 HA ASP 139 HA ASP 139 2.088 -22.671 -0.420 1060 1HB ASP 139 1HB ASP 139 3.000 -23.681 1.692 1061 2HB ASP 139 2HB ASP 139 4.019 -23.949 0.281 1062 H SER 140 H SER 140 3.767 -20.251 1.480 1063 HA SER 140 HA SER 140 1.263 -19.703 2.980 1064 1HB SER 140 1HB SER 140 3.072 -18.280 4.316 1065 2HB SER 140 2HB SER 140 2.863 -19.999 4.614 1066 HG SER 140 HG SER 140 4.935 -19.992 4.160 1067 HA PRO 141 HA PRO 141 1.144 -15.815 0.739 1068 1HB PRO 141 1HB PRO 141 -0.899 -14.664 2.121 1069 2HB PRO 141 2HB PRO 141 -1.134 -15.979 0.960 1070 1HG PRO 141 1HG PRO 141 -1.351 -16.021 3.888 1071 2HG PRO 141 2HG PRO 141 -2.018 -17.140 2.693 1072 1HD PRO 141 1HD PRO 141 0.326 -17.499 4.326 1073 2HD PRO 141 2HD PRO 141 -0.345 -18.611 3.112 1074 H PHE 142 H PHE 142 1.304 -13.408 1.209 1075 HA PHE 142 HA PHE 142 1.978 -12.442 3.838 1076 1HB PHE 142 1HB PHE 142 4.092 -13.722 2.336 1077 2HB PHE 142 2HB PHE 142 4.462 -12.009 2.518 1078 HD1 PHE 142 HD1 PHE 142 4.397 -10.980 4.845 1079 HD2 PHE 142 HD2 PHE 142 4.277 -15.221 4.167 1080 HE1 PHE 142 HE1 PHE 142 5.060 -11.376 7.202 1081 HE2 PHE 142 HE2 PHE 142 4.940 -15.616 6.524 1082 HZ PHE 142 HZ PHE 142 5.332 -13.693 8.041 1083 H GLY 143 H GLY 143 3.649 -10.293 3.118 1084 1HA GLY 143 1HA GLY 143 3.209 -8.917 0.753 1085 2HA GLY 143 2HA GLY 143 1.751 -8.610 1.691 1086 H LEU 144 H LEU 144 1.810 -6.994 3.182 1087 HA LEU 144 HA LEU 144 4.487 -5.976 3.992 1088 1HB LEU 144 1HB LEU 144 3.077 -3.675 4.076 1089 2HB LEU 144 2HB LEU 144 4.094 -4.165 2.730 1090 HG LEU 144 HG LEU 144 1.173 -4.878 2.896 1091 1HD1 LEU 144 1HD1 LEU 144 1.995 -2.327 2.872 1092 2HD1 LEU 144 2HD1 LEU 144 2.160 -2.678 1.151 1093 3HD1 LEU 144 3HD1 LEU 144 0.597 -2.868 1.942 1094 1HD2 LEU 144 1HD2 LEU 144 3.414 -5.235 0.987 1095 2HD2 LEU 144 2HD2 LEU 144 1.924 -6.162 1.146 1096 3HD2 LEU 144 3HD2 LEU 144 1.924 -4.644 0.252 1097 H SER 145 H SER 145 4.619 -5.041 6.061 1098 HA SER 145 HA SER 145 2.868 -6.224 8.017 1099 1HB SER 145 1HB SER 145 5.367 -4.737 7.985 1100 2HB SER 145 2HB SER 145 4.332 -4.231 9.318 1101 HG SER 145 HG SER 145 4.991 -5.999 10.233 1102 H PHE 146 H PHE 146 2.720 -3.215 6.268 1103 HA PHE 146 HA PHE 146 0.177 -2.514 7.347 1104 1HB PHE 146 1HB PHE 146 0.711 -0.620 8.799 1105 2HB PHE 146 2HB PHE 146 1.506 -2.054 9.431 1106 HD1 PHE 146 HD1 PHE 146 2.007 1.087 7.535 1107 HD2 PHE 146 HD2 PHE 146 3.924 -2.230 9.478 1108 HE1 PHE 146 HE1 PHE 146 4.189 2.241 7.340 1109 HE2 PHE 146 HE2 PHE 146 6.114 -1.076 9.277 1110 HZ PHE 146 HZ PHE 146 6.244 1.152 8.198 1111 H VAL 147 H VAL 147 -0.242 -0.037 6.949 1112 HA VAL 147 HA VAL 147 1.375 1.172 4.831 1113 HB VAL 147 HB VAL 147 -0.615 1.365 3.284 1114 1HG1 VAL 147 1HG1 VAL 147 1.313 -0.373 3.175 1115 2HG1 VAL 147 2HG1 VAL 147 0.092 -1.528 3.707 1116 3HG1 VAL 147 3HG1 VAL 147 -0.124 -0.653 2.191 1117 1HG2 VAL 147 1HG2 VAL 147 -2.339 0.785 4.978 1118 2HG2 VAL 147 2HG2 VAL 147 -2.430 -0.271 3.568 1119 3HG2 VAL 147 3HG2 VAL 147 -1.684 -0.851 5.057 1120 H ARG 148 H ARG 148 1.268 3.357 5.125 1121 HA ARG 148 HA ARG 148 -1.174 4.526 6.365 1122 1HB ARG 148 1HB ARG 148 1.583 5.292 7.344 1123 2HB ARG 148 2HB ARG 148 0.026 5.649 8.083 1124 1HG ARG 148 1HG ARG 148 -0.136 2.983 8.142 1125 2HG ARG 148 2HG ARG 148 1.620 3.127 8.149 1126 1HD ARG 148 1HD ARG 148 0.189 4.950 9.995 1127 2HD ARG 148 2HD ARG 148 0.107 3.236 10.403 1128 HE ARG 148 HE ARG 148 2.813 4.002 9.765 1129 1HH1 ARG 148 1HH1 ARG 148 0.378 4.189 12.269 1130 2HH1 ARG 148 2HH1 ARG 148 1.547 4.312 13.536 1131 1HH2 ARG 148 1HH2 ARG 148 4.291 4.163 11.436 1132 2HH2 ARG 148 2HH2 ARG 148 3.740 4.296 13.072 1133 H PHE 149 H PHE 149 -1.325 6.845 6.010 1134 HA PHE 149 HA PHE 149 0.507 7.877 3.882 1135 1HB PHE 149 1HB PHE 149 -2.501 8.234 4.067 1136 2HB PHE 149 2HB PHE 149 -1.460 9.042 2.896 1137 HD1 PHE 149 HD1 PHE 149 0.352 7.174 1.868 1138 HD2 PHE 149 HD2 PHE 149 -3.693 6.464 3.117 1139 HE1 PHE 149 HE1 PHE 149 0.240 5.200 0.373 1140 HE2 PHE 149 HE2 PHE 149 -3.804 4.488 1.621 1141 HZ PHE 149 HZ PHE 149 -1.840 3.856 0.250 1142 H HIS 150 H HIS 150 0.944 10.133 4.018 1143 HA HIS 150 HA HIS 150 -0.328 11.641 6.221 1144 1HB HIS 150 1HB HIS 150 2.358 12.351 6.574 1145 2HB HIS 150 2HB HIS 150 1.381 11.390 7.671 1146 HD1 HIS 150 HD1 HIS 150 4.486 11.256 5.955 1147 HD2 HIS 150 HD2 HIS 150 1.524 8.439 6.760 1148 HE1 HIS 150 HE1 HIS 150 5.566 8.982 5.677 1149 H SER 151 H SER 151 -0.660 13.703 5.629 1150 HA SER 151 HA SER 151 0.530 14.630 3.070 1151 1HB SER 151 1HB SER 151 -1.301 16.555 3.855 1152 2HB SER 151 2HB SER 151 -1.641 15.215 2.768 1153 HG SER 151 HG SER 151 -2.321 15.602 5.430 Start of MODEL 14 1 H MET 1 H MET 1 -3.995 17.785 12.663 2 HA MET 1 HA MET 1 -4.639 14.984 12.094 3 1HB MET 1 1HB MET 1 -5.477 15.674 9.846 4 2HB MET 1 2HB MET 1 -6.552 16.179 11.151 5 1HG MET 1 1HG MET 1 -5.044 18.371 11.070 6 2HG MET 1 2HG MET 1 -4.769 17.837 9.413 7 1HE MET 1 1HE MET 1 -5.661 19.822 8.428 8 2HE MET 1 2HE MET 1 -7.298 20.465 8.544 9 3HE MET 1 3HE MET 1 -6.174 20.648 9.898 10 HA PRO 2 HA PRO 2 -0.470 16.517 10.713 11 1HB PRO 2 1HB PRO 2 1.035 14.996 12.405 12 2HB PRO 2 2HB PRO 2 0.407 16.593 12.834 13 1HG PRO 2 1HG PRO 2 -0.399 13.953 13.823 14 2HG PRO 2 2HG PRO 2 -0.679 15.551 14.527 15 1HD PRO 2 1HD PRO 2 -2.531 13.927 13.024 16 2HD PRO 2 2HD PRO 2 -2.816 15.522 13.755 17 H GLU 3 H GLU 3 -2.290 13.892 10.228 18 HA GLU 3 HA GLU 3 -0.361 12.646 8.420 19 1HB GLU 3 1HB GLU 3 -0.621 10.372 9.450 20 2HB GLU 3 2HB GLU 3 0.279 11.496 10.467 21 1HG GLU 3 1HG GLU 3 -1.906 12.023 11.642 22 2HG GLU 3 2HG GLU 3 -2.619 10.673 10.758 23 H ILE 4 H ILE 4 -1.504 10.583 7.459 24 HA ILE 4 HA ILE 4 -4.413 11.202 7.151 25 HB ILE 4 HB ILE 4 -2.351 10.405 5.077 26 1HG1 ILE 4 1HG1 ILE 4 -4.333 12.692 5.192 27 2HG1 ILE 4 2HG1 ILE 4 -2.649 12.815 5.700 28 1HG2 ILE 4 1HG2 ILE 4 -5.374 10.393 4.862 29 2HG2 ILE 4 2HG2 ILE 4 -4.297 10.410 3.464 30 3HG2 ILE 4 3HG2 ILE 4 -4.278 9.040 4.576 31 1HD1 ILE 4 1HD1 ILE 4 -3.409 11.835 2.948 32 2HD1 ILE 4 2HD1 ILE 4 -3.194 13.551 3.298 33 3HD1 ILE 4 3HD1 ILE 4 -1.845 12.433 3.503 34 H ARG 5 H ARG 5 -5.661 9.555 7.809 35 HA ARG 5 HA ARG 5 -4.427 6.857 8.104 36 1HB ARG 5 1HB ARG 5 -6.739 8.242 9.461 37 2HB ARG 5 2HB ARG 5 -6.559 6.490 9.536 38 1HG ARG 5 1HG ARG 5 -5.106 6.760 11.236 39 2HG ARG 5 2HG ARG 5 -3.995 7.540 10.113 40 1HD ARG 5 1HD ARG 5 -4.230 9.299 11.559 41 2HD ARG 5 2HD ARG 5 -5.677 9.606 10.599 42 HE ARG 5 HE ARG 5 -6.162 7.779 12.816 43 1HH1 ARG 5 1HH1 ARG 5 -5.944 11.138 11.858 44 2HH1 ARG 5 2HH1 ARG 5 -6.953 11.677 13.154 45 1HH2 ARG 5 1HH2 ARG 5 -7.464 8.522 14.477 46 2HH2 ARG 5 2HH2 ARG 5 -7.805 10.214 14.624 47 H LEU 6 H LEU 6 -6.144 5.040 7.845 48 HA LEU 6 HA LEU 6 -7.511 5.487 5.237 49 1HB LEU 6 1HB LEU 6 -6.051 3.266 6.485 50 2HB LEU 6 2HB LEU 6 -7.578 2.763 5.767 51 HG LEU 6 HG LEU 6 -6.941 3.747 3.622 52 1HD1 LEU 6 1HD1 LEU 6 -4.400 4.560 5.076 53 2HD1 LEU 6 2HD1 LEU 6 -4.640 4.673 3.332 54 3HD1 LEU 6 3HD1 LEU 6 -5.622 5.651 4.424 55 1HD2 LEU 6 1HD2 LEU 6 -4.750 2.047 4.850 56 2HD2 LEU 6 2HD2 LEU 6 -6.222 1.450 4.086 57 3HD2 LEU 6 3HD2 LEU 6 -5.001 2.279 3.121 58 H ARG 7 H ARG 7 -9.604 4.266 4.970 59 HA ARG 7 HA ARG 7 -11.164 4.257 7.524 60 1HB ARG 7 1HB ARG 7 -11.755 6.132 5.959 61 2HB ARG 7 2HB ARG 7 -12.210 4.923 4.758 62 1HG ARG 7 1HG ARG 7 -14.223 5.588 5.916 63 2HG ARG 7 2HG ARG 7 -13.810 3.959 6.455 64 1HD ARG 7 1HD ARG 7 -13.247 4.652 8.570 65 2HD ARG 7 2HD ARG 7 -12.644 6.212 8.011 66 HE ARG 7 HE ARG 7 -15.366 6.387 7.576 67 1HH1 ARG 7 1HH1 ARG 7 -13.381 5.582 10.342 68 2HH1 ARG 7 2HH1 ARG 7 -14.542 6.183 11.475 69 1HH2 ARG 7 1HH2 ARG 7 -16.835 7.155 9.075 70 2HH2 ARG 7 2HH2 ARG 7 -16.475 7.065 10.768 71 H HIS 8 H HIS 8 -10.982 2.928 4.242 72 HA HIS 8 HA HIS 8 -11.498 0.233 5.230 73 1HB HIS 8 1HB HIS 8 -13.528 -0.103 3.806 74 2HB HIS 8 2HB HIS 8 -13.799 1.007 5.147 75 HD1 HIS 8 HD1 HIS 8 -14.550 3.343 4.574 76 HD2 HIS 8 HD2 HIS 8 -13.115 1.295 1.239 77 HE1 HIS 8 HE1 HIS 8 -15.026 4.815 2.569 78 H VAL 9 H VAL 9 -12.027 -1.119 2.956 79 HA VAL 9 HA VAL 9 -9.753 -0.354 1.196 80 HB VAL 9 HB VAL 9 -9.596 -2.587 2.222 81 1HG1 VAL 9 1HG1 VAL 9 -12.376 -2.664 1.748 82 2HG1 VAL 9 2HG1 VAL 9 -11.683 -3.913 0.713 83 3HG1 VAL 9 3HG1 VAL 9 -11.378 -3.936 2.449 84 1HG2 VAL 9 1HG2 VAL 9 -10.169 -2.601 -0.757 85 2HG2 VAL 9 2HG2 VAL 9 -8.609 -2.327 0.017 86 3HG2 VAL 9 3HG2 VAL 9 -9.371 -3.916 0.105 87 H VAL 10 H VAL 10 -10.820 1.135 -0.176 88 HA VAL 10 HA VAL 10 -13.379 0.828 -1.322 89 HB VAL 10 HB VAL 10 -12.394 2.961 -1.589 90 1HG1 VAL 10 1HG1 VAL 10 -9.968 1.582 -1.855 91 2HG1 VAL 10 2HG1 VAL 10 -10.180 2.411 -3.391 92 3HG1 VAL 10 3HG1 VAL 10 -10.198 3.325 -1.885 93 1HG2 VAL 10 1HG2 VAL 10 -13.411 1.642 -3.780 94 2HG2 VAL 10 2HG2 VAL 10 -13.043 3.363 -3.735 95 3HG2 VAL 10 3HG2 VAL 10 -11.871 2.232 -4.404 96 H SER 11 H SER 11 -10.274 0.023 -2.990 97 HA SER 11 HA SER 11 -11.848 -2.035 -4.470 98 1HB SER 11 1HB SER 11 -10.205 0.122 -5.496 99 2HB SER 11 2HB SER 11 -9.580 -1.436 -6.028 100 HG SER 11 HG SER 11 -11.178 -0.717 -7.447 101 H CYS 12 H CYS 12 -10.409 -3.928 -5.174 102 HA CYS 12 HA CYS 12 -7.897 -4.253 -3.682 103 1HB CYS 12 1HB CYS 12 -8.763 -6.214 -2.409 104 2HB CYS 12 2HB CYS 12 -9.488 -4.697 -1.907 105 HG CYS 12 HG CYS 12 -11.457 -6.355 -2.252 106 H SER 13 H SER 13 -6.696 -6.065 -4.367 107 HA SER 13 HA SER 13 -7.893 -7.964 -6.269 108 1HB SER 13 1HB SER 13 -6.810 -5.680 -7.324 109 2HB SER 13 2HB SER 13 -5.417 -6.757 -7.333 110 HG SER 13 HG SER 13 -7.513 -6.731 -8.970 111 H SER 14 H SER 14 -6.994 -8.645 -3.817 112 HA SER 14 HA SER 14 -5.418 -10.822 -3.913 113 1HB SER 14 1HB SER 14 -3.659 -8.422 -4.089 114 2HB SER 14 2HB SER 14 -3.136 -9.754 -3.073 115 HG SER 14 HG SER 14 -3.544 -11.122 -4.928 116 H GLN 15 H GLN 15 -7.237 -10.478 -2.174 117 HA GLN 15 HA GLN 15 -5.882 -9.727 0.384 118 1HB GLN 15 1HB GLN 15 -8.842 -9.600 0.395 119 2HB GLN 15 2HB GLN 15 -7.679 -8.501 1.103 120 1HG GLN 15 1HG GLN 15 -8.457 -8.622 -1.823 121 2HG GLN 15 2HG GLN 15 -8.965 -7.390 -0.671 122 1HE2 GLN 15 2HE2 GLN 15 -6.267 -7.274 0.643 123 2HE2 GLN 15 1HE2 GLN 15 -5.272 -6.455 -0.458 124 H ASP 16 H ASP 16 -5.938 -11.208 1.969 125 HA ASP 16 HA ASP 16 -7.122 -13.839 1.438 126 1HB ASP 16 1HB ASP 16 -4.876 -13.095 2.709 127 2HB ASP 16 2HB ASP 16 -5.964 -13.141 4.091 128 H SER 17 H SER 17 -8.106 -14.769 3.729 129 HA SER 17 HA SER 17 -10.501 -13.103 4.178 130 1HB SER 17 1HB SER 17 -10.287 -15.764 3.815 131 2HB SER 17 2HB SER 17 -10.157 -15.715 5.571 132 HG SER 17 HG SER 17 -12.316 -15.340 3.976 133 H THR 18 H THR 18 -8.362 -15.023 6.325 134 HA THR 18 HA THR 18 -9.056 -13.540 8.681 135 HB THR 18 HB THR 18 -6.591 -14.549 9.274 136 HG1 THR 18 HG1 THR 18 -6.044 -15.511 7.455 137 1HG2 THR 18 1HG2 THR 18 -9.301 -15.867 9.164 138 2HG2 THR 18 2HG2 THR 18 -7.902 -16.688 9.857 139 3HG2 THR 18 3HG2 THR 18 -8.475 -15.176 10.561 140 H HIS 19 H HIS 19 -6.056 -13.484 6.717 141 HA HIS 19 HA HIS 19 -5.391 -10.836 7.884 142 1HB HIS 19 1HB HIS 19 -3.776 -12.560 5.977 143 2HB HIS 19 2HB HIS 19 -3.200 -11.145 6.856 144 HD1 HIS 19 HD1 HIS 19 -3.629 -11.442 9.634 145 HD2 HIS 19 HD2 HIS 19 -3.165 -14.880 7.322 146 HE1 HIS 19 HE1 HIS 19 -2.982 -13.298 11.232 147 H CYS 20 H CYS 20 -7.391 -10.065 6.598 148 HA CYS 20 HA CYS 20 -6.965 -9.799 3.701 149 1HB CYS 20 1HB CYS 20 -9.155 -8.634 3.732 150 2HB CYS 20 2HB CYS 20 -9.240 -10.204 4.522 151 HG CYS 20 HG CYS 20 -10.237 -7.944 5.896 152 H ALA 21 H ALA 21 -7.217 -7.568 2.735 153 HA ALA 21 HA ALA 21 -5.162 -5.827 3.655 154 1HB ALA 21 1HB ALA 21 -7.299 -5.760 1.585 155 2HB ALA 21 2HB ALA 21 -6.635 -4.201 2.075 156 3HB ALA 21 3HB ALA 21 -5.570 -5.450 1.431 157 H GLU 22 H GLU 22 -8.559 -6.056 4.473 158 HA GLU 22 HA GLU 22 -8.967 -3.396 5.426 159 1HB GLU 22 1HB GLU 22 -10.544 -5.624 5.196 160 2HB GLU 22 2HB GLU 22 -10.317 -5.543 6.943 161 1HG GLU 22 1HG GLU 22 -10.988 -3.117 6.848 162 2HG GLU 22 2HG GLU 22 -11.383 -3.347 5.144 163 H ASN 23 H ASN 23 -7.134 -6.050 6.734 164 HA ASN 23 HA ASN 23 -7.180 -5.272 9.505 165 1HB ASN 23 1HB ASN 23 -5.257 -6.852 7.815 166 2HB ASN 23 2HB ASN 23 -4.927 -6.521 9.513 167 1HD2 ASN 23 2HD2 ASN 23 -6.035 -8.964 7.699 168 2HD2 ASN 23 1HD2 ASN 23 -7.218 -9.622 8.724 169 H LEU 24 H LEU 24 -5.665 -3.955 6.715 170 HA LEU 24 HA LEU 24 -3.428 -2.651 7.923 171 1HB LEU 24 1HB LEU 24 -5.026 -1.778 5.493 172 2HB LEU 24 2HB LEU 24 -3.363 -1.330 5.880 173 HG LEU 24 HG LEU 24 -4.074 -4.242 5.655 174 1HD1 LEU 24 1HD1 LEU 24 -4.895 -2.822 3.623 175 2HD1 LEU 24 2HD1 LEU 24 -3.178 -2.689 3.248 176 3HD1 LEU 24 3HD1 LEU 24 -3.942 -4.277 3.328 177 1HD2 LEU 24 1HD2 LEU 24 -1.781 -2.910 6.292 178 2HD2 LEU 24 2HD2 LEU 24 -1.820 -4.524 5.583 179 3HD2 LEU 24 3HD2 LEU 24 -1.577 -3.114 4.552 180 H LEU 25 H LEU 25 -6.866 -1.991 7.828 181 HA LEU 25 HA LEU 25 -6.845 0.791 8.407 182 1HB LEU 25 1HB LEU 25 -8.734 -1.494 8.900 183 2HB LEU 25 2HB LEU 25 -9.053 0.054 9.657 184 HG LEU 25 HG LEU 25 -10.216 -0.258 7.454 185 1HD1 LEU 25 1HD1 LEU 25 -8.276 1.983 7.939 186 2HD1 LEU 25 2HD1 LEU 25 -9.244 1.956 6.469 187 3HD1 LEU 25 3HD1 LEU 25 -10.032 1.986 8.044 188 1HD2 LEU 25 1HD2 LEU 25 -8.323 -1.526 6.381 189 2HD2 LEU 25 2HD2 LEU 25 -8.938 -0.199 5.396 190 3HD2 LEU 25 3HD2 LEU 25 -7.427 -0.010 6.286 191 H LYS 26 H LYS 26 -5.969 -1.990 10.304 192 HA LYS 26 HA LYS 26 -5.946 -0.311 12.780 193 1HB LYS 26 1HB LYS 26 -5.629 -3.324 12.662 194 2HB LYS 26 2HB LYS 26 -6.004 -2.328 14.065 195 1HG LYS 26 1HG LYS 26 -7.815 -2.603 11.651 196 2HG LYS 26 2HG LYS 26 -8.005 -3.525 13.143 197 1HD LYS 26 1HD LYS 26 -7.886 -1.086 14.225 198 2HD LYS 26 2HD LYS 26 -8.489 -0.623 12.633 199 1HE LYS 26 1HE LYS 26 -10.476 -1.035 13.793 200 2HE LYS 26 2HE LYS 26 -10.189 -2.586 13.003 201 1HZ LYS 26 1HZ LYS 26 -8.897 -3.123 15.143 202 2HZ LYS 26 2HZ LYS 26 -9.769 -1.837 15.822 203 3HZ LYS 26 3HZ LYS 26 -10.595 -3.176 15.183 204 H ALA 27 H ALA 27 -3.985 0.530 11.385 205 HA ALA 27 HA ALA 27 -1.598 -0.894 11.013 206 1HB ALA 27 1HB ALA 27 -2.316 1.952 11.422 207 2HB ALA 27 2HB ALA 27 -0.631 1.540 11.737 208 3HB ALA 27 3HB ALA 27 -1.340 1.205 10.158 209 H ASP 28 H ASP 28 -3.018 0.202 14.019 210 HA ASP 28 HA ASP 28 -0.568 -0.736 15.459 211 1HB ASP 28 1HB ASP 28 -2.463 1.525 15.980 212 2HB ASP 28 2HB ASP 28 -1.712 0.721 17.359 213 H THR 29 H THR 29 -1.572 -2.921 15.257 214 HA THR 29 HA THR 29 -3.189 -3.508 17.625 215 HB THR 29 HB THR 29 -4.849 -4.842 16.121 216 HG1 THR 29 HG1 THR 29 -4.674 -4.496 14.076 217 1HG2 THR 29 1HG2 THR 29 -5.135 -2.595 17.467 218 2HG2 THR 29 2HG2 THR 29 -5.188 -1.876 15.857 219 3HG2 THR 29 3HG2 THR 29 -6.374 -3.098 16.316 220 H TYR 30 H TYR 30 -3.143 -5.623 14.779 221 HA TYR 30 HA TYR 30 -0.709 -7.000 15.342 222 1HB TYR 30 1HB TYR 30 -1.642 -9.034 16.441 223 2HB TYR 30 2HB TYR 30 -1.777 -7.602 17.460 224 HD1 TYR 30 HD1 TYR 30 -3.955 -6.475 17.778 225 HD2 TYR 30 HD2 TYR 30 -3.602 -10.096 15.496 226 HE1 TYR 30 HE1 TYR 30 -6.413 -6.791 17.899 227 HE2 TYR 30 HE2 TYR 30 -6.059 -10.413 15.617 228 HH TYR 30 HH TYR 30 -8.080 -8.984 15.946 229 H ARG 31 H ARG 31 -2.377 -6.174 13.077 230 HA ARG 31 HA ARG 31 -2.452 -8.779 11.658 231 1HB ARG 31 1HB ARG 31 -4.747 -6.790 11.697 232 2HB ARG 31 2HB ARG 31 -4.631 -8.166 10.604 233 1HG ARG 31 1HG ARG 31 -4.529 -8.481 13.610 234 2HG ARG 31 2HG ARG 31 -6.039 -8.525 12.704 235 1HD ARG 31 1HD ARG 31 -3.882 -10.238 11.619 236 2HD ARG 31 2HD ARG 31 -4.508 -10.725 13.195 237 HE ARG 31 HE ARG 31 -6.619 -10.126 11.277 238 1HH1 ARG 31 1HH1 ARG 31 -4.404 -12.572 12.433 239 2HH1 ARG 31 2HH1 ARG 31 -5.414 -13.876 11.916 240 1HH2 ARG 31 1HH2 ARG 31 -7.893 -11.843 10.614 241 2HH2 ARG 31 2HH2 ARG 31 -7.368 -13.469 10.894 242 H LYS 32 H LYS 32 -1.897 -8.552 9.455 243 HA LYS 32 HA LYS 32 -1.415 -5.758 8.500 244 1HB LYS 32 1HB LYS 32 0.475 -7.841 7.537 245 2HB LYS 32 2HB LYS 32 0.757 -6.150 7.917 246 1HG LYS 32 1HG LYS 32 0.340 -8.301 10.013 247 2HG LYS 32 2HG LYS 32 1.924 -7.750 9.471 248 1HD LYS 32 1HD LYS 32 1.766 -5.762 10.584 249 2HD LYS 32 2HD LYS 32 0.035 -5.614 10.283 250 1HE LYS 32 1HE LYS 32 0.228 -5.984 12.628 251 2HE LYS 32 2HE LYS 32 -0.261 -7.539 11.955 252 1HZ LYS 32 1HZ LYS 32 2.594 -6.881 12.274 253 2HZ LYS 32 2HZ LYS 32 1.694 -7.460 13.595 254 3HZ LYS 32 3HZ LYS 32 1.851 -8.404 12.191 255 H TRP 33 H TRP 33 -0.432 -6.492 5.919 256 HA TRP 33 HA TRP 33 -2.954 -7.563 4.758 257 1HB TRP 33 1HB TRP 33 -2.073 -5.405 3.815 258 2HB TRP 33 2HB TRP 33 -0.618 -6.250 3.339 259 HD1 TRP 33 HD1 TRP 33 -4.022 -7.923 2.989 260 HE1 TRP 33 HE1 TRP 33 -4.516 -8.285 0.480 261 HE3 TRP 33 HE3 TRP 33 -0.145 -5.332 0.969 262 HZ2 TRP 33 HZ2 TRP 33 -3.415 -7.521 -2.052 263 HZ3 TRP 33 HZ3 TRP 33 0.117 -5.177 -1.499 264 HH2 TRP 33 HH2 TRP 33 -1.514 -6.253 -2.993 265 H ARG 34 H ARG 34 -3.017 -9.461 3.688 266 HA ARG 34 HA ARG 34 -0.498 -10.790 2.905 267 1HB ARG 34 1HB ARG 34 -1.978 -11.533 5.232 268 2HB ARG 34 2HB ARG 34 -2.282 -12.777 4.022 269 1HG ARG 34 1HG ARG 34 0.062 -13.208 3.749 270 2HG ARG 34 2HG ARG 34 0.498 -11.779 4.688 271 1HD ARG 34 1HD ARG 34 -0.381 -12.757 6.713 272 2HD ARG 34 2HD ARG 34 -1.064 -14.116 5.819 273 HE ARG 34 HE ARG 34 1.821 -13.866 5.479 274 1HH1 ARG 34 1HH1 ARG 34 -0.735 -15.150 7.494 275 2HH1 ARG 34 2HH1 ARG 34 0.271 -16.395 8.148 276 1HH2 ARG 34 1HH2 ARG 34 3.085 -15.489 6.353 277 2HH2 ARG 34 2HH2 ARG 34 2.410 -16.586 7.511 278 H ALA 35 H ALA 35 -0.797 -11.533 0.845 279 HA ALA 35 HA ALA 35 -3.159 -11.137 -0.653 280 1HB ALA 35 1HB ALA 35 -0.768 -11.698 -1.463 281 2HB ALA 35 2HB ALA 35 -1.219 -13.387 -1.234 282 3HB ALA 35 3HB ALA 35 -2.108 -12.384 -2.380 283 H ALA 36 H ALA 36 -4.627 -12.738 -1.591 284 HA ALA 36 HA ALA 36 -5.605 -14.622 0.432 285 1HB ALA 36 1HB ALA 36 -6.775 -13.100 -1.609 286 2HB ALA 36 2HB ALA 36 -6.934 -14.769 -2.156 287 3HB ALA 36 3HB ALA 36 -7.590 -14.286 -0.592 288 H LYS 37 H LYS 37 -4.346 -14.752 -2.871 289 HA LYS 37 HA LYS 37 -4.352 -17.666 -2.943 290 1HB LYS 37 1HB LYS 37 -4.409 -15.815 -4.896 291 2HB LYS 37 2HB LYS 37 -2.664 -16.060 -4.815 292 1HG LYS 37 1HG LYS 37 -3.161 -17.756 -6.282 293 2HG LYS 37 2HG LYS 37 -3.446 -18.632 -4.777 294 1HD LYS 37 1HD LYS 37 -5.453 -19.066 -5.825 295 2HD LYS 37 2HD LYS 37 -5.873 -17.539 -5.048 296 1HE LYS 37 1HE LYS 37 -6.488 -16.962 -7.178 297 2HE LYS 37 2HE LYS 37 -4.769 -16.596 -7.331 298 1HZ LYS 37 1HZ LYS 37 -5.903 -19.266 -7.932 299 2HZ LYS 37 2HZ LYS 37 -5.739 -18.054 -9.108 300 3HZ LYS 37 3HZ LYS 37 -4.361 -18.673 -8.329 301 H ALA 38 H ALA 38 -1.629 -17.841 -4.142 302 HA ALA 38 HA ALA 38 0.076 -17.168 -1.807 303 1HB ALA 38 1HB ALA 38 -0.904 -19.646 -1.923 304 2HB ALA 38 2HB ALA 38 0.442 -19.860 -3.042 305 3HB ALA 38 3HB ALA 38 0.746 -19.332 -1.387 306 H GLY 39 H GLY 39 2.400 -18.330 -2.614 307 1HA GLY 39 1HA GLY 39 4.021 -18.390 -4.361 308 2HA GLY 39 2HA GLY 39 2.943 -17.515 -5.415 309 H GLU 40 H GLU 40 2.437 -15.611 -3.011 310 HA GLU 40 HA GLU 40 3.285 -13.543 -2.352 311 1HB GLU 40 1HB GLU 40 5.434 -15.577 -2.105 312 2HB GLU 40 2HB GLU 40 5.929 -13.903 -1.955 313 1HG GLU 40 1HG GLU 40 4.401 -13.528 -0.132 314 2HG GLU 40 2HG GLU 40 3.582 -15.056 -0.437 315 H LYS 41 H LYS 41 2.887 -13.463 -5.058 316 HA LYS 41 HA LYS 41 5.429 -12.383 -6.178 317 1HB LYS 41 1HB LYS 41 4.075 -12.560 -8.411 318 2HB LYS 41 2HB LYS 41 4.765 -14.017 -7.701 319 1HG LYS 41 1HG LYS 41 2.682 -14.757 -6.898 320 2HG LYS 41 2HG LYS 41 1.958 -13.155 -7.022 321 1HD LYS 41 1HD LYS 41 2.133 -13.288 -9.496 322 2HD LYS 41 2HD LYS 41 2.793 -14.917 -9.347 323 1HE LYS 41 1HE LYS 41 0.681 -15.517 -8.050 324 2HE LYS 41 2HE LYS 41 0.028 -13.964 -8.573 325 1HZ LYS 41 1HZ LYS 41 0.423 -14.629 -10.873 326 2HZ LYS 41 2HZ LYS 41 0.994 -16.141 -10.347 327 3HZ LYS 41 3HZ LYS 41 -0.626 -15.710 -10.087 328 H THR 42 H THR 42 2.472 -11.417 -7.776 329 HA THR 42 HA THR 42 2.884 -8.669 -6.697 330 HB THR 42 HB THR 42 1.883 -7.868 -8.762 331 HG1 THR 42 HG1 THR 42 1.047 -9.272 -10.244 332 1HG2 THR 42 1HG2 THR 42 4.333 -8.935 -8.603 333 2HG2 THR 42 2HG2 THR 42 3.654 -10.024 -9.812 334 3HG2 THR 42 3HG2 THR 42 3.696 -8.286 -10.115 335 H ILE 43 H ILE 43 1.132 -7.549 -5.855 336 HA ILE 43 HA ILE 43 -1.548 -8.825 -5.910 337 HB ILE 43 HB ILE 43 -1.703 -8.298 -3.387 338 1HG1 ILE 43 1HG1 ILE 43 1.309 -8.511 -3.650 339 2HG1 ILE 43 2HG1 ILE 43 0.425 -7.036 -3.258 340 1HG2 ILE 43 1HG2 ILE 43 -1.240 -10.584 -4.734 341 2HG2 ILE 43 2HG2 ILE 43 0.195 -10.533 -3.716 342 3HG2 ILE 43 3HG2 ILE 43 -1.401 -10.505 -2.983 343 1HD1 ILE 43 1HD1 ILE 43 -0.629 -8.620 -1.375 344 2HD1 ILE 43 2HD1 ILE 43 0.909 -9.459 -1.577 345 3HD1 ILE 43 3HD1 ILE 43 0.887 -7.758 -1.112 346 H SER 44 H SER 44 -3.250 -7.297 -5.632 347 HA SER 44 HA SER 44 -2.309 -4.463 -5.420 348 1HB SER 44 1HB SER 44 -4.847 -4.911 -6.828 349 2HB SER 44 2HB SER 44 -3.521 -3.840 -7.228 350 HG SER 44 HG SER 44 -3.826 -5.628 -8.701 351 H VAL 45 H VAL 45 -3.492 -3.096 -4.121 352 HA VAL 45 HA VAL 45 -6.028 -4.011 -2.929 353 HB VAL 45 HB VAL 45 -4.357 -5.000 -1.428 354 1HG1 VAL 45 1HG1 VAL 45 -2.626 -3.153 -1.989 355 2HG1 VAL 45 2HG1 VAL 45 -3.416 -2.230 -0.716 356 3HG1 VAL 45 3HG1 VAL 45 -2.663 -3.779 -0.346 357 1HG2 VAL 45 1HG2 VAL 45 -5.921 -2.627 -0.409 358 2HG2 VAL 45 2HG2 VAL 45 -6.338 -4.338 -0.308 359 3HG2 VAL 45 3HG2 VAL 45 -5.030 -3.689 0.679 360 H VAL 46 H VAL 46 -7.195 -2.187 -3.499 361 HA VAL 46 HA VAL 46 -5.914 0.470 -3.240 362 HB VAL 46 HB VAL 46 -8.708 -0.099 -4.199 363 1HG1 VAL 46 1HG1 VAL 46 -7.896 2.250 -3.596 364 2HG1 VAL 46 2HG1 VAL 46 -6.822 2.116 -4.989 365 3HG1 VAL 46 3HG1 VAL 46 -8.571 2.045 -5.213 366 1HG2 VAL 46 1HG2 VAL 46 -6.083 -0.483 -5.564 367 2HG2 VAL 46 2HG2 VAL 46 -7.598 -1.356 -5.792 368 3HG2 VAL 46 3HG2 VAL 46 -7.386 0.243 -6.507 369 H LEU 47 H LEU 47 -6.075 1.468 -1.341 370 HA LEU 47 HA LEU 47 -8.357 0.788 0.442 371 1HB LEU 47 1HB LEU 47 -5.996 2.437 1.301 372 2HB LEU 47 2HB LEU 47 -7.029 1.390 2.270 373 HG LEU 47 HG LEU 47 -5.981 -0.412 0.482 374 1HD1 LEU 47 1HD1 LEU 47 -4.104 1.894 0.770 375 2HD1 LEU 47 2HD1 LEU 47 -3.416 0.270 0.813 376 3HD1 LEU 47 3HD1 LEU 47 -4.343 0.799 -0.593 377 1HD2 LEU 47 1HD2 LEU 47 -6.085 -0.281 3.110 378 2HD2 LEU 47 2HD2 LEU 47 -4.873 -1.302 2.339 379 3HD2 LEU 47 3HD2 LEU 47 -4.421 0.284 2.959 380 H GLN 48 H GLN 48 -9.540 2.472 1.483 381 HA GLN 48 HA GLN 48 -9.781 4.904 -0.182 382 1HB GLN 48 1HB GLN 48 -11.691 3.334 0.853 383 2HB GLN 48 2HB GLN 48 -11.506 4.447 2.210 384 1HG GLN 48 1HG GLN 48 -11.665 5.638 -0.518 385 2HG GLN 48 2HG GLN 48 -13.153 4.976 0.163 386 1HE2 GLN 48 2HE2 GLN 48 -12.024 7.883 -0.227 387 2HE2 GLN 48 1HE2 GLN 48 -12.307 8.603 1.283 388 H LEU 49 H LEU 49 -9.897 7.026 0.873 389 HA LEU 49 HA LEU 49 -8.098 7.194 3.242 390 1HB LEU 49 1HB LEU 49 -8.682 9.074 0.947 391 2HB LEU 49 2HB LEU 49 -7.964 9.662 2.443 392 HG LEU 49 HG LEU 49 -6.219 9.134 0.789 393 1HD1 LEU 49 1HD1 LEU 49 -6.111 8.547 3.380 394 2HD1 LEU 49 2HD1 LEU 49 -5.989 6.899 2.762 395 3HD1 LEU 49 3HD1 LEU 49 -4.795 8.108 2.290 396 1HD2 LEU 49 1HD2 LEU 49 -7.758 7.231 -0.187 397 2HD2 LEU 49 2HD2 LEU 49 -6.005 7.064 -0.265 398 3HD2 LEU 49 3HD2 LEU 49 -6.917 6.219 0.986 399 H GLU 50 H GLU 50 -9.076 7.787 5.095 400 HA GLU 50 HA GLU 50 -11.827 8.195 5.445 401 1HB GLU 50 1HB GLU 50 -10.186 7.679 7.247 402 2HB GLU 50 2HB GLU 50 -9.635 9.353 7.180 403 1HG GLU 50 1HG GLU 50 -11.642 10.190 8.037 404 2HG GLU 50 2HG GLU 50 -12.560 8.768 7.541 405 H LYS 51 H LYS 51 -9.726 10.439 3.952 406 HA LYS 51 HA LYS 51 -11.829 12.437 3.840 407 1HB LYS 51 1HB LYS 51 -10.381 14.264 4.795 408 2HB LYS 51 2HB LYS 51 -10.907 13.080 5.992 409 1HG LYS 51 1HG LYS 51 -8.776 11.972 5.958 410 2HG LYS 51 2HG LYS 51 -8.252 12.894 4.549 411 1HD LYS 51 1HD LYS 51 -8.497 14.989 5.950 412 2HD LYS 51 2HD LYS 51 -8.741 13.940 7.348 413 1HE LYS 51 1HE LYS 51 -6.496 12.824 6.320 414 2HE LYS 51 2HE LYS 51 -6.264 14.495 5.807 415 1HZ LYS 51 1HZ LYS 51 -6.893 15.049 8.214 416 2HZ LYS 51 2HZ LYS 51 -6.539 13.423 8.540 417 3HZ LYS 51 3HZ LYS 51 -5.335 14.442 7.909 418 H GLU 52 H GLU 52 -11.540 13.722 2.010 419 HA GLU 52 HA GLU 52 -9.479 12.915 0.127 420 1HB GLU 52 1HB GLU 52 -11.902 13.712 -0.389 421 2HB GLU 52 2HB GLU 52 -11.236 15.332 -0.191 422 1HG GLU 52 1HG GLU 52 -9.381 14.511 -1.832 423 2HG GLU 52 2HG GLU 52 -10.552 13.264 -2.260 424 H GLU 53 H GLU 53 -7.481 13.642 0.356 425 HA GLU 53 HA GLU 53 -6.991 16.527 0.766 426 1HB GLU 53 1HB GLU 53 -5.030 15.624 2.391 427 2HB GLU 53 2HB GLU 53 -6.606 16.120 2.999 428 1HG GLU 53 1HG GLU 53 -5.880 13.931 3.932 429 2HG GLU 53 2HG GLU 53 -7.368 13.791 3.000 430 H GLN 54 H GLN 54 -4.368 16.683 0.816 431 HA GLN 54 HA GLN 54 -3.538 15.438 -1.736 432 1HB GLN 54 1HB GLN 54 -2.173 17.538 -0.017 433 2HB GLN 54 2HB GLN 54 -1.643 17.020 -1.614 434 1HG GLN 54 1HG GLN 54 -3.502 17.972 -2.685 435 2HG GLN 54 2HG GLN 54 -4.430 18.051 -1.196 436 1HE2 GLN 54 2HE2 GLN 54 -1.033 19.107 -1.584 437 2HE2 GLN 54 1HE2 GLN 54 -1.338 20.744 -1.253 438 H ILE 55 H ILE 55 -1.096 14.732 -1.734 439 HA ILE 55 HA ILE 55 -0.484 13.299 0.821 440 HB ILE 55 HB ILE 55 -0.094 12.186 -1.975 441 1HG1 ILE 55 1HG1 ILE 55 -1.885 10.534 -0.767 442 2HG1 ILE 55 2HG1 ILE 55 -2.352 12.074 -0.046 443 1HG2 ILE 55 1HG2 ILE 55 1.486 11.455 -0.124 444 2HG2 ILE 55 2HG2 ILE 55 0.080 10.790 0.707 445 3HG2 ILE 55 3HG2 ILE 55 0.555 10.155 -0.868 446 1HD1 ILE 55 1HD1 ILE 55 -2.140 12.902 -2.573 447 2HD1 ILE 55 2HD1 ILE 55 -2.473 11.202 -2.900 448 3HD1 ILE 55 3HD1 ILE 55 -3.623 12.163 -1.970 449 H HIS 56 H HIS 56 1.453 13.966 1.574 450 HA HIS 56 HA HIS 56 3.468 14.978 -0.389 451 1HB HIS 56 1HB HIS 56 2.507 16.454 1.551 452 2HB HIS 56 2HB HIS 56 3.594 15.504 2.566 453 HD1 HIS 56 HD1 HIS 56 3.736 17.609 -0.611 454 HD2 HIS 56 HD2 HIS 56 6.213 16.402 2.517 455 HE1 HIS 56 HE1 HIS 56 5.936 18.822 -0.932 456 H SER 57 H SER 57 2.880 12.735 2.254 457 HA SER 57 HA SER 57 5.414 11.349 1.575 458 1HB SER 57 1HB SER 57 4.790 12.630 4.216 459 2HB SER 57 2HB SER 57 5.686 11.114 4.196 460 HG SER 57 HG SER 57 7.308 12.431 3.864 461 H VAL 58 H VAL 58 5.410 9.145 2.376 462 HA VAL 58 HA VAL 58 2.767 8.160 3.322 463 HB VAL 58 HB VAL 58 4.256 7.170 0.881 464 1HG1 VAL 58 1HG1 VAL 58 1.822 6.175 2.356 465 2HG1 VAL 58 2HG1 VAL 58 2.053 5.830 0.642 466 3HG1 VAL 58 3HG1 VAL 58 3.232 5.266 1.822 467 1HG2 VAL 58 1HG2 VAL 58 1.859 8.914 1.313 468 2HG2 VAL 58 2HG2 VAL 58 3.162 9.076 0.135 469 3HG2 VAL 58 3HG2 VAL 58 1.905 7.862 -0.102 470 H ASP 59 H ASP 59 2.905 5.866 4.038 471 HA ASP 59 HA ASP 59 5.663 4.966 4.724 472 1HB ASP 59 1HB ASP 59 3.387 5.573 6.581 473 2HB ASP 59 2HB ASP 59 4.480 4.254 6.986 474 H ILE 60 H ILE 60 5.888 2.727 4.697 475 HA ILE 60 HA ILE 60 3.536 0.971 4.671 476 HB ILE 60 HB ILE 60 5.057 1.672 2.192 477 1HG1 ILE 60 1HG1 ILE 60 2.566 0.730 1.494 478 2HG1 ILE 60 2HG1 ILE 60 2.279 1.354 3.117 479 1HG2 ILE 60 1HG2 ILE 60 4.216 -1.135 2.882 480 2HG2 ILE 60 2HG2 ILE 60 4.164 -0.574 1.210 481 3HG2 ILE 60 3HG2 ILE 60 5.693 -0.585 2.088 482 1HD1 ILE 60 1HD1 ILE 60 3.778 3.368 2.087 483 2HD1 ILE 60 2HD1 ILE 60 2.964 2.804 0.628 484 3HD1 ILE 60 3HD1 ILE 60 2.016 3.332 2.020 485 H GLY 61 H GLY 61 4.141 -0.769 5.862 486 1HA GLY 61 1HA GLY 61 6.992 -1.204 6.370 487 2HA GLY 61 2HA GLY 61 5.688 -2.005 7.210 488 H ASN 62 H ASN 62 8.140 -2.582 5.220 489 HA ASN 62 HA ASN 62 6.881 -4.337 3.250 490 1HB ASN 62 1HB ASN 62 9.534 -3.325 3.817 491 2HB ASN 62 2HB ASN 62 9.611 -5.067 3.562 492 1HD2 ASN 62 2HD2 ASN 62 7.268 -2.825 2.031 493 2HD2 ASN 62 1HD2 ASN 62 7.810 -3.095 0.446 494 H ASP 63 H ASP 63 6.194 -6.426 3.597 495 HA ASP 63 HA ASP 63 7.431 -7.936 5.871 496 1HB ASP 63 1HB ASP 63 4.886 -7.050 5.972 497 2HB ASP 63 2HB ASP 63 4.621 -8.545 5.078 498 H GLY 64 H GLY 64 8.719 -8.334 3.711 499 1HA GLY 64 1HA GLY 64 9.331 -10.390 2.532 500 2HA GLY 64 2HA GLY 64 7.616 -10.811 2.461 501 H SER 65 H SER 65 6.869 -8.018 1.788 502 HA SER 65 HA SER 65 6.753 -8.140 -1.033 503 1HB SER 65 1HB SER 65 6.431 -5.528 -0.643 504 2HB SER 65 2HB SER 65 5.202 -6.680 -0.129 505 HG SER 65 HG SER 65 7.330 -5.858 1.552 506 H ALA 66 H ALA 66 7.736 -6.507 -2.526 507 HA ALA 66 HA ALA 66 10.472 -5.662 -1.727 508 1HB ALA 66 1HB ALA 66 10.030 -7.930 -3.238 509 2HB ALA 66 2HB ALA 66 10.319 -6.704 -4.470 510 3HB ALA 66 3HB ALA 66 11.527 -7.004 -3.221 511 H PHE 67 H PHE 67 8.230 -5.691 -4.521 512 HA PHE 67 HA PHE 67 8.987 -2.847 -5.033 513 1HB PHE 67 1HB PHE 67 7.418 -4.749 -6.803 514 2HB PHE 67 2HB PHE 67 7.990 -3.156 -7.249 515 HD1 PHE 67 HD1 PHE 67 10.689 -2.998 -6.236 516 HD2 PHE 67 HD2 PHE 67 8.651 -6.342 -8.004 517 HE1 PHE 67 HE1 PHE 67 12.864 -3.955 -6.931 518 HE2 PHE 67 HE2 PHE 67 10.826 -7.300 -8.694 519 HZ PHE 67 HZ PHE 67 12.936 -6.110 -8.160 520 H VAL 68 H VAL 68 7.611 -1.301 -4.361 521 HA VAL 68 HA VAL 68 4.733 -2.052 -4.015 522 HB VAL 68 HB VAL 68 6.332 -0.157 -2.271 523 1HG1 VAL 68 1HG1 VAL 68 3.840 0.286 -2.582 524 2HG1 VAL 68 2HG1 VAL 68 3.554 -1.289 -1.843 525 3HG1 VAL 68 3HG1 VAL 68 4.348 -0.014 -0.920 526 1HG2 VAL 68 1HG2 VAL 68 5.515 -3.044 -2.025 527 2HG2 VAL 68 2HG2 VAL 68 7.083 -2.307 -1.692 528 3HG2 VAL 68 3HG2 VAL 68 5.734 -2.056 -0.582 529 H GLU 69 H GLU 69 3.628 -1.031 -5.548 530 HA GLU 69 HA GLU 69 4.438 1.724 -6.373 531 1HB GLU 69 1HB GLU 69 4.295 0.078 -8.201 532 2HB GLU 69 2HB GLU 69 2.642 -0.313 -7.738 533 1HG GLU 69 1HG GLU 69 1.789 1.536 -8.750 534 2HG GLU 69 2HG GLU 69 3.106 2.566 -8.194 535 H VAL 70 H VAL 70 2.957 3.424 -6.156 536 HA VAL 70 HA VAL 70 0.303 2.719 -4.985 537 HB VAL 70 HB VAL 70 2.033 5.028 -4.077 538 1HG1 VAL 70 1HG1 VAL 70 -0.747 4.147 -3.567 539 2HG1 VAL 70 2HG1 VAL 70 0.178 4.615 -2.139 540 3HG1 VAL 70 3HG1 VAL 70 -0.039 5.759 -3.464 541 1HG2 VAL 70 1HG2 VAL 70 1.764 2.208 -3.166 542 2HG2 VAL 70 2HG2 VAL 70 3.147 3.296 -3.053 543 3HG2 VAL 70 3HG2 VAL 70 1.813 3.444 -1.909 544 H LEU 71 H LEU 71 -1.334 3.629 -6.049 545 HA LEU 71 HA LEU 71 -0.780 5.918 -7.869 546 1HB LEU 71 1HB LEU 71 -2.265 3.423 -8.181 547 2HB LEU 71 2HB LEU 71 -3.272 4.821 -8.551 548 HG LEU 71 HG LEU 71 -1.371 5.647 -10.021 549 1HD1 LEU 71 1HD1 LEU 71 -0.401 2.832 -9.464 550 2HD1 LEU 71 2HD1 LEU 71 0.208 3.845 -10.773 551 3HD1 LEU 71 3HD1 LEU 71 0.445 4.336 -9.095 552 1HD2 LEU 71 1HD2 LEU 71 -2.856 3.076 -10.580 553 2HD2 LEU 71 2HD2 LEU 71 -3.253 4.705 -11.127 554 3HD2 LEU 71 3HD2 LEU 71 -1.862 3.861 -11.808 555 H VAL 72 H VAL 72 -2.591 7.489 -8.012 556 HA VAL 72 HA VAL 72 -4.102 7.661 -5.435 557 HB VAL 72 HB VAL 72 -3.950 10.166 -5.873 558 1HG1 VAL 72 1HG1 VAL 72 -1.590 8.445 -5.135 559 2HG1 VAL 72 2HG1 VAL 72 -1.552 10.200 -4.976 560 3HG1 VAL 72 3HG1 VAL 72 -2.722 9.259 -4.055 561 1HG2 VAL 72 1HG2 VAL 72 -3.174 9.956 -8.230 562 2HG2 VAL 72 2HG2 VAL 72 -2.055 10.904 -7.250 563 3HG2 VAL 72 3HG2 VAL 72 -1.681 9.227 -7.646 564 H GLY 73 H GLY 73 -6.141 8.914 -5.582 565 1HA GLY 73 1HA GLY 73 -7.336 9.741 -7.996 566 2HA GLY 73 2HA GLY 73 -7.794 8.061 -7.734 567 H SER 74 H SER 74 -9.727 9.918 -7.747 568 HA SER 74 HA SER 74 -10.457 10.262 -4.892 569 1HB SER 74 1HB SER 74 -10.237 12.430 -5.911 570 2HB SER 74 2HB SER 74 -11.168 11.925 -7.310 571 HG SER 74 HG SER 74 -12.215 13.154 -5.458 572 H SER 75 H SER 75 -12.724 10.019 -4.434 573 HA SER 75 HA SER 75 -13.994 7.944 -6.108 574 1HB SER 75 1HB SER 75 -15.376 7.481 -4.228 575 2HB SER 75 2HB SER 75 -13.794 7.831 -3.541 576 HG SER 75 HG SER 75 -14.490 9.818 -2.938 577 H ALA 76 H ALA 76 -13.836 11.111 -6.489 578 HA ALA 76 HA ALA 76 -16.424 12.190 -6.301 579 1HB ALA 76 1HB ALA 76 -14.207 12.706 -8.290 580 2HB ALA 76 2HB ALA 76 -15.685 13.665 -8.234 581 3HB ALA 76 3HB ALA 76 -14.598 13.639 -6.846 582 H GLY 77 H GLY 77 -15.115 11.364 -9.511 583 1HA GLY 77 1HA GLY 77 -17.813 10.270 -10.200 584 2HA GLY 77 2HA GLY 77 -16.741 11.054 -11.360 585 H GLY 78 H GLY 78 -14.321 9.760 -10.498 586 1HA GLY 78 1HA GLY 78 -14.426 7.374 -12.071 587 2HA GLY 78 2HA GLY 78 -13.091 7.829 -11.011 588 H ALA 79 H ALA 79 -15.561 5.595 -11.460 589 HA ALA 79 HA ALA 79 -16.346 4.983 -8.783 590 1HB ALA 79 1HB ALA 79 -16.181 3.333 -11.309 591 2HB ALA 79 2HB ALA 79 -16.735 2.642 -9.784 592 3HB ALA 79 3HB ALA 79 -17.619 3.979 -10.519 593 H GLY 80 H GLY 80 -13.476 4.185 -10.642 594 1HA GLY 80 1HA GLY 80 -11.540 3.818 -8.910 595 2HA GLY 80 2HA GLY 80 -12.512 2.420 -8.446 596 H GLU 81 H GLU 81 -9.868 2.212 -9.470 597 HA GLU 81 HA GLU 81 -8.667 0.911 -11.000 598 1HB GLU 81 1HB GLU 81 -11.368 0.026 -12.056 599 2HB GLU 81 2HB GLU 81 -9.830 -0.822 -12.207 600 1HG GLU 81 1HG GLU 81 -9.732 -1.100 -9.759 601 2HG GLU 81 2HG GLU 81 -11.269 -0.248 -9.600 602 H GLN 82 H GLN 82 -7.650 1.642 -12.782 603 HA GLN 82 HA GLN 82 -7.238 2.809 -14.768 604 1HB GLN 82 1HB GLN 82 -9.874 1.530 -15.115 605 2HB GLN 82 2HB GLN 82 -9.602 2.918 -16.169 606 1HG GLN 82 1HG GLN 82 -8.695 1.170 -17.430 607 2HG GLN 82 2HG GLN 82 -7.272 1.799 -16.600 608 1HE2 GLN 82 2HE2 GLN 82 -7.628 -0.981 -17.537 609 2HE2 GLN 82 1HE2 GLN 82 -7.555 -1.968 -16.157 610 H ASP 83 H ASP 83 -8.475 4.197 -12.314 611 HA ASP 83 HA ASP 83 -9.138 6.720 -13.751 612 1HB ASP 83 1HB ASP 83 -11.121 5.308 -12.638 613 2HB ASP 83 2HB ASP 83 -10.552 6.139 -11.190 614 H TYR 84 H TYR 84 -6.758 5.529 -12.208 615 HA TYR 84 HA TYR 84 -6.523 7.645 -10.121 616 1HB TYR 84 1HB TYR 84 -5.348 4.874 -10.367 617 2HB TYR 84 2HB TYR 84 -4.605 6.087 -9.330 618 HD1 TYR 84 HD1 TYR 84 -8.168 5.092 -10.060 619 HD2 TYR 84 HD2 TYR 84 -5.130 5.750 -7.098 620 HE1 TYR 84 HE1 TYR 84 -9.797 4.561 -8.281 621 HE2 TYR 84 HE2 TYR 84 -6.768 5.220 -5.312 622 HH TYR 84 HH TYR 84 -9.694 3.705 -5.905 623 H GLU 85 H GLU 85 -3.916 7.889 -9.822 624 HA GLU 85 HA GLU 85 -2.643 8.079 -12.482 625 1HB GLU 85 1HB GLU 85 -2.899 10.312 -12.627 626 2HB GLU 85 2HB GLU 85 -3.772 10.324 -11.109 627 1HG GLU 85 1HG GLU 85 -1.868 10.924 -9.876 628 2HG GLU 85 2HG GLU 85 -0.756 10.326 -11.111 629 H VAL 86 H VAL 86 -0.497 7.583 -12.388 630 HA VAL 86 HA VAL 86 0.524 6.198 -10.158 631 HB VAL 86 HB VAL 86 2.153 7.527 -12.337 632 1HG1 VAL 86 1HG1 VAL 86 2.637 5.266 -10.393 633 2HG1 VAL 86 2HG1 VAL 86 3.553 5.403 -11.894 634 3HG1 VAL 86 3HG1 VAL 86 3.639 6.688 -10.689 635 1HG2 VAL 86 1HG2 VAL 86 0.343 5.155 -12.296 636 2HG2 VAL 86 2HG2 VAL 86 0.734 6.246 -13.626 637 3HG2 VAL 86 3HG2 VAL 86 1.871 4.982 -13.160 638 H LEU 87 H LEU 87 0.335 7.491 -8.262 639 HA LEU 87 HA LEU 87 1.571 10.081 -7.948 640 1HB LEU 87 1HB LEU 87 -0.168 8.992 -6.414 641 2HB LEU 87 2HB LEU 87 1.144 8.002 -5.782 642 HG LEU 87 HG LEU 87 2.370 10.268 -5.411 643 1HD1 LEU 87 1HD1 LEU 87 -0.327 11.102 -6.271 644 2HD1 LEU 87 2HD1 LEU 87 0.215 11.860 -4.775 645 3HD1 LEU 87 3HD1 LEU 87 1.178 12.019 -6.243 646 1HD2 LEU 87 1HD2 LEU 87 1.318 8.681 -3.684 647 2HD2 LEU 87 2HD2 LEU 87 1.505 10.363 -3.187 648 3HD2 LEU 87 3HD2 LEU 87 -0.074 9.765 -3.697 649 H LEU 88 H LEU 88 2.612 6.799 -6.946 650 HA LEU 88 HA LEU 88 5.411 7.668 -7.409 651 1HB LEU 88 1HB LEU 88 6.182 6.718 -5.315 652 2HB LEU 88 2HB LEU 88 4.965 7.949 -5.000 653 HG LEU 88 HG LEU 88 3.436 5.669 -5.259 654 1HD1 LEU 88 1HD1 LEU 88 6.179 4.976 -4.337 655 2HD1 LEU 88 2HD1 LEU 88 4.843 4.277 -3.423 656 3HD1 LEU 88 3HD1 LEU 88 4.981 3.974 -5.155 657 1HD2 LEU 88 1HD2 LEU 88 4.667 6.951 -2.799 658 2HD2 LEU 88 2HD2 LEU 88 3.125 7.367 -3.549 659 3HD2 LEU 88 3HD2 LEU 88 3.324 5.809 -2.745 660 H VAL 89 H VAL 89 6.361 6.236 -8.735 661 HA VAL 89 HA VAL 89 5.162 3.873 -9.691 662 HB VAL 89 HB VAL 89 7.434 3.283 -10.535 663 1HG1 VAL 89 1HG1 VAL 89 5.835 5.220 -11.407 664 2HG1 VAL 89 2HG1 VAL 89 7.178 6.243 -10.899 665 3HG1 VAL 89 3HG1 VAL 89 7.436 4.984 -12.107 666 1HG2 VAL 89 1HG2 VAL 89 8.165 5.325 -8.486 667 2HG2 VAL 89 2HG2 VAL 89 9.046 3.888 -9.005 668 3HG2 VAL 89 3HG2 VAL 89 9.079 5.347 -9.995 669 H THR 90 H THR 90 6.608 1.673 -9.494 670 HA THR 90 HA THR 90 6.123 0.772 -6.808 671 HB THR 90 HB THR 90 6.076 -0.550 -9.079 672 HG1 THR 90 HG1 THR 90 6.201 -2.393 -7.869 673 1HG2 THR 90 1HG2 THR 90 8.673 -0.088 -9.282 674 2HG2 THR 90 2HG2 THR 90 8.790 -1.480 -8.206 675 3HG2 THR 90 3HG2 THR 90 8.004 -1.644 -9.776 676 H SER 91 H SER 91 7.526 0.523 -5.129 677 HA SER 91 HA SER 91 10.280 1.577 -5.521 678 1HB SER 91 1HB SER 91 10.151 1.945 -3.007 679 2HB SER 91 2HB SER 91 9.056 2.930 -3.968 680 HG SER 91 HG SER 91 8.478 0.538 -2.552 681 H SER 92 H SER 92 11.899 0.173 -5.314 682 HA SER 92 HA SER 92 11.403 -2.578 -4.410 683 1HB SER 92 1HB SER 92 13.664 -3.020 -5.164 684 2HB SER 92 2HB SER 92 12.869 -2.026 -6.381 685 HG SER 92 HG SER 92 14.314 -0.555 -6.020 686 H PHE 93 H PHE 93 11.239 -2.727 -2.188 687 HA PHE 93 HA PHE 93 13.187 -1.226 -0.517 688 1HB PHE 93 1HB PHE 93 10.621 -2.652 0.164 689 2HB PHE 93 2HB PHE 93 11.678 -1.937 1.369 690 HD1 PHE 93 HD1 PHE 93 12.528 0.563 -0.157 691 HD2 PHE 93 HD2 PHE 93 8.687 -1.308 0.343 692 HE1 PHE 93 HE1 PHE 93 11.418 2.743 -0.525 693 HE2 PHE 93 HE2 PHE 93 7.582 0.881 -0.022 694 HZ PHE 93 HZ PHE 93 8.949 2.906 -0.456 695 H MET 94 H MET 94 11.857 -4.518 -0.895 696 HA MET 94 HA MET 94 14.322 -5.529 0.469 697 1HB MET 94 1HB MET 94 11.562 -6.008 1.035 698 2HB MET 94 2HB MET 94 12.245 -7.518 0.436 699 1HG MET 94 1HG MET 94 14.039 -7.405 2.092 700 2HG MET 94 2HG MET 94 13.457 -5.838 2.652 701 1HE MET 94 1HE MET 94 12.465 -9.221 1.638 702 2HE MET 94 2HE MET 94 12.926 -9.833 3.223 703 3HE MET 94 3HE MET 94 11.223 -9.794 2.747 704 H SER 95 H SER 95 14.495 -8.049 -0.183 705 HA SER 95 HA SER 95 14.453 -8.120 -3.173 706 1HB SER 95 1HB SER 95 16.292 -9.996 -2.521 707 2HB SER 95 2HB SER 95 16.706 -8.305 -2.777 708 HG SER 95 HG SER 95 17.108 -9.688 -0.626 709 HA PRO 96 HA PRO 96 12.175 -11.944 -2.823 710 1HB PRO 96 1HB PRO 96 13.105 -13.340 -4.978 711 2HB PRO 96 2HB PRO 96 12.078 -11.907 -5.116 712 1HG PRO 96 1HG PRO 96 14.911 -12.225 -5.781 713 2HG PRO 96 2HG PRO 96 13.775 -10.966 -6.280 714 1HD PRO 96 1HD PRO 96 15.791 -10.835 -4.213 715 2HD PRO 96 2HD PRO 96 14.696 -9.547 -4.760 716 H SER 97 H SER 97 15.093 -11.931 -1.571 717 HA SER 97 HA SER 97 15.338 -14.906 -1.398 718 1HB SER 97 1HB SER 97 17.564 -12.924 -0.877 719 2HB SER 97 2HB SER 97 17.699 -14.667 -1.098 720 HG SER 97 HG SER 97 17.946 -14.216 -3.128 721 H GLU 98 H GLU 98 15.893 -11.870 0.436 722 HA GLU 98 HA GLU 98 16.176 -13.055 2.990 723 1HB GLU 98 1HB GLU 98 15.261 -10.379 1.996 724 2HB GLU 98 2HB GLU 98 15.111 -10.764 3.711 725 1HG GLU 98 1HG GLU 98 17.252 -9.701 3.343 726 2HG GLU 98 2HG GLU 98 17.524 -11.397 3.731 727 H SER 99 H SER 99 13.344 -12.670 1.008 728 HA SER 99 HA SER 99 11.209 -12.516 2.758 729 1HB SER 99 1HB SER 99 9.897 -13.597 1.103 730 2HB SER 99 2HB SER 99 11.198 -12.809 0.217 731 HG SER 99 HG SER 99 11.677 -14.719 -0.487 732 H ARG 100 H ARG 100 13.386 -15.251 2.396 733 HA ARG 100 HA ARG 100 11.625 -16.894 4.137 734 1HB ARG 100 1HB ARG 100 13.712 -18.551 3.826 735 2HB ARG 100 2HB ARG 100 12.411 -18.445 2.650 736 1HG ARG 100 1HG ARG 100 14.762 -16.614 2.327 737 2HG ARG 100 2HG ARG 100 14.953 -18.310 1.898 738 1HD ARG 100 1HD ARG 100 12.475 -17.539 0.795 739 2HD ARG 100 2HD ARG 100 13.583 -16.215 0.443 740 HE ARG 100 HE ARG 100 13.643 -18.812 -0.787 741 1HH1 ARG 100 1HH1 ARG 100 15.736 -16.298 0.451 742 2HH1 ARG 100 2HH1 ARG 100 17.032 -16.715 -0.613 743 1HH2 ARG 100 1HH2 ARG 100 15.348 -19.319 -2.141 744 2HH2 ARG 100 2HH2 ARG 100 16.818 -18.405 -2.065 745 H SER 101 H SER 101 15.195 -16.625 4.215 746 HA SER 101 HA SER 101 15.190 -15.388 6.834 747 1HB SER 101 1HB SER 101 14.720 -18.061 6.962 748 2HB SER 101 2HB SER 101 16.481 -18.066 6.919 749 HG SER 101 HG SER 101 16.541 -16.949 8.774 750 H GLY 102 H GLY 102 16.310 -14.884 4.252 751 1HA GLY 102 1HA GLY 102 19.118 -15.667 4.266 752 2HA GLY 102 2HA GLY 102 18.372 -14.498 3.172 753 H SER 103 H SER 103 17.182 -13.020 5.492 754 HA SER 103 HA SER 103 19.181 -12.100 7.276 755 1HB SER 103 1HB SER 103 19.473 -11.097 4.572 756 2HB SER 103 2HB SER 103 19.236 -9.790 5.725 757 HG SER 103 HG SER 103 21.357 -11.488 5.386 758 H ASN 104 H ASN 104 17.290 -9.916 5.329 759 HA ASN 104 HA ASN 104 15.578 -9.355 7.691 760 1HB ASN 104 1HB ASN 104 15.247 -7.105 6.656 761 2HB ASN 104 2HB ASN 104 16.939 -7.427 7.030 762 1HD2 ASN 104 2HD2 ASN 104 18.347 -8.112 5.147 763 2HD2 ASN 104 1HD2 ASN 104 17.908 -7.656 3.569 764 HA PRO 105 HA PRO 105 12.781 -11.297 4.569 765 1HB PRO 105 1HB PRO 105 11.120 -12.405 6.450 766 2HB PRO 105 2HB PRO 105 12.592 -13.190 5.869 767 1HG PRO 105 1HG PRO 105 12.121 -11.726 8.418 768 2HG PRO 105 2HG PRO 105 13.099 -13.170 8.111 769 1HD PRO 105 1HD PRO 105 14.163 -10.650 8.405 770 2HD PRO 105 2HD PRO 105 14.942 -11.941 7.463 771 H ASN 106 H ASN 106 12.270 -9.260 7.345 772 HA ASN 106 HA ASN 106 9.951 -7.993 5.974 773 1HB ASN 106 1HB ASN 106 10.114 -8.646 8.933 774 2HB ASN 106 2HB ASN 106 8.813 -7.763 8.147 775 1HD2 ASN 106 2HD2 ASN 106 8.685 -9.448 5.736 776 2HD2 ASN 106 1HD2 ASN 106 8.057 -10.943 6.219 777 H ARG 107 H ARG 107 9.809 -5.734 6.337 778 HA ARG 107 HA ARG 107 11.686 -4.433 8.173 779 1HB ARG 107 1HB ARG 107 12.635 -5.016 5.639 780 2HB ARG 107 2HB ARG 107 12.057 -3.360 5.459 781 1HG ARG 107 1HG ARG 107 13.346 -2.813 7.589 782 2HG ARG 107 2HG ARG 107 14.093 -4.404 7.440 783 1HD ARG 107 1HD ARG 107 14.484 -3.523 4.930 784 2HD ARG 107 2HD ARG 107 14.465 -1.971 5.766 785 HE ARG 107 HE ARG 107 16.168 -3.891 7.113 786 1HH1 ARG 107 1HH1 ARG 107 16.002 -1.649 4.432 787 2HH1 ARG 107 2HH1 ARG 107 17.713 -1.410 4.395 788 1HH2 ARG 107 1HH2 ARG 107 18.377 -3.546 7.033 789 2HH2 ARG 107 2HH2 ARG 107 19.045 -2.466 5.857 790 H VAL 108 H VAL 108 11.626 -1.893 7.186 791 HA VAL 108 HA VAL 108 8.756 -1.224 6.722 792 HB VAL 108 HB VAL 108 10.559 -0.015 8.821 793 1HG1 VAL 108 1HG1 VAL 108 7.901 0.769 7.698 794 2HG1 VAL 108 2HG1 VAL 108 8.199 1.031 9.416 795 3HG1 VAL 108 3HG1 VAL 108 9.239 1.795 8.214 796 1HG2 VAL 108 1HG2 VAL 108 8.143 -1.821 8.957 797 2HG2 VAL 108 2HG2 VAL 108 9.752 -2.120 9.614 798 3HG2 VAL 108 3HG2 VAL 108 8.715 -0.896 10.345 799 H ARG 109 H ARG 109 8.622 0.316 5.096 800 HA ARG 109 HA ARG 109 10.938 2.111 4.648 801 1HB ARG 109 1HB ARG 109 9.766 0.130 2.741 802 2HB ARG 109 2HB ARG 109 10.273 1.693 2.095 803 1HG ARG 109 1HG ARG 109 12.079 0.084 3.898 804 2HG ARG 109 2HG ARG 109 12.045 -0.187 2.159 805 1HD ARG 109 1HD ARG 109 12.640 2.121 1.728 806 2HD ARG 109 2HD ARG 109 12.529 2.508 3.444 807 HE ARG 109 HE ARG 109 14.791 1.265 2.131 808 1HH1 ARG 109 1HH1 ARG 109 12.983 1.383 5.125 809 2HH1 ARG 109 2HH1 ARG 109 14.342 0.901 6.079 810 1HH2 ARG 109 1HH2 ARG 109 16.519 0.643 3.407 811 2HH2 ARG 109 2HH2 ARG 109 16.322 0.487 5.121 812 H MET 110 H MET 110 10.330 4.106 3.686 813 HA MET 110 HA MET 110 7.392 4.582 3.469 814 1HB MET 110 1HB MET 110 9.364 6.394 4.888 815 2HB MET 110 2HB MET 110 7.624 6.645 4.750 816 1HG MET 110 1HG MET 110 7.156 4.698 6.078 817 2HG MET 110 2HG MET 110 8.838 4.189 6.021 818 1HE MET 110 1HE MET 110 10.723 5.591 6.685 819 2HE MET 110 2HE MET 110 10.783 6.361 8.269 820 3HE MET 110 3HE MET 110 10.402 4.645 8.145 821 H PHE 111 H PHE 111 6.909 6.698 2.403 822 HA PHE 111 HA PHE 111 8.952 7.351 0.319 823 1HB PHE 111 1HB PHE 111 5.951 7.596 0.004 824 2HB PHE 111 2HB PHE 111 7.171 7.725 -1.253 825 HD1 PHE 111 HD1 PHE 111 5.968 5.273 1.346 826 HD2 PHE 111 HD2 PHE 111 7.593 5.872 -2.590 827 HE1 PHE 111 HE1 PHE 111 5.757 2.855 0.880 828 HE2 PHE 111 HE2 PHE 111 7.387 3.443 -3.040 829 HZ PHE 111 HZ PHE 111 6.465 1.929 -1.299 830 H GLY 112 H GLY 112 8.470 9.640 -0.593 831 1HA GLY 112 1HA GLY 112 7.350 11.477 1.435 832 2HA GLY 112 2HA GLY 112 9.006 11.706 0.925 833 HA PRO 113 HA PRO 113 6.540 14.210 -2.052 834 1HB PRO 113 1HB PRO 113 8.341 16.257 -2.140 835 2HB PRO 113 2HB PRO 113 7.071 16.128 -0.914 836 1HG PRO 113 1HG PRO 113 9.982 15.599 -0.679 837 2HG PRO 113 2HG PRO 113 8.840 16.194 0.534 838 1HD PRO 113 1HD PRO 113 9.787 13.564 0.376 839 2HD PRO 113 2HD PRO 113 8.339 14.074 1.253 840 H ASP 114 H ASP 114 10.010 13.535 -2.010 841 HA ASP 114 HA ASP 114 10.521 14.045 -4.782 842 1HB ASP 114 1HB ASP 114 11.933 12.572 -2.589 843 2HB ASP 114 2HB ASP 114 12.464 12.321 -4.253 844 H LYS 115 H LYS 115 9.162 11.323 -3.068 845 HA LYS 115 HA LYS 115 9.420 9.595 -5.448 846 1HB LYS 115 1HB LYS 115 8.591 9.169 -2.594 847 2HB LYS 115 2HB LYS 115 8.118 7.997 -3.825 848 1HG LYS 115 1HG LYS 115 10.162 7.101 -3.252 849 2HG LYS 115 2HG LYS 115 10.701 8.237 -4.490 850 1HD LYS 115 1HD LYS 115 11.272 9.890 -2.818 851 2HD LYS 115 2HD LYS 115 10.556 8.908 -1.538 852 1HE LYS 115 1HE LYS 115 12.771 7.800 -3.252 853 2HE LYS 115 2HE LYS 115 13.139 8.820 -1.861 854 1HZ LYS 115 1HZ LYS 115 11.846 7.314 -0.472 855 2HZ LYS 115 2HZ LYS 115 11.537 6.320 -1.815 856 3HZ LYS 115 3HZ LYS 115 13.123 6.497 -1.239 857 H LEU 116 H LEU 116 7.300 12.010 -4.601 858 HA LEU 116 HA LEU 116 5.053 10.537 -5.929 859 1HB LEU 116 1HB LEU 116 3.509 12.142 -4.706 860 2HB LEU 116 2HB LEU 116 4.260 10.887 -3.731 861 HG LEU 116 HG LEU 116 6.088 12.653 -3.238 862 1HD1 LEU 116 1HD1 LEU 116 4.394 14.178 -4.961 863 2HD1 LEU 116 2HD1 LEU 116 4.283 14.873 -3.351 864 3HD1 LEU 116 3HD1 LEU 116 5.850 14.705 -4.132 865 1HD2 LEU 116 1HD2 LEU 116 3.255 12.732 -2.203 866 2HD2 LEU 116 2HD2 LEU 116 4.657 11.944 -1.480 867 3HD2 LEU 116 3HD2 LEU 116 4.539 13.703 -1.483 868 H VAL 117 H VAL 117 4.005 11.516 -7.555 869 HA VAL 117 HA VAL 117 5.342 13.557 -9.052 870 HB VAL 117 HB VAL 117 3.777 11.933 -10.076 871 1HG1 VAL 117 1HG1 VAL 117 2.198 11.882 -8.162 872 2HG1 VAL 117 2HG1 VAL 117 1.634 13.476 -8.624 873 3HG1 VAL 117 3HG1 VAL 117 1.386 12.107 -9.707 874 1HG2 VAL 117 1HG2 VAL 117 4.155 14.337 -11.000 875 2HG2 VAL 117 2HG2 VAL 117 2.791 13.414 -11.633 876 3HG2 VAL 117 3HG2 VAL 117 2.524 14.656 -10.410 877 H ARG 118 H ARG 118 5.064 15.797 -9.069 878 HA ARG 118 HA ARG 118 3.719 16.986 -6.762 879 1HB ARG 118 1HB ARG 118 5.578 17.863 -8.877 880 2HB ARG 118 2HB ARG 118 4.401 19.093 -8.415 881 1HG ARG 118 1HG ARG 118 5.537 17.689 -6.100 882 2HG ARG 118 2HG ARG 118 6.758 18.523 -7.061 883 1HD ARG 118 1HD ARG 118 4.216 19.778 -5.986 884 2HD ARG 118 2HD ARG 118 5.831 20.009 -5.318 885 HE ARG 118 HE ARG 118 5.677 20.682 -8.148 886 1HH1 ARG 118 1HH1 ARG 118 5.166 21.849 -4.891 887 2HH1 ARG 118 2HH1 ARG 118 5.361 23.506 -5.346 888 1HH2 ARG 118 1HH2 ARG 118 5.922 22.837 -8.694 889 2HH2 ARG 118 2HH2 ARG 118 5.785 24.062 -7.476 890 H ALA 119 H ALA 119 3.072 16.625 -10.207 891 HA ALA 119 HA ALA 119 0.902 18.489 -10.358 892 1HB ALA 119 1HB ALA 119 1.653 16.076 -12.015 893 2HB ALA 119 2HB ALA 119 0.263 17.092 -12.397 894 3HB ALA 119 3HB ALA 119 1.888 17.779 -12.411 895 H ALA 120 H ALA 120 1.128 15.333 -8.956 896 HA ALA 120 HA ALA 120 -1.855 15.191 -8.812 897 1HB ALA 120 1HB ALA 120 -0.195 13.300 -9.863 898 2HB ALA 120 2HB ALA 120 -0.313 12.747 -8.194 899 3HB ALA 120 3HB ALA 120 -1.774 12.945 -9.162 900 H ALA 121 H ALA 121 1.158 14.505 -6.982 901 HA ALA 121 HA ALA 121 0.088 13.811 -4.502 902 1HB ALA 121 1HB ALA 121 2.491 15.528 -5.142 903 2HB ALA 121 2HB ALA 121 2.131 14.927 -3.524 904 3HB ALA 121 3HB ALA 121 2.461 13.794 -4.830 905 H GLU 122 H GLU 122 0.442 17.105 -5.817 906 HA GLU 122 HA GLU 122 -0.606 18.289 -3.350 907 1HB GLU 122 1HB GLU 122 -0.476 20.426 -4.571 908 2HB GLU 122 2HB GLU 122 1.029 19.524 -4.725 909 1HG GLU 122 1HG GLU 122 0.776 19.926 -6.952 910 2HG GLU 122 2HG GLU 122 -0.361 18.579 -6.883 911 H LYS 123 H LYS 123 -2.131 16.563 -5.717 912 HA LYS 123 HA LYS 123 -4.530 18.285 -5.815 913 1HB LYS 123 1HB LYS 123 -4.090 15.565 -7.074 914 2HB LYS 123 2HB LYS 123 -5.390 16.697 -7.438 915 1HG LYS 123 1HG LYS 123 -3.490 18.356 -8.029 916 2HG LYS 123 2HG LYS 123 -2.458 16.928 -8.089 917 1HD LYS 123 1HD LYS 123 -3.432 16.138 -10.002 918 2HD LYS 123 2HD LYS 123 -5.036 16.703 -9.538 919 1HE LYS 123 1HE LYS 123 -3.812 19.086 -9.889 920 2HE LYS 123 2HE LYS 123 -2.892 18.114 -11.038 921 1HZ LYS 123 1HZ LYS 123 -5.847 18.055 -10.962 922 2HZ LYS 123 2HZ LYS 123 -5.003 19.210 -11.874 923 3HZ LYS 123 3HZ LYS 123 -4.811 17.555 -12.213 924 H ARG 124 H ARG 124 -6.303 17.852 -4.560 925 HA ARG 124 HA ARG 124 -6.043 16.067 -2.330 926 1HB ARG 124 1HB ARG 124 -8.355 17.659 -3.440 927 2HB ARG 124 2HB ARG 124 -8.525 16.632 -2.016 928 1HG ARG 124 1HG ARG 124 -6.521 17.861 -1.037 929 2HG ARG 124 2HG ARG 124 -6.685 19.008 -2.367 930 1HD ARG 124 1HD ARG 124 -8.809 18.348 -0.305 931 2HD ARG 124 2HD ARG 124 -7.885 19.847 -0.404 932 HE ARG 124 HE ARG 124 -9.216 19.388 -2.899 933 1HH1 ARG 124 1HH1 ARG 124 -9.856 20.303 0.416 934 2HH1 ARG 124 2HH1 ARG 124 -11.264 21.215 -0.003 935 1HH2 ARG 124 1HH2 ARG 124 -11.044 20.579 -3.395 936 2HH2 ARG 124 2HH2 ARG 124 -11.931 21.372 -2.136 937 H TRP 125 H TRP 125 -6.130 13.919 -2.519 938 HA TRP 125 HA TRP 125 -8.166 12.684 -4.347 939 1HB TRP 125 1HB TRP 125 -5.593 11.444 -3.296 940 2HB TRP 125 2HB TRP 125 -6.703 10.727 -4.458 941 HD1 TRP 125 HD1 TRP 125 -3.701 12.876 -4.220 942 HE1 TRP 125 HE1 TRP 125 -3.089 13.827 -6.538 943 HE3 TRP 125 HE3 TRP 125 -7.936 11.702 -6.805 944 HZ2 TRP 125 HZ2 TRP 125 -4.236 14.040 -9.146 945 HZ3 TRP 125 HZ3 TRP 125 -8.149 12.263 -9.200 946 HH2 TRP 125 HH2 TRP 125 -6.309 13.443 -10.378 947 H ASP 126 H ASP 126 -8.990 10.521 -3.386 948 HA ASP 126 HA ASP 126 -8.834 10.514 -0.417 949 1HB ASP 126 1HB ASP 126 -11.273 10.263 -0.199 950 2HB ASP 126 2HB ASP 126 -10.840 11.807 -0.930 951 H ARG 127 H ARG 127 -8.172 8.764 -2.975 952 HA ARG 127 HA ARG 127 -8.742 6.219 -1.599 953 1HB ARG 127 1HB ARG 127 -9.401 6.610 -4.537 954 2HB ARG 127 2HB ARG 127 -9.641 5.149 -3.583 955 1HG ARG 127 1HG ARG 127 -11.101 6.745 -2.070 956 2HG ARG 127 2HG ARG 127 -11.201 7.707 -3.543 957 1HD ARG 127 1HD ARG 127 -12.430 6.109 -4.660 958 2HD ARG 127 2HD ARG 127 -11.676 4.777 -3.796 959 HE ARG 127 HE ARG 127 -13.129 5.999 -1.821 960 1HH1 ARG 127 1HH1 ARG 127 -13.940 4.903 -5.044 961 2HH1 ARG 127 2HH1 ARG 127 -15.597 4.625 -4.639 962 1HH2 ARG 127 1HH2 ARG 127 -15.278 5.617 -1.342 963 2HH2 ARG 127 2HH2 ARG 127 -16.348 5.021 -2.567 964 H VAL 128 H VAL 128 -7.027 4.758 -1.982 965 HA VAL 128 HA VAL 128 -4.980 5.675 -3.950 966 HB VAL 128 HB VAL 128 -4.476 6.338 -1.565 967 1HG1 VAL 128 1HG1 VAL 128 -5.145 3.644 -1.048 968 2HG1 VAL 128 2HG1 VAL 128 -3.412 3.776 -0.756 969 3HG1 VAL 128 3HG1 VAL 128 -4.535 4.833 0.097 970 1HG2 VAL 128 1HG2 VAL 128 -2.659 4.591 -3.205 971 2HG2 VAL 128 2HG2 VAL 128 -2.638 6.344 -3.020 972 3HG2 VAL 128 3HG2 VAL 128 -2.101 5.311 -1.695 973 H LYS 129 H LYS 129 -3.854 4.061 -5.019 974 HA LYS 129 HA LYS 129 -4.901 1.295 -4.633 975 1HB LYS 129 1HB LYS 129 -5.291 2.354 -6.855 976 2HB LYS 129 2HB LYS 129 -3.548 2.497 -7.055 977 1HG LYS 129 1HG LYS 129 -3.783 -0.149 -6.394 978 2HG LYS 129 2HG LYS 129 -5.279 0.117 -7.289 979 1HD LYS 129 1HD LYS 129 -3.797 1.274 -9.057 980 2HD LYS 129 2HD LYS 129 -2.439 0.506 -8.232 981 1HE LYS 129 1HE LYS 129 -2.904 -1.200 -9.690 982 2HE LYS 129 2HE LYS 129 -4.089 -1.623 -8.455 983 1HZ LYS 129 1HZ LYS 129 -5.608 -0.025 -9.736 984 2HZ LYS 129 2HZ LYS 129 -4.507 -0.224 -11.014 985 3HZ LYS 129 3HZ LYS 129 -5.329 -1.569 -10.389 986 H ILE 130 H ILE 130 -3.511 0.048 -3.496 987 HA ILE 130 HA ILE 130 -0.581 0.562 -3.747 988 HB ILE 130 HB ILE 130 -2.078 -1.076 -1.676 989 1HG1 ILE 130 1HG1 ILE 130 -2.688 1.319 -1.567 990 2HG1 ILE 130 2HG1 ILE 130 -1.722 0.845 -0.173 991 1HG2 ILE 130 1HG2 ILE 130 0.796 -0.215 -2.009 992 2HG2 ILE 130 2HG2 ILE 130 0.141 -0.639 -0.428 993 3HG2 ILE 130 3HG2 ILE 130 0.160 -1.835 -1.723 994 1HD1 ILE 130 1HD1 ILE 130 0.072 1.688 -2.240 995 2HD1 ILE 130 2HD1 ILE 130 -1.186 2.912 -2.069 996 3HD1 ILE 130 3HD1 ILE 130 -0.218 2.441 -0.673 997 H VAL 131 H VAL 131 0.408 -0.807 -5.201 998 HA VAL 131 HA VAL 131 -0.587 -3.607 -5.329 999 HB VAL 131 HB VAL 131 0.656 -1.986 -7.566 1000 1HG1 VAL 131 1HG1 VAL 131 1.026 -4.447 -7.610 1001 2HG1 VAL 131 2HG1 VAL 131 -0.722 -4.680 -7.541 1002 3HG1 VAL 131 3HG1 VAL 131 0.008 -3.889 -8.939 1003 1HG2 VAL 131 1HG2 VAL 131 -2.158 -2.479 -6.682 1004 2HG2 VAL 131 2HG2 VAL 131 -1.458 -1.050 -7.440 1005 3HG2 VAL 131 3HG2 VAL 131 -1.829 -2.472 -8.415 1006 H CYS 132 H CYS 132 0.904 -4.924 -4.439 1007 HA CYS 132 HA CYS 132 3.740 -4.097 -4.315 1008 1HB CYS 132 1HB CYS 132 2.716 -5.043 -2.285 1009 2HB CYS 132 2HB CYS 132 2.314 -6.517 -3.159 1010 HG CYS 132 HG CYS 132 4.593 -7.334 -2.679 1011 H SER 133 H SER 133 5.454 -5.562 -5.124 1012 HA SER 133 HA SER 133 4.623 -7.639 -7.062 1013 1HB SER 133 1HB SER 133 5.222 -4.962 -7.849 1014 2HB SER 133 2HB SER 133 6.555 -5.974 -8.392 1015 HG SER 133 HG SER 133 5.036 -6.122 -9.963 1016 H GLN 134 H GLN 134 6.017 -9.306 -6.950 1017 HA GLN 134 HA GLN 134 8.642 -9.658 -7.246 1018 1HB GLN 134 1HB GLN 134 9.289 -7.959 -5.583 1019 2HB GLN 134 2HB GLN 134 8.387 -8.807 -4.335 1020 1HG GLN 134 1HG GLN 134 10.482 -9.685 -3.917 1021 2HG GLN 134 2HG GLN 134 9.983 -10.825 -5.156 1022 1HE2 GLN 134 2HE2 GLN 134 12.548 -8.897 -4.315 1023 2HE2 GLN 134 1HE2 GLN 134 13.211 -8.622 -5.853 1024 HA PRO 135 HA PRO 135 6.970 -13.580 -5.813 1025 1HB PRO 135 1HB PRO 135 8.953 -15.170 -6.791 1026 2HB PRO 135 2HB PRO 135 7.705 -14.442 -7.812 1027 1HG PRO 135 1HG PRO 135 10.561 -13.782 -7.599 1028 2HG PRO 135 2HG PRO 135 9.423 -13.453 -8.912 1029 1HD PRO 135 1HD PRO 135 10.355 -11.624 -6.911 1030 2HD PRO 135 2HD PRO 135 9.156 -11.320 -8.186 1031 H TYR 136 H TYR 136 7.316 -13.231 -3.468 1032 HA TYR 136 HA TYR 136 10.020 -13.857 -2.466 1033 1HB TYR 136 1HB TYR 136 8.328 -13.612 -0.211 1034 2HB TYR 136 2HB TYR 136 9.525 -12.469 -0.783 1035 HD1 TYR 136 HD1 TYR 136 8.613 -10.983 -2.897 1036 HD2 TYR 136 HD2 TYR 136 6.196 -12.804 0.147 1037 HE1 TYR 136 HE1 TYR 136 6.807 -9.329 -3.318 1038 HE2 TYR 136 HE2 TYR 136 4.397 -11.168 -0.286 1039 HH TYR 136 HH TYR 136 3.693 -9.704 -2.303 1040 H SER 137 H SER 137 7.469 -15.762 -3.408 1041 HA SER 137 HA SER 137 8.575 -18.063 -2.052 1042 1HB SER 137 1HB SER 137 7.167 -16.962 -0.248 1043 2HB SER 137 2HB SER 137 5.756 -17.334 -1.233 1044 HG SER 137 HG SER 137 5.948 -19.104 -0.020 1045 H LYS 138 H LYS 138 6.341 -19.773 -2.209 1046 HA LYS 138 HA LYS 138 5.400 -19.525 -5.028 1047 1HB LYS 138 1HB LYS 138 7.078 -21.716 -3.845 1048 2HB LYS 138 2HB LYS 138 5.874 -22.133 -5.064 1049 1HG LYS 138 1HG LYS 138 6.991 -19.987 -6.266 1050 2HG LYS 138 2HG LYS 138 8.380 -20.559 -5.341 1051 1HD LYS 138 1HD LYS 138 8.672 -21.900 -7.176 1052 2HD LYS 138 2HD LYS 138 7.507 -22.916 -6.328 1053 1HE LYS 138 1HE LYS 138 5.684 -21.616 -7.564 1054 2HE LYS 138 2HE LYS 138 6.975 -20.964 -8.574 1055 1HZ LYS 138 1HZ LYS 138 7.640 -23.348 -8.956 1056 2HZ LYS 138 2HZ LYS 138 6.154 -23.791 -8.262 1057 3HZ LYS 138 3HZ LYS 138 6.182 -22.859 -9.680 1058 H ASP 139 H ASP 139 5.068 -21.219 -1.887 1059 HA ASP 139 HA ASP 139 2.244 -21.775 -2.636 1060 1HB ASP 139 1HB ASP 139 2.400 -23.594 -0.900 1061 2HB ASP 139 2HB ASP 139 3.408 -23.851 -2.319 1062 H SER 140 H SER 140 4.230 -20.018 -0.473 1063 HA SER 140 HA SER 140 2.031 -19.783 1.501 1064 1HB SER 140 1HB SER 140 4.026 -18.413 2.637 1065 2HB SER 140 2HB SER 140 3.891 -20.160 2.778 1066 HG SER 140 HG SER 140 5.812 -20.107 1.915 1067 HA PRO 141 HA PRO 141 1.298 -15.628 -0.079 1068 1HB PRO 141 1HB PRO 141 -0.591 -14.907 1.751 1069 2HB PRO 141 2HB PRO 141 -0.909 -16.039 0.430 1070 1HG PRO 141 1HG PRO 141 -0.675 -16.557 3.309 1071 2HG PRO 141 2HG PRO 141 -1.431 -17.538 2.046 1072 1HD PRO 141 1HD PRO 141 1.156 -17.910 3.260 1073 2HD PRO 141 2HD PRO 141 0.386 -18.890 1.992 1074 H PHE 142 H PHE 142 1.082 -13.304 1.003 1075 HA PHE 142 HA PHE 142 2.055 -12.650 3.552 1076 1HB PHE 142 1HB PHE 142 4.152 -13.631 1.830 1077 2HB PHE 142 2HB PHE 142 4.442 -11.927 2.161 1078 HD1 PHE 142 HD1 PHE 142 4.059 -11.217 4.706 1079 HD2 PHE 142 HD2 PHE 142 4.895 -15.207 3.363 1080 HE1 PHE 142 HE1 PHE 142 4.863 -11.814 6.976 1081 HE2 PHE 142 HE2 PHE 142 5.702 -15.804 5.631 1082 HZ PHE 142 HZ PHE 142 5.686 -14.106 7.438 1083 H GLY 143 H GLY 143 3.607 -10.338 2.973 1084 1HA GLY 143 1HA GLY 143 2.912 -8.738 0.816 1085 2HA GLY 143 2HA GLY 143 1.537 -8.596 1.906 1086 H LEU 144 H LEU 144 1.656 -7.001 3.397 1087 HA LEU 144 HA LEU 144 4.354 -6.107 4.260 1088 1HB LEU 144 1HB LEU 144 3.115 -3.732 4.356 1089 2HB LEU 144 2HB LEU 144 4.086 -4.273 2.996 1090 HG LEU 144 HG LEU 144 1.133 -4.811 3.154 1091 1HD1 LEU 144 1HD1 LEU 144 1.954 -2.326 3.320 1092 2HD1 LEU 144 2HD1 LEU 144 2.342 -2.540 1.612 1093 3HD1 LEU 144 3HD1 LEU 144 0.681 -2.743 2.172 1094 1HD2 LEU 144 1HD2 LEU 144 3.354 -5.126 1.196 1095 2HD2 LEU 144 2HD2 LEU 144 1.869 -6.062 1.363 1096 3HD2 LEU 144 3HD2 LEU 144 1.842 -4.509 0.530 1097 H SER 145 H SER 145 4.377 -4.886 6.265 1098 HA SER 145 HA SER 145 2.641 -6.114 8.242 1099 1HB SER 145 1HB SER 145 4.792 -4.001 8.487 1100 2HB SER 145 2HB SER 145 3.979 -4.762 9.851 1101 HG SER 145 HG SER 145 5.761 -5.850 7.969 1102 H PHE 146 H PHE 146 2.633 -3.086 6.488 1103 HA PHE 146 HA PHE 146 0.037 -2.339 7.375 1104 1HB PHE 146 1HB PHE 146 0.546 -0.449 8.891 1105 2HB PHE 146 2HB PHE 146 1.105 -1.965 9.586 1106 HD1 PHE 146 HD1 PHE 146 3.538 -2.540 9.559 1107 HD2 PHE 146 HD2 PHE 146 2.076 1.253 8.179 1108 HE1 PHE 146 HE1 PHE 146 5.844 -1.626 9.628 1109 HE2 PHE 146 HE2 PHE 146 4.372 2.175 8.258 1110 HZ PHE 146 HZ PHE 146 6.265 0.725 8.973 1111 H VAL 147 H VAL 147 -0.261 0.179 7.044 1112 HA VAL 147 HA VAL 147 1.567 1.374 5.080 1113 HB VAL 147 HB VAL 147 -0.182 1.638 3.350 1114 1HG1 VAL 147 1HG1 VAL 147 1.398 -0.384 3.460 1115 2HG1 VAL 147 2HG1 VAL 147 0.014 -1.290 4.068 1116 3HG1 VAL 147 3HG1 VAL 147 -0.044 -0.565 2.462 1117 1HG2 VAL 147 1HG2 VAL 147 -1.805 0.241 5.441 1118 2HG2 VAL 147 2HG2 VAL 147 -2.277 1.533 4.338 1119 3HG2 VAL 147 3HG2 VAL 147 -2.153 -0.126 3.751 1120 H ARG 148 H ARG 148 1.558 3.578 5.486 1121 HA ARG 148 HA ARG 148 -0.902 4.777 6.667 1122 1HB ARG 148 1HB ARG 148 1.856 5.330 7.770 1123 2HB ARG 148 2HB ARG 148 0.306 5.820 8.445 1124 1HG ARG 148 1HG ARG 148 -0.110 3.176 8.373 1125 2HG ARG 148 2HG ARG 148 1.647 3.166 8.512 1126 1HD ARG 148 1HD ARG 148 0.913 5.069 10.377 1127 2HD ARG 148 2HD ARG 148 -0.378 3.879 10.505 1128 HE ARG 148 HE ARG 148 1.185 2.286 11.272 1129 1HH1 ARG 148 1HH1 ARG 148 2.816 5.168 10.146 1130 2HH1 ARG 148 2HH1 ARG 148 4.321 4.712 10.858 1131 1HH2 ARG 148 1HH2 ARG 148 3.160 1.728 12.156 1132 2HH2 ARG 148 2HH2 ARG 148 4.519 2.787 11.979 1133 H PHE 149 H PHE 149 -1.425 6.420 5.278 1134 HA PHE 149 HA PHE 149 0.680 7.816 3.747 1135 1HB PHE 149 1HB PHE 149 -2.335 8.187 3.774 1136 2HB PHE 149 2HB PHE 149 -1.220 8.958 2.647 1137 HD1 PHE 149 HD1 PHE 149 0.394 7.313 1.357 1138 HD2 PHE 149 HD2 PHE 149 -3.320 6.154 3.164 1139 HE1 PHE 149 HE1 PHE 149 0.303 5.318 -0.114 1140 HE2 PHE 149 HE2 PHE 149 -3.411 4.161 1.688 1141 HZ PHE 149 HZ PHE 149 -1.597 3.742 0.056 1142 H HIS 150 H HIS 150 0.846 10.203 3.839 1143 HA HIS 150 HA HIS 150 -0.450 11.580 6.091 1144 1HB HIS 150 1HB HIS 150 2.145 12.363 6.620 1145 2HB HIS 150 2HB HIS 150 1.219 11.218 7.577 1146 HD1 HIS 150 HD1 HIS 150 4.331 11.523 5.804 1147 HD2 HIS 150 HD2 HIS 150 1.685 8.394 6.554 1148 HE1 HIS 150 HE1 HIS 150 5.617 9.381 5.387 1149 H SER 151 H SER 151 -0.657 13.734 5.670 1150 HA SER 151 HA SER 151 0.321 14.674 3.056 1151 1HB SER 151 1HB SER 151 -2.052 15.030 4.418 1152 2HB SER 151 2HB SER 151 -1.239 16.571 4.662 1153 HG SER 151 HG SER 151 -0.977 16.724 2.424 Start of MODEL 15 1 H MET 1 H MET 1 -2.296 19.455 6.086 2 HA MET 1 HA MET 1 -4.185 19.026 8.299 3 1HB MET 1 1HB MET 1 -3.961 17.483 5.769 4 2HB MET 1 2HB MET 1 -3.961 16.537 7.256 5 1HG MET 1 1HG MET 1 -6.258 16.785 6.535 6 2HG MET 1 2HG MET 1 -6.026 17.789 7.967 7 1HE MET 1 1HE MET 1 -6.900 17.400 4.442 8 2HE MET 1 2HE MET 1 -6.844 18.979 3.665 9 3HE MET 1 3HE MET 1 -5.345 18.123 4.013 10 HA PRO 2 HA PRO 2 -0.389 17.484 10.043 11 1HB PRO 2 1HB PRO 2 -1.393 15.827 11.963 12 2HB PRO 2 2HB PRO 2 -1.492 17.591 12.058 13 1HG PRO 2 1HG PRO 2 -3.622 15.629 11.563 14 2HG PRO 2 2HG PRO 2 -3.739 17.301 12.128 15 1HD PRO 2 1HD PRO 2 -4.222 16.305 9.473 16 2HD PRO 2 2HD PRO 2 -4.308 17.988 10.038 17 H GLU 3 H GLU 3 -2.757 14.811 9.668 18 HA GLU 3 HA GLU 3 -0.707 13.231 8.223 19 1HB GLU 3 1HB GLU 3 -1.760 12.629 10.939 20 2HB GLU 3 2HB GLU 3 -1.670 11.270 9.819 21 1HG GLU 3 1HG GLU 3 0.630 11.341 9.695 22 2HG GLU 3 2HG GLU 3 0.697 13.082 9.972 23 H ILE 4 H ILE 4 -1.970 10.897 7.882 24 HA ILE 4 HA ILE 4 -4.780 11.466 7.096 25 HB ILE 4 HB ILE 4 -2.550 10.547 5.257 26 1HG1 ILE 4 1HG1 ILE 4 -4.576 12.782 4.997 27 2HG1 ILE 4 2HG1 ILE 4 -2.941 12.999 5.624 28 1HG2 ILE 4 1HG2 ILE 4 -5.544 10.342 4.924 29 2HG2 ILE 4 2HG2 ILE 4 -4.465 10.449 3.534 30 3HG2 ILE 4 3HG2 ILE 4 -4.326 9.095 4.654 31 1HD1 ILE 4 1HD1 ILE 4 -3.519 11.797 2.907 32 2HD1 ILE 4 2HD1 ILE 4 -3.222 13.518 3.156 33 3HD1 ILE 4 3HD1 ILE 4 -1.962 12.342 3.533 34 H ARG 5 H ARG 5 -6.056 9.763 7.660 35 HA ARG 5 HA ARG 5 -4.708 7.166 8.278 36 1HB ARG 5 1HB ARG 5 -7.126 8.515 9.490 37 2HB ARG 5 2HB ARG 5 -6.779 6.805 9.744 38 1HG ARG 5 1HG ARG 5 -5.475 7.464 11.469 39 2HG ARG 5 2HG ARG 5 -4.332 8.031 10.253 40 1HD ARG 5 1HD ARG 5 -4.612 10.080 11.170 41 2HD ARG 5 2HD ARG 5 -6.187 10.095 10.378 42 HE ARG 5 HE ARG 5 -6.239 8.752 12.962 43 1HH1 ARG 5 1HH1 ARG 5 -6.414 11.842 11.333 44 2HH1 ARG 5 2HH1 ARG 5 -7.298 12.583 12.619 45 1HH2 ARG 5 1HH2 ARG 5 -7.384 9.752 14.602 46 2HH2 ARG 5 2HH2 ARG 5 -7.843 11.415 14.450 47 H LEU 6 H LEU 6 -5.787 5.230 7.660 48 HA LEU 6 HA LEU 6 -7.405 5.493 5.222 49 1HB LEU 6 1HB LEU 6 -5.584 3.592 6.305 50 2HB LEU 6 2HB LEU 6 -7.134 2.771 6.151 51 HG LEU 6 HG LEU 6 -7.270 3.434 3.784 52 1HD1 LEU 6 1HD1 LEU 6 -5.535 5.466 4.456 53 2HD1 LEU 6 2HD1 LEU 6 -4.456 4.337 3.639 54 3HD1 LEU 6 3HD1 LEU 6 -5.879 4.957 2.805 55 1HD2 LEU 6 1HD2 LEU 6 -4.783 2.039 4.765 56 2HD2 LEU 6 2HD2 LEU 6 -6.251 1.329 4.094 57 3HD2 LEU 6 3HD2 LEU 6 -5.125 2.189 3.042 58 H ARG 7 H ARG 7 -9.540 4.646 5.008 59 HA ARG 7 HA ARG 7 -11.005 4.403 7.593 60 1HB ARG 7 1HB ARG 7 -11.686 6.156 5.855 61 2HB ARG 7 2HB ARG 7 -12.222 4.805 4.854 62 1HG ARG 7 1HG ARG 7 -14.192 5.184 5.978 63 2HG ARG 7 2HG ARG 7 -13.427 4.118 7.159 64 1HD ARG 7 1HD ARG 7 -12.694 5.962 8.492 65 2HD ARG 7 2HD ARG 7 -13.090 7.122 7.224 66 HE ARG 7 HE ARG 7 -15.322 7.085 7.966 67 1HH1 ARG 7 1HH1 ARG 7 -13.611 4.289 9.185 68 2HH1 ARG 7 2HH1 ARG 7 -14.935 3.788 10.177 69 1HH2 ARG 7 1HH2 ARG 7 -17.010 6.399 9.267 70 2HH2 ARG 7 2HH2 ARG 7 -16.838 4.967 10.227 71 H HIS 8 H HIS 8 -10.872 2.984 4.340 72 HA HIS 8 HA HIS 8 -11.118 0.290 5.423 73 1HB HIS 8 1HB HIS 8 -13.206 -0.238 4.156 74 2HB HIS 8 2HB HIS 8 -13.474 0.909 5.466 75 HD1 HIS 8 HD1 HIS 8 -14.489 3.121 4.844 76 HD2 HIS 8 HD2 HIS 8 -12.995 1.103 1.517 77 HE1 HIS 8 HE1 HIS 8 -15.181 4.472 2.816 78 H VAL 9 H VAL 9 -11.530 -1.227 3.310 79 HA VAL 9 HA VAL 9 -9.511 -0.288 1.343 80 HB VAL 9 HB VAL 9 -9.046 -2.436 2.447 81 1HG1 VAL 9 1HG1 VAL 9 -11.827 -2.833 2.156 82 2HG1 VAL 9 2HG1 VAL 9 -11.060 -4.056 1.143 83 3HG1 VAL 9 3HG1 VAL 9 -10.655 -3.949 2.856 84 1HG2 VAL 9 1HG2 VAL 9 -9.781 -2.601 -0.490 85 2HG2 VAL 9 2HG2 VAL 9 -8.203 -2.216 0.198 86 3HG2 VAL 9 3HG2 VAL 9 -8.858 -3.846 0.353 87 H VAL 10 H VAL 10 -10.698 0.938 -0.114 88 HA VAL 10 HA VAL 10 -13.324 0.442 -1.002 89 HB VAL 10 HB VAL 10 -12.393 2.565 -1.524 90 1HG1 VAL 10 1HG1 VAL 10 -9.993 1.238 -1.898 91 2HG1 VAL 10 2HG1 VAL 10 -10.404 1.765 -3.526 92 3HG1 VAL 10 3HG1 VAL 10 -10.280 2.944 -2.224 93 1HG2 VAL 10 1HG2 VAL 10 -13.841 1.354 -3.320 94 2HG2 VAL 10 2HG2 VAL 10 -12.993 2.828 -3.787 95 3HG2 VAL 10 3HG2 VAL 10 -12.339 1.253 -4.238 96 H SER 11 H SER 11 -10.331 -0.466 -2.826 97 HA SER 11 HA SER 11 -11.971 -2.659 -4.003 98 1HB SER 11 1HB SER 11 -10.438 -0.579 -5.310 99 2HB SER 11 2HB SER 11 -9.826 -2.167 -5.759 100 HG SER 11 HG SER 11 -12.464 -1.157 -5.975 101 H CYS 12 H CYS 12 -10.760 -4.674 -4.407 102 HA CYS 12 HA CYS 12 -8.083 -4.826 -3.113 103 1HB CYS 12 1HB CYS 12 -8.818 -6.818 -1.812 104 2HB CYS 12 2HB CYS 12 -9.659 -5.348 -1.331 105 HG CYS 12 HG CYS 12 -11.377 -7.375 -1.734 106 H SER 13 H SER 13 -6.728 -5.979 -4.391 107 HA SER 13 HA SER 13 -7.900 -8.122 -6.122 108 1HB SER 13 1HB SER 13 -6.137 -5.822 -6.827 109 2HB SER 13 2HB SER 13 -5.780 -7.364 -7.597 110 HG SER 13 HG SER 13 -7.321 -6.050 -8.743 111 H SER 14 H SER 14 -6.978 -8.765 -3.662 112 HA SER 14 HA SER 14 -5.268 -10.874 -3.771 113 1HB SER 14 1HB SER 14 -3.074 -9.690 -2.908 114 2HB SER 14 2HB SER 14 -3.364 -9.891 -4.627 115 HG SER 14 HG SER 14 -4.378 -7.590 -3.392 116 H GLN 15 H GLN 15 -7.301 -9.956 -2.102 117 HA GLN 15 HA GLN 15 -5.895 -9.498 0.506 118 1HB GLN 15 1HB GLN 15 -8.473 -8.545 -0.599 119 2HB GLN 15 2HB GLN 15 -8.557 -9.089 1.064 120 1HG GLN 15 1HG GLN 15 -7.998 -6.839 1.297 121 2HG GLN 15 2HG GLN 15 -6.433 -7.635 1.408 122 1HE2 GLN 15 2HE2 GLN 15 -5.257 -7.797 -0.804 123 2HE2 GLN 15 1HE2 GLN 15 -5.408 -6.490 -1.865 124 H ASP 16 H ASP 16 -6.354 -10.787 2.245 125 HA ASP 16 HA ASP 16 -7.503 -13.441 1.588 126 1HB ASP 16 1HB ASP 16 -5.186 -12.807 2.753 127 2HB ASP 16 2HB ASP 16 -6.199 -12.821 4.195 128 H SER 17 H SER 17 -8.368 -14.350 4.005 129 HA SER 17 HA SER 17 -10.707 -12.604 4.525 130 1HB SER 17 1HB SER 17 -11.280 -14.879 3.922 131 2HB SER 17 2HB SER 17 -10.173 -15.524 5.130 132 HG SER 17 HG SER 17 -12.600 -15.219 5.572 133 H THR 18 H THR 18 -8.812 -14.866 6.560 134 HA THR 18 HA THR 18 -9.344 -13.466 8.996 135 HB THR 18 HB THR 18 -7.001 -14.745 9.530 136 HG1 THR 18 HG1 THR 18 -6.784 -15.356 7.338 137 1HG2 THR 18 1HG2 THR 18 -9.464 -15.072 10.345 138 2HG2 THR 18 2HG2 THR 18 -9.493 -16.380 9.164 139 3HG2 THR 18 3HG2 THR 18 -8.328 -16.413 10.488 140 H HIS 19 H HIS 19 -6.726 -13.252 6.632 141 HA HIS 19 HA HIS 19 -5.703 -10.848 8.088 142 1HB HIS 19 1HB HIS 19 -4.270 -12.919 6.410 143 2HB HIS 19 2HB HIS 19 -3.554 -11.348 6.771 144 HD1 HIS 19 HD1 HIS 19 -2.208 -11.291 8.863 145 HD2 HIS 19 HD2 HIS 19 -5.129 -14.261 9.011 146 HE1 HIS 19 HE1 HIS 19 -1.892 -12.496 11.068 147 H CYS 20 H CYS 20 -7.584 -9.900 6.798 148 HA CYS 20 HA CYS 20 -7.101 -9.577 3.896 149 1HB CYS 20 1HB CYS 20 -9.180 -8.214 3.966 150 2HB CYS 20 2HB CYS 20 -9.419 -9.816 4.646 151 HG CYS 20 HG CYS 20 -9.410 -7.166 6.256 152 H ALA 21 H ALA 21 -7.356 -7.282 3.109 153 HA ALA 21 HA ALA 21 -5.152 -5.699 4.001 154 1HB ALA 21 1HB ALA 21 -7.486 -5.121 2.151 155 2HB ALA 21 2HB ALA 21 -6.137 -4.010 2.390 156 3HB ALA 21 3HB ALA 21 -5.853 -5.605 1.696 157 H GLU 22 H GLU 22 -8.544 -5.802 4.859 158 HA GLU 22 HA GLU 22 -8.854 -3.187 5.928 159 1HB GLU 22 1HB GLU 22 -10.467 -5.395 5.703 160 2HB GLU 22 2HB GLU 22 -10.170 -5.357 7.442 161 1HG GLU 22 1HG GLU 22 -10.770 -2.876 7.357 162 2HG GLU 22 2HG GLU 22 -11.352 -3.169 5.717 163 H ASN 23 H ASN 23 -6.976 -5.900 7.060 164 HA ASN 23 HA ASN 23 -6.906 -5.233 9.860 165 1HB ASN 23 1HB ASN 23 -5.141 -6.777 7.996 166 2HB ASN 23 2HB ASN 23 -4.550 -6.384 9.611 167 1HD2 ASN 23 2HD2 ASN 23 -6.473 -8.579 7.835 168 2HD2 ASN 23 1HD2 ASN 23 -7.222 -9.355 9.147 169 H LEU 24 H LEU 24 -5.527 -3.786 7.058 170 HA LEU 24 HA LEU 24 -3.275 -2.465 8.228 171 1HB LEU 24 1HB LEU 24 -4.969 -1.542 5.886 172 2HB LEU 24 2HB LEU 24 -3.296 -1.100 6.222 173 HG LEU 24 HG LEU 24 -3.981 -4.012 5.936 174 1HD1 LEU 24 1HD1 LEU 24 -4.876 -2.395 3.994 175 2HD1 LEU 24 2HD1 LEU 24 -3.192 -2.522 3.486 176 3HD1 LEU 24 3HD1 LEU 24 -4.175 -3.976 3.654 177 1HD2 LEU 24 1HD2 LEU 24 -1.616 -2.239 5.856 178 2HD2 LEU 24 2HD2 LEU 24 -1.750 -3.922 6.363 179 3HD2 LEU 24 3HD2 LEU 24 -1.626 -3.526 4.651 180 H LEU 25 H LEU 25 -6.728 -1.841 8.193 181 HA LEU 25 HA LEU 25 -6.707 0.919 8.880 182 1HB LEU 25 1HB LEU 25 -8.615 -1.373 9.274 183 2HB LEU 25 2HB LEU 25 -8.936 0.161 10.055 184 HG LEU 25 HG LEU 25 -10.057 -0.106 7.820 185 1HD1 LEU 25 1HD1 LEU 25 -8.154 2.123 8.444 186 2HD1 LEU 25 2HD1 LEU 25 -9.018 2.135 6.909 187 3HD1 LEU 25 3HD1 LEU 25 -9.914 2.124 8.427 188 1HD2 LEU 25 1HD2 LEU 25 -8.135 -1.345 6.761 189 2HD2 LEU 25 2HD2 LEU 25 -8.735 0.002 5.793 190 3HD2 LEU 25 3HD2 LEU 25 -7.244 0.177 6.720 191 H LYS 26 H LYS 26 -5.797 -1.916 10.671 192 HA LYS 26 HA LYS 26 -5.822 -0.318 13.200 193 1HB LYS 26 1HB LYS 26 -5.456 -3.312 13.162 194 2HB LYS 26 2HB LYS 26 -6.080 -2.285 14.450 195 1HG LYS 26 1HG LYS 26 -7.949 -1.799 12.562 196 2HG LYS 26 2HG LYS 26 -7.493 -3.441 12.105 197 1HD LYS 26 1HD LYS 26 -7.819 -4.119 14.508 198 2HD LYS 26 2HD LYS 26 -8.465 -2.507 14.819 199 1HE LYS 26 1HE LYS 26 -9.654 -3.910 12.499 200 2HE LYS 26 2HE LYS 26 -10.000 -4.631 14.071 201 1HZ LYS 26 1HZ LYS 26 -10.409 -1.774 13.373 202 2HZ LYS 26 2HZ LYS 26 -11.635 -2.948 13.454 203 3HZ LYS 26 3HZ LYS 26 -10.786 -2.503 14.857 204 H ALA 27 H ALA 27 -3.838 0.572 11.979 205 HA ALA 27 HA ALA 27 -1.460 -0.822 11.492 206 1HB ALA 27 1HB ALA 27 -1.978 1.967 12.513 207 2HB ALA 27 2HB ALA 27 -0.333 1.385 12.249 208 3HB ALA 27 3HB ALA 27 -1.469 1.462 10.901 209 H ASP 28 H ASP 28 -2.556 0.543 14.610 210 HA ASP 28 HA ASP 28 -0.258 -0.686 16.004 211 1HB ASP 28 1HB ASP 28 -1.293 0.368 18.032 212 2HB ASP 28 2HB ASP 28 -0.943 1.529 16.751 213 H THR 29 H THR 29 -0.941 -2.905 15.414 214 HA THR 29 HA THR 29 -2.587 -4.105 17.499 215 HB THR 29 HB THR 29 -3.479 -4.815 14.733 216 HG1 THR 29 HG1 THR 29 -4.409 -2.532 16.128 217 1HG2 THR 29 1HG2 THR 29 -4.215 -5.633 17.188 218 2HG2 THR 29 2HG2 THR 29 -5.323 -4.275 16.996 219 3HG2 THR 29 3HG2 THR 29 -5.332 -5.593 15.824 220 H TYR 30 H TYR 30 -2.909 -6.591 15.884 221 HA TYR 30 HA TYR 30 -0.039 -7.270 15.453 222 1HB TYR 30 1HB TYR 30 -0.424 -9.412 16.613 223 2HB TYR 30 2HB TYR 30 -0.743 -8.034 17.671 224 HD1 TYR 30 HD1 TYR 30 -3.123 -7.285 18.052 225 HD2 TYR 30 HD2 TYR 30 -2.152 -10.964 16.057 226 HE1 TYR 30 HE1 TYR 30 -5.433 -8.102 18.434 227 HE2 TYR 30 HE2 TYR 30 -4.462 -11.780 16.440 228 HH TYR 30 HH TYR 30 -6.955 -10.029 17.029 229 H ARG 31 H ARG 31 -1.899 -6.602 13.442 230 HA ARG 31 HA ARG 31 -1.863 -9.109 11.884 231 1HB ARG 31 1HB ARG 31 -4.357 -7.625 12.677 232 2HB ARG 31 2HB ARG 31 -4.289 -8.436 11.113 233 1HG ARG 31 1HG ARG 31 -3.293 -10.400 12.701 234 2HG ARG 31 2HG ARG 31 -4.372 -9.599 13.842 235 1HD ARG 31 1HD ARG 31 -5.926 -9.718 11.566 236 2HD ARG 31 2HD ARG 31 -5.022 -11.230 11.483 237 HE ARG 31 HE ARG 31 -5.887 -11.161 14.099 238 1HH1 ARG 31 1HH1 ARG 31 -7.482 -10.829 11.004 239 2HH1 ARG 31 2HH1 ARG 31 -8.973 -11.480 11.591 240 1HH2 ARG 31 1HH2 ARG 31 -7.834 -11.997 14.814 241 2HH2 ARG 31 2HH2 ARG 31 -9.172 -12.134 13.724 242 H LYS 32 H LYS 32 -1.400 -8.663 9.743 243 HA LYS 32 HA LYS 32 -1.583 -5.807 8.886 244 1HB LYS 32 1HB LYS 32 0.569 -6.058 7.736 245 2HB LYS 32 2HB LYS 32 0.750 -6.408 9.448 246 1HG LYS 32 1HG LYS 32 0.047 -8.818 7.980 247 2HG LYS 32 2HG LYS 32 1.489 -8.071 7.299 248 1HD LYS 32 1HD LYS 32 2.560 -9.207 8.959 249 2HD LYS 32 2HD LYS 32 2.034 -7.851 9.958 250 1HE LYS 32 1HE LYS 32 0.354 -9.069 10.970 251 2HE LYS 32 2HE LYS 32 0.117 -10.109 9.566 252 1HZ LYS 32 1HZ LYS 32 2.306 -11.114 10.073 253 2HZ LYS 32 2HZ LYS 32 2.357 -10.209 11.510 254 3HZ LYS 32 3HZ LYS 32 1.145 -11.379 11.281 255 H TRP 33 H TRP 33 -0.623 -6.298 6.220 256 HA TRP 33 HA TRP 33 -3.062 -7.483 5.092 257 1HB TRP 33 1HB TRP 33 -2.080 -5.386 4.125 258 2HB TRP 33 2HB TRP 33 -0.660 -6.301 3.680 259 HD1 TRP 33 HD1 TRP 33 -4.193 -7.710 3.306 260 HE1 TRP 33 HE1 TRP 33 -4.636 -8.111 0.811 261 HE3 TRP 33 HE3 TRP 33 -0.032 -5.586 1.347 262 HZ2 TRP 33 HZ2 TRP 33 -3.393 -7.587 -1.705 263 HZ3 TRP 33 HZ3 TRP 33 0.338 -5.557 -1.122 264 HH2 TRP 33 HH2 TRP 33 -1.347 -6.538 -2.645 265 H ARG 34 H ARG 34 -3.174 -9.370 3.949 266 HA ARG 34 HA ARG 34 -0.688 -10.858 3.337 267 1HB ARG 34 1HB ARG 34 -3.023 -11.951 4.946 268 2HB ARG 34 2HB ARG 34 -1.797 -12.971 4.198 269 1HG ARG 34 1HG ARG 34 -0.852 -10.723 5.922 270 2HG ARG 34 2HG ARG 34 -1.557 -12.125 6.724 271 1HD ARG 34 1HD ARG 34 0.141 -13.220 4.783 272 2HD ARG 34 2HD ARG 34 1.041 -11.854 5.444 273 HE ARG 34 HE ARG 34 1.275 -13.061 7.441 274 1HH1 ARG 34 1HH1 ARG 34 -1.400 -14.346 5.594 275 2HH1 ARG 34 2HH1 ARG 34 -1.660 -15.656 6.693 276 1HH2 ARG 34 1HH2 ARG 34 0.906 -14.771 8.834 277 2HH2 ARG 34 2HH2 ARG 34 -0.369 -15.897 8.507 278 H ALA 35 H ALA 35 -0.879 -11.674 1.280 279 HA ALA 35 HA ALA 35 -3.046 -11.036 -0.407 280 1HB ALA 35 1HB ALA 35 -0.705 -11.789 -1.090 281 2HB ALA 35 2HB ALA 35 -1.245 -13.443 -0.798 282 3HB ALA 35 3HB ALA 35 -2.025 -12.468 -2.043 283 H ALA 36 H ALA 36 -4.541 -12.518 -1.503 284 HA ALA 36 HA ALA 36 -6.094 -14.009 0.404 285 1HB ALA 36 1HB ALA 36 -6.732 -12.749 -1.855 286 2HB ALA 36 2HB ALA 36 -6.509 -14.364 -2.528 287 3HB ALA 36 3HB ALA 36 -7.698 -14.097 -1.252 288 H LYS 37 H LYS 37 -3.695 -14.890 -1.990 289 HA LYS 37 HA LYS 37 -3.910 -17.699 -1.046 290 1HB LYS 37 1HB LYS 37 -4.688 -16.989 -3.538 291 2HB LYS 37 2HB LYS 37 -2.972 -17.245 -3.829 292 1HG LYS 37 1HG LYS 37 -3.105 -19.491 -3.451 293 2HG LYS 37 2HG LYS 37 -4.320 -19.311 -2.186 294 1HD LYS 37 1HD LYS 37 -5.154 -18.616 -4.960 295 2HD LYS 37 2HD LYS 37 -4.915 -20.326 -4.603 296 1HE LYS 37 1HE LYS 37 -6.574 -18.526 -2.829 297 2HE LYS 37 2HE LYS 37 -7.269 -19.410 -4.188 298 1HZ LYS 37 1HZ LYS 37 -5.612 -20.840 -2.226 299 2HZ LYS 37 2HZ LYS 37 -7.225 -20.474 -1.840 300 3HZ LYS 37 3HZ LYS 37 -6.874 -21.426 -3.200 301 H ALA 38 H ALA 38 -1.777 -18.781 -2.146 302 HA ALA 38 HA ALA 38 0.479 -17.224 -0.993 303 1HB ALA 38 1HB ALA 38 -0.006 -19.635 -0.303 304 2HB ALA 38 2HB ALA 38 0.516 -20.109 -1.919 305 3HB ALA 38 3HB ALA 38 1.647 -19.310 -0.827 306 H GLY 39 H GLY 39 2.592 -18.373 -2.388 307 1HA GLY 39 1HA GLY 39 3.827 -18.134 -4.376 308 2HA GLY 39 2HA GLY 39 2.306 -18.348 -5.244 309 H GLU 40 H GLU 40 3.268 -15.882 -2.923 310 HA GLU 40 HA GLU 40 2.046 -13.666 -3.989 311 1HB GLU 40 1HB GLU 40 4.586 -14.027 -2.446 312 2HB GLU 40 2HB GLU 40 4.142 -12.425 -3.031 313 1HG GLU 40 1HG GLU 40 3.137 -12.506 -0.917 314 2HG GLU 40 2HG GLU 40 1.818 -12.942 -1.998 315 H LYS 41 H LYS 41 2.121 -13.699 -6.243 316 HA LYS 41 HA LYS 41 4.740 -13.260 -7.580 317 1HB LYS 41 1HB LYS 41 3.030 -14.838 -8.569 318 2HB LYS 41 2HB LYS 41 1.981 -13.444 -8.831 319 1HG LYS 41 1HG LYS 41 3.319 -12.573 -10.500 320 2HG LYS 41 2HG LYS 41 4.791 -13.277 -9.832 321 1HD LYS 41 1HD LYS 41 4.412 -15.349 -10.810 322 2HD LYS 41 2HD LYS 41 2.664 -15.114 -10.871 323 1HE LYS 41 1HE LYS 41 3.128 -13.254 -12.575 324 2HE LYS 41 2HE LYS 41 4.769 -13.894 -12.665 325 1HZ LYS 41 1HZ LYS 41 3.863 -16.049 -13.263 326 2HZ LYS 41 2HZ LYS 41 2.281 -15.433 -13.178 327 3HZ LYS 41 3HZ LYS 41 3.350 -14.860 -14.364 328 H THR 42 H THR 42 1.501 -11.770 -7.526 329 HA THR 42 HA THR 42 2.645 -9.096 -7.213 330 HB THR 42 HB THR 42 1.407 -8.253 -9.287 331 HG1 THR 42 HG1 THR 42 0.333 -9.707 -10.319 332 1HG2 THR 42 1HG2 THR 42 3.967 -8.885 -8.983 333 2HG2 THR 42 2HG2 THR 42 3.564 -10.131 -10.163 334 3HG2 THR 42 3HG2 THR 42 3.328 -8.430 -10.563 335 H ILE 43 H ILE 43 1.316 -8.386 -5.627 336 HA ILE 43 HA ILE 43 -1.591 -9.082 -5.804 337 HB ILE 43 HB ILE 43 -1.525 -8.379 -3.302 338 1HG1 ILE 43 1HG1 ILE 43 1.403 -9.037 -3.697 339 2HG1 ILE 43 2HG1 ILE 43 0.780 -7.408 -3.449 340 1HG2 ILE 43 1HG2 ILE 43 -1.563 -10.748 -4.448 341 2HG2 ILE 43 2HG2 ILE 43 0.069 -10.855 -3.787 342 3HG2 ILE 43 3HG2 ILE 43 -1.303 -10.594 -2.711 343 1HD1 ILE 43 1HD1 ILE 43 -0.417 -8.798 -1.387 344 2HD1 ILE 43 2HD1 ILE 43 1.159 -9.583 -1.500 345 3HD1 ILE 43 3HD1 ILE 43 1.058 -7.843 -1.231 346 H SER 44 H SER 44 -3.120 -7.409 -5.779 347 HA SER 44 HA SER 44 -1.988 -4.655 -5.518 348 1HB SER 44 1HB SER 44 -4.101 -5.543 -7.481 349 2HB SER 44 2HB SER 44 -3.525 -3.898 -7.278 350 HG SER 44 HG SER 44 -2.551 -5.358 -8.981 351 H VAL 45 H VAL 45 -2.933 -3.574 -3.927 352 HA VAL 45 HA VAL 45 -5.735 -4.275 -3.170 353 HB VAL 45 HB VAL 45 -4.170 -5.060 -1.455 354 1HG1 VAL 45 1HG1 VAL 45 -2.361 -3.400 -2.030 355 2HG1 VAL 45 2HG1 VAL 45 -3.295 -2.185 -1.161 356 3HG1 VAL 45 3HG1 VAL 45 -2.659 -3.586 -0.304 357 1HG2 VAL 45 1HG2 VAL 45 -6.395 -3.541 -1.025 358 2HG2 VAL 45 2HG2 VAL 45 -5.483 -4.339 0.251 359 3HG2 VAL 45 3HG2 VAL 45 -5.194 -2.639 -0.101 360 H VAL 46 H VAL 46 -7.103 -2.543 -3.378 361 HA VAL 46 HA VAL 46 -5.890 0.173 -3.575 362 HB VAL 46 HB VAL 46 -8.724 -0.534 -4.320 363 1HG1 VAL 46 1HG1 VAL 46 -6.770 1.598 -5.215 364 2HG1 VAL 46 2HG1 VAL 46 -8.420 1.418 -5.814 365 3HG1 VAL 46 3HG1 VAL 46 -8.135 1.833 -4.123 366 1HG2 VAL 46 1HG2 VAL 46 -6.237 -1.339 -5.672 367 2HG2 VAL 46 2HG2 VAL 46 -7.885 -1.898 -5.942 368 3HG2 VAL 46 3HG2 VAL 46 -7.320 -0.419 -6.716 369 H LEU 47 H LEU 47 -5.970 1.236 -1.669 370 HA LEU 47 HA LEU 47 -8.150 0.604 0.250 371 1HB LEU 47 1HB LEU 47 -5.810 2.407 0.837 372 2HB LEU 47 2HB LEU 47 -6.773 1.449 1.960 373 HG LEU 47 HG LEU 47 -5.796 -0.509 0.317 374 1HD1 LEU 47 1HD1 LEU 47 -4.360 1.619 -0.551 375 2HD1 LEU 47 2HD1 LEU 47 -3.319 1.068 0.762 376 3HD1 LEU 47 3HD1 LEU 47 -3.736 -0.031 -0.553 377 1HD2 LEU 47 1HD2 LEU 47 -5.760 -0.171 2.896 378 2HD2 LEU 47 2HD2 LEU 47 -4.498 -1.165 2.172 379 3HD2 LEU 47 3HD2 LEU 47 -4.151 0.501 2.635 380 H GLN 48 H GLN 48 -8.911 2.563 1.566 381 HA GLN 48 HA GLN 48 -9.478 4.810 -0.325 382 1HB GLN 48 1HB GLN 48 -11.213 3.132 1.217 383 2HB GLN 48 2HB GLN 48 -11.322 4.761 1.880 384 1HG GLN 48 1HG GLN 48 -11.389 4.441 -1.095 385 2HG GLN 48 2HG GLN 48 -12.834 4.015 -0.177 386 1HE2 GLN 48 2HE2 GLN 48 -12.947 5.909 1.821 387 2HE2 GLN 48 1HE2 GLN 48 -13.024 7.473 1.168 388 H LEU 49 H LEU 49 -10.092 6.875 1.032 389 HA LEU 49 HA LEU 49 -8.164 7.156 3.296 390 1HB LEU 49 1HB LEU 49 -8.671 8.907 0.901 391 2HB LEU 49 2HB LEU 49 -8.153 9.645 2.414 392 HG LEU 49 HG LEU 49 -6.221 9.136 0.967 393 1HD1 LEU 49 1HD1 LEU 49 -6.402 8.682 3.625 394 2HD1 LEU 49 2HD1 LEU 49 -5.928 7.073 3.080 395 3HD1 LEU 49 3HD1 LEU 49 -4.908 8.464 2.713 396 1HD2 LEU 49 1HD2 LEU 49 -7.596 6.953 0.156 397 2HD2 LEU 49 2HD2 LEU 49 -5.846 7.093 -0.006 398 3HD2 LEU 49 3HD2 LEU 49 -6.538 6.204 1.352 399 H GLU 50 H GLU 50 -8.986 8.247 5.069 400 HA GLU 50 HA GLU 50 -11.876 8.542 5.258 401 1HB GLU 50 1HB GLU 50 -10.380 7.773 7.130 402 2HB GLU 50 2HB GLU 50 -9.776 9.425 7.253 403 1HG GLU 50 1HG GLU 50 -12.683 9.408 7.214 404 2HG GLU 50 2HG GLU 50 -12.076 8.364 8.497 405 H LYS 51 H LYS 51 -10.381 10.441 3.395 406 HA LYS 51 HA LYS 51 -11.916 12.728 3.572 407 1HB LYS 51 1HB LYS 51 -10.223 14.390 4.508 408 2HB LYS 51 2HB LYS 51 -10.985 13.356 5.712 409 1HG LYS 51 1HG LYS 51 -9.030 11.855 5.672 410 2HG LYS 51 2HG LYS 51 -8.274 12.867 4.442 411 1HD LYS 51 1HD LYS 51 -8.850 14.738 6.337 412 2HD LYS 51 2HD LYS 51 -8.558 13.327 7.353 413 1HE LYS 51 1HE LYS 51 -6.465 13.062 5.697 414 2HE LYS 51 2HE LYS 51 -6.675 14.810 5.579 415 1HZ LYS 51 1HZ LYS 51 -6.494 13.331 8.145 416 2HZ LYS 51 2HZ LYS 51 -5.176 14.091 7.396 417 3HZ LYS 51 3HZ LYS 51 -6.496 15.017 7.931 418 H GLU 52 H GLU 52 -11.561 13.791 1.643 419 HA GLU 52 HA GLU 52 -9.390 12.885 -0.066 420 1HB GLU 52 1HB GLU 52 -11.781 13.646 -0.771 421 2HB GLU 52 2HB GLU 52 -11.116 15.271 -0.638 422 1HG GLU 52 1HG GLU 52 -9.249 14.562 -2.168 423 2HG GLU 52 2HG GLU 52 -10.113 13.046 -2.421 424 H GLU 53 H GLU 53 -7.414 13.618 0.309 425 HA GLU 53 HA GLU 53 -6.974 16.529 0.632 426 1HB GLU 53 1HB GLU 53 -5.030 15.625 2.306 427 2HB GLU 53 2HB GLU 53 -6.599 16.185 2.868 428 1HG GLU 53 1HG GLU 53 -5.944 14.004 3.875 429 2HG GLU 53 2HG GLU 53 -7.432 13.887 2.940 430 H GLN 54 H GLN 54 -4.591 17.013 0.368 431 HA GLN 54 HA GLN 54 -3.631 15.718 -2.038 432 1HB GLN 54 1HB GLN 54 -2.263 17.705 -0.192 433 2HB GLN 54 2HB GLN 54 -1.673 17.227 -1.783 434 1HG GLN 54 1HG GLN 54 -3.446 18.280 -2.901 435 2HG GLN 54 2HG GLN 54 -4.461 18.302 -1.462 436 1HE2 GLN 54 2HE2 GLN 54 -1.033 19.331 -1.721 437 2HE2 GLN 54 1HE2 GLN 54 -1.323 20.943 -1.276 438 H ILE 55 H ILE 55 -1.045 15.174 -1.892 439 HA ILE 55 HA ILE 55 -0.677 13.381 0.479 440 HB ILE 55 HB ILE 55 0.547 12.611 -2.136 441 1HG1 ILE 55 1HG1 ILE 55 -1.773 13.067 -2.794 442 2HG1 ILE 55 2HG1 ILE 55 -1.456 11.335 -2.795 443 1HG2 ILE 55 1HG2 ILE 55 0.947 11.431 0.055 444 2HG2 ILE 55 2HG2 ILE 55 -0.749 10.944 0.024 445 3HG2 ILE 55 3HG2 ILE 55 0.351 10.392 -1.240 446 1HD1 ILE 55 1HD1 ILE 55 -2.303 11.928 -0.182 447 2HD1 ILE 55 2HD1 ILE 55 -3.380 12.835 -1.244 448 3HD1 ILE 55 3HD1 ILE 55 -3.222 11.090 -1.434 449 H HIS 56 H HIS 56 1.223 13.741 1.530 450 HA HIS 56 HA HIS 56 3.347 15.267 0.071 451 1HB HIS 56 1HB HIS 56 2.168 16.555 1.881 452 2HB HIS 56 2HB HIS 56 2.763 15.370 3.042 453 HD1 HIS 56 HD1 HIS 56 4.131 17.798 0.441 454 HD2 HIS 56 HD2 HIS 56 5.334 15.887 3.946 455 HE1 HIS 56 HE1 HIS 56 6.412 18.734 1.021 456 H SER 57 H SER 57 2.667 12.803 2.535 457 HA SER 57 HA SER 57 5.254 11.502 1.873 458 1HB SER 57 1HB SER 57 4.512 12.682 4.529 459 2HB SER 57 2HB SER 57 5.422 11.174 4.503 460 HG SER 57 HG SER 57 6.550 13.366 4.418 461 H VAL 58 H VAL 58 5.291 9.266 2.766 462 HA VAL 58 HA VAL 58 2.653 8.183 3.566 463 HB VAL 58 HB VAL 58 4.194 7.331 1.096 464 1HG1 VAL 58 1HG1 VAL 58 1.789 6.146 2.499 465 2HG1 VAL 58 2HG1 VAL 58 2.129 5.833 0.796 466 3HG1 VAL 58 3HG1 VAL 58 3.286 5.341 2.032 467 1HG2 VAL 58 1HG2 VAL 58 1.635 8.838 1.584 468 2HG2 VAL 58 2HG2 VAL 58 2.960 9.230 0.488 469 3HG2 VAL 58 3HG2 VAL 58 1.851 7.915 0.098 470 H ASP 59 H ASP 59 2.846 5.884 4.247 471 HA ASP 59 HA ASP 59 5.617 5.008 4.885 472 1HB ASP 59 1HB ASP 59 3.456 5.755 6.787 473 2HB ASP 59 2HB ASP 59 4.370 4.299 7.173 474 H ILE 60 H ILE 60 5.836 2.874 4.388 475 HA ILE 60 HA ILE 60 3.496 1.084 4.632 476 HB ILE 60 HB ILE 60 4.811 1.882 2.076 477 1HG1 ILE 60 1HG1 ILE 60 2.328 0.886 1.511 478 2HG1 ILE 60 2HG1 ILE 60 2.122 1.380 3.190 479 1HG2 ILE 60 1HG2 ILE 60 4.120 -0.976 2.736 480 2HG2 ILE 60 2HG2 ILE 60 3.947 -0.367 1.090 481 3HG2 ILE 60 3HG2 ILE 60 5.527 -0.352 1.874 482 1HD1 ILE 60 1HD1 ILE 60 3.532 3.297 1.410 483 2HD1 ILE 60 2HD1 ILE 60 1.805 3.082 1.127 484 3HD1 ILE 60 3HD1 ILE 60 2.380 3.604 2.710 485 H GLY 61 H GLY 61 4.105 -0.812 5.509 486 1HA GLY 61 1HA GLY 61 6.980 -1.278 5.904 487 2HA GLY 61 2HA GLY 61 5.705 -2.069 6.806 488 H ASN 62 H ASN 62 8.039 -2.791 4.812 489 HA ASN 62 HA ASN 62 6.615 -4.392 2.804 490 1HB ASN 62 1HB ASN 62 9.353 -3.527 3.290 491 2HB ASN 62 2HB ASN 62 9.294 -5.240 2.876 492 1HD2 ASN 62 2HD2 ASN 62 9.972 -5.141 0.682 493 2HD2 ASN 62 1HD2 ASN 62 9.140 -4.273 -0.516 494 H ASP 63 H ASP 63 5.668 -6.309 3.383 495 HA ASP 63 HA ASP 63 6.910 -7.876 5.609 496 1HB ASP 63 1HB ASP 63 4.359 -7.106 5.457 497 2HB ASP 63 2HB ASP 63 4.228 -8.554 4.461 498 H GLY 64 H GLY 64 8.461 -8.238 3.588 499 1HA GLY 64 1HA GLY 64 9.320 -10.271 2.559 500 2HA GLY 64 2HA GLY 64 7.660 -10.844 2.386 501 H SER 65 H SER 65 6.739 -8.178 1.439 502 HA SER 65 HA SER 65 6.975 -8.546 -1.376 503 1HB SER 65 1HB SER 65 5.957 -6.314 -1.535 504 2HB SER 65 2HB SER 65 5.150 -7.270 -0.296 505 HG SER 65 HG SER 65 6.428 -4.932 -0.061 506 H ALA 66 H ALA 66 7.827 -6.678 -2.803 507 HA ALA 66 HA ALA 66 10.374 -5.574 -1.750 508 1HB ALA 66 1HB ALA 66 10.658 -7.809 -3.050 509 2HB ALA 66 2HB ALA 66 10.272 -6.849 -4.479 510 3HB ALA 66 3HB ALA 66 11.685 -6.448 -3.503 511 H PHE 67 H PHE 67 8.273 -5.749 -4.638 512 HA PHE 67 HA PHE 67 8.918 -2.906 -5.219 513 1HB PHE 67 1HB PHE 67 7.246 -4.857 -6.831 514 2HB PHE 67 2HB PHE 67 7.812 -3.284 -7.363 515 HD1 PHE 67 HD1 PHE 67 10.574 -3.155 -6.471 516 HD2 PHE 67 HD2 PHE 67 8.379 -6.484 -8.068 517 HE1 PHE 67 HE1 PHE 67 12.691 -4.177 -7.244 518 HE2 PHE 67 HE2 PHE 67 10.491 -7.511 -8.834 519 HZ PHE 67 HZ PHE 67 12.654 -6.360 -8.429 520 H VAL 68 H VAL 68 7.578 -1.332 -4.544 521 HA VAL 68 HA VAL 68 4.707 -2.043 -4.069 522 HB VAL 68 HB VAL 68 6.391 -0.189 -2.360 523 1HG1 VAL 68 1HG1 VAL 68 3.895 0.295 -2.605 524 2HG1 VAL 68 2HG1 VAL 68 3.608 -1.275 -1.854 525 3HG1 VAL 68 3HG1 VAL 68 4.449 -0.009 -0.959 526 1HG2 VAL 68 1HG2 VAL 68 5.381 -3.015 -1.952 527 2HG2 VAL 68 2HG2 VAL 68 7.061 -2.478 -1.981 528 3HG2 VAL 68 3HG2 VAL 68 6.007 -2.007 -0.648 529 H GLU 69 H GLU 69 3.578 -0.984 -5.566 530 HA GLU 69 HA GLU 69 4.457 1.736 -6.436 531 1HB GLU 69 1HB GLU 69 4.123 0.026 -8.210 532 2HB GLU 69 2HB GLU 69 2.448 -0.162 -7.694 533 1HG GLU 69 1HG GLU 69 1.788 1.782 -8.683 534 2HG GLU 69 2HG GLU 69 3.270 2.628 -8.238 535 H VAL 70 H VAL 70 3.109 3.514 -6.134 536 HA VAL 70 HA VAL 70 0.497 2.966 -4.780 537 HB VAL 70 HB VAL 70 2.340 5.282 -4.171 538 1HG1 VAL 70 1HG1 VAL 70 -0.380 5.028 -3.759 539 2HG1 VAL 70 2HG1 VAL 70 0.298 4.503 -2.218 540 3HG1 VAL 70 3HG1 VAL 70 0.694 6.096 -2.858 541 1HG2 VAL 70 1HG2 VAL 70 2.766 2.651 -3.435 542 2HG2 VAL 70 2HG2 VAL 70 3.361 4.055 -2.552 543 3HG2 VAL 70 3HG2 VAL 70 1.853 3.283 -2.067 544 H LEU 71 H LEU 71 -1.167 3.774 -5.900 545 HA LEU 71 HA LEU 71 -0.690 6.068 -7.752 546 1HB LEU 71 1HB LEU 71 -2.110 3.536 -8.061 547 2HB LEU 71 2HB LEU 71 -3.164 4.907 -8.405 548 HG LEU 71 HG LEU 71 -1.336 5.807 -9.905 549 1HD1 LEU 71 1HD1 LEU 71 -0.222 3.026 -9.423 550 2HD1 LEU 71 2HD1 LEU 71 0.349 4.136 -10.668 551 3HD1 LEU 71 3HD1 LEU 71 0.541 4.548 -8.965 552 1HD2 LEU 71 1HD2 LEU 71 -2.915 3.316 -10.359 553 2HD2 LEU 71 2HD2 LEU 71 -3.008 4.870 -11.187 554 3HD2 LEU 71 3HD2 LEU 71 -1.711 3.740 -11.577 555 H VAL 72 H VAL 72 -2.583 7.574 -7.901 556 HA VAL 72 HA VAL 72 -4.164 7.633 -5.367 557 HB VAL 72 HB VAL 72 -3.947 10.161 -5.603 558 1HG1 VAL 72 1HG1 VAL 72 -2.534 8.299 -4.172 559 2HG1 VAL 72 2HG1 VAL 72 -1.245 9.197 -4.971 560 3HG1 VAL 72 3HG1 VAL 72 -2.405 10.042 -3.949 561 1HG2 VAL 72 1HG2 VAL 72 -2.879 9.809 -7.959 562 2HG2 VAL 72 2HG2 VAL 72 -2.230 11.074 -6.918 563 3HG2 VAL 72 3HG2 VAL 72 -1.398 9.525 -7.055 564 H GLY 73 H GLY 73 -6.174 8.902 -5.536 565 1HA GLY 73 1HA GLY 73 -7.205 9.924 -7.969 566 2HA GLY 73 2HA GLY 73 -7.726 8.248 -7.805 567 H SER 74 H SER 74 -9.696 9.969 -7.797 568 HA SER 74 HA SER 74 -10.412 10.459 -4.966 569 1HB SER 74 1HB SER 74 -10.500 12.520 -6.172 570 2HB SER 74 2HB SER 74 -11.332 11.768 -7.523 571 HG SER 74 HG SER 74 -12.343 12.855 -5.285 572 H SER 75 H SER 75 -12.641 10.079 -4.411 573 HA SER 75 HA SER 75 -13.686 7.623 -5.605 574 1HB SER 75 1HB SER 75 -15.333 7.749 -3.724 575 2HB SER 75 2HB SER 75 -13.662 7.772 -3.171 576 HG SER 75 HG SER 75 -14.089 9.633 -2.315 577 H ALA 76 H ALA 76 -13.895 10.726 -6.552 578 HA ALA 76 HA ALA 76 -16.638 11.358 -6.713 579 1HB ALA 76 1HB ALA 76 -14.304 12.016 -8.512 580 2HB ALA 76 2HB ALA 76 -15.923 12.651 -8.807 581 3HB ALA 76 3HB ALA 76 -15.078 13.050 -7.311 582 H GLY 77 H GLY 77 -18.184 10.031 -7.533 583 1HA GLY 77 1HA GLY 77 -19.326 8.648 -9.044 584 2HA GLY 77 2HA GLY 77 -18.236 9.264 -10.287 585 H GLY 78 H GLY 78 -16.589 7.953 -10.997 586 1HA GLY 78 1HA GLY 78 -15.637 5.689 -9.406 587 2HA GLY 78 2HA GLY 78 -16.587 5.217 -10.815 588 H ALA 79 H ALA 79 -13.483 5.852 -9.779 589 HA ALA 79 HA ALA 79 -12.326 7.199 -12.022 590 1HB ALA 79 1HB ALA 79 -11.380 5.708 -9.683 591 2HB ALA 79 2HB ALA 79 -10.343 5.487 -11.091 592 3HB ALA 79 3HB ALA 79 -10.668 7.109 -10.480 593 H GLY 80 H GLY 80 -12.351 3.698 -11.256 594 1HA GLY 80 1HA GLY 80 -13.104 2.142 -13.064 595 2HA GLY 80 2HA GLY 80 -12.250 3.182 -14.203 596 H GLU 81 H GLU 81 -10.832 2.456 -11.085 597 HA GLU 81 HA GLU 81 -8.981 1.165 -10.468 598 1HB GLU 81 1HB GLU 81 -10.297 -0.403 -12.503 599 2HB GLU 81 2HB GLU 81 -8.553 -0.549 -12.705 600 1HG GLU 81 1HG GLU 81 -8.440 -0.990 -10.188 601 2HG GLU 81 2HG GLU 81 -10.194 -1.170 -10.242 602 H GLN 82 H GLN 82 -8.757 1.484 -14.045 603 HA GLN 82 HA GLN 82 -5.957 2.390 -13.709 604 1HB GLN 82 1HB GLN 82 -6.858 0.671 -15.478 605 2HB GLN 82 2HB GLN 82 -7.332 2.121 -16.367 606 1HG GLN 82 1HG GLN 82 -5.192 1.949 -17.178 607 2HG GLN 82 2HG GLN 82 -4.817 2.827 -15.695 608 1HE2 GLN 82 2HE2 GLN 82 -3.894 0.133 -17.447 609 2HE2 GLN 82 1HE2 GLN 82 -3.234 -0.797 -16.189 610 H ASP 83 H ASP 83 -7.978 4.205 -12.795 611 HA ASP 83 HA ASP 83 -7.625 6.414 -14.775 612 1HB ASP 83 1HB ASP 83 -10.029 5.465 -14.394 613 2HB ASP 83 2HB ASP 83 -9.941 6.320 -12.853 614 H TYR 84 H TYR 84 -5.948 5.587 -12.495 615 HA TYR 84 HA TYR 84 -6.349 7.820 -10.572 616 1HB TYR 84 1HB TYR 84 -4.866 5.196 -10.511 617 2HB TYR 84 2HB TYR 84 -4.360 6.500 -9.445 618 HD1 TYR 84 HD1 TYR 84 -7.820 5.553 -10.560 619 HD2 TYR 84 HD2 TYR 84 -5.026 5.832 -7.307 620 HE1 TYR 84 HE1 TYR 84 -9.612 4.933 -8.964 621 HE2 TYR 84 HE2 TYR 84 -6.823 5.218 -5.714 622 HH TYR 84 HH TYR 84 -9.083 3.856 -5.943 623 H GLU 85 H GLU 85 -3.914 8.383 -9.777 624 HA GLU 85 HA GLU 85 -2.345 9.041 -12.229 625 1HB GLU 85 1HB GLU 85 -1.650 10.876 -10.131 626 2HB GLU 85 2HB GLU 85 -2.349 11.236 -11.701 627 1HG GLU 85 1HG GLU 85 -4.086 10.317 -9.407 628 2HG GLU 85 2HG GLU 85 -3.635 12.008 -9.595 629 H VAL 86 H VAL 86 -0.371 8.144 -12.214 630 HA VAL 86 HA VAL 86 0.512 6.440 -10.123 631 HB VAL 86 HB VAL 86 2.223 7.735 -12.262 632 1HG1 VAL 86 1HG1 VAL 86 2.550 5.455 -10.348 633 2HG1 VAL 86 2HG1 VAL 86 3.269 5.311 -11.952 634 3HG1 VAL 86 3HG1 VAL 86 3.740 6.639 -10.892 635 1HG2 VAL 86 1HG2 VAL 86 0.374 5.342 -12.292 636 2HG2 VAL 86 2HG2 VAL 86 0.405 6.707 -13.407 637 3HG2 VAL 86 3HG2 VAL 86 1.698 5.510 -13.444 638 H LEU 87 H LEU 87 0.398 7.737 -8.182 639 HA LEU 87 HA LEU 87 1.824 10.157 -7.746 640 1HB LEU 87 1HB LEU 87 0.156 8.636 -6.246 641 2HB LEU 87 2HB LEU 87 1.697 8.206 -5.508 642 HG LEU 87 HG LEU 87 2.159 10.745 -5.448 643 1HD1 LEU 87 1HD1 LEU 87 -0.052 10.979 -6.940 644 2HD1 LEU 87 2HD1 LEU 87 -0.792 11.105 -5.345 645 3HD1 LEU 87 3HD1 LEU 87 0.464 12.244 -5.825 646 1HD2 LEU 87 1HD2 LEU 87 0.322 9.143 -3.736 647 2HD2 LEU 87 2HD2 LEU 87 1.849 9.922 -3.320 648 3HD2 LEU 87 3HD2 LEU 87 0.373 10.880 -3.439 649 H LEU 88 H LEU 88 2.852 6.807 -6.918 650 HA LEU 88 HA LEU 88 5.616 7.642 -7.556 651 1HB LEU 88 1HB LEU 88 6.564 6.810 -5.520 652 2HB LEU 88 2HB LEU 88 5.292 7.956 -5.111 653 HG LEU 88 HG LEU 88 3.944 5.530 -5.251 654 1HD1 LEU 88 1HD1 LEU 88 6.774 5.166 -4.360 655 2HD1 LEU 88 2HD1 LEU 88 5.515 4.309 -3.470 656 3HD1 LEU 88 3HD1 LEU 88 5.711 4.038 -5.201 657 1HD2 LEU 88 1HD2 LEU 88 4.969 7.352 -3.121 658 2HD2 LEU 88 2HD2 LEU 88 3.309 6.895 -3.501 659 3HD2 LEU 88 3HD2 LEU 88 4.346 5.784 -2.606 660 H VAL 89 H VAL 89 6.523 6.201 -8.864 661 HA VAL 89 HA VAL 89 5.246 3.849 -9.789 662 HB VAL 89 HB VAL 89 8.258 4.115 -9.795 663 1HG1 VAL 89 1HG1 VAL 89 6.151 2.798 -11.459 664 2HG1 VAL 89 2HG1 VAL 89 7.631 3.336 -12.253 665 3HG1 VAL 89 3HG1 VAL 89 7.713 2.174 -10.929 666 1HG2 VAL 89 1HG2 VAL 89 6.220 5.815 -11.202 667 2HG2 VAL 89 2HG2 VAL 89 7.789 6.275 -10.541 668 3HG2 VAL 89 3HG2 VAL 89 7.700 5.382 -12.059 669 H THR 90 H THR 90 6.337 1.561 -9.577 670 HA THR 90 HA THR 90 6.084 0.727 -6.892 671 HB THR 90 HB THR 90 5.945 -0.621 -9.152 672 HG1 THR 90 HG1 THR 90 5.956 -2.414 -7.911 673 1HG2 THR 90 1HG2 THR 90 8.532 -0.248 -9.441 674 2HG2 THR 90 2HG2 THR 90 8.660 -1.582 -8.295 675 3HG2 THR 90 3HG2 THR 90 7.830 -1.818 -9.833 676 H SER 91 H SER 91 7.508 0.527 -5.249 677 HA SER 91 HA SER 91 10.286 1.471 -5.735 678 1HB SER 91 1HB SER 91 10.225 1.853 -3.205 679 2HB SER 91 2HB SER 91 9.183 2.896 -4.168 680 HG SER 91 HG SER 91 7.447 1.821 -3.480 681 H SER 92 H SER 92 11.853 0.004 -5.571 682 HA SER 92 HA SER 92 11.286 -2.707 -4.588 683 1HB SER 92 1HB SER 92 13.505 -3.249 -5.419 684 2HB SER 92 2HB SER 92 12.677 -2.275 -6.632 685 HG SER 92 HG SER 92 14.982 -1.785 -5.451 686 H PHE 93 H PHE 93 11.672 -3.316 -2.499 687 HA PHE 93 HA PHE 93 13.591 -1.669 -0.898 688 1HB PHE 93 1HB PHE 93 11.092 -3.069 0.051 689 2HB PHE 93 2HB PHE 93 12.209 -2.182 1.078 690 HD1 PHE 93 HD1 PHE 93 12.849 0.214 -0.392 691 HD2 PHE 93 HD2 PHE 93 9.097 -1.868 -0.125 692 HE1 PHE 93 HE1 PHE 93 11.647 2.319 -0.904 693 HE2 PHE 93 HE2 PHE 93 7.897 0.242 -0.639 694 HZ PHE 93 HZ PHE 93 9.173 2.334 -1.028 695 H MET 94 H MET 94 12.155 -4.892 -1.297 696 HA MET 94 HA MET 94 14.602 -6.033 -0.007 697 1HB MET 94 1HB MET 94 11.798 -6.417 0.563 698 2HB MET 94 2HB MET 94 12.497 -7.948 0.042 699 1HG MET 94 1HG MET 94 14.249 -7.769 1.731 700 2HG MET 94 2HG MET 94 13.671 -6.170 2.200 701 1HE MET 94 1HE MET 94 12.411 -9.537 1.229 702 2HE MET 94 2HE MET 94 13.130 -10.096 2.736 703 3HE MET 94 3HE MET 94 11.379 -10.112 2.545 704 H SER 95 H SER 95 14.202 -8.682 -0.689 705 HA SER 95 HA SER 95 14.153 -8.683 -3.676 706 1HB SER 95 1HB SER 95 16.152 -9.946 -3.773 707 2HB SER 95 2HB SER 95 16.489 -8.749 -2.531 708 HG SER 95 HG SER 95 16.576 -10.289 -1.101 709 HA PRO 96 HA PRO 96 11.741 -12.402 -3.145 710 1HB PRO 96 1HB PRO 96 12.522 -13.922 -5.275 711 2HB PRO 96 2HB PRO 96 11.559 -12.446 -5.433 712 1HG PRO 96 1HG PRO 96 14.356 -12.927 -6.169 713 2HG PRO 96 2HG PRO 96 13.257 -11.649 -6.702 714 1HD PRO 96 1HD PRO 96 15.344 -11.480 -4.719 715 2HD PRO 96 2HD PRO 96 14.253 -10.190 -5.271 716 H SER 97 H SER 97 14.808 -12.511 -2.138 717 HA SER 97 HA SER 97 14.798 -15.471 -1.722 718 1HB SER 97 1HB SER 97 17.060 -13.541 -2.196 719 2HB SER 97 2HB SER 97 17.340 -15.052 -1.337 720 HG SER 97 HG SER 97 17.588 -15.059 -3.713 721 H GLU 98 H GLU 98 15.763 -12.339 -0.303 722 HA GLU 98 HA GLU 98 16.401 -13.219 2.297 723 1HB GLU 98 1HB GLU 98 15.688 -10.693 0.990 724 2HB GLU 98 2HB GLU 98 15.193 -10.747 2.681 725 1HG GLU 98 1HG GLU 98 17.413 -9.904 2.700 726 2HG GLU 98 2HG GLU 98 17.542 -11.592 3.195 727 H SER 99 H SER 99 13.278 -12.955 0.768 728 HA SER 99 HA SER 99 11.524 -12.587 2.910 729 1HB SER 99 1HB SER 99 10.863 -14.750 0.969 730 2HB SER 99 2HB SER 99 9.877 -13.402 1.527 731 HG SER 99 HG SER 99 11.254 -12.031 0.282 732 H ARG 100 H ARG 100 13.275 -15.555 2.043 733 HA ARG 100 HA ARG 100 11.890 -17.189 3.997 734 1HB ARG 100 1HB ARG 100 14.497 -17.609 2.507 735 2HB ARG 100 2HB ARG 100 13.712 -18.832 3.509 736 1HG ARG 100 1HG ARG 100 11.777 -18.865 2.083 737 2HG ARG 100 2HG ARG 100 12.344 -17.454 1.186 738 1HD ARG 100 1HD ARG 100 14.436 -18.895 0.658 739 2HD ARG 100 2HD ARG 100 13.440 -20.257 1.159 740 HE ARG 100 HE ARG 100 13.195 -18.807 -1.332 741 1HH1 ARG 100 1HH1 ARG 100 11.384 -20.543 1.106 742 2HH1 ARG 100 2HH1 ARG 100 10.129 -20.984 0.002 743 1HH2 ARG 100 1HH2 ARG 100 11.557 -19.409 -2.726 744 2HH2 ARG 100 2HH2 ARG 100 10.226 -20.354 -2.148 745 H SER 101 H SER 101 15.437 -16.828 4.035 746 HA SER 101 HA SER 101 15.485 -15.437 6.572 747 1HB SER 101 1HB SER 101 14.873 -17.955 7.037 748 2HB SER 101 2HB SER 101 16.574 -18.243 6.680 749 HG SER 101 HG SER 101 15.468 -17.301 8.915 750 H GLY 102 H GLY 102 16.599 -15.128 3.954 751 1HA GLY 102 1HA GLY 102 19.403 -15.967 4.060 752 2HA GLY 102 2HA GLY 102 18.670 -14.946 2.820 753 H SER 103 H SER 103 17.491 -13.198 4.994 754 HA SER 103 HA SER 103 19.628 -12.061 6.516 755 1HB SER 103 1HB SER 103 19.435 -11.240 3.717 756 2HB SER 103 2HB SER 103 19.407 -9.890 4.847 757 HG SER 103 HG SER 103 21.349 -11.939 4.591 758 H ASN 104 H ASN 104 17.430 -10.081 4.687 759 HA ASN 104 HA ASN 104 15.872 -9.579 7.169 760 1HB ASN 104 1HB ASN 104 15.328 -7.347 5.887 761 2HB ASN 104 2HB ASN 104 16.864 -7.503 6.734 762 1HD2 ASN 104 2HD2 ASN 104 15.545 -8.287 3.448 763 2HD2 ASN 104 1HD2 ASN 104 16.926 -7.761 2.613 764 HA PRO 105 HA PRO 105 12.914 -11.451 4.179 765 1HB PRO 105 1HB PRO 105 11.362 -12.619 6.108 766 2HB PRO 105 2HB PRO 105 12.815 -13.366 5.438 767 1HG PRO 105 1HG PRO 105 12.436 -12.008 8.052 768 2HG PRO 105 2HG PRO 105 13.449 -13.400 7.640 769 1HD PRO 105 1HD PRO 105 14.404 -10.822 7.974 770 2HD PRO 105 2HD PRO 105 15.224 -12.081 7.021 771 H ASN 106 H ASN 106 12.575 -9.398 6.952 772 HA ASN 106 HA ASN 106 10.005 -8.334 5.845 773 1HB ASN 106 1HB ASN 106 10.574 -9.368 8.481 774 2HB ASN 106 2HB ASN 106 10.198 -7.651 8.607 775 1HD2 ASN 106 2HD2 ASN 106 8.891 -9.951 6.182 776 2HD2 ASN 106 1HD2 ASN 106 7.276 -9.794 6.677 777 H ARG 107 H ARG 107 9.746 -5.985 6.148 778 HA ARG 107 HA ARG 107 12.082 -4.459 7.060 779 1HB ARG 107 1HB ARG 107 11.628 -5.067 4.233 780 2HB ARG 107 2HB ARG 107 11.696 -3.332 4.534 781 1HG ARG 107 1HG ARG 107 13.791 -4.212 6.063 782 2HG ARG 107 2HG ARG 107 13.835 -5.364 4.729 783 1HD ARG 107 1HD ARG 107 13.627 -3.292 3.194 784 2HD ARG 107 2HD ARG 107 14.077 -2.359 4.621 785 HE ARG 107 HE ARG 107 15.894 -4.578 4.103 786 1HH1 ARG 107 1HH1 ARG 107 15.122 -1.257 3.319 787 2HH1 ARG 107 2HH1 ARG 107 16.742 -0.888 2.844 788 1HH2 ARG 107 1HH2 ARG 107 17.977 -4.056 3.477 789 2HH2 ARG 107 2HH2 ARG 107 18.343 -2.453 2.931 790 H VAL 108 H VAL 108 11.595 -2.018 6.207 791 HA VAL 108 HA VAL 108 8.738 -1.326 6.295 792 HB VAL 108 HB VAL 108 10.647 -0.753 8.559 793 1HG1 VAL 108 1HG1 VAL 108 8.291 0.796 7.630 794 2HG1 VAL 108 2HG1 VAL 108 8.392 0.489 9.363 795 3HG1 VAL 108 3HG1 VAL 108 9.701 1.336 8.540 796 1HG2 VAL 108 1HG2 VAL 108 8.022 -2.177 8.249 797 2HG2 VAL 108 2HG2 VAL 108 9.515 -2.763 8.982 798 3HG2 VAL 108 3HG2 VAL 108 8.530 -1.564 9.822 799 H ARG 109 H ARG 109 8.707 0.210 4.656 800 HA ARG 109 HA ARG 109 10.918 2.193 4.617 801 1HB ARG 109 1HB ARG 109 9.563 0.830 2.278 802 2HB ARG 109 2HB ARG 109 10.650 2.209 2.117 803 1HG ARG 109 1HG ARG 109 11.800 0.107 3.794 804 2HG ARG 109 2HG ARG 109 11.402 -0.481 2.185 805 1HD ARG 109 1HD ARG 109 13.347 0.423 1.523 806 2HD ARG 109 2HD ARG 109 12.575 1.993 1.689 807 HE ARG 109 HE ARG 109 14.523 0.805 3.542 808 1HH1 ARG 109 1HH1 ARG 109 12.057 3.245 3.067 809 2HH1 ARG 109 2HH1 ARG 109 12.651 4.232 4.353 810 1HH2 ARG 109 1HH2 ARG 109 15.248 2.118 5.196 811 2HH2 ARG 109 2HH2 ARG 109 14.432 3.605 5.546 812 H MET 110 H MET 110 10.260 4.199 3.463 813 HA MET 110 HA MET 110 7.342 4.753 3.582 814 1HB MET 110 1HB MET 110 9.426 6.545 4.858 815 2HB MET 110 2HB MET 110 7.676 6.764 4.889 816 1HG MET 110 1HG MET 110 7.391 4.744 6.201 817 2HG MET 110 2HG MET 110 9.101 4.361 6.048 818 1HE MET 110 1HE MET 110 8.191 3.975 8.410 819 2HE MET 110 2HE MET 110 9.801 4.472 8.925 820 3HE MET 110 3HE MET 110 8.382 5.138 9.729 821 H PHE 111 H PHE 111 6.995 7.113 2.765 822 HA PHE 111 HA PHE 111 8.909 7.777 0.577 823 1HB PHE 111 1HB PHE 111 5.902 7.797 0.202 824 2HB PHE 111 2HB PHE 111 7.140 8.001 -1.031 825 HD1 PHE 111 HD1 PHE 111 5.999 5.508 1.543 826 HD2 PHE 111 HD2 PHE 111 7.776 6.156 -2.317 827 HE1 PHE 111 HE1 PHE 111 5.974 3.077 1.118 828 HE2 PHE 111 HE2 PHE 111 7.759 3.709 -2.731 829 HZ PHE 111 HZ PHE 111 6.852 2.166 -1.010 830 H GLY 112 H GLY 112 8.631 10.058 -0.128 831 1HA GLY 112 1HA GLY 112 7.227 11.745 1.883 832 2HA GLY 112 2HA GLY 112 8.825 12.151 1.285 833 HA PRO 113 HA PRO 113 5.870 14.293 -1.533 834 1HB PRO 113 1HB PRO 113 7.304 16.619 -1.634 835 2HB PRO 113 2HB PRO 113 6.104 16.264 -0.381 836 1HG PRO 113 1HG PRO 113 9.067 16.234 -0.219 837 2HG PRO 113 2HG PRO 113 7.870 16.601 1.033 838 1HD PRO 113 1HD PRO 113 9.255 14.176 0.784 839 2HD PRO 113 2HD PRO 113 7.775 14.414 1.722 840 H ASP 114 H ASP 114 9.402 14.173 -1.594 841 HA ASP 114 HA ASP 114 9.710 14.746 -4.398 842 1HB ASP 114 1HB ASP 114 11.513 13.267 -2.454 843 2HB ASP 114 2HB ASP 114 11.985 13.749 -4.083 844 H LYS 115 H LYS 115 9.013 11.857 -2.544 845 HA LYS 115 HA LYS 115 9.526 10.055 -4.771 846 1HB LYS 115 1HB LYS 115 9.218 9.769 -2.006 847 2HB LYS 115 2HB LYS 115 7.797 8.977 -2.684 848 1HG LYS 115 1HG LYS 115 9.395 7.256 -2.672 849 2HG LYS 115 2HG LYS 115 9.498 7.865 -4.323 850 1HD LYS 115 1HD LYS 115 11.753 7.728 -3.607 851 2HD LYS 115 2HD LYS 115 11.342 9.434 -3.435 852 1HE LYS 115 1HE LYS 115 11.180 9.294 -1.101 853 2HE LYS 115 2HE LYS 115 10.932 7.548 -1.128 854 1HZ LYS 115 1HZ LYS 115 13.453 8.707 -2.115 855 2HZ LYS 115 2HZ LYS 115 13.218 8.473 -0.450 856 3HZ LYS 115 3HZ LYS 115 13.155 7.147 -1.511 857 H LEU 116 H LEU 116 7.060 12.268 -4.235 858 HA LEU 116 HA LEU 116 5.233 10.589 -5.893 859 1HB LEU 116 1HB LEU 116 3.440 12.287 -4.744 860 2HB LEU 116 2HB LEU 116 3.723 10.635 -4.244 861 HG LEU 116 HG LEU 116 5.647 12.294 -2.895 862 1HD1 LEU 116 1HD1 LEU 116 2.797 13.287 -2.845 863 2HD1 LEU 116 2HD1 LEU 116 3.946 13.618 -1.549 864 3HD1 LEU 116 3HD1 LEU 116 4.259 14.215 -3.179 865 1HD2 LEU 116 1HD2 LEU 116 3.195 10.730 -2.049 866 2HD2 LEU 116 2HD2 LEU 116 4.875 10.197 -1.990 867 3HD2 LEU 116 3HD2 LEU 116 4.312 11.463 -0.900 868 H VAL 117 H VAL 117 4.269 11.513 -7.586 869 HA VAL 117 HA VAL 117 5.525 13.586 -8.992 870 HB VAL 117 HB VAL 117 3.960 11.973 -10.008 871 1HG1 VAL 117 1HG1 VAL 117 2.394 11.935 -8.106 872 2HG1 VAL 117 2HG1 VAL 117 1.830 13.532 -8.565 873 3HG1 VAL 117 3HG1 VAL 117 1.568 12.164 -9.647 874 1HG2 VAL 117 1HG2 VAL 117 4.326 14.433 -10.900 875 2HG2 VAL 117 2HG2 VAL 117 3.074 13.419 -11.621 876 3HG2 VAL 117 3HG2 VAL 117 2.641 14.640 -10.424 877 H ARG 118 H ARG 118 5.270 15.824 -9.092 878 HA ARG 118 HA ARG 118 3.978 17.141 -6.841 879 1HB ARG 118 1HB ARG 118 5.922 17.821 -8.812 880 2HB ARG 118 2HB ARG 118 4.607 18.985 -8.970 881 1HG ARG 118 1HG ARG 118 4.742 19.160 -6.380 882 2HG ARG 118 2HG ARG 118 6.325 18.406 -6.561 883 1HD ARG 118 1HD ARG 118 6.347 20.388 -8.508 884 2HD ARG 118 2HD ARG 118 5.492 21.148 -7.166 885 HE ARG 118 HE ARG 118 7.921 19.775 -6.326 886 1HH1 ARG 118 1HH1 ARG 118 6.602 22.744 -7.623 887 2HH1 ARG 118 2HH1 ARG 118 7.913 23.702 -7.029 888 1HH2 ARG 118 1HH2 ARG 118 9.597 21.053 -5.578 889 2HH2 ARG 118 2HH2 ARG 118 9.591 22.758 -5.883 890 H ALA 119 H ALA 119 3.272 16.740 -10.293 891 HA ALA 119 HA ALA 119 1.047 18.496 -10.445 892 1HB ALA 119 1HB ALA 119 1.887 16.067 -12.008 893 2HB ALA 119 2HB ALA 119 0.355 16.868 -12.353 894 3HB ALA 119 3HB ALA 119 1.868 17.757 -12.515 895 H ALA 120 H ALA 120 1.324 15.362 -8.970 896 HA ALA 120 HA ALA 120 -1.649 15.251 -8.686 897 1HB ALA 120 1HB ALA 120 -0.061 13.311 -9.754 898 2HB ALA 120 2HB ALA 120 -0.086 12.818 -8.062 899 3HB ALA 120 3HB ALA 120 -1.597 12.987 -8.954 900 H ALA 121 H ALA 121 1.444 14.685 -6.951 901 HA ALA 121 HA ALA 121 0.514 14.050 -4.400 902 1HB ALA 121 1HB ALA 121 2.788 15.891 -5.173 903 2HB ALA 121 2HB ALA 121 2.523 15.298 -3.534 904 3HB ALA 121 3HB ALA 121 2.884 14.165 -4.835 905 H GLU 122 H GLU 122 0.449 17.234 -5.953 906 HA GLU 122 HA GLU 122 -0.584 18.415 -3.436 907 1HB GLU 122 1HB GLU 122 -0.323 20.583 -4.526 908 2HB GLU 122 2HB GLU 122 1.161 19.654 -4.720 909 1HG GLU 122 1HG GLU 122 -0.002 18.878 -6.973 910 2HG GLU 122 2HG GLU 122 -0.907 20.374 -6.768 911 H LYS 123 H LYS 123 -2.122 16.508 -5.202 912 HA LYS 123 HA LYS 123 -4.442 18.284 -5.771 913 1HB LYS 123 1HB LYS 123 -3.712 15.609 -6.980 914 2HB LYS 123 2HB LYS 123 -5.201 16.484 -7.325 915 1HG LYS 123 1HG LYS 123 -3.414 18.439 -7.803 916 2HG LYS 123 2HG LYS 123 -2.418 17.038 -8.190 917 1HD LYS 123 1HD LYS 123 -3.854 16.330 -9.913 918 2HD LYS 123 2HD LYS 123 -5.210 17.272 -9.294 919 1HE LYS 123 1HE LYS 123 -2.801 18.833 -10.044 920 2HE LYS 123 2HE LYS 123 -3.670 18.077 -11.379 921 1HZ LYS 123 1HZ LYS 123 -5.737 19.051 -10.308 922 2HZ LYS 123 2HZ LYS 123 -4.685 20.019 -9.396 923 3HZ LYS 123 3HZ LYS 123 -4.691 20.135 -11.092 924 H ARG 124 H ARG 124 -6.338 17.810 -4.692 925 HA ARG 124 HA ARG 124 -6.221 16.178 -2.351 926 1HB ARG 124 1HB ARG 124 -8.418 17.601 -3.816 927 2HB ARG 124 2HB ARG 124 -8.811 16.523 -2.476 928 1HG ARG 124 1HG ARG 124 -7.586 17.804 -0.924 929 2HG ARG 124 2HG ARG 124 -6.672 18.625 -2.188 930 1HD ARG 124 1HD ARG 124 -9.649 18.969 -2.130 931 2HD ARG 124 2HD ARG 124 -8.679 19.845 -0.958 932 HE ARG 124 HE ARG 124 -7.636 21.066 -2.742 933 1HH1 ARG 124 1HH1 ARG 124 -10.001 18.757 -3.924 934 2HH1 ARG 124 2HH1 ARG 124 -10.059 19.484 -5.485 935 1HH2 ARG 124 1HH2 ARG 124 -7.758 21.956 -4.776 936 2HH2 ARG 124 2HH2 ARG 124 -8.812 21.268 -5.967 937 H TRP 125 H TRP 125 -6.207 14.041 -2.308 938 HA TRP 125 HA TRP 125 -7.864 12.502 -4.284 939 1HB TRP 125 1HB TRP 125 -5.237 11.685 -2.985 940 2HB TRP 125 2HB TRP 125 -6.165 10.721 -4.127 941 HD1 TRP 125 HD1 TRP 125 -3.304 12.892 -4.065 942 HE1 TRP 125 HE1 TRP 125 -2.818 13.925 -6.380 943 HE3 TRP 125 HE3 TRP 125 -7.712 11.885 -6.427 944 HZ2 TRP 125 HZ2 TRP 125 -4.116 14.258 -8.898 945 HZ3 TRP 125 HZ3 TRP 125 -8.062 12.555 -8.783 946 HH2 TRP 125 HH2 TRP 125 -6.272 13.747 -10.024 947 H ASP 126 H ASP 126 -8.931 10.621 -3.378 948 HA ASP 126 HA ASP 126 -8.755 10.391 -0.413 949 1HB ASP 126 1HB ASP 126 -11.180 10.209 -0.202 950 2HB ASP 126 2HB ASP 126 -10.746 11.747 -0.939 951 H ARG 127 H ARG 127 -8.263 8.800 -3.199 952 HA ARG 127 HA ARG 127 -8.909 6.163 -1.982 953 1HB ARG 127 1HB ARG 127 -9.146 6.837 -4.938 954 2HB ARG 127 2HB ARG 127 -9.456 5.271 -4.202 955 1HG ARG 127 1HG ARG 127 -11.047 7.285 -2.872 956 2HG ARG 127 2HG ARG 127 -11.313 7.383 -4.611 957 1HD ARG 127 1HD ARG 127 -11.308 4.635 -4.038 958 2HD ARG 127 2HD ARG 127 -12.227 5.358 -2.733 959 HE ARG 127 HE ARG 127 -13.898 5.967 -4.289 960 1HH1 ARG 127 1HH1 ARG 127 -11.042 4.808 -5.946 961 2HH1 ARG 127 2HH1 ARG 127 -11.876 4.613 -7.446 962 1HH2 ARG 127 1HH2 ARG 127 -14.922 5.720 -6.254 963 2HH2 ARG 127 2HH2 ARG 127 -14.044 5.123 -7.622 964 H VAL 128 H VAL 128 -7.143 4.698 -2.237 965 HA VAL 128 HA VAL 128 -4.885 5.700 -3.900 966 HB VAL 128 HB VAL 128 -4.693 6.289 -1.423 967 1HG1 VAL 128 1HG1 VAL 128 -5.332 3.649 -1.004 968 2HG1 VAL 128 2HG1 VAL 128 -3.578 3.633 -0.821 969 3HG1 VAL 128 3HG1 VAL 128 -4.559 4.699 0.184 970 1HG2 VAL 128 1HG2 VAL 128 -2.574 4.681 -2.853 971 2HG2 VAL 128 2HG2 VAL 128 -2.785 6.432 -2.863 972 3HG2 VAL 128 3HG2 VAL 128 -2.265 5.616 -1.389 973 H LYS 129 H LYS 129 -3.688 4.139 -4.922 974 HA LYS 129 HA LYS 129 -4.679 1.334 -4.640 975 1HB LYS 129 1HB LYS 129 -4.703 2.808 -6.882 976 2HB LYS 129 2HB LYS 129 -3.063 2.174 -6.997 977 1HG LYS 129 1HG LYS 129 -3.769 0.040 -7.375 978 2HG LYS 129 2HG LYS 129 -5.125 0.186 -6.258 979 1HD LYS 129 1HD LYS 129 -6.517 1.157 -7.863 980 2HD LYS 129 2HD LYS 129 -5.162 1.706 -8.849 981 1HE LYS 129 1HE LYS 129 -4.642 -0.801 -9.194 982 2HE LYS 129 2HE LYS 129 -6.271 -1.088 -8.583 983 1HZ LYS 129 1HZ LYS 129 -7.073 0.488 -10.302 984 2HZ LYS 129 2HZ LYS 129 -5.504 0.529 -10.949 985 3HZ LYS 129 3HZ LYS 129 -6.379 -0.924 -10.941 986 H ILE 130 H ILE 130 -3.284 -0.031 -3.662 987 HA ILE 130 HA ILE 130 -0.356 0.593 -3.795 988 HB ILE 130 HB ILE 130 -1.882 -0.944 -1.663 989 1HG1 ILE 130 1HG1 ILE 130 -2.381 1.474 -1.629 990 2HG1 ILE 130 2HG1 ILE 130 -1.408 1.014 -0.233 991 1HG2 ILE 130 1HG2 ILE 130 1.029 -0.258 -2.059 992 2HG2 ILE 130 2HG2 ILE 130 0.377 -0.533 -0.444 993 3HG2 ILE 130 3HG2 ILE 130 0.309 -1.815 -1.652 994 1HD1 ILE 130 1HD1 ILE 130 0.639 1.717 -1.586 995 2HD1 ILE 130 2HD1 ILE 130 -0.484 2.427 -2.746 996 3HD1 ILE 130 3HD1 ILE 130 -0.431 3.026 -1.089 997 H VAL 131 H VAL 131 0.613 -0.790 -5.244 998 HA VAL 131 HA VAL 131 -0.431 -3.572 -5.386 999 HB VAL 131 HB VAL 131 1.034 -1.966 -7.495 1000 1HG1 VAL 131 1HG1 VAL 131 -0.063 -4.770 -7.374 1001 2HG1 VAL 131 2HG1 VAL 131 0.173 -3.936 -8.910 1002 3HG1 VAL 131 3HG1 VAL 131 1.551 -4.245 -7.854 1003 1HG2 VAL 131 1HG2 VAL 131 -1.872 -2.776 -7.177 1004 2HG2 VAL 131 2HG2 VAL 131 -1.230 -1.134 -7.176 1005 3HG2 VAL 131 3HG2 VAL 131 -1.193 -2.095 -8.654 1006 H CYS 132 H CYS 132 0.885 -4.976 -4.398 1007 HA CYS 132 HA CYS 132 3.762 -4.338 -4.091 1008 1HB CYS 132 1HB CYS 132 3.159 -5.120 -2.025 1009 2HB CYS 132 2HB CYS 132 1.764 -5.978 -2.642 1010 HG CYS 132 HG CYS 132 3.083 -8.075 -2.501 1011 H SER 133 H SER 133 5.346 -5.487 -5.196 1012 HA SER 133 HA SER 133 4.482 -7.780 -6.891 1013 1HB SER 133 1HB SER 133 5.072 -5.155 -7.822 1014 2HB SER 133 2HB SER 133 6.415 -6.179 -8.312 1015 HG SER 133 HG SER 133 4.739 -6.244 -9.843 1016 H GLN 134 H GLN 134 5.812 -9.448 -6.583 1017 HA GLN 134 HA GLN 134 8.557 -9.593 -6.840 1018 1HB GLN 134 1HB GLN 134 8.742 -8.076 -4.843 1019 2HB GLN 134 2HB GLN 134 7.885 -9.279 -3.888 1020 1HG GLN 134 1HG GLN 134 10.172 -9.704 -3.457 1021 2HG GLN 134 2HG GLN 134 9.728 -10.917 -4.658 1022 1HE2 GLN 134 2HE2 GLN 134 12.180 -8.823 -3.962 1023 2HE2 GLN 134 1HE2 GLN 134 12.737 -8.490 -5.530 1024 HA PRO 135 HA PRO 135 6.979 -13.769 -6.110 1025 1HB PRO 135 1HB PRO 135 9.096 -15.096 -7.204 1026 2HB PRO 135 2HB PRO 135 7.860 -14.288 -8.181 1027 1HG PRO 135 1HG PRO 135 10.662 -13.534 -7.723 1028 2HG PRO 135 2HG PRO 135 9.564 -13.051 -9.023 1029 1HD PRO 135 1HD PRO 135 10.306 -11.532 -6.695 1030 2HD PRO 135 2HD PRO 135 9.183 -11.066 -7.990 1031 H TYR 136 H TYR 136 7.170 -13.828 -3.769 1032 HA TYR 136 HA TYR 136 9.807 -14.845 -2.818 1033 1HB TYR 136 1HB TYR 136 9.184 -13.671 -0.604 1034 2HB TYR 136 2HB TYR 136 9.780 -12.678 -1.929 1035 HD1 TYR 136 HD1 TYR 136 8.230 -11.260 -3.234 1036 HD2 TYR 136 HD2 TYR 136 6.877 -13.540 0.144 1037 HE1 TYR 136 HE1 TYR 136 6.152 -9.906 -3.150 1038 HE2 TYR 136 HE2 TYR 136 4.801 -12.187 0.225 1039 HH TYR 136 HH TYR 136 3.603 -10.518 -2.100 1040 H SER 137 H SER 137 6.508 -15.579 -3.029 1041 HA SER 137 HA SER 137 6.884 -17.579 -0.834 1042 1HB SER 137 1HB SER 137 4.931 -15.517 -0.977 1043 2HB SER 137 2HB SER 137 4.093 -17.050 -1.177 1044 HG SER 137 HG SER 137 5.744 -16.162 0.935 1045 H LYS 138 H LYS 138 5.012 -19.300 -1.084 1046 HA LYS 138 HA LYS 138 4.330 -19.953 -3.862 1047 1HB LYS 138 1HB LYS 138 6.587 -21.233 -2.415 1048 2HB LYS 138 2HB LYS 138 5.486 -22.330 -3.251 1049 1HG LYS 138 1HG LYS 138 5.794 -20.438 -5.167 1050 2HG LYS 138 2HG LYS 138 7.362 -20.318 -4.369 1051 1HD LYS 138 1HD LYS 138 7.935 -22.529 -4.867 1052 2HD LYS 138 2HD LYS 138 6.253 -23.022 -5.073 1053 1HE LYS 138 1HE LYS 138 7.552 -21.022 -6.925 1054 2HE LYS 138 2HE LYS 138 7.660 -22.758 -7.215 1055 1HZ LYS 138 1HZ LYS 138 5.165 -22.772 -7.000 1056 2HZ LYS 138 2HZ LYS 138 5.224 -21.079 -7.091 1057 3HZ LYS 138 3HZ LYS 138 5.785 -22.019 -8.391 1058 H ASP 139 H ASP 139 4.508 -21.072 -0.482 1059 HA ASP 139 HA ASP 139 1.909 -22.457 -0.890 1060 1HB ASP 139 1HB ASP 139 2.556 -23.720 1.192 1061 2HB ASP 139 2HB ASP 139 3.599 -24.029 -0.190 1062 H SER 140 H SER 140 3.715 -20.295 1.172 1063 HA SER 140 HA SER 140 1.279 -19.709 2.757 1064 1HB SER 140 1HB SER 140 3.171 -18.275 3.980 1065 2HB SER 140 2HB SER 140 2.943 -19.984 4.317 1066 HG SER 140 HG SER 140 5.148 -19.200 3.760 1067 HA PRO 141 HA PRO 141 1.014 -15.788 0.594 1068 1HB PRO 141 1HB PRO 141 -0.891 -14.639 2.163 1069 2HB PRO 141 2HB PRO 141 -1.234 -15.934 1.011 1070 1HG PRO 141 1HG PRO 141 -1.217 -16.017 3.937 1071 2HG PRO 141 2HG PRO 141 -1.970 -17.123 2.782 1072 1HD PRO 141 1HD PRO 141 0.502 -17.488 4.225 1073 2HD PRO 141 2HD PRO 141 -0.275 -18.596 3.075 1074 H PHE 142 H PHE 142 0.900 -13.326 1.289 1075 HA PHE 142 HA PHE 142 1.945 -12.394 3.755 1076 1HB PHE 142 1HB PHE 142 3.926 -13.565 1.981 1077 2HB PHE 142 2HB PHE 142 4.246 -11.845 2.191 1078 HD1 PHE 142 HD1 PHE 142 4.119 -10.949 4.666 1079 HD2 PHE 142 HD2 PHE 142 4.660 -15.073 3.603 1080 HE1 PHE 142 HE1 PHE 142 5.071 -11.404 6.911 1081 HE2 PHE 142 HE2 PHE 142 5.611 -15.529 5.847 1082 HZ PHE 142 HZ PHE 142 5.816 -13.693 7.502 1083 H GLY 143 H GLY 143 3.268 -10.095 3.025 1084 1HA GLY 143 1HA GLY 143 2.657 -8.783 0.659 1085 2HA GLY 143 2HA GLY 143 1.189 -8.629 1.619 1086 H LEU 144 H LEU 144 1.078 -6.913 2.941 1087 HA LEU 144 HA LEU 144 3.624 -5.477 3.562 1088 1HB LEU 144 1HB LEU 144 0.929 -4.584 2.748 1089 2HB LEU 144 2HB LEU 144 1.636 -3.650 4.063 1090 HG LEU 144 HG LEU 144 3.702 -3.365 2.696 1091 1HD1 LEU 144 1HD1 LEU 144 2.004 -4.655 0.539 1092 2HD1 LEU 144 2HD1 LEU 144 3.584 -3.916 0.287 1093 3HD1 LEU 144 3HD1 LEU 144 3.438 -5.366 1.279 1094 1HD2 LEU 144 1HD2 LEU 144 1.038 -2.429 1.618 1095 2HD2 LEU 144 2HD2 LEU 144 2.178 -1.539 2.629 1096 3HD2 LEU 144 3HD2 LEU 144 2.567 -1.867 0.940 1097 H SER 145 H SER 145 3.953 -4.675 5.656 1098 HA SER 145 HA SER 145 2.605 -6.196 7.777 1099 1HB SER 145 1HB SER 145 4.877 -4.194 7.823 1100 2HB SER 145 2HB SER 145 4.267 -5.018 9.255 1101 HG SER 145 HG SER 145 5.557 -6.567 8.682 1102 H PHE 146 H PHE 146 2.609 -2.947 6.458 1103 HA PHE 146 HA PHE 146 0.155 -2.248 7.749 1104 1HB PHE 146 1HB PHE 146 0.926 -0.592 9.371 1105 2HB PHE 146 2HB PHE 146 1.655 -2.150 9.754 1106 HD1 PHE 146 HD1 PHE 146 4.045 -2.558 9.370 1107 HD2 PHE 146 HD2 PHE 146 2.249 1.231 8.441 1108 HE1 PHE 146 HE1 PHE 146 6.298 -1.545 9.145 1109 HE2 PHE 146 HE2 PHE 146 4.494 2.251 8.221 1110 HZ PHE 146 HZ PHE 146 6.528 0.851 8.564 1111 H VAL 147 H VAL 147 -0.293 0.187 7.435 1112 HA VAL 147 HA VAL 147 1.387 1.478 5.379 1113 HB VAL 147 HB VAL 147 -0.505 1.775 3.815 1114 1HG1 VAL 147 1HG1 VAL 147 1.110 -0.238 3.781 1115 2HG1 VAL 147 2HG1 VAL 147 -0.242 -1.170 4.421 1116 3HG1 VAL 147 3HG1 VAL 147 -0.381 -0.384 2.850 1117 1HG2 VAL 147 1HG2 VAL 147 -1.931 0.343 6.013 1118 2HG2 VAL 147 2HG2 VAL 147 -2.518 1.609 4.935 1119 3HG2 VAL 147 3HG2 VAL 147 -2.401 -0.055 4.360 1120 H ARG 148 H ARG 148 1.322 3.685 5.632 1121 HA ARG 148 HA ARG 148 -0.959 4.923 7.068 1122 1HB ARG 148 1HB ARG 148 1.907 5.399 7.925 1123 2HB ARG 148 2HB ARG 148 0.448 5.962 8.723 1124 1HG ARG 148 1HG ARG 148 -0.141 3.430 8.913 1125 2HG ARG 148 2HG ARG 148 1.578 3.180 8.613 1126 1HD ARG 148 1HD ARG 148 1.701 5.124 10.507 1127 2HD ARG 148 2HD ARG 148 0.218 4.304 10.996 1128 HE ARG 148 HE ARG 148 2.396 2.449 10.462 1129 1HH1 ARG 148 1HH1 ARG 148 0.958 4.566 12.845 1130 2HH1 ARG 148 2HH1 ARG 148 1.633 3.693 14.176 1131 1HH2 ARG 148 1HH2 ARG 148 3.249 1.348 12.213 1132 2HH2 ARG 148 2HH2 ARG 148 2.916 1.889 13.824 1133 H PHE 149 H PHE 149 -1.557 6.538 5.684 1134 HA PHE 149 HA PHE 149 0.490 7.883 4.008 1135 1HB PHE 149 1HB PHE 149 -2.534 8.136 4.069 1136 2HB PHE 149 2HB PHE 149 -1.478 8.965 2.930 1137 HD1 PHE 149 HD1 PHE 149 0.290 7.324 1.729 1138 HD2 PHE 149 HD2 PHE 149 -3.508 6.147 3.351 1139 HE1 PHE 149 HE1 PHE 149 0.277 5.329 0.254 1140 HE2 PHE 149 HE2 PHE 149 -3.525 4.159 1.867 1141 HZ PHE 149 HZ PHE 149 -1.633 3.749 0.323 1142 H HIS 150 H HIS 150 0.723 10.214 4.054 1143 HA HIS 150 HA HIS 150 -0.639 11.659 6.240 1144 1HB HIS 150 1HB HIS 150 2.089 12.521 6.402 1145 2HB HIS 150 2HB HIS 150 1.099 11.804 7.661 1146 HD1 HIS 150 HD1 HIS 150 4.198 11.300 6.073 1147 HD2 HIS 150 HD2 HIS 150 1.143 8.711 7.215 1148 HE1 HIS 150 HE1 HIS 150 5.227 8.991 6.192 1149 H SER 151 H SER 151 -1.077 13.722 5.654 1150 HA SER 151 HA SER 151 -0.264 14.590 2.958 1151 1HB SER 151 1HB SER 151 -2.557 14.908 4.532 1152 2HB SER 151 2HB SER 151 -1.827 16.510 4.515 1153 HG SER 151 HG SER 151 -3.043 16.400 2.695 Start of MODEL 16 1 H MET 1 H MET 1 -6.149 16.834 14.253 2 HA MET 1 HA MET 1 -4.610 14.861 13.679 3 1HB MET 1 1HB MET 1 -7.172 15.428 13.121 4 2HB MET 1 2HB MET 1 -6.537 15.458 11.476 5 1HG MET 1 1HG MET 1 -5.822 13.211 11.583 6 2HG MET 1 2HG MET 1 -5.894 13.181 13.345 7 1HE MET 1 1HE MET 1 -7.625 14.021 10.276 8 2HE MET 1 2HE MET 1 -8.283 12.394 10.047 9 3HE MET 1 3HE MET 1 -9.348 13.724 10.497 10 HA PRO 2 HA PRO 2 -2.026 16.775 10.355 11 1HB PRO 2 1HB PRO 2 0.384 16.271 11.533 12 2HB PRO 2 2HB PRO 2 -0.582 17.713 11.878 13 1HG PRO 2 1HG PRO 2 -0.045 15.384 13.579 14 2HG PRO 2 2HG PRO 2 -0.604 17.000 14.028 15 1HD PRO 2 1HD PRO 2 -2.176 14.597 13.756 16 2HD PRO 2 2HD PRO 2 -2.731 16.221 14.218 17 H GLU 3 H GLU 3 -3.193 14.270 10.052 18 HA GLU 3 HA GLU 3 -1.068 12.788 8.694 19 1HB GLU 3 1HB GLU 3 -2.231 11.854 11.288 20 2HB GLU 3 2HB GLU 3 -1.951 10.648 10.032 21 1HG GLU 3 1HG GLU 3 0.403 11.761 9.828 22 2HG GLU 3 2HG GLU 3 0.048 12.413 11.428 23 H ILE 4 H ILE 4 -1.959 11.054 7.382 24 HA ILE 4 HA ILE 4 -4.635 11.688 6.384 25 HB ILE 4 HB ILE 4 -2.656 9.521 5.637 26 1HG1 ILE 4 1HG1 ILE 4 -1.804 11.805 5.277 27 2HG1 ILE 4 2HG1 ILE 4 -2.097 10.996 3.744 28 1HG2 ILE 4 1HG2 ILE 4 -5.317 10.328 4.522 29 2HG2 ILE 4 2HG2 ILE 4 -4.066 9.769 3.411 30 3HG2 ILE 4 3HG2 ILE 4 -4.627 8.715 4.710 31 1HD1 ILE 4 1HD1 ILE 4 -4.395 12.131 3.766 32 2HD1 ILE 4 2HD1 ILE 4 -3.770 13.127 5.080 33 3HD1 ILE 4 3HD1 ILE 4 -3.005 13.180 3.493 34 H ARG 5 H ARG 5 -6.496 10.540 6.850 35 HA ARG 5 HA ARG 5 -6.205 8.219 8.707 36 1HB ARG 5 1HB ARG 5 -7.611 10.468 9.152 37 2HB ARG 5 2HB ARG 5 -8.848 9.532 8.311 38 1HG ARG 5 1HG ARG 5 -9.036 8.004 10.003 39 2HG ARG 5 2HG ARG 5 -7.318 8.073 10.395 40 1HD ARG 5 1HD ARG 5 -7.965 10.540 11.170 41 2HD ARG 5 2HD ARG 5 -9.554 9.801 11.364 42 HE ARG 5 HE ARG 5 -7.417 8.231 12.575 43 1HH1 ARG 5 1HH1 ARG 5 -9.650 10.884 13.037 44 2HH1 ARG 5 2HH1 ARG 5 -9.619 10.740 14.759 45 1HH2 ARG 5 1HH2 ARG 5 -7.410 8.080 14.806 46 2HH2 ARG 5 2HH2 ARG 5 -8.366 9.170 15.753 47 H LEU 6 H LEU 6 -6.410 6.310 7.667 48 HA LEU 6 HA LEU 6 -7.819 6.077 5.121 49 1HB LEU 6 1HB LEU 6 -5.771 4.699 6.392 50 2HB LEU 6 2HB LEU 6 -7.128 3.585 6.510 51 HG LEU 6 HG LEU 6 -7.492 3.783 4.068 52 1HD1 LEU 6 1HD1 LEU 6 -5.999 6.116 4.307 53 2HD1 LEU 6 2HD1 LEU 6 -4.878 5.007 3.519 54 3HD1 LEU 6 3HD1 LEU 6 -6.449 5.340 2.790 55 1HD2 LEU 6 1HD2 LEU 6 -4.813 2.949 5.159 56 2HD2 LEU 6 2HD2 LEU 6 -6.163 1.934 4.651 57 3HD2 LEU 6 3HD2 LEU 6 -5.178 2.762 3.444 58 H ARG 7 H ARG 7 -9.843 5.138 4.802 59 HA ARG 7 HA ARG 7 -11.524 4.816 7.216 60 1HB ARG 7 1HB ARG 7 -12.291 6.172 5.235 61 2HB ARG 7 2HB ARG 7 -12.342 4.675 4.304 62 1HG ARG 7 1HG ARG 7 -14.205 3.901 5.390 63 2HG ARG 7 2HG ARG 7 -13.739 4.630 6.926 64 1HD ARG 7 1HD ARG 7 -14.541 6.764 6.289 65 2HD ARG 7 2HD ARG 7 -14.598 6.325 4.582 66 HE ARG 7 HE ARG 7 -16.359 4.586 5.959 67 1HH1 ARG 7 1HH1 ARG 7 -16.045 7.991 5.219 68 2HH1 ARG 7 2HH1 ARG 7 -17.753 8.256 5.242 69 1HH2 ARG 7 1HH2 ARG 7 -18.563 4.976 5.978 70 2HH2 ARG 7 2HH2 ARG 7 -19.165 6.569 5.667 71 H HIS 8 H HIS 8 -11.233 3.014 4.160 72 HA HIS 8 HA HIS 8 -10.811 0.485 5.552 73 1HB HIS 8 1HB HIS 8 -12.880 -0.572 4.608 74 2HB HIS 8 2HB HIS 8 -13.222 0.647 5.834 75 HD1 HIS 8 HD1 HIS 8 -15.180 2.007 5.125 76 HD2 HIS 8 HD2 HIS 8 -12.751 1.031 1.881 77 HE1 HIS 8 HE1 HIS 8 -16.209 3.123 3.098 78 H VAL 9 H VAL 9 -10.879 -1.349 3.804 79 HA VAL 9 HA VAL 9 -9.252 -0.423 1.559 80 HB VAL 9 HB VAL 9 -8.695 -2.526 2.703 81 1HG1 VAL 9 1HG1 VAL 9 -11.439 -2.940 2.758 82 2HG1 VAL 9 2HG1 VAL 9 -10.881 -4.115 1.568 83 3HG1 VAL 9 3HG1 VAL 9 -10.210 -4.126 3.198 84 1HG2 VAL 9 1HG2 VAL 9 -8.142 -2.282 0.296 85 2HG2 VAL 9 2HG2 VAL 9 -8.468 -3.962 0.721 86 3HG2 VAL 9 3HG2 VAL 9 -9.691 -3.012 -0.123 87 H VAL 10 H VAL 10 -10.711 0.841 0.303 88 HA VAL 10 HA VAL 10 -13.315 0.137 -0.495 89 HB VAL 10 HB VAL 10 -12.583 2.353 -1.004 90 1HG1 VAL 10 1HG1 VAL 10 -10.110 1.268 -1.494 91 2HG1 VAL 10 2HG1 VAL 10 -10.637 1.688 -3.117 92 3HG1 VAL 10 3HG1 VAL 10 -10.566 2.927 -1.865 93 1HG2 VAL 10 1HG2 VAL 10 -13.993 1.003 -2.778 94 2HG2 VAL 10 2HG2 VAL 10 -13.380 2.605 -3.190 95 3HG2 VAL 10 3HG2 VAL 10 -12.542 1.165 -3.767 96 H SER 11 H SER 11 -10.301 -0.509 -2.368 97 HA SER 11 HA SER 11 -11.814 -2.741 -3.643 98 1HB SER 11 1HB SER 11 -10.531 -0.506 -4.874 99 2HB SER 11 2HB SER 11 -9.629 -1.955 -5.312 100 HG SER 11 HG SER 11 -11.329 -2.711 -6.349 101 H CYS 12 H CYS 12 -10.503 -4.661 -4.132 102 HA CYS 12 HA CYS 12 -7.791 -4.735 -2.938 103 1HB CYS 12 1HB CYS 12 -8.378 -6.795 -1.641 104 2HB CYS 12 2HB CYS 12 -9.210 -5.352 -1.062 105 HG CYS 12 HG CYS 12 -11.370 -6.425 -1.608 106 H SER 13 H SER 13 -6.482 -5.830 -4.295 107 HA SER 13 HA SER 13 -7.711 -7.887 -6.084 108 1HB SER 13 1HB SER 13 -6.514 -5.532 -6.886 109 2HB SER 13 2HB SER 13 -5.194 -6.690 -7.021 110 HG SER 13 HG SER 13 -7.809 -7.049 -8.075 111 H SER 14 H SER 14 -6.796 -8.612 -3.590 112 HA SER 14 HA SER 14 -5.358 -10.872 -3.758 113 1HB SER 14 1HB SER 14 -3.465 -8.574 -3.966 114 2HB SER 14 2HB SER 14 -2.995 -9.945 -2.972 115 HG SER 14 HG SER 14 -3.438 -11.283 -4.793 116 H GLN 15 H GLN 15 -6.929 -10.804 -1.949 117 HA GLN 15 HA GLN 15 -5.526 -10.203 0.580 118 1HB GLN 15 1HB GLN 15 -6.679 -8.308 0.966 119 2HB GLN 15 2HB GLN 15 -7.551 -8.500 -0.534 120 1HG GLN 15 1HG GLN 15 -8.490 -10.021 1.889 121 2HG GLN 15 2HG GLN 15 -8.848 -8.306 1.742 122 1HE2 GLN 15 2HE2 GLN 15 -8.622 -10.378 -1.146 123 2HE2 GLN 15 1HE2 GLN 15 -10.277 -10.308 -1.518 124 H ASP 16 H ASP 16 -6.005 -11.709 2.158 125 HA ASP 16 HA ASP 16 -7.671 -13.995 1.357 126 1HB ASP 16 1HB ASP 16 -5.392 -13.655 2.966 127 2HB ASP 16 2HB ASP 16 -6.674 -14.081 4.095 128 H SER 17 H SER 17 -8.652 -14.789 3.886 129 HA SER 17 HA SER 17 -10.901 -12.889 4.150 130 1HB SER 17 1HB SER 17 -11.439 -15.271 3.855 131 2HB SER 17 2HB SER 17 -10.501 -15.671 5.291 132 HG SER 17 HG SER 17 -12.813 -15.424 5.623 133 H THR 18 H THR 18 -9.147 -14.879 6.562 134 HA THR 18 HA THR 18 -9.699 -13.096 8.729 135 HB THR 18 HB THR 18 -7.472 -14.384 9.578 136 HG1 THR 18 HG1 THR 18 -7.547 -16.456 8.558 137 1HG2 THR 18 1HG2 THR 18 -10.302 -15.396 9.293 138 2HG2 THR 18 2HG2 THR 18 -9.077 -16.270 10.213 139 3HG2 THR 18 3HG2 THR 18 -9.555 -14.645 10.703 140 H HIS 19 H HIS 19 -6.575 -13.698 7.080 141 HA HIS 19 HA HIS 19 -5.569 -11.098 8.050 142 1HB HIS 19 1HB HIS 19 -4.332 -13.397 6.523 143 2HB HIS 19 2HB HIS 19 -3.489 -11.862 6.735 144 HD1 HIS 19 HD1 HIS 19 -2.316 -11.500 8.931 145 HD2 HIS 19 HD2 HIS 19 -5.007 -14.679 9.104 146 HE1 HIS 19 HE1 HIS 19 -1.985 -12.596 11.190 147 H CYS 20 H CYS 20 -7.427 -10.133 6.682 148 HA CYS 20 HA CYS 20 -6.821 -10.024 3.792 149 1HB CYS 20 1HB CYS 20 -8.907 -8.672 3.647 150 2HB CYS 20 2HB CYS 20 -9.167 -10.248 4.378 151 HG CYS 20 HG CYS 20 -10.328 -8.530 5.944 152 H ALA 21 H ALA 21 -7.013 -7.779 2.789 153 HA ALA 21 HA ALA 21 -4.881 -6.141 3.739 154 1HB ALA 21 1HB ALA 21 -6.864 -6.075 1.547 155 2HB ALA 21 2HB ALA 21 -6.252 -4.497 2.047 156 3HB ALA 21 3HB ALA 21 -5.131 -5.749 1.508 157 H GLU 22 H GLU 22 -8.303 -6.161 4.447 158 HA GLU 22 HA GLU 22 -8.584 -3.462 5.339 159 1HB GLU 22 1HB GLU 22 -10.261 -5.644 5.163 160 2HB GLU 22 2HB GLU 22 -10.074 -5.467 6.907 161 1HG GLU 22 1HG GLU 22 -10.644 -3.035 6.668 162 2HG GLU 22 2HG GLU 22 -10.969 -3.320 4.959 163 H ASN 23 H ASN 23 -6.856 -6.152 6.700 164 HA ASN 23 HA ASN 23 -6.898 -5.356 9.466 165 1HB ASN 23 1HB ASN 23 -5.007 -6.988 7.789 166 2HB ASN 23 2HB ASN 23 -4.654 -6.640 9.479 167 1HD2 ASN 23 1HD2 ASN 23 -5.882 -9.048 7.656 168 2HD2 ASN 23 2HD2 ASN 23 -7.038 -9.690 8.721 169 H LEU 24 H LEU 24 -5.376 -4.061 6.678 170 HA LEU 24 HA LEU 24 -3.094 -2.816 7.854 171 1HB LEU 24 1HB LEU 24 -4.726 -1.893 5.468 172 2HB LEU 24 2HB LEU 24 -3.053 -1.468 5.827 173 HG LEU 24 HG LEU 24 -3.801 -4.368 5.589 174 1HD1 LEU 24 1HD1 LEU 24 -4.538 -2.748 3.573 175 2HD1 LEU 24 2HD1 LEU 24 -2.842 -2.977 3.145 176 3HD1 LEU 24 3HD1 LEU 24 -3.908 -4.374 3.305 177 1HD2 LEU 24 1HD2 LEU 24 -1.461 -2.987 6.128 178 2HD2 LEU 24 2HD2 LEU 24 -1.561 -4.658 5.582 179 3HD2 LEU 24 3HD2 LEU 24 -1.311 -3.363 4.412 180 H LEU 25 H LEU 25 -6.515 -2.076 7.834 181 HA LEU 25 HA LEU 25 -6.423 0.698 8.440 182 1HB LEU 25 1HB LEU 25 -8.350 -1.551 8.893 183 2HB LEU 25 2HB LEU 25 -8.612 -0.048 9.760 184 HG LEU 25 HG LEU 25 -9.854 -0.068 7.629 185 1HD1 LEU 25 1HD1 LEU 25 -8.739 2.042 8.601 186 2HD1 LEU 25 2HD1 LEU 25 -7.545 1.847 7.319 187 3HD1 LEU 25 3HD1 LEU 25 -9.238 2.101 6.912 188 1HD2 LEU 25 1HD2 LEU 25 -7.961 -1.539 6.558 189 2HD2 LEU 25 2HD2 LEU 25 -8.844 -0.398 5.544 190 3HD2 LEU 25 3HD2 LEU 25 -7.239 0.016 6.145 191 H LYS 26 H LYS 26 -5.553 -2.108 10.292 192 HA LYS 26 HA LYS 26 -5.135 -0.349 12.672 193 1HB LYS 26 1HB LYS 26 -5.717 -3.310 12.918 194 2HB LYS 26 2HB LYS 26 -5.799 -2.066 14.164 195 1HG LYS 26 1HG LYS 26 -7.611 -1.076 12.406 196 2HG LYS 26 2HG LYS 26 -7.801 -2.802 12.101 197 1HD LYS 26 1HD LYS 26 -8.392 -3.252 14.349 198 2HD LYS 26 2HD LYS 26 -7.773 -1.698 14.909 199 1HE LYS 26 1HE LYS 26 -9.612 -0.824 13.137 200 2HE LYS 26 2HE LYS 26 -10.368 -2.346 13.611 201 1HZ LYS 26 1HZ LYS 26 -9.916 -1.604 15.973 202 2HZ LYS 26 2HZ LYS 26 -9.609 -0.064 15.332 203 3HZ LYS 26 3HZ LYS 26 -11.141 -0.774 15.135 204 H ALA 27 H ALA 27 -3.045 -0.129 11.480 205 HA ALA 27 HA ALA 27 -1.209 -2.126 10.852 206 1HB ALA 27 1HB ALA 27 -0.875 0.329 10.511 207 2HB ALA 27 2HB ALA 27 -0.517 0.483 12.231 208 3HB ALA 27 3HB ALA 27 0.540 -0.475 11.193 209 H ASP 28 H ASP 28 -1.530 -0.555 14.065 210 HA ASP 28 HA ASP 28 0.287 -2.549 15.252 211 1HB ASP 28 1HB ASP 28 -1.306 -0.349 16.603 212 2HB ASP 28 2HB ASP 28 0.037 -1.255 17.302 213 H THR 29 H THR 29 -1.159 -4.394 14.734 214 HA THR 29 HA THR 29 -2.909 -5.025 16.988 215 HB THR 29 HB THR 29 -4.274 -5.397 14.401 216 HG1 THR 29 HG1 THR 29 -4.194 -2.861 15.661 217 1HG2 THR 29 1HG2 THR 29 -4.953 -4.806 17.248 218 2HG2 THR 29 2HG2 THR 29 -6.132 -4.406 15.999 219 3HG2 THR 29 3HG2 THR 29 -5.576 -6.069 16.187 220 H TYR 30 H TYR 30 -0.508 -6.068 15.643 221 HA TYR 30 HA TYR 30 0.397 -8.045 14.809 222 1HB TYR 30 1HB TYR 30 -0.178 -9.951 16.103 223 2HB TYR 30 2HB TYR 30 -0.455 -8.552 17.129 224 HD1 TYR 30 HD1 TYR 30 -2.146 -11.185 15.122 225 HD2 TYR 30 HD2 TYR 30 -2.623 -7.981 17.946 226 HE1 TYR 30 HE1 TYR 30 -4.476 -11.906 15.548 227 HE2 TYR 30 HE2 TYR 30 -4.949 -8.719 18.384 228 HH TYR 30 HH TYR 30 -6.600 -10.866 16.386 229 H ARG 31 H ARG 31 -1.805 -6.826 13.160 230 HA ARG 31 HA ARG 31 -2.473 -9.291 11.605 231 1HB ARG 31 1HB ARG 31 -4.193 -6.841 12.091 232 2HB ARG 31 2HB ARG 31 -4.553 -8.060 10.869 233 1HG ARG 31 1HG ARG 31 -4.110 -8.793 13.765 234 2HG ARG 31 2HG ARG 31 -5.702 -8.349 13.149 235 1HD ARG 31 1HD ARG 31 -4.981 -10.141 11.260 236 2HD ARG 31 2HD ARG 31 -4.086 -10.789 12.636 237 HE ARG 31 HE ARG 31 -6.857 -10.167 13.283 238 1HH1 ARG 31 1HH1 ARG 31 -4.689 -12.564 11.945 239 2HH1 ARG 31 2HH1 ARG 31 -5.756 -13.875 12.307 240 1HH2 ARG 31 1HH2 ARG 31 -8.207 -11.894 13.732 241 2HH2 ARG 31 2HH2 ARG 31 -7.726 -13.503 13.307 242 H LYS 32 H LYS 32 -1.622 -9.215 9.583 243 HA LYS 32 HA LYS 32 -0.936 -6.531 8.446 244 1HB LYS 32 1HB LYS 32 0.564 -9.150 8.166 245 2HB LYS 32 2HB LYS 32 1.003 -7.638 7.381 246 1HG LYS 32 1HG LYS 32 1.615 -6.615 9.401 247 2HG LYS 32 2HG LYS 32 0.652 -7.734 10.365 248 1HD LYS 32 1HD LYS 32 2.331 -9.502 9.244 249 2HD LYS 32 2HD LYS 32 3.377 -8.083 9.217 250 1HE LYS 32 1HE LYS 32 3.870 -8.785 11.344 251 2HE LYS 32 2HE LYS 32 2.415 -7.865 11.729 252 1HZ LYS 32 1HZ LYS 32 2.240 -10.705 10.956 253 2HZ LYS 32 2HZ LYS 32 2.601 -10.268 12.557 254 3HZ LYS 32 3HZ LYS 32 1.138 -9.774 11.847 255 H TRP 33 H TRP 33 -0.663 -6.674 5.976 256 HA TRP 33 HA TRP 33 -3.078 -7.827 4.832 257 1HB TRP 33 1HB TRP 33 -2.071 -5.697 3.965 258 2HB TRP 33 2HB TRP 33 -0.677 -6.610 3.437 259 HD1 TRP 33 HD1 TRP 33 -4.222 -7.976 3.012 260 HE1 TRP 33 HE1 TRP 33 -4.737 -8.143 0.480 261 HE3 TRP 33 HE3 TRP 33 -0.103 -5.673 1.176 262 HZ2 TRP 33 HZ2 TRP 33 -3.514 -7.361 -2.010 263 HZ3 TRP 33 HZ3 TRP 33 0.228 -5.403 -1.273 264 HH2 TRP 33 HH2 TRP 33 -1.477 -6.236 -2.856 265 H ARG 34 H ARG 34 -3.230 -9.661 3.559 266 HA ARG 34 HA ARG 34 -0.745 -11.120 2.876 267 1HB ARG 34 1HB ARG 34 -3.062 -12.326 4.429 268 2HB ARG 34 2HB ARG 34 -1.726 -13.249 3.742 269 1HG ARG 34 1HG ARG 34 -0.195 -11.651 5.086 270 2HG ARG 34 2HG ARG 34 -1.654 -11.231 5.984 271 1HD ARG 34 1HD ARG 34 -1.654 -13.196 7.110 272 2HD ARG 34 2HD ARG 34 -1.305 -14.129 5.654 273 HE ARG 34 HE ARG 34 1.089 -12.840 6.261 274 1HH1 ARG 34 1HH1 ARG 34 -1.087 -15.016 7.924 275 2HH1 ARG 34 2HH1 ARG 34 0.179 -15.722 8.866 276 1HH2 ARG 34 1HH2 ARG 34 2.696 -13.782 7.501 277 2HH2 ARG 34 2HH2 ARG 34 2.297 -15.033 8.630 278 H ALA 35 H ALA 35 -0.918 -11.926 0.834 279 HA ALA 35 HA ALA 35 -3.039 -11.311 -0.908 280 1HB ALA 35 1HB ALA 35 -0.670 -12.170 -1.460 281 2HB ALA 35 2HB ALA 35 -1.320 -13.790 -1.212 282 3HB ALA 35 3HB ALA 35 -1.979 -12.761 -2.484 283 H ALA 36 H ALA 36 -4.753 -12.589 -1.788 284 HA ALA 36 HA ALA 36 -6.132 -14.240 0.136 285 1HB ALA 36 1HB ALA 36 -6.894 -12.785 -2.051 286 2HB ALA 36 2HB ALA 36 -6.986 -14.427 -2.687 287 3HB ALA 36 3HB ALA 36 -7.915 -13.981 -1.257 288 H LYS 37 H LYS 37 -4.139 -14.896 -2.685 289 HA LYS 37 HA LYS 37 -4.578 -17.812 -2.326 290 1HB LYS 37 1HB LYS 37 -3.537 -18.049 -4.540 291 2HB LYS 37 2HB LYS 37 -4.843 -16.874 -4.617 292 1HG LYS 37 1HG LYS 37 -2.672 -15.293 -3.961 293 2HG LYS 37 2HG LYS 37 -1.957 -16.491 -5.038 294 1HD LYS 37 1HD LYS 37 -3.711 -16.014 -6.721 295 2HD LYS 37 2HD LYS 37 -4.392 -14.789 -5.650 296 1HE LYS 37 1HE LYS 37 -3.025 -13.418 -6.889 297 2HE LYS 37 2HE LYS 37 -1.845 -13.933 -5.685 298 1HZ LYS 37 1HZ LYS 37 -1.482 -15.883 -7.324 299 2HZ LYS 37 2HZ LYS 37 -2.173 -14.831 -8.464 300 3HZ LYS 37 3HZ LYS 37 -0.761 -14.377 -7.643 301 H ALA 38 H ALA 38 -2.006 -18.550 -3.444 302 HA ALA 38 HA ALA 38 -0.142 -17.552 -1.333 303 1HB ALA 38 1HB ALA 38 -1.019 -19.797 -0.726 304 2HB ALA 38 2HB ALA 38 -0.410 -20.429 -2.256 305 3HB ALA 38 3HB ALA 38 0.715 -19.826 -1.041 306 H GLY 39 H GLY 39 2.189 -18.086 -1.928 307 1HA GLY 39 1HA GLY 39 3.881 -18.464 -3.598 308 2HA GLY 39 2HA GLY 39 2.655 -18.338 -4.853 309 H GLU 40 H GLU 40 1.487 -15.886 -3.781 310 HA GLU 40 HA GLU 40 1.686 -13.600 -4.137 311 1HB GLU 40 1HB GLU 40 4.466 -13.974 -3.029 312 2HB GLU 40 2HB GLU 40 3.437 -12.545 -2.929 313 1HG GLU 40 1HG GLU 40 2.995 -13.447 -0.848 314 2HG GLU 40 2HG GLU 40 1.775 -14.301 -1.781 315 H LYS 41 H LYS 41 1.725 -13.114 -6.261 316 HA LYS 41 HA LYS 41 4.379 -13.131 -7.651 317 1HB LYS 41 1HB LYS 41 2.527 -14.654 -8.588 318 2HB LYS 41 2HB LYS 41 1.680 -13.169 -9.024 319 1HG LYS 41 1HG LYS 41 3.964 -12.505 -10.126 320 2HG LYS 41 2HG LYS 41 4.284 -14.239 -10.080 321 1HD LYS 41 1HD LYS 41 1.755 -13.065 -11.257 322 2HD LYS 41 2HD LYS 41 3.195 -13.402 -12.218 323 1HE LYS 41 1HE LYS 41 3.048 -15.780 -11.132 324 2HE LYS 41 2HE LYS 41 1.372 -15.334 -10.810 325 1HZ LYS 41 1HZ LYS 41 1.303 -14.689 -13.253 326 2HZ LYS 41 2HZ LYS 41 2.740 -15.582 -13.416 327 3HZ LYS 41 3HZ LYS 41 1.322 -16.349 -12.889 328 H THR 42 H THR 42 1.220 -11.527 -7.503 329 HA THR 42 HA THR 42 2.449 -8.882 -7.344 330 HB THR 42 HB THR 42 1.006 -8.103 -9.357 331 HG1 THR 42 HG1 THR 42 1.338 -10.846 -9.997 332 1HG2 THR 42 1HG2 THR 42 3.652 -8.747 -9.125 333 2HG2 THR 42 2HG2 THR 42 3.169 -9.776 -10.471 334 3HG2 THR 42 3HG2 THR 42 2.930 -8.032 -10.565 335 H ILE 43 H ILE 43 1.244 -8.355 -5.534 336 HA ILE 43 HA ILE 43 -1.681 -8.941 -5.636 337 HB ILE 43 HB ILE 43 -1.584 -8.447 -3.153 338 1HG1 ILE 43 1HG1 ILE 43 1.404 -8.687 -3.576 339 2HG1 ILE 43 2HG1 ILE 43 0.572 -7.161 -3.262 340 1HG2 ILE 43 1HG2 ILE 43 -1.184 -10.746 -4.499 341 2HG2 ILE 43 2HG2 ILE 43 0.340 -10.651 -3.623 342 3HG2 ILE 43 3HG2 ILE 43 -1.182 -10.652 -2.739 343 1HD1 ILE 43 1HD1 ILE 43 -0.471 -8.537 -1.241 344 2HD1 ILE 43 2HD1 ILE 43 0.992 -9.501 -1.436 345 3HD1 ILE 43 3HD1 ILE 43 1.113 -7.776 -1.087 346 H SER 44 H SER 44 -3.193 -7.311 -5.475 347 HA SER 44 HA SER 44 -2.087 -4.539 -5.253 348 1HB SER 44 1HB SER 44 -4.620 -4.742 -6.706 349 2HB SER 44 2HB SER 44 -3.152 -3.881 -7.132 350 HG SER 44 HG SER 44 -3.333 -5.485 -8.611 351 H VAL 45 H VAL 45 -3.382 -3.036 -4.106 352 HA VAL 45 HA VAL 45 -5.899 -3.944 -2.893 353 HB VAL 45 HB VAL 45 -4.201 -4.878 -1.349 354 1HG1 VAL 45 1HG1 VAL 45 -2.511 -3.011 -1.919 355 2HG1 VAL 45 2HG1 VAL 45 -3.369 -2.047 -0.719 356 3HG1 VAL 45 3HG1 VAL 45 -2.585 -3.554 -0.245 357 1HG2 VAL 45 1HG2 VAL 45 -5.779 -2.499 -0.342 358 2HG2 VAL 45 2HG2 VAL 45 -6.280 -4.190 -0.348 359 3HG2 VAL 45 3HG2 VAL 45 -4.984 -3.657 0.723 360 H VAL 46 H VAL 46 -7.146 -2.200 -3.324 361 HA VAL 46 HA VAL 46 -5.926 0.496 -3.283 362 HB VAL 46 HB VAL 46 -8.789 -0.171 -3.984 363 1HG1 VAL 46 1HG1 VAL 46 -7.994 2.211 -3.574 364 2HG1 VAL 46 2HG1 VAL 46 -6.972 2.021 -4.998 365 3HG1 VAL 46 3HG1 VAL 46 -8.726 1.916 -5.152 366 1HG2 VAL 46 1HG2 VAL 46 -6.269 -0.519 -5.581 367 2HG2 VAL 46 2HG2 VAL 46 -7.713 -1.528 -5.553 368 3HG2 VAL 46 3HG2 VAL 46 -7.733 0.015 -6.407 369 H LEU 47 H LEU 47 -6.025 1.630 -1.420 370 HA LEU 47 HA LEU 47 -8.031 0.844 0.624 371 1HB LEU 47 1HB LEU 47 -5.742 2.798 0.939 372 2HB LEU 47 2HB LEU 47 -6.660 2.003 2.216 373 HG LEU 47 HG LEU 47 -5.722 -0.135 0.691 374 1HD1 LEU 47 1HD1 LEU 47 -3.549 1.966 0.950 375 2HD1 LEU 47 2HD1 LEU 47 -3.298 0.290 0.461 376 3HD1 LEU 47 3HD1 LEU 47 -4.239 1.376 -0.562 377 1HD2 LEU 47 1HD2 LEU 47 -5.789 0.386 3.258 378 2HD2 LEU 47 2HD2 LEU 47 -4.550 -0.708 2.644 379 3HD2 LEU 47 3HD2 LEU 47 -4.143 0.969 3.009 380 H GLN 48 H GLN 48 -9.154 2.579 1.812 381 HA GLN 48 HA GLN 48 -9.897 4.817 -0.020 382 1HB GLN 48 1HB GLN 48 -11.769 3.358 0.509 383 2HB GLN 48 2HB GLN 48 -11.414 3.453 2.229 384 1HG GLN 48 1HG GLN 48 -13.295 4.925 1.693 385 2HG GLN 48 2HG GLN 48 -11.902 5.893 2.172 386 1HE2 GLN 48 2HE2 GLN 48 -12.828 4.348 -0.959 387 2HE2 GLN 48 1HE2 GLN 48 -12.676 5.774 -1.866 388 H LEU 49 H LEU 49 -9.926 6.927 0.787 389 HA LEU 49 HA LEU 49 -8.505 7.349 3.369 390 1HB LEU 49 1HB LEU 49 -8.949 9.297 1.078 391 2HB LEU 49 2HB LEU 49 -7.935 9.561 2.496 392 HG LEU 49 HG LEU 49 -7.479 7.278 0.564 393 1HD1 LEU 49 1HD1 LEU 49 -7.262 9.459 -0.606 394 2HD1 LEU 49 2HD1 LEU 49 -6.124 9.991 0.630 395 3HD1 LEU 49 3HD1 LEU 49 -5.706 8.649 -0.434 396 1HD2 LEU 49 1HD2 LEU 49 -6.550 7.577 3.076 397 2HD2 LEU 49 2HD2 LEU 49 -5.586 6.839 1.797 398 3HD2 LEU 49 3HD2 LEU 49 -5.342 8.533 2.219 399 H GLU 50 H GLU 50 -9.631 8.351 4.985 400 HA GLU 50 HA GLU 50 -12.496 8.829 4.610 401 1HB GLU 50 1HB GLU 50 -11.361 7.808 6.684 402 2HB GLU 50 2HB GLU 50 -10.913 9.462 7.103 403 1HG GLU 50 1HG GLU 50 -13.219 10.149 7.183 404 2HG GLU 50 2HG GLU 50 -13.757 8.613 6.505 405 H LYS 51 H LYS 51 -11.087 10.634 3.016 406 HA LYS 51 HA LYS 51 -12.234 13.087 3.309 407 1HB LYS 51 1HB LYS 51 -10.329 14.493 4.293 408 2HB LYS 51 2HB LYS 51 -11.270 13.568 5.459 409 1HG LYS 51 1HG LYS 51 -9.507 12.244 6.012 410 2HG LYS 51 2HG LYS 51 -8.986 12.083 4.335 411 1HD LYS 51 1HD LYS 51 -8.003 14.352 4.426 412 2HD LYS 51 2HD LYS 51 -8.505 14.495 6.111 413 1HE LYS 51 1HE LYS 51 -6.817 12.165 5.235 414 2HE LYS 51 2HE LYS 51 -6.066 13.722 5.587 415 1HZ LYS 51 1HZ LYS 51 -7.275 13.658 7.754 416 2HZ LYS 51 2HZ LYS 51 -7.703 12.051 7.408 417 3HZ LYS 51 3HZ LYS 51 -6.068 12.479 7.583 418 H GLU 52 H GLU 52 -11.816 13.985 1.324 419 HA GLU 52 HA GLU 52 -9.655 12.950 -0.314 420 1HB GLU 52 1HB GLU 52 -11.990 13.906 -1.052 421 2HB GLU 52 2HB GLU 52 -11.156 15.454 -0.975 422 1HG GLU 52 1HG GLU 52 -9.432 14.638 -2.518 423 2HG GLU 52 2HG GLU 52 -10.231 13.068 -2.588 424 H GLU 53 H GLU 53 -7.634 13.556 0.244 425 HA GLU 53 HA GLU 53 -7.071 16.459 0.576 426 1HB GLU 53 1HB GLU 53 -5.228 15.597 2.256 427 2HB GLU 53 2HB GLU 53 -6.871 15.866 2.820 428 1HG GLU 53 1HG GLU 53 -5.870 13.687 3.597 429 2HG GLU 53 2HG GLU 53 -7.371 13.496 2.699 430 H GLN 54 H GLN 54 -4.526 16.678 0.586 431 HA GLN 54 HA GLN 54 -3.605 15.376 -1.900 432 1HB GLN 54 1HB GLN 54 -2.315 17.540 -0.202 433 2HB GLN 54 2HB GLN 54 -1.725 16.980 -1.767 434 1HG GLN 54 1HG GLN 54 -3.594 17.847 -2.916 435 2HG GLN 54 2HG GLN 54 -4.531 18.008 -1.442 436 1HE2 GLN 54 2HE2 GLN 54 -1.127 19.046 -1.742 437 2HE2 GLN 54 1HE2 GLN 54 -1.450 20.701 -1.557 438 H ILE 55 H ILE 55 -1.068 14.843 -1.757 439 HA ILE 55 HA ILE 55 -0.562 13.394 0.807 440 HB ILE 55 HB ILE 55 -0.009 12.321 -1.979 441 1HG1 ILE 55 1HG1 ILE 55 -1.753 10.576 -0.885 442 2HG1 ILE 55 2HG1 ILE 55 -2.295 12.051 -0.085 443 1HG2 ILE 55 1HG2 ILE 55 0.646 11.436 0.797 444 2HG2 ILE 55 2HG2 ILE 55 0.183 10.192 -0.363 445 3HG2 ILE 55 3HG2 ILE 55 1.568 11.233 -0.693 446 1HD1 ILE 55 1HD1 ILE 55 -2.023 12.960 -2.631 447 2HD1 ILE 55 2HD1 ILE 55 -2.457 11.280 -2.944 448 3HD1 ILE 55 3HD1 ILE 55 -3.530 12.306 -1.992 449 H HIS 56 H HIS 56 1.284 14.159 1.676 450 HA HIS 56 HA HIS 56 3.373 15.264 -0.152 451 1HB HIS 56 1HB HIS 56 2.269 16.682 1.739 452 2HB HIS 56 2HB HIS 56 3.288 15.729 2.821 453 HD1 HIS 56 HD1 HIS 56 3.360 18.663 0.670 454 HD2 HIS 56 HD2 HIS 56 6.173 15.904 2.030 455 HE1 HIS 56 HE1 HIS 56 5.633 19.713 0.293 456 H SER 57 H SER 57 2.726 12.928 2.399 457 HA SER 57 HA SER 57 5.320 11.646 1.802 458 1HB SER 57 1HB SER 57 4.555 12.719 4.515 459 2HB SER 57 2HB SER 57 5.708 11.403 4.332 460 HG SER 57 HG SER 57 7.072 12.980 4.044 461 H VAL 58 H VAL 58 5.256 9.423 2.221 462 HA VAL 58 HA VAL 58 2.654 8.355 3.226 463 HB VAL 58 HB VAL 58 4.197 7.627 0.722 464 1HG1 VAL 58 1HG1 VAL 58 2.003 6.119 2.148 465 2HG1 VAL 58 2HG1 VAL 58 2.260 5.954 0.413 466 3HG1 VAL 58 3HG1 VAL 58 3.538 5.507 1.540 467 1HG2 VAL 58 1HG2 VAL 58 1.588 8.937 1.364 468 2HG2 VAL 58 2HG2 VAL 58 2.771 9.340 0.119 469 3HG2 VAL 58 3HG2 VAL 58 1.693 7.962 -0.102 470 H ASP 59 H ASP 59 2.829 6.072 3.926 471 HA ASP 59 HA ASP 59 5.569 5.130 4.565 472 1HB ASP 59 1HB ASP 59 4.826 6.395 6.551 473 2HB ASP 59 2HB ASP 59 3.343 5.454 6.606 474 H ILE 60 H ILE 60 5.705 2.918 4.387 475 HA ILE 60 HA ILE 60 3.346 1.204 4.614 476 HB ILE 60 HB ILE 60 4.504 1.997 1.963 477 1HG1 ILE 60 1HG1 ILE 60 1.953 1.061 1.565 478 2HG1 ILE 60 2HG1 ILE 60 1.875 1.599 3.240 479 1HG2 ILE 60 1HG2 ILE 60 3.991 -0.838 2.729 480 2HG2 ILE 60 2HG2 ILE 60 3.349 -0.308 1.174 481 3HG2 ILE 60 3HG2 ILE 60 5.077 -0.183 1.504 482 1HD1 ILE 60 1HD1 ILE 60 3.202 3.686 2.144 483 2HD1 ILE 60 2HD1 ILE 60 2.229 3.185 0.762 484 3HD1 ILE 60 3HD1 ILE 60 1.445 3.626 2.281 485 H GLY 61 H GLY 61 4.063 -0.765 5.391 486 1HA GLY 61 1HA GLY 61 7.009 -1.148 5.376 487 2HA GLY 61 2HA GLY 61 5.948 -1.825 6.592 488 H ASN 62 H ASN 62 7.848 -2.820 4.365 489 HA ASN 62 HA ASN 62 6.115 -4.566 2.767 490 1HB ASN 62 1HB ASN 62 8.310 -5.441 1.888 491 2HB ASN 62 2HB ASN 62 8.086 -3.705 1.676 492 1HD2 ASN 62 2HD2 ASN 62 9.658 -2.343 2.594 493 2HD2 ASN 62 1HD2 ASN 62 10.884 -2.872 3.641 494 H ASP 63 H ASP 63 5.529 -6.609 3.336 495 HA ASP 63 HA ASP 63 6.835 -7.828 5.725 496 1HB ASP 63 1HB ASP 63 4.196 -7.538 5.231 497 2HB ASP 63 2HB ASP 63 4.456 -9.094 4.442 498 H GLY 64 H GLY 64 8.693 -8.185 4.157 499 1HA GLY 64 1HA GLY 64 9.985 -9.900 3.142 500 2HA GLY 64 2HA GLY 64 8.540 -10.910 3.071 501 H SER 65 H SER 65 7.827 -7.825 1.884 502 HA SER 65 HA SER 65 7.690 -8.815 -0.875 503 1HB SER 65 1HB SER 65 6.922 -6.208 -1.013 504 2HB SER 65 2HB SER 65 5.832 -7.530 -0.611 505 HG SER 65 HG SER 65 5.590 -6.515 1.208 506 H ALA 66 H ALA 66 8.203 -6.769 -2.450 507 HA ALA 66 HA ALA 66 10.907 -5.739 -1.791 508 1HB ALA 66 1HB ALA 66 10.751 -8.006 -3.213 509 2HB ALA 66 2HB ALA 66 10.494 -6.857 -4.526 510 3HB ALA 66 3HB ALA 66 11.963 -6.776 -3.559 511 H PHE 67 H PHE 67 8.389 -5.872 -4.326 512 HA PHE 67 HA PHE 67 9.002 -3.014 -4.941 513 1HB PHE 67 1HB PHE 67 7.307 -4.942 -6.546 514 2HB PHE 67 2HB PHE 67 7.859 -3.361 -7.055 515 HD1 PHE 67 HD1 PHE 67 10.616 -3.181 -6.328 516 HD2 PHE 67 HD2 PHE 67 8.441 -6.607 -7.736 517 HE1 PHE 67 HE1 PHE 67 12.724 -4.170 -7.173 518 HE2 PHE 67 HE2 PHE 67 10.550 -7.598 -8.579 519 HZ PHE 67 HZ PHE 67 12.692 -6.381 -8.299 520 H VAL 68 H VAL 68 7.599 -1.431 -4.425 521 HA VAL 68 HA VAL 68 4.772 -2.184 -3.814 522 HB VAL 68 HB VAL 68 6.485 -0.343 -2.117 523 1HG1 VAL 68 1HG1 VAL 68 3.606 -1.279 -1.907 524 2HG1 VAL 68 2HG1 VAL 68 4.472 -0.483 -0.593 525 3HG1 VAL 68 3HG1 VAL 68 4.171 0.380 -2.102 526 1HG2 VAL 68 1HG2 VAL 68 5.390 -3.128 -1.622 527 2HG2 VAL 68 2HG2 VAL 68 7.089 -2.703 -1.831 528 3HG2 VAL 68 3HG2 VAL 68 6.205 -2.135 -0.413 529 H GLU 69 H GLU 69 3.594 -1.098 -5.261 530 HA GLU 69 HA GLU 69 4.476 1.619 -6.137 531 1HB GLU 69 1HB GLU 69 4.161 -0.060 -7.929 532 2HB GLU 69 2HB GLU 69 2.497 -0.305 -7.404 533 1HG GLU 69 1HG GLU 69 1.770 1.646 -8.348 534 2HG GLU 69 2HG GLU 69 3.254 2.511 -7.955 535 H VAL 70 H VAL 70 2.930 3.344 -6.168 536 HA VAL 70 HA VAL 70 0.355 2.823 -4.780 537 HB VAL 70 HB VAL 70 2.226 5.048 -3.955 538 1HG1 VAL 70 1HG1 VAL 70 -0.557 4.255 -3.308 539 2HG1 VAL 70 2HG1 VAL 70 0.448 4.727 -1.938 540 3HG1 VAL 70 3HG1 VAL 70 0.195 5.849 -3.276 541 1HG2 VAL 70 1HG2 VAL 70 1.767 2.278 -2.882 542 2HG2 VAL 70 2HG2 VAL 70 3.288 3.147 -3.091 543 3HG2 VAL 70 3HG2 VAL 70 2.196 3.584 -1.777 544 H LEU 71 H LEU 71 -1.229 3.742 -5.936 545 HA LEU 71 HA LEU 71 -0.573 6.066 -7.688 546 1HB LEU 71 1HB LEU 71 -2.120 3.621 -8.104 547 2HB LEU 71 2HB LEU 71 -3.076 5.057 -8.461 548 HG LEU 71 HG LEU 71 -1.185 5.876 -9.901 549 1HD1 LEU 71 1HD1 LEU 71 0.567 4.491 -8.765 550 2HD1 LEU 71 2HD1 LEU 71 -0.140 3.057 -9.509 551 3HD1 LEU 71 3HD1 LEU 71 0.574 4.313 -10.520 552 1HD2 LEU 71 1HD2 LEU 71 -2.748 3.379 -10.413 553 2HD2 LEU 71 2HD2 LEU 71 -2.843 4.945 -11.218 554 3HD2 LEU 71 3HD2 LEU 71 -1.519 3.841 -11.591 555 H VAL 72 H VAL 72 -2.414 7.635 -7.898 556 HA VAL 72 HA VAL 72 -4.044 7.772 -5.404 557 HB VAL 72 HB VAL 72 -3.749 10.294 -5.680 558 1HG1 VAL 72 1HG1 VAL 72 -1.438 8.531 -4.855 559 2HG1 VAL 72 2HG1 VAL 72 -1.606 10.230 -4.412 560 3HG1 VAL 72 3HG1 VAL 72 -2.778 9.047 -3.831 561 1HG2 VAL 72 1HG2 VAL 72 -1.440 9.285 -7.354 562 2HG2 VAL 72 2HG2 VAL 72 -2.726 10.368 -7.874 563 3HG2 VAL 72 3HG2 VAL 72 -1.533 10.917 -6.700 564 H GLY 73 H GLY 73 -6.064 8.977 -5.648 565 1HA GLY 73 1HA GLY 73 -7.016 10.076 -8.062 566 2HA GLY 73 2HA GLY 73 -7.464 8.377 -8.045 567 H SER 74 H SER 74 -9.520 9.952 -8.052 568 HA SER 74 HA SER 74 -10.427 10.262 -5.251 569 1HB SER 74 1HB SER 74 -10.651 12.351 -6.378 570 2HB SER 74 2HB SER 74 -11.283 11.585 -7.826 571 HG SER 74 HG SER 74 -12.549 12.343 -5.516 572 H SER 75 H SER 75 -12.599 9.542 -4.805 573 HA SER 75 HA SER 75 -13.303 7.109 -6.291 574 1HB SER 75 1HB SER 75 -14.898 6.705 -4.494 575 2HB SER 75 2HB SER 75 -13.350 7.162 -3.790 576 HG SER 75 HG SER 75 -15.578 8.262 -3.243 577 H ALA 76 H ALA 76 -13.840 10.236 -6.966 578 HA ALA 76 HA ALA 76 -16.660 10.462 -7.249 579 1HB ALA 76 1HB ALA 76 -14.439 11.733 -8.872 580 2HB ALA 76 2HB ALA 76 -16.128 12.240 -8.905 581 3HB ALA 76 3HB ALA 76 -15.185 12.409 -7.423 582 H GLY 77 H GLY 77 -17.687 10.629 -9.545 583 1HA GLY 77 1HA GLY 77 -18.226 9.628 -11.607 584 2HA GLY 77 2HA GLY 77 -16.601 8.941 -11.639 585 H GLY 78 H GLY 78 -16.340 6.806 -11.069 586 1HA GLY 78 1HA GLY 78 -18.471 5.412 -9.572 587 2HA GLY 78 2HA GLY 78 -18.182 4.851 -11.219 588 H ALA 79 H ALA 79 -17.238 2.866 -10.808 589 HA ALA 79 HA ALA 79 -14.878 2.806 -8.984 590 1HB ALA 79 1HB ALA 79 -16.942 1.155 -8.874 591 2HB ALA 79 2HB ALA 79 -16.089 0.338 -10.184 592 3HB ALA 79 3HB ALA 79 -15.306 0.549 -8.618 593 H GLY 80 H GLY 80 -13.546 3.854 -10.658 594 1HA GLY 80 1HA GLY 80 -12.949 2.136 -13.019 595 2HA GLY 80 2HA GLY 80 -12.491 3.832 -12.856 596 H GLU 81 H GLU 81 -10.782 1.463 -13.425 597 HA GLU 81 HA GLU 81 -9.024 1.532 -11.007 598 1HB GLU 81 1HB GLU 81 -7.969 -0.522 -12.030 599 2HB GLU 81 2HB GLU 81 -9.653 -0.734 -11.552 600 1HG GLU 81 1HG GLU 81 -9.173 0.225 -14.328 601 2HG GLU 81 2HG GLU 81 -8.738 -1.449 -13.985 602 H GLN 82 H GLN 82 -9.209 2.218 -14.436 603 HA GLN 82 HA GLN 82 -6.314 2.913 -14.488 604 1HB GLN 82 1HB GLN 82 -7.732 1.555 -16.331 605 2HB GLN 82 2HB GLN 82 -8.015 3.193 -16.918 606 1HG GLN 82 1HG GLN 82 -5.222 2.404 -16.177 607 2HG GLN 82 2HG GLN 82 -5.883 1.832 -17.709 608 1HE2 GLN 82 2HE2 GLN 82 -3.897 4.156 -16.759 609 2HE2 GLN 82 1HE2 GLN 82 -4.393 5.454 -17.734 610 H ASP 83 H ASP 83 -8.144 4.551 -12.983 611 HA ASP 83 HA ASP 83 -8.014 7.061 -14.607 612 1HB ASP 83 1HB ASP 83 -10.366 6.169 -14.208 613 2HB ASP 83 2HB ASP 83 -10.102 6.480 -12.492 614 H TYR 84 H TYR 84 -6.012 5.988 -12.762 615 HA TYR 84 HA TYR 84 -6.193 7.979 -10.553 616 1HB TYR 84 1HB TYR 84 -4.911 5.266 -10.749 617 2HB TYR 84 2HB TYR 84 -4.272 6.458 -9.618 618 HD1 TYR 84 HD1 TYR 84 -7.731 5.473 -10.723 619 HD2 TYR 84 HD2 TYR 84 -5.014 6.087 -7.453 620 HE1 TYR 84 HE1 TYR 84 -9.541 4.930 -9.118 621 HE2 TYR 84 HE2 TYR 84 -6.825 5.545 -5.849 622 HH TYR 84 HH TYR 84 -9.256 3.961 -6.292 623 H GLU 85 H GLU 85 -3.755 8.381 -9.834 624 HA GLU 85 HA GLU 85 -2.175 9.045 -12.275 625 1HB GLU 85 1HB GLU 85 -1.463 10.872 -10.178 626 2HB GLU 85 2HB GLU 85 -2.166 11.242 -11.745 627 1HG GLU 85 1HG GLU 85 -3.905 10.335 -9.449 628 2HG GLU 85 2HG GLU 85 -3.434 12.024 -9.624 629 H VAL 86 H VAL 86 -0.142 8.230 -12.212 630 HA VAL 86 HA VAL 86 0.668 6.465 -10.131 631 HB VAL 86 HB VAL 86 2.420 7.825 -12.196 632 1HG1 VAL 86 1HG1 VAL 86 3.604 6.653 -10.323 633 2HG1 VAL 86 2HG1 VAL 86 2.739 5.175 -10.748 634 3HG1 VAL 86 3HG1 VAL 86 3.876 5.893 -11.890 635 1HG2 VAL 86 1HG2 VAL 86 0.573 5.442 -12.279 636 2HG2 VAL 86 2HG2 VAL 86 0.717 6.766 -13.435 637 3HG2 VAL 86 3HG2 VAL 86 1.973 5.530 -13.348 638 H LEU 87 H LEU 87 0.476 7.689 -8.165 639 HA LEU 87 HA LEU 87 1.852 10.119 -7.605 640 1HB LEU 87 1HB LEU 87 0.085 8.840 -6.187 641 2HB LEU 87 2HB LEU 87 1.459 7.931 -5.562 642 HG LEU 87 HG LEU 87 2.541 10.168 -5.013 643 1HD1 LEU 87 1HD1 LEU 87 0.552 11.216 -6.568 644 2HD1 LEU 87 2HD1 LEU 87 -0.129 11.448 -4.957 645 3HD1 LEU 87 3HD1 LEU 87 1.442 12.138 -5.357 646 1HD2 LEU 87 1HD2 LEU 87 0.146 8.965 -3.714 647 2HD2 LEU 87 2HD2 LEU 87 1.772 9.198 -3.075 648 3HD2 LEU 87 3HD2 LEU 87 0.644 10.553 -3.132 649 H LEU 88 H LEU 88 2.816 6.747 -6.897 650 HA LEU 88 HA LEU 88 5.624 7.513 -7.386 651 1HB LEU 88 1HB LEU 88 6.414 6.480 -5.312 652 2HB LEU 88 2HB LEU 88 5.351 7.842 -4.986 653 HG LEU 88 HG LEU 88 3.653 5.601 -5.182 654 1HD1 LEU 88 1HD1 LEU 88 6.299 4.996 -3.937 655 2HD1 LEU 88 2HD1 LEU 88 4.856 4.385 -3.128 656 3HD1 LEU 88 3HD1 LEU 88 5.192 3.925 -4.797 657 1HD2 LEU 88 1HD2 LEU 88 4.663 7.453 -3.059 658 2HD2 LEU 88 2HD2 LEU 88 3.018 7.219 -3.649 659 3HD2 LEU 88 3HD2 LEU 88 3.736 6.042 -2.548 660 H VAL 89 H VAL 89 6.413 6.047 -8.762 661 HA VAL 89 HA VAL 89 5.064 3.683 -9.573 662 HB VAL 89 HB VAL 89 8.069 3.952 -9.769 663 1HG1 VAL 89 1HG1 VAL 89 5.869 2.595 -11.273 664 2HG1 VAL 89 2HG1 VAL 89 7.297 3.118 -12.168 665 3HG1 VAL 89 3HG1 VAL 89 7.463 1.985 -10.826 666 1HG2 VAL 89 1HG2 VAL 89 5.940 5.591 -11.127 667 2HG2 VAL 89 2HG2 VAL 89 7.508 6.106 -10.505 668 3HG2 VAL 89 3HG2 VAL 89 7.415 5.182 -12.004 669 H THR 90 H THR 90 6.192 1.399 -9.376 670 HA THR 90 HA THR 90 6.064 0.597 -6.681 671 HB THR 90 HB THR 90 5.922 -0.773 -8.938 672 HG1 THR 90 HG1 THR 90 5.735 -2.419 -7.634 673 1HG2 THR 90 1HG2 THR 90 8.319 -0.478 -9.542 674 2HG2 THR 90 2HG2 THR 90 8.775 -1.333 -8.069 675 3HG2 THR 90 3HG2 THR 90 7.886 -2.175 -9.338 676 H SER 91 H SER 91 7.522 0.471 -5.073 677 HA SER 91 HA SER 91 10.249 1.509 -5.616 678 1HB SER 91 1HB SER 91 10.184 1.762 -3.026 679 2HB SER 91 2HB SER 91 9.238 2.883 -3.996 680 HG SER 91 HG SER 91 7.416 1.804 -3.479 681 H SER 92 H SER 92 11.897 0.139 -5.462 682 HA SER 92 HA SER 92 11.468 -2.625 -4.534 683 1HB SER 92 1HB SER 92 13.653 -3.070 -5.490 684 2HB SER 92 2HB SER 92 12.726 -2.110 -6.640 685 HG SER 92 HG SER 92 15.068 -1.551 -5.541 686 H PHE 93 H PHE 93 11.841 -3.159 -2.453 687 HA PHE 93 HA PHE 93 13.758 -1.491 -0.883 688 1HB PHE 93 1HB PHE 93 11.608 -3.327 0.172 689 2HB PHE 93 2HB PHE 93 12.573 -2.194 1.107 690 HD1 PHE 93 HD1 PHE 93 12.552 0.231 -0.536 691 HD2 PHE 93 HD2 PHE 93 9.387 -2.573 0.259 692 HE1 PHE 93 HE1 PHE 93 10.873 2.004 -0.955 693 HE2 PHE 93 HE2 PHE 93 7.713 -0.794 -0.161 694 HZ PHE 93 HZ PHE 93 8.458 1.492 -0.767 695 H MET 94 H MET 94 12.599 -4.845 -1.217 696 HA MET 94 HA MET 94 15.345 -5.756 -0.419 697 1HB MET 94 1HB MET 94 12.766 -7.286 0.016 698 2HB MET 94 2HB MET 94 14.356 -7.668 0.664 699 1HG MET 94 1HG MET 94 14.266 -5.985 2.260 700 2HG MET 94 2HG MET 94 13.123 -5.018 1.331 701 1HE MET 94 1HE MET 94 13.728 -8.445 2.511 702 2HE MET 94 2HE MET 94 12.406 -8.886 3.600 703 3HE MET 94 3HE MET 94 12.212 -9.060 1.858 704 H SER 95 H SER 95 14.968 -8.465 -1.009 705 HA SER 95 HA SER 95 14.424 -8.484 -3.943 706 1HB SER 95 1HB SER 95 16.353 -9.795 -4.322 707 2HB SER 95 2HB SER 95 16.907 -8.637 -3.122 708 HG SER 95 HG SER 95 17.354 -10.318 -1.956 709 HA PRO 96 HA PRO 96 11.972 -12.088 -2.964 710 1HB PRO 96 1HB PRO 96 12.454 -13.778 -5.052 711 2HB PRO 96 2HB PRO 96 11.540 -12.271 -5.208 712 1HG PRO 96 1HG PRO 96 14.228 -12.930 -6.192 713 2HG PRO 96 2HG PRO 96 13.118 -11.658 -6.716 714 1HD PRO 96 1HD PRO 96 15.408 -11.396 -4.997 715 2HD PRO 96 2HD PRO 96 14.275 -10.122 -5.502 716 H SER 97 H SER 97 15.164 -12.292 -2.342 717 HA SER 97 HA SER 97 15.033 -15.204 -1.677 718 1HB SER 97 1HB SER 97 16.839 -14.084 -3.376 719 2HB SER 97 2HB SER 97 17.702 -13.927 -1.849 720 HG SER 97 HG SER 97 17.383 -16.157 -1.525 721 H GLU 98 H GLU 98 16.094 -11.984 -0.601 722 HA GLU 98 HA GLU 98 16.974 -13.009 1.991 723 1HB GLU 98 1HB GLU 98 17.432 -10.671 2.518 724 2HB GLU 98 2HB GLU 98 18.043 -11.041 0.911 725 1HG GLU 98 1HG GLU 98 15.527 -10.231 0.282 726 2HG GLU 98 2HG GLU 98 15.820 -9.249 1.719 727 H SER 99 H SER 99 13.965 -12.025 0.630 728 HA SER 99 HA SER 99 12.644 -10.929 2.887 729 1HB SER 99 1HB SER 99 11.400 -12.716 0.785 730 2HB SER 99 2HB SER 99 10.582 -11.504 1.765 731 HG SER 99 HG SER 99 11.015 -10.474 -0.101 732 H ARG 100 H ARG 100 13.572 -14.227 2.178 733 HA ARG 100 HA ARG 100 11.711 -15.513 3.955 734 1HB ARG 100 1HB ARG 100 14.448 -16.388 2.982 735 2HB ARG 100 2HB ARG 100 13.308 -17.429 3.836 736 1HG ARG 100 1HG ARG 100 11.732 -17.337 2.067 737 2HG ARG 100 2HG ARG 100 12.525 -15.948 1.324 738 1HD ARG 100 1HD ARG 100 13.585 -18.781 1.481 739 2HD ARG 100 2HD ARG 100 13.091 -17.911 0.030 740 HE ARG 100 HE ARG 100 15.078 -16.310 1.067 741 1HH1 ARG 100 1HH1 ARG 100 14.867 -19.711 0.274 742 2HH1 ARG 100 2HH1 ARG 100 16.555 -19.837 -0.075 743 1HH2 ARG 100 1HH2 ARG 100 17.256 -16.520 0.601 744 2HH2 ARG 100 2HH2 ARG 100 17.895 -18.052 0.108 745 H SER 101 H SER 101 15.214 -15.634 4.599 746 HA SER 101 HA SER 101 14.997 -14.151 7.091 747 1HB SER 101 1HB SER 101 13.976 -16.410 7.639 748 2HB SER 101 2HB SER 101 15.545 -17.127 7.284 749 HG SER 101 HG SER 101 16.344 -16.277 9.063 750 H GLY 102 H GLY 102 16.610 -13.998 4.743 751 1HA GLY 102 1HA GLY 102 19.277 -14.898 5.746 752 2HA GLY 102 2HA GLY 102 18.908 -14.578 4.051 753 H SER 103 H SER 103 17.334 -12.100 4.990 754 HA SER 103 HA SER 103 19.159 -10.306 6.263 755 1HB SER 103 1HB SER 103 19.652 -10.835 3.441 756 2HB SER 103 2HB SER 103 19.314 -9.132 3.726 757 HG SER 103 HG SER 103 21.252 -9.020 4.503 758 H ASN 104 H ASN 104 17.768 -8.868 7.071 759 HA ASN 104 HA ASN 104 15.785 -7.665 7.418 760 1HB ASN 104 1HB ASN 104 15.405 -5.984 5.524 761 2HB ASN 104 2HB ASN 104 16.994 -5.968 6.281 762 1HD2 ASN 104 2HD2 ASN 104 15.261 -7.281 3.409 763 2HD2 ASN 104 1HD2 ASN 104 16.638 -7.346 2.417 764 HA PRO 105 HA PRO 105 13.075 -10.470 4.851 765 1HB PRO 105 1HB PRO 105 11.980 -11.838 6.948 766 2HB PRO 105 2HB PRO 105 13.473 -12.329 6.136 767 1HG PRO 105 1HG PRO 105 13.102 -11.051 8.782 768 2HG PRO 105 2HG PRO 105 14.368 -12.155 8.227 769 1HD PRO 105 1HD PRO 105 14.626 -9.373 8.495 770 2HD PRO 105 2HD PRO 105 15.725 -10.435 7.589 771 H ASN 106 H ASN 106 12.526 -8.641 7.817 772 HA ASN 106 HA ASN 106 9.855 -7.851 6.739 773 1HB ASN 106 1HB ASN 106 10.421 -9.263 9.201 774 2HB ASN 106 2HB ASN 106 9.709 -7.692 9.568 775 1HD2 ASN 106 2HD2 ASN 106 9.066 -9.681 6.653 776 2HD2 ASN 106 1HD2 ASN 106 7.417 -9.912 6.982 777 H ARG 107 H ARG 107 11.002 -5.968 5.941 778 HA ARG 107 HA ARG 107 11.710 -4.007 8.093 779 1HB ARG 107 1HB ARG 107 13.505 -4.795 6.363 780 2HB ARG 107 2HB ARG 107 12.624 -3.773 5.228 781 1HG ARG 107 1HG ARG 107 13.119 -1.813 6.399 782 2HG ARG 107 2HG ARG 107 13.414 -2.672 7.910 783 1HD ARG 107 1HD ARG 107 15.273 -3.641 5.950 784 2HD ARG 107 2HD ARG 107 15.324 -1.878 5.946 785 HE ARG 107 HE ARG 107 15.371 -2.993 8.634 786 1HH1 ARG 107 1HH1 ARG 107 17.305 -2.154 5.843 787 2HH1 ARG 107 2HH1 ARG 107 18.752 -1.982 6.773 788 1HH2 ARG 107 1HH2 ARG 107 17.267 -2.759 9.798 789 2HH2 ARG 107 2HH2 ARG 107 18.734 -2.320 8.987 790 H VAL 108 H VAL 108 11.316 -1.653 7.228 791 HA VAL 108 HA VAL 108 8.817 -1.624 5.602 792 HB VAL 108 HB VAL 108 7.855 0.047 7.027 793 1HG1 VAL 108 1HG1 VAL 108 9.052 -2.259 8.590 794 2HG1 VAL 108 2HG1 VAL 108 7.719 -1.255 9.160 795 3HG1 VAL 108 3HG1 VAL 108 7.513 -2.262 7.727 796 1HG2 VAL 108 1HG2 VAL 108 10.574 0.020 8.292 797 2HG2 VAL 108 2HG2 VAL 108 9.582 1.398 7.815 798 3HG2 VAL 108 3HG2 VAL 108 9.164 0.466 9.254 799 H ARG 109 H ARG 109 8.367 0.757 4.840 800 HA ARG 109 HA ARG 109 10.774 2.384 4.469 801 1HB ARG 109 1HB ARG 109 10.278 0.403 2.579 802 2HB ARG 109 2HB ARG 109 9.559 1.839 1.852 803 1HG ARG 109 1HG ARG 109 11.697 2.235 1.148 804 2HG ARG 109 2HG ARG 109 11.898 2.882 2.776 805 1HD ARG 109 1HD ARG 109 12.502 0.473 3.466 806 2HD ARG 109 2HD ARG 109 12.676 0.155 1.741 807 HE ARG 109 HE ARG 109 14.164 2.506 2.572 808 1HH1 ARG 109 1HH1 ARG 109 14.221 -0.988 2.419 809 2HH1 ARG 109 2HH1 ARG 109 15.948 -1.058 2.414 810 1HH2 ARG 109 1HH2 ARG 109 16.397 2.367 2.563 811 2HH2 ARG 109 2HH2 ARG 109 17.169 0.818 2.494 812 H MET 110 H MET 110 10.249 4.503 3.884 813 HA MET 110 HA MET 110 7.330 5.099 3.629 814 1HB MET 110 1HB MET 110 9.428 6.760 5.055 815 2HB MET 110 2HB MET 110 7.705 7.122 4.950 816 1HG MET 110 1HG MET 110 7.160 5.619 6.562 817 2HG MET 110 2HG MET 110 8.302 4.417 5.964 818 1HE MET 110 1HE MET 110 7.652 4.477 8.523 819 2HE MET 110 2HE MET 110 9.060 4.630 9.572 820 3HE MET 110 3HE MET 110 7.882 5.946 9.468 821 H PHE 111 H PHE 111 6.806 6.960 2.362 822 HA PHE 111 HA PHE 111 8.953 7.793 0.464 823 1HB PHE 111 1HB PHE 111 5.983 7.924 -0.097 824 2HB PHE 111 2HB PHE 111 7.310 8.005 -1.250 825 HD1 PHE 111 HD1 PHE 111 5.717 5.711 1.249 826 HD2 PHE 111 HD2 PHE 111 8.035 6.058 -2.352 827 HE1 PHE 111 HE1 PHE 111 5.565 3.264 0.912 828 HE2 PHE 111 HE2 PHE 111 7.885 3.604 -2.684 829 HZ PHE 111 HZ PHE 111 6.645 2.205 -1.049 830 H GLY 112 H GLY 112 8.685 10.065 -0.299 831 1HA GLY 112 1HA GLY 112 7.233 11.796 1.632 832 2HA GLY 112 2HA GLY 112 8.886 12.137 1.191 833 HA PRO 113 HA PRO 113 6.385 14.530 -1.848 834 1HB PRO 113 1HB PRO 113 8.123 16.633 -1.930 835 2HB PRO 113 2HB PRO 113 6.842 16.471 -0.720 836 1HG PRO 113 1HG PRO 113 9.766 16.021 -0.448 837 2HG PRO 113 2HG PRO 113 8.598 16.610 0.744 838 1HD PRO 113 1HD PRO 113 9.602 14.006 0.656 839 2HD PRO 113 2HD PRO 113 8.112 14.488 1.476 840 H ASP 114 H ASP 114 9.895 14.027 -1.785 841 HA ASP 114 HA ASP 114 10.368 14.495 -4.573 842 1HB ASP 114 1HB ASP 114 12.074 14.342 -2.622 843 2HB ASP 114 2HB ASP 114 12.005 12.599 -2.892 844 H LYS 115 H LYS 115 9.247 11.722 -2.755 845 HA LYS 115 HA LYS 115 9.584 9.930 -5.067 846 1HB LYS 115 1HB LYS 115 8.640 9.568 -2.231 847 2HB LYS 115 2HB LYS 115 8.379 8.310 -3.439 848 1HG LYS 115 1HG LYS 115 10.652 7.891 -3.694 849 2HG LYS 115 2HG LYS 115 11.114 9.507 -3.163 850 1HD LYS 115 1HD LYS 115 10.249 8.874 -0.858 851 2HD LYS 115 2HD LYS 115 10.128 7.216 -1.449 852 1HE LYS 115 1HE LYS 115 12.617 7.604 -2.203 853 2HE LYS 115 2HE LYS 115 12.581 8.887 -0.995 854 1HZ LYS 115 1HZ LYS 115 11.579 6.211 -0.304 855 2HZ LYS 115 2HZ LYS 115 13.254 6.498 -0.311 856 3HZ LYS 115 3HZ LYS 115 12.244 7.406 0.706 857 H LEU 116 H LEU 116 7.361 12.291 -4.410 858 HA LEU 116 HA LEU 116 5.206 10.671 -5.714 859 1HB LEU 116 1HB LEU 116 3.568 12.274 -4.580 860 2HB LEU 116 2HB LEU 116 4.310 11.039 -3.571 861 HG LEU 116 HG LEU 116 6.096 12.891 -3.079 862 1HD1 LEU 116 1HD1 LEU 116 4.407 14.321 -4.814 863 2HD1 LEU 116 2HD1 LEU 116 4.042 14.935 -3.206 864 3HD1 LEU 116 3HD1 LEU 116 5.694 14.983 -3.814 865 1HD2 LEU 116 1HD2 LEU 116 3.265 12.934 -2.007 866 2HD2 LEU 116 2HD2 LEU 116 4.606 11.972 -1.392 867 3HD2 LEU 116 3HD2 LEU 116 4.632 13.727 -1.229 868 H VAL 117 H VAL 117 4.192 11.532 -7.415 869 HA VAL 117 HA VAL 117 5.449 13.586 -8.945 870 HB VAL 117 HB VAL 117 3.955 11.856 -9.922 871 1HG1 VAL 117 1HG1 VAL 117 2.336 11.937 -7.996 872 2HG1 VAL 117 2HG1 VAL 117 1.702 13.418 -8.689 873 3HG1 VAL 117 3HG1 VAL 117 1.581 11.912 -9.591 874 1HG2 VAL 117 1HG2 VAL 117 4.278 14.311 -10.864 875 2HG2 VAL 117 2HG2 VAL 117 3.106 13.222 -11.606 876 3HG2 VAL 117 3HG2 VAL 117 2.566 14.457 -10.467 877 H ARG 118 H ARG 118 5.262 15.805 -8.822 878 HA ARG 118 HA ARG 118 3.694 16.981 -6.674 879 1HB ARG 118 1HB ARG 118 5.572 17.987 -8.774 880 2HB ARG 118 2HB ARG 118 4.464 19.146 -8.040 881 1HG ARG 118 1HG ARG 118 5.412 18.936 -5.939 882 2HG ARG 118 2HG ARG 118 5.959 17.286 -6.236 883 1HD ARG 118 1HD ARG 118 7.914 18.698 -6.220 884 2HD ARG 118 2HD ARG 118 7.617 18.226 -7.893 885 HE ARG 118 HE ARG 118 6.247 20.633 -7.584 886 1HH1 ARG 118 1HH1 ARG 118 9.548 19.549 -7.174 887 2HH1 ARG 118 2HH1 ARG 118 10.210 21.098 -7.562 888 1HH2 ARG 118 1HH2 ARG 118 7.147 22.620 -8.079 889 2HH2 ARG 118 2HH2 ARG 118 8.868 22.819 -8.069 890 H ALA 119 H ALA 119 3.296 16.570 -10.142 891 HA ALA 119 HA ALA 119 1.157 18.447 -10.489 892 1HB ALA 119 1HB ALA 119 2.090 16.032 -12.028 893 2HB ALA 119 2HB ALA 119 0.635 16.907 -12.507 894 3HB ALA 119 3HB ALA 119 2.194 17.733 -12.482 895 H ALA 120 H ALA 120 1.268 15.280 -9.074 896 HA ALA 120 HA ALA 120 -1.714 15.191 -9.057 897 1HB ALA 120 1HB ALA 120 -0.031 13.277 -10.054 898 2HB ALA 120 2HB ALA 120 -0.245 12.710 -8.398 899 3HB ALA 120 3HB ALA 120 -1.649 12.944 -9.439 900 H ALA 121 H ALA 121 1.204 14.429 -7.089 901 HA ALA 121 HA ALA 121 0.009 13.736 -4.672 902 1HB ALA 121 1HB ALA 121 2.473 13.837 -5.171 903 2HB ALA 121 2HB ALA 121 2.394 15.579 -4.905 904 3HB ALA 121 3HB ALA 121 2.026 14.468 -3.586 905 H GLU 122 H GLU 122 0.475 17.049 -5.922 906 HA GLU 122 HA GLU 122 -0.621 18.236 -3.482 907 1HB GLU 122 1HB GLU 122 -0.460 20.371 -4.693 908 2HB GLU 122 2HB GLU 122 1.038 19.457 -4.857 909 1HG GLU 122 1HG GLU 122 0.756 19.938 -7.076 910 2HG GLU 122 2HG GLU 122 -0.303 18.528 -7.020 911 H LYS 123 H LYS 123 -2.116 16.537 -5.904 912 HA LYS 123 HA LYS 123 -4.508 18.257 -6.027 913 1HB LYS 123 1HB LYS 123 -3.976 15.547 -7.261 914 2HB LYS 123 2HB LYS 123 -5.352 16.586 -7.617 915 1HG LYS 123 1HG LYS 123 -3.447 18.347 -8.143 916 2HG LYS 123 2HG LYS 123 -2.478 16.895 -8.382 917 1HD LYS 123 1HD LYS 123 -3.353 17.238 -10.523 918 2HD LYS 123 2HD LYS 123 -4.516 16.104 -9.835 919 1HE LYS 123 1HE LYS 123 -5.873 18.125 -9.097 920 2HE LYS 123 2HE LYS 123 -4.800 19.105 -10.095 921 1HZ LYS 123 1HZ LYS 123 -5.380 17.421 -11.917 922 2HZ LYS 123 2HZ LYS 123 -6.700 17.010 -10.929 923 3HZ LYS 123 3HZ LYS 123 -6.535 18.596 -11.514 924 H ARG 124 H ARG 124 -6.304 17.837 -4.787 925 HA ARG 124 HA ARG 124 -6.082 16.082 -2.532 926 1HB ARG 124 1HB ARG 124 -8.382 17.643 -3.708 927 2HB ARG 124 2HB ARG 124 -8.577 16.628 -2.280 928 1HG ARG 124 1HG ARG 124 -6.750 17.866 -1.157 929 2HG ARG 124 2HG ARG 124 -6.595 18.904 -2.575 930 1HD ARG 124 1HD ARG 124 -9.105 18.606 -0.898 931 2HD ARG 124 2HD ARG 124 -7.985 19.966 -0.818 932 HE ARG 124 HE ARG 124 -8.860 19.604 -3.524 933 1HH1 ARG 124 1HH1 ARG 124 -9.983 20.719 -0.406 934 2HH1 ARG 124 2HH1 ARG 124 -11.142 21.799 -1.097 935 1HH2 ARG 124 1HH2 ARG 124 -10.370 21.016 -4.377 936 2HH2 ARG 124 2HH2 ARG 124 -11.360 21.969 -3.320 937 H TRP 125 H TRP 125 -6.167 13.942 -2.662 938 HA TRP 125 HA TRP 125 -8.113 12.642 -4.540 939 1HB TRP 125 1HB TRP 125 -5.544 11.508 -3.380 940 2HB TRP 125 2HB TRP 125 -6.593 10.721 -4.555 941 HD1 TRP 125 HD1 TRP 125 -3.582 12.762 -4.363 942 HE1 TRP 125 HE1 TRP 125 -3.008 13.791 -6.657 943 HE3 TRP 125 HE3 TRP 125 -7.963 11.929 -6.842 944 HZ2 TRP 125 HZ2 TRP 125 -4.215 14.181 -9.204 945 HZ3 TRP 125 HZ3 TRP 125 -8.223 12.616 -9.200 946 HH2 TRP 125 HH2 TRP 125 -6.362 13.752 -10.389 947 H ASP 126 H ASP 126 -8.994 10.540 -3.628 948 HA ASP 126 HA ASP 126 -8.951 10.508 -0.653 949 1HB ASP 126 1HB ASP 126 -11.372 10.194 -0.543 950 2HB ASP 126 2HB ASP 126 -10.977 11.717 -1.331 951 H ARG 127 H ARG 127 -8.192 8.772 -3.270 952 HA ARG 127 HA ARG 127 -8.758 6.197 -1.913 953 1HB ARG 127 1HB ARG 127 -9.102 6.779 -4.875 954 2HB ARG 127 2HB ARG 127 -9.158 5.170 -4.153 955 1HG ARG 127 1HG ARG 127 -10.949 6.485 -2.576 956 2HG ARG 127 2HG ARG 127 -11.179 7.332 -4.108 957 1HD ARG 127 1HD ARG 127 -11.141 4.317 -3.908 958 2HD ARG 127 2HD ARG 127 -12.618 5.262 -3.762 959 HE ARG 127 HE ARG 127 -11.536 6.188 -6.114 960 1HH1 ARG 127 1HH1 ARG 127 -12.265 2.996 -4.879 961 2HH1 ARG 127 2HH1 ARG 127 -12.525 2.338 -6.456 962 1HH2 ARG 127 1HH2 ARG 127 -11.886 5.294 -8.133 963 2HH2 ARG 127 2HH2 ARG 127 -12.315 3.622 -8.279 964 H VAL 128 H VAL 128 -7.046 4.655 -2.282 965 HA VAL 128 HA VAL 128 -4.740 5.702 -3.840 966 HB VAL 128 HB VAL 128 -4.602 6.133 -1.308 967 1HG1 VAL 128 1HG1 VAL 128 -5.219 3.497 -1.038 968 2HG1 VAL 128 2HG1 VAL 128 -3.458 3.428 -0.964 969 3HG1 VAL 128 3HG1 VAL 128 -4.350 4.429 0.181 970 1HG2 VAL 128 1HG2 VAL 128 -2.755 6.087 -3.106 971 2HG2 VAL 128 2HG2 VAL 128 -2.268 6.004 -1.413 972 3HG2 VAL 128 3HG2 VAL 128 -2.304 4.539 -2.394 973 H LYS 129 H LYS 129 -3.641 4.180 -4.984 974 HA LYS 129 HA LYS 129 -4.711 1.395 -4.853 975 1HB LYS 129 1HB LYS 129 -4.489 3.092 -7.006 976 2HB LYS 129 2HB LYS 129 -3.012 2.141 -7.149 977 1HG LYS 129 1HG LYS 129 -5.779 0.953 -6.816 978 2HG LYS 129 2HG LYS 129 -4.951 1.129 -8.363 979 1HD LYS 129 1HD LYS 129 -2.996 -0.116 -7.039 980 2HD LYS 129 2HD LYS 129 -4.358 -0.726 -6.099 981 1HE LYS 129 1HE LYS 129 -4.132 -0.878 -9.119 982 2HE LYS 129 2HE LYS 129 -3.804 -2.213 -8.016 983 1HZ LYS 129 1HZ LYS 129 -6.092 -1.976 -7.178 984 2HZ LYS 129 2HZ LYS 129 -6.388 -0.791 -8.360 985 3HZ LYS 129 3HZ LYS 129 -6.038 -2.383 -8.827 986 H ILE 130 H ILE 130 -3.369 0.353 -3.390 987 HA ILE 130 HA ILE 130 -0.426 0.704 -3.655 988 HB ILE 130 HB ILE 130 -2.060 -0.809 -1.586 989 1HG1 ILE 130 1HG1 ILE 130 -2.441 1.634 -1.522 990 2HG1 ILE 130 2HG1 ILE 130 -1.529 1.101 -0.111 991 1HG2 ILE 130 1HG2 ILE 130 0.883 -0.313 -1.960 992 2HG2 ILE 130 2HG2 ILE 130 0.225 -0.458 -0.330 993 3HG2 ILE 130 3HG2 ILE 130 0.056 -1.792 -1.472 994 1HD1 ILE 130 1HD1 ILE 130 0.581 1.781 -1.259 995 2HD1 ILE 130 2HD1 ILE 130 -0.380 2.397 -2.603 996 3HD1 ILE 130 3HD1 ILE 130 -0.518 3.138 -1.010 997 H VAL 131 H VAL 131 0.629 -0.723 -4.980 998 HA VAL 131 HA VAL 131 -0.477 -3.471 -5.210 999 HB VAL 131 HB VAL 131 1.024 -1.913 -7.329 1000 1HG1 VAL 131 1HG1 VAL 131 -0.459 -4.549 -7.350 1001 2HG1 VAL 131 2HG1 VAL 131 0.243 -3.770 -8.769 1002 3HG1 VAL 131 3HG1 VAL 131 1.289 -4.338 -7.467 1003 1HG2 VAL 131 1HG2 VAL 131 -1.884 -2.233 -6.689 1004 2HG2 VAL 131 2HG2 VAL 131 -1.033 -0.837 -7.350 1005 3HG2 VAL 131 3HG2 VAL 131 -1.403 -2.216 -8.386 1006 H CYS 132 H CYS 132 0.874 -4.964 -4.407 1007 HA CYS 132 HA CYS 132 3.747 -4.265 -4.045 1008 1HB CYS 132 1HB CYS 132 2.049 -5.238 -2.214 1009 2HB CYS 132 2HB CYS 132 2.585 -6.769 -2.908 1010 HG CYS 132 HG CYS 132 4.225 -5.935 -0.956 1011 H SER 133 H SER 133 5.355 -5.457 -5.072 1012 HA SER 133 HA SER 133 4.513 -7.797 -6.719 1013 1HB SER 133 1HB SER 133 5.135 -5.200 -7.690 1014 2HB SER 133 2HB SER 133 6.486 -6.234 -8.132 1015 HG SER 133 HG SER 133 4.984 -6.469 -9.722 1016 H GLN 134 H GLN 134 5.909 -9.455 -6.631 1017 HA GLN 134 HA GLN 134 8.533 -9.809 -6.866 1018 1HB GLN 134 1HB GLN 134 9.148 -8.156 -5.160 1019 2HB GLN 134 2HB GLN 134 8.176 -8.990 -3.958 1020 1HG GLN 134 1HG GLN 134 10.183 -9.956 -3.428 1021 2HG GLN 134 2HG GLN 134 9.803 -11.024 -4.773 1022 1HE2 GLN 134 2HE2 GLN 134 10.476 -9.823 -7.045 1023 2HE2 GLN 134 1HE2 GLN 134 12.046 -9.185 -7.028 1024 HA PRO 135 HA PRO 135 6.808 -13.776 -5.646 1025 1HB PRO 135 1HB PRO 135 8.853 -15.330 -6.569 1026 2HB PRO 135 2HB PRO 135 7.649 -14.585 -7.631 1027 1HG PRO 135 1HG PRO 135 10.486 -13.894 -7.243 1028 2HG PRO 135 2HG PRO 135 9.424 -13.569 -8.619 1029 1HD PRO 135 1HD PRO 135 10.208 -11.737 -6.575 1030 2HD PRO 135 2HD PRO 135 9.034 -11.456 -7.878 1031 H TYR 136 H TYR 136 6.895 -13.890 -3.392 1032 HA TYR 136 HA TYR 136 9.420 -13.905 -1.949 1033 1HB TYR 136 1HB TYR 136 6.910 -14.858 -0.642 1034 2HB TYR 136 2HB TYR 136 8.189 -13.843 0.012 1035 HD1 TYR 136 HD1 TYR 136 8.338 -11.744 -2.182 1036 HD2 TYR 136 HD2 TYR 136 4.981 -13.579 -0.220 1037 HE1 TYR 136 HE1 TYR 136 6.950 -9.746 -2.656 1038 HE2 TYR 136 HE2 TYR 136 3.599 -11.590 -0.720 1039 HH TYR 136 HH TYR 136 3.953 -9.579 -2.813 1040 H SER 137 H SER 137 6.832 -16.300 -2.120 1041 HA SER 137 HA SER 137 8.832 -18.457 -2.425 1042 1HB SER 137 1HB SER 137 8.175 -17.833 0.111 1043 2HB SER 137 2HB SER 137 6.835 -18.914 -0.261 1044 HG SER 137 HG SER 137 9.559 -19.422 -0.037 1045 H LYS 138 H LYS 138 7.067 -20.600 -1.860 1046 HA LYS 138 HA LYS 138 4.770 -20.155 -3.710 1047 1HB LYS 138 1HB LYS 138 6.967 -22.201 -3.929 1048 2HB LYS 138 2HB LYS 138 5.361 -22.540 -4.578 1049 1HG LYS 138 1HG LYS 138 5.754 -20.048 -5.578 1050 2HG LYS 138 2HG LYS 138 7.420 -20.623 -5.526 1051 1HD LYS 138 1HD LYS 138 6.379 -22.796 -6.608 1052 2HD LYS 138 2HD LYS 138 5.100 -21.684 -7.099 1053 1HE LYS 138 1HE LYS 138 8.019 -21.077 -7.585 1054 2HE LYS 138 2HE LYS 138 7.044 -21.978 -8.747 1055 1HZ LYS 138 1HZ LYS 138 5.423 -20.041 -8.534 1056 2HZ LYS 138 2HZ LYS 138 6.714 -19.190 -7.829 1057 3HZ LYS 138 3HZ LYS 138 6.846 -19.777 -9.418 1058 H ASP 139 H ASP 139 4.891 -20.392 -0.789 1059 HA ASP 139 HA ASP 139 3.235 -22.839 -0.494 1060 1HB ASP 139 1HB ASP 139 4.275 -22.710 1.978 1061 2HB ASP 139 2HB ASP 139 4.995 -23.683 0.703 1062 H SER 140 H SER 140 4.195 -20.356 1.805 1063 HA SER 140 HA SER 140 1.357 -19.916 2.482 1064 1HB SER 140 1HB SER 140 2.687 -18.315 4.184 1065 2HB SER 140 2HB SER 140 2.451 -20.029 4.490 1066 HG SER 140 HG SER 140 4.502 -20.396 4.040 1067 HA PRO 141 HA PRO 141 1.137 -15.982 0.410 1068 1HB PRO 141 1HB PRO 141 -0.779 -14.771 1.923 1069 2HB PRO 141 2HB PRO 141 -1.119 -16.087 0.791 1070 1HG PRO 141 1HG PRO 141 -1.062 -16.117 3.739 1071 2HG PRO 141 2HG PRO 141 -1.945 -17.158 2.616 1072 1HD PRO 141 1HD PRO 141 0.438 -17.811 4.004 1073 2HD PRO 141 2HD PRO 141 -0.320 -18.746 2.698 1074 H PHE 142 H PHE 142 1.073 -13.518 0.987 1075 HA PHE 142 HA PHE 142 2.134 -12.579 3.484 1076 1HB PHE 142 1HB PHE 142 4.049 -13.611 1.541 1077 2HB PHE 142 2HB PHE 142 4.333 -11.902 1.857 1078 HD1 PHE 142 HD1 PHE 142 4.368 -11.162 4.358 1079 HD2 PHE 142 HD2 PHE 142 4.826 -15.227 3.050 1080 HE1 PHE 142 HE1 PHE 142 5.425 -11.742 6.525 1081 HE2 PHE 142 HE2 PHE 142 5.884 -15.807 5.216 1082 HZ PHE 142 HZ PHE 142 6.184 -14.063 6.955 1083 H GLY 143 H GLY 143 3.459 -10.264 2.588 1084 1HA GLY 143 1HA GLY 143 2.640 -8.887 0.368 1085 2HA GLY 143 2HA GLY 143 1.208 -8.819 1.391 1086 H LEU 144 H LEU 144 1.099 -7.174 2.811 1087 HA LEU 144 HA LEU 144 3.634 -5.707 3.437 1088 1HB LEU 144 1HB LEU 144 0.960 -4.790 2.575 1089 2HB LEU 144 2HB LEU 144 1.651 -3.872 3.908 1090 HG LEU 144 HG LEU 144 3.735 -3.572 2.581 1091 1HD1 LEU 144 1HD1 LEU 144 2.155 -5.246 0.660 1092 2HD1 LEU 144 2HD1 LEU 144 3.256 -4.028 0.016 1093 3HD1 LEU 144 3HD1 LEU 144 3.872 -5.317 1.050 1094 1HD2 LEU 144 1HD2 LEU 144 1.080 -2.651 1.476 1095 2HD2 LEU 144 2HD2 LEU 144 2.234 -1.744 2.453 1096 3HD2 LEU 144 3HD2 LEU 144 2.601 -2.112 0.768 1097 H SER 145 H SER 145 3.889 -4.894 5.549 1098 HA SER 145 HA SER 145 2.504 -6.436 7.630 1099 1HB SER 145 1HB SER 145 4.658 -4.313 7.831 1100 2HB SER 145 2HB SER 145 4.090 -5.318 9.161 1101 HG SER 145 HG SER 145 5.225 -6.926 8.408 1102 H PHE 146 H PHE 146 2.433 -3.215 6.266 1103 HA PHE 146 HA PHE 146 -0.069 -2.537 7.471 1104 1HB PHE 146 1HB PHE 146 0.700 -0.788 9.059 1105 2HB PHE 146 2HB PHE 146 1.294 -2.379 9.546 1106 HD1 PHE 146 HD1 PHE 146 2.194 0.857 8.041 1107 HD2 PHE 146 HD2 PHE 146 3.641 -2.971 9.328 1108 HE1 PHE 146 HE1 PHE 146 4.516 1.665 7.786 1109 HE2 PHE 146 HE2 PHE 146 5.966 -2.184 9.062 1110 HZ PHE 146 HZ PHE 146 6.423 0.132 8.274 1111 H VAL 147 H VAL 147 -0.615 -0.204 6.997 1112 HA VAL 147 HA VAL 147 1.197 1.077 5.024 1113 HB VAL 147 HB VAL 147 -0.638 1.450 3.439 1114 1HG1 VAL 147 1HG1 VAL 147 0.801 -0.726 3.544 1115 2HG1 VAL 147 2HG1 VAL 147 -0.702 -1.493 4.058 1116 3HG1 VAL 147 3HG1 VAL 147 -0.612 -0.692 2.490 1117 1HG2 VAL 147 1HG2 VAL 147 -2.219 0.338 5.678 1118 2HG2 VAL 147 2HG2 VAL 147 -2.712 1.442 4.396 1119 3HG2 VAL 147 3HG2 VAL 147 -2.661 -0.294 4.091 1120 H ARG 148 H ARG 148 1.161 3.301 5.171 1121 HA ARG 148 HA ARG 148 -1.016 4.629 6.664 1122 1HB ARG 148 1HB ARG 148 1.389 5.780 7.695 1123 2HB ARG 148 2HB ARG 148 0.145 4.915 8.579 1124 1HG ARG 148 1HG ARG 148 1.350 2.762 7.854 1125 2HG ARG 148 2HG ARG 148 2.687 3.803 7.391 1126 1HD ARG 148 1HD ARG 148 1.447 3.573 10.145 1127 2HD ARG 148 2HD ARG 148 3.054 3.028 9.666 1128 HE ARG 148 HE ARG 148 2.760 5.838 9.124 1129 1HH1 ARG 148 1HH1 ARG 148 3.207 3.556 11.737 1130 2HH1 ARG 148 2HH1 ARG 148 4.012 4.711 12.740 1131 1HH2 ARG 148 1HH2 ARG 148 3.805 7.299 10.456 1132 2HH2 ARG 148 2HH2 ARG 148 4.347 6.807 12.026 1133 H PHE 149 H PHE 149 -1.143 6.878 6.233 1134 HA PHE 149 HA PHE 149 0.706 7.914 4.122 1135 1HB PHE 149 1HB PHE 149 -2.302 8.262 4.276 1136 2HB PHE 149 2HB PHE 149 -1.256 9.088 3.126 1137 HD1 PHE 149 HD1 PHE 149 0.468 7.362 1.906 1138 HD2 PHE 149 HD2 PHE 149 -3.394 6.375 3.497 1139 HE1 PHE 149 HE1 PHE 149 0.350 5.396 0.399 1140 HE2 PHE 149 HE2 PHE 149 -3.513 4.411 1.987 1141 HZ PHE 149 HZ PHE 149 -1.642 3.921 0.441 1142 H HIS 150 H HIS 150 0.800 10.343 4.110 1143 HA HIS 150 HA HIS 150 -0.283 11.723 6.471 1144 1HB HIS 150 1HB HIS 150 2.521 12.381 6.502 1145 2HB HIS 150 2HB HIS 150 1.528 11.731 7.799 1146 HD1 HIS 150 HD1 HIS 150 1.478 9.111 8.061 1147 HD2 HIS 150 HD2 HIS 150 4.208 10.503 5.242 1148 HE1 HIS 150 HE1 HIS 150 3.028 7.177 7.551 1149 H SER 151 H SER 151 -0.939 13.633 5.721 1150 HA SER 151 HA SER 151 0.051 14.672 3.172 1151 1HB SER 151 1HB SER 151 -2.365 14.828 4.512 1152 2HB SER 151 2HB SER 151 -1.700 16.444 4.725 1153 HG SER 151 HG SER 151 -2.335 16.745 2.749 Start of MODEL 17 1 H MET 1 H MET 1 0.065 17.388 15.640 2 HA MET 1 HA MET 1 0.366 18.051 13.429 3 1HB MET 1 1HB MET 1 1.775 16.200 12.493 4 2HB MET 1 2HB MET 1 2.131 16.553 14.184 5 1HG MET 1 1HG MET 1 0.486 14.701 14.785 6 2HG MET 1 2HG MET 1 0.499 14.258 13.079 7 1HE MET 1 1HE MET 1 1.183 12.662 15.683 8 2HE MET 1 2HE MET 1 1.355 11.756 14.182 9 3HE MET 1 3HE MET 1 2.662 11.755 15.374 10 HA PRO 2 HA PRO 2 -2.581 16.577 10.432 11 1HB PRO 2 1HB PRO 2 -1.345 17.400 8.143 12 2HB PRO 2 2HB PRO 2 -2.097 18.515 9.293 13 1HG PRO 2 1HG PRO 2 0.748 18.064 8.725 14 2HG PRO 2 2HG PRO 2 -0.041 19.450 9.488 15 1HD PRO 2 1HD PRO 2 1.386 17.308 10.776 16 2HD PRO 2 2HD PRO 2 0.573 18.691 11.539 17 H GLU 3 H GLU 3 -2.880 14.461 9.852 18 HA GLU 3 HA GLU 3 -0.745 13.100 8.278 19 1HB GLU 3 1HB GLU 3 -1.178 11.015 9.606 20 2HB GLU 3 2HB GLU 3 -0.445 12.307 10.558 21 1HG GLU 3 1HG GLU 3 -2.394 12.730 11.742 22 2HG GLU 3 2HG GLU 3 -3.433 12.131 10.447 23 H ILE 4 H ILE 4 -1.776 10.847 7.536 24 HA ILE 4 HA ILE 4 -4.641 11.263 6.821 25 HB ILE 4 HB ILE 4 -2.461 10.432 4.878 26 1HG1 ILE 4 1HG1 ILE 4 -4.082 12.994 5.034 27 2HG1 ILE 4 2HG1 ILE 4 -2.396 12.840 5.526 28 1HG2 ILE 4 1HG2 ILE 4 -5.034 9.663 4.740 29 2HG2 ILE 4 2HG2 ILE 4 -5.196 11.269 4.030 30 3HG2 ILE 4 3HG2 ILE 4 -4.108 10.091 3.302 31 1HD1 ILE 4 1HD1 ILE 4 -2.272 11.776 3.027 32 2HD1 ILE 4 2HD1 ILE 4 -3.568 12.953 2.809 33 3HD1 ILE 4 3HD1 ILE 4 -1.982 13.480 3.375 34 H ARG 5 H ARG 5 -5.806 9.450 7.188 35 HA ARG 5 HA ARG 5 -4.330 6.854 7.423 36 1HB ARG 5 1HB ARG 5 -6.491 8.084 9.105 37 2HB ARG 5 2HB ARG 5 -6.412 6.327 8.965 38 1HG ARG 5 1HG ARG 5 -4.017 6.417 9.659 39 2HG ARG 5 2HG ARG 5 -4.180 8.156 9.898 40 1HD ARG 5 1HD ARG 5 -5.553 7.913 11.755 41 2HD ARG 5 2HD ARG 5 -6.141 6.331 11.241 42 HE ARG 5 HE ARG 5 -3.302 6.299 11.865 43 1HH1 ARG 5 1HH1 ARG 5 -6.521 6.143 13.226 44 2HH1 ARG 5 2HH1 ARG 5 -5.996 5.275 14.626 45 1HH2 ARG 5 1HH2 ARG 5 -2.667 5.176 13.692 46 2HH2 ARG 5 2HH2 ARG 5 -3.838 4.732 14.890 47 H LEU 6 H LEU 6 -6.273 5.037 7.407 48 HA LEU 6 HA LEU 6 -7.750 5.567 4.865 49 1HB LEU 6 1HB LEU 6 -6.500 3.078 6.017 50 2HB LEU 6 2HB LEU 6 -7.803 2.952 4.838 51 HG LEU 6 HG LEU 6 -5.561 2.868 3.769 52 1HD1 LEU 6 1HD1 LEU 6 -7.564 3.833 2.601 53 2HD1 LEU 6 2HD1 LEU 6 -7.016 5.435 3.088 54 3HD1 LEU 6 3HD1 LEU 6 -6.025 4.455 2.014 55 1HD2 LEU 6 1HD2 LEU 6 -4.710 4.602 5.591 56 2HD2 LEU 6 2HD2 LEU 6 -3.979 4.549 3.987 57 3HD2 LEU 6 3HD2 LEU 6 -5.184 5.779 4.367 58 H ARG 7 H ARG 7 -9.855 4.499 4.677 59 HA ARG 7 HA ARG 7 -11.255 4.394 7.315 60 1HB ARG 7 1HB ARG 7 -12.019 6.133 5.679 61 2HB ARG 7 2HB ARG 7 -12.444 4.837 4.562 62 1HG ARG 7 1HG ARG 7 -13.939 3.882 6.343 63 2HG ARG 7 2HG ARG 7 -13.614 5.319 7.314 64 1HD ARG 7 1HD ARG 7 -14.310 6.498 4.980 65 2HD ARG 7 2HD ARG 7 -15.273 5.025 4.869 66 HE ARG 7 HE ARG 7 -15.758 7.235 6.676 67 1HH1 ARG 7 1HH1 ARG 7 -16.006 3.764 6.334 68 2HH1 ARG 7 2HH1 ARG 7 -17.301 3.644 7.475 69 1HH2 ARG 7 1HH2 ARG 7 -17.433 7.034 8.145 70 2HH2 ARG 7 2HH2 ARG 7 -18.101 5.473 8.489 71 H HIS 8 H HIS 8 -11.179 2.868 4.112 72 HA HIS 8 HA HIS 8 -11.506 0.219 5.286 73 1HB HIS 8 1HB HIS 8 -13.591 -0.294 3.998 74 2HB HIS 8 2HB HIS 8 -13.848 0.900 5.269 75 HD1 HIS 8 HD1 HIS 8 -15.228 2.807 4.477 76 HD2 HIS 8 HD2 HIS 8 -12.857 1.274 1.411 77 HE1 HIS 8 HE1 HIS 8 -15.732 4.196 2.421 78 H VAL 9 H VAL 9 -11.368 -1.470 3.551 79 HA VAL 9 HA VAL 9 -9.499 -0.613 1.471 80 HB VAL 9 HB VAL 9 -9.158 -2.761 2.624 81 1HG1 VAL 9 1HG1 VAL 9 -11.917 -3.016 2.432 82 2HG1 VAL 9 2HG1 VAL 9 -11.320 -4.216 1.287 83 3HG1 VAL 9 3HG1 VAL 9 -10.800 -4.268 2.971 84 1HG2 VAL 9 1HG2 VAL 9 -9.904 -3.057 -0.303 85 2HG2 VAL 9 2HG2 VAL 9 -8.328 -2.585 0.332 86 3HG2 VAL 9 3HG2 VAL 9 -8.937 -4.217 0.610 87 H VAL 10 H VAL 10 -10.869 0.785 0.205 88 HA VAL 10 HA VAL 10 -13.397 0.187 -0.852 89 HB VAL 10 HB VAL 10 -12.565 2.398 -1.193 90 1HG1 VAL 10 1HG1 VAL 10 -10.089 1.259 -1.524 91 2HG1 VAL 10 2HG1 VAL 10 -10.464 1.769 -3.164 92 3HG1 VAL 10 3HG1 VAL 10 -10.467 2.946 -1.852 93 1HG2 VAL 10 1HG2 VAL 10 -13.889 1.237 -3.114 94 2HG2 VAL 10 2HG2 VAL 10 -13.096 2.773 -3.463 95 3HG2 VAL 10 3HG2 VAL 10 -12.353 1.258 -3.979 96 H SER 11 H SER 11 -10.259 -0.458 -2.513 97 HA SER 11 HA SER 11 -11.709 -2.619 -3.970 98 1HB SER 11 1HB SER 11 -10.341 -0.358 -5.051 99 2HB SER 11 2HB SER 11 -9.411 -1.793 -5.467 100 HG SER 11 HG SER 11 -12.140 -1.233 -5.980 101 H CYS 12 H CYS 12 -10.335 -4.523 -4.462 102 HA CYS 12 HA CYS 12 -7.699 -4.630 -3.146 103 1HB CYS 12 1HB CYS 12 -8.356 -6.645 -1.795 104 2HB CYS 12 2HB CYS 12 -9.130 -5.154 -1.266 105 HG CYS 12 HG CYS 12 -11.361 -6.020 -2.002 106 H SER 13 H SER 13 -6.467 -5.551 -4.680 107 HA SER 13 HA SER 13 -7.662 -7.686 -6.385 108 1HB SER 13 1HB SER 13 -5.779 -5.503 -6.876 109 2HB SER 13 2HB SER 13 -5.173 -7.048 -7.462 110 HG SER 13 HG SER 13 -7.136 -7.304 -8.585 111 H SER 14 H SER 14 -7.071 -8.445 -3.858 112 HA SER 14 HA SER 14 -5.822 -10.802 -3.804 113 1HB SER 14 1HB SER 14 -3.715 -10.195 -4.630 114 2HB SER 14 2HB SER 14 -3.704 -8.670 -3.758 115 HG SER 14 HG SER 14 -3.299 -9.764 -1.876 116 H GLN 15 H GLN 15 -6.823 -11.350 -1.889 117 HA GLN 15 HA GLN 15 -5.910 -10.106 0.569 118 1HB GLN 15 1HB GLN 15 -8.000 -9.139 1.272 119 2HB GLN 15 2HB GLN 15 -7.670 -8.523 -0.337 120 1HG GLN 15 1HG GLN 15 -9.843 -9.156 -0.685 121 2HG GLN 15 2HG GLN 15 -9.079 -10.707 -1.021 122 1HE2 GLN 15 2HE2 GLN 15 -8.521 -10.698 2.188 123 2HE2 GLN 15 1HE2 GLN 15 -9.992 -11.309 2.751 124 H ASP 16 H ASP 16 -5.866 -11.688 2.092 125 HA ASP 16 HA ASP 16 -7.252 -14.238 1.559 126 1HB ASP 16 1HB ASP 16 -4.870 -13.484 2.901 127 2HB ASP 16 2HB ASP 16 -5.940 -14.127 4.142 128 H SER 17 H SER 17 -8.810 -15.146 3.014 129 HA SER 17 HA SER 17 -10.709 -13.309 4.090 130 1HB SER 17 1HB SER 17 -10.432 -16.177 4.999 131 2HB SER 17 2HB SER 17 -11.901 -15.214 4.860 132 HG SER 17 HG SER 17 -11.537 -15.186 2.586 133 H THR 18 H THR 18 -8.463 -15.500 5.851 134 HA THR 18 HA THR 18 -9.028 -14.428 8.441 135 HB THR 18 HB THR 18 -6.461 -15.299 8.691 136 HG1 THR 18 HG1 THR 18 -6.340 -17.098 7.215 137 1HG2 THR 18 1HG2 THR 18 -8.494 -16.167 9.834 138 2HG2 THR 18 2HG2 THR 18 -8.879 -17.095 8.384 139 3HG2 THR 18 3HG2 THR 18 -7.417 -17.459 9.302 140 H HIS 19 H HIS 19 -6.147 -13.885 6.389 141 HA HIS 19 HA HIS 19 -5.756 -11.264 7.763 142 1HB HIS 19 1HB HIS 19 -3.889 -12.923 6.036 143 2HB HIS 19 2HB HIS 19 -3.482 -11.348 6.717 144 HD1 HIS 19 HD1 HIS 19 -2.637 -11.315 9.086 145 HD2 HIS 19 HD2 HIS 19 -4.444 -14.946 8.123 146 HE1 HIS 19 HE1 HIS 19 -2.240 -12.856 11.056 147 H CYS 20 H CYS 20 -7.452 -10.219 6.538 148 HA CYS 20 HA CYS 20 -7.107 -10.097 3.606 149 1HB CYS 20 1HB CYS 20 -9.253 -8.856 3.639 150 2HB CYS 20 2HB CYS 20 -9.381 -10.407 4.460 151 HG CYS 20 HG CYS 20 -8.755 -8.583 6.633 152 H ALA 21 H ALA 21 -7.202 -7.941 2.561 153 HA ALA 21 HA ALA 21 -5.133 -6.224 3.474 154 1HB ALA 21 1HB ALA 21 -7.015 -6.369 1.243 155 2HB ALA 21 2HB ALA 21 -6.678 -4.706 1.725 156 3HB ALA 21 3HB ALA 21 -5.353 -5.778 1.269 157 H GLU 22 H GLU 22 -8.531 -6.323 4.234 158 HA GLU 22 HA GLU 22 -8.906 -3.596 4.999 159 1HB GLU 22 1HB GLU 22 -10.539 -5.762 4.864 160 2HB GLU 22 2HB GLU 22 -10.288 -5.672 6.608 161 1HG GLU 22 1HG GLU 22 -10.871 -3.206 6.460 162 2HG GLU 22 2HG GLU 22 -11.361 -3.498 4.791 163 H ASN 23 H ASN 23 -7.118 -6.183 6.495 164 HA ASN 23 HA ASN 23 -7.206 -5.250 9.213 165 1HB ASN 23 1HB ASN 23 -5.253 -6.928 7.655 166 2HB ASN 23 2HB ASN 23 -4.967 -6.510 9.342 167 1HD2 ASN 23 2HD2 ASN 23 -6.157 -8.986 7.535 168 2HD2 ASN 23 1HD2 ASN 23 -7.324 -9.603 8.602 169 H LEU 24 H LEU 24 -5.650 -4.069 6.389 170 HA LEU 24 HA LEU 24 -3.423 -2.714 7.570 171 1HB LEU 24 1HB LEU 24 -4.984 -1.961 5.078 172 2HB LEU 24 2HB LEU 24 -3.331 -1.485 5.469 173 HG LEU 24 HG LEU 24 -4.095 -4.399 5.306 174 1HD1 LEU 24 1HD1 LEU 24 -3.873 -2.459 3.104 175 2HD1 LEU 24 2HD1 LEU 24 -2.856 -3.887 2.916 176 3HD1 LEU 24 3HD1 LEU 24 -4.596 -4.067 3.125 177 1HD2 LEU 24 1HD2 LEU 24 -1.656 -2.788 5.618 178 2HD2 LEU 24 2HD2 LEU 24 -1.955 -4.474 6.038 179 3HD2 LEU 24 3HD2 LEU 24 -1.519 -4.041 4.386 180 H LEU 25 H LEU 25 -6.853 -2.035 7.346 181 HA LEU 25 HA LEU 25 -6.781 0.773 7.828 182 1HB LEU 25 1HB LEU 25 -8.775 -1.436 8.214 183 2HB LEU 25 2HB LEU 25 -9.099 0.132 8.928 184 HG LEU 25 HG LEU 25 -10.102 -0.137 6.656 185 1HD1 LEU 25 1HD1 LEU 25 -9.555 2.101 7.504 186 2HD1 LEU 25 2HD1 LEU 25 -7.924 1.960 6.855 187 3HD1 LEU 25 3HD1 LEU 25 -9.302 2.014 5.762 188 1HD2 LEU 25 1HD2 LEU 25 -8.110 -1.535 5.828 189 2HD2 LEU 25 2HD2 LEU 25 -8.756 -0.338 4.706 190 3HD2 LEU 25 3HD2 LEU 25 -7.273 0.001 5.598 191 H LYS 26 H LYS 26 -6.022 -1.936 9.848 192 HA LYS 26 HA LYS 26 -6.175 -0.174 12.262 193 1HB LYS 26 1HB LYS 26 -5.876 -3.173 12.408 194 2HB LYS 26 2HB LYS 26 -6.511 -2.065 13.620 195 1HG LYS 26 1HG LYS 26 -7.873 -2.715 10.992 196 2HG LYS 26 2HG LYS 26 -8.308 -3.407 12.556 197 1HD LYS 26 1HD LYS 26 -8.207 -0.418 12.177 198 2HD LYS 26 2HD LYS 26 -9.641 -1.335 11.714 199 1HE LYS 26 1HE LYS 26 -8.447 -1.808 14.421 200 2HE LYS 26 2HE LYS 26 -9.414 -0.356 14.164 201 1HZ LYS 26 1HZ LYS 26 -11.130 -1.899 13.175 202 2HZ LYS 26 2HZ LYS 26 -10.236 -3.182 13.840 203 3HZ LYS 26 3HZ LYS 26 -10.909 -2.002 14.857 204 H ALA 27 H ALA 27 -4.093 0.588 11.086 205 HA ALA 27 HA ALA 27 -1.724 -0.866 10.838 206 1HB ALA 27 1HB ALA 27 -2.070 1.971 11.850 207 2HB ALA 27 2HB ALA 27 -0.541 1.280 11.303 208 3HB ALA 27 3HB ALA 27 -1.880 1.471 10.170 209 H ASP 28 H ASP 28 -3.301 0.149 13.803 210 HA ASP 28 HA ASP 28 -0.939 -0.697 15.406 211 1HB ASP 28 1HB ASP 28 -2.074 1.477 15.940 212 2HB ASP 28 2HB ASP 28 -3.531 0.569 16.348 213 H THR 29 H THR 29 -1.570 -2.948 14.503 214 HA THR 29 HA THR 29 -3.055 -4.369 16.596 215 HB THR 29 HB THR 29 -4.541 -5.522 14.962 216 HG1 THR 29 HG1 THR 29 -4.114 -5.293 12.940 217 1HG2 THR 29 1HG2 THR 29 -5.235 -3.424 16.192 218 2HG2 THR 29 2HG2 THR 29 -4.842 -2.527 14.724 219 3HG2 THR 29 3HG2 THR 29 -6.119 -3.744 14.699 220 H TYR 30 H TYR 30 -3.169 -6.852 15.177 221 HA TYR 30 HA TYR 30 -0.297 -7.263 14.484 222 1HB TYR 30 1HB TYR 30 -0.391 -9.404 15.707 223 2HB TYR 30 2HB TYR 30 -0.754 -8.034 16.762 224 HD1 TYR 30 HD1 TYR 30 -3.102 -7.548 17.433 225 HD2 TYR 30 HD2 TYR 30 -2.061 -11.068 15.201 226 HE1 TYR 30 HE1 TYR 30 -5.291 -8.561 18.009 227 HE2 TYR 30 HE2 TYR 30 -4.250 -12.081 15.779 228 HH TYR 30 HH TYR 30 -6.566 -11.200 16.434 229 H ARG 31 H ARG 31 -2.543 -6.848 12.702 230 HA ARG 31 HA ARG 31 -2.582 -9.514 11.345 231 1HB ARG 31 1HB ARG 31 -4.766 -7.413 11.496 232 2HB ARG 31 2HB ARG 31 -4.802 -8.785 10.386 233 1HG ARG 31 1HG ARG 31 -4.321 -10.159 12.611 234 2HG ARG 31 2HG ARG 31 -5.067 -8.752 13.368 235 1HD ARG 31 1HD ARG 31 -6.655 -9.477 11.095 236 2HD ARG 31 2HD ARG 31 -6.358 -10.931 12.048 237 HE ARG 31 HE ARG 31 -7.068 -9.005 13.925 238 1HH1 ARG 31 1HH1 ARG 31 -8.524 -10.342 11.039 239 2HH1 ARG 31 2HH1 ARG 31 -10.134 -10.090 11.613 240 1HH2 ARG 31 1HH2 ARG 31 -9.170 -8.698 14.629 241 2HH2 ARG 31 2HH2 ARG 31 -10.499 -9.171 13.623 242 H LYS 32 H LYS 32 -1.066 -9.225 9.761 243 HA LYS 32 HA LYS 32 -0.858 -6.631 8.359 244 1HB LYS 32 1HB LYS 32 0.733 -9.200 8.154 245 2HB LYS 32 2HB LYS 32 1.087 -7.744 7.236 246 1HG LYS 32 1HG LYS 32 1.428 -6.487 9.316 247 2HG LYS 32 2HG LYS 32 0.992 -7.909 10.263 248 1HD LYS 32 1HD LYS 32 2.920 -9.052 8.871 249 2HD LYS 32 2HD LYS 32 3.472 -7.392 8.660 250 1HE LYS 32 1HE LYS 32 4.000 -7.137 10.880 251 2HE LYS 32 2HE LYS 32 2.696 -8.195 11.417 252 1HZ LYS 32 1HZ LYS 32 4.033 -10.061 10.415 253 2HZ LYS 32 2HZ LYS 32 5.325 -8.967 10.297 254 3HZ LYS 32 3HZ LYS 32 4.679 -9.357 11.819 255 H TRP 33 H TRP 33 -0.805 -6.643 5.929 256 HA TRP 33 HA TRP 33 -3.138 -7.953 4.850 257 1HB TRP 33 1HB TRP 33 -2.293 -5.807 3.905 258 2HB TRP 33 2HB TRP 33 -0.834 -6.619 3.401 259 HD1 TRP 33 HD1 TRP 33 -4.337 -8.129 3.000 260 HE1 TRP 33 HE1 TRP 33 -4.795 -8.454 0.463 261 HE3 TRP 33 HE3 TRP 33 -0.213 -5.883 1.134 262 HZ2 TRP 33 HZ2 TRP 33 -3.511 -7.793 -2.032 263 HZ3 TRP 33 HZ3 TRP 33 0.182 -5.753 -1.325 264 HH2 TRP 33 HH2 TRP 33 -1.471 -6.697 -2.898 265 H ARG 34 H ARG 34 -3.274 -9.801 3.649 266 HA ARG 34 HA ARG 34 -0.796 -11.169 2.809 267 1HB ARG 34 1HB ARG 34 -2.294 -11.952 5.124 268 2HB ARG 34 2HB ARG 34 -2.580 -13.165 3.884 269 1HG ARG 34 1HG ARG 34 -0.585 -14.065 4.420 270 2HG ARG 34 2HG ARG 34 0.175 -12.636 3.727 271 1HD ARG 34 1HD ARG 34 0.745 -11.823 5.765 272 2HD ARG 34 2HD ARG 34 -0.840 -12.188 6.448 273 HE ARG 34 HE ARG 34 0.749 -14.583 6.034 274 1HH1 ARG 34 1HH1 ARG 34 0.173 -11.888 8.187 275 2HH1 ARG 34 2HH1 ARG 34 0.747 -12.744 9.575 276 1HH2 ARG 34 1HH2 ARG 34 1.482 -15.653 7.857 277 2HH2 ARG 34 2HH2 ARG 34 1.481 -14.852 9.393 278 H ALA 35 H ALA 35 -1.131 -11.886 0.757 279 HA ALA 35 HA ALA 35 -3.523 -11.390 -0.667 280 1HB ALA 35 1HB ALA 35 -1.091 -11.973 -1.497 281 2HB ALA 35 2HB ALA 35 -1.679 -13.636 -1.475 282 3HB ALA 35 3HB ALA 35 -2.473 -12.434 -2.493 283 H ALA 36 H ALA 36 -4.909 -13.015 -1.737 284 HA ALA 36 HA ALA 36 -5.938 -14.907 0.251 285 1HB ALA 36 1HB ALA 36 -7.091 -13.308 -1.677 286 2HB ALA 36 2HB ALA 36 -7.170 -14.906 -2.416 287 3HB ALA 36 3HB ALA 36 -7.907 -14.627 -0.838 288 H LYS 37 H LYS 37 -4.197 -14.973 -2.787 289 HA LYS 37 HA LYS 37 -4.382 -17.926 -2.924 290 1HB LYS 37 1HB LYS 37 -4.483 -16.120 -4.915 291 2HB LYS 37 2HB LYS 37 -2.735 -16.341 -4.850 292 1HG LYS 37 1HG LYS 37 -3.161 -18.101 -6.233 293 2HG LYS 37 2HG LYS 37 -3.554 -18.930 -4.727 294 1HD LYS 37 1HD LYS 37 -5.814 -18.875 -5.124 295 2HD LYS 37 2HD LYS 37 -5.734 -17.325 -5.962 296 1HE LYS 37 1HE LYS 37 -4.581 -19.841 -7.170 297 2HE LYS 37 2HE LYS 37 -6.271 -19.392 -7.398 298 1HZ LYS 37 1HZ LYS 37 -4.050 -17.521 -7.969 299 2HZ LYS 37 2HZ LYS 37 -4.642 -18.599 -9.137 300 3HZ LYS 37 3HZ LYS 37 -5.668 -17.418 -8.474 301 H ALA 38 H ALA 38 -1.745 -18.245 -4.113 302 HA ALA 38 HA ALA 38 0.076 -17.434 -1.909 303 1HB ALA 38 1HB ALA 38 -0.738 -20.180 -2.670 304 2HB ALA 38 2HB ALA 38 0.993 -19.938 -2.437 305 3HB ALA 38 3HB ALA 38 -0.133 -19.569 -1.131 306 H GLY 39 H GLY 39 2.420 -18.044 -2.619 307 1HA GLY 39 1HA GLY 39 4.049 -18.261 -4.392 308 2HA GLY 39 2HA GLY 39 2.781 -17.911 -5.566 309 H GLU 40 H GLU 40 1.851 -15.637 -3.812 310 HA GLU 40 HA GLU 40 2.055 -13.326 -3.905 311 1HB GLU 40 1HB GLU 40 4.887 -13.958 -3.094 312 2HB GLU 40 2HB GLU 40 3.945 -12.520 -2.704 313 1HG GLU 40 1HG GLU 40 3.091 -13.523 -0.896 314 2HG GLU 40 2HG GLU 40 2.446 -14.827 -1.877 315 H LYS 41 H LYS 41 2.227 -14.151 -6.447 316 HA LYS 41 HA LYS 41 4.648 -13.370 -7.826 317 1HB LYS 41 1HB LYS 41 2.587 -14.755 -8.693 318 2HB LYS 41 2HB LYS 41 1.916 -13.171 -9.081 319 1HG LYS 41 1HG LYS 41 3.441 -12.778 -10.747 320 2HG LYS 41 2HG LYS 41 4.730 -13.650 -9.914 321 1HD LYS 41 1HD LYS 41 4.111 -14.934 -11.868 322 2HD LYS 41 2HD LYS 41 3.522 -15.795 -10.446 323 1HE LYS 41 1HE LYS 41 1.317 -14.487 -10.821 324 2HE LYS 41 2HE LYS 41 1.950 -14.160 -12.434 325 1HZ LYS 41 1HZ LYS 41 1.841 -16.899 -11.324 326 2HZ LYS 41 2HZ LYS 41 0.523 -16.216 -12.149 327 3HZ LYS 41 3HZ LYS 41 2.009 -16.425 -12.943 328 H THR 42 H THR 42 1.478 -11.770 -7.569 329 HA THR 42 HA THR 42 2.687 -9.172 -7.020 330 HB THR 42 HB THR 42 1.469 -8.147 -9.062 331 HG1 THR 42 HG1 THR 42 0.464 -9.562 -10.214 332 1HG2 THR 42 1HG2 THR 42 4.046 -8.797 -8.681 333 2HG2 THR 42 2HG2 THR 42 3.703 -9.840 -10.061 334 3HG2 THR 42 3HG2 THR 42 3.465 -8.097 -10.191 335 H ILE 43 H ILE 43 1.182 -8.009 -5.813 336 HA ILE 43 HA ILE 43 -1.681 -8.844 -6.059 337 HB ILE 43 HB ILE 43 -1.813 -8.561 -3.527 338 1HG1 ILE 43 1HG1 ILE 43 1.185 -8.895 -3.787 339 2HG1 ILE 43 2HG1 ILE 43 0.353 -7.437 -3.243 340 1HG2 ILE 43 1HG2 ILE 43 -1.845 -10.727 -4.771 341 2HG2 ILE 43 2HG2 ILE 43 -0.102 -10.827 -4.535 342 3HG2 ILE 43 3HG2 ILE 43 -1.181 -10.847 -3.143 343 1HD1 ILE 43 1HD1 ILE 43 -0.779 -9.152 -1.540 344 2HD1 ILE 43 2HD1 ILE 43 0.714 -10.046 -1.826 345 3HD1 ILE 43 3HD1 ILE 43 0.778 -8.405 -1.185 346 H SER 44 H SER 44 -3.228 -7.228 -5.443 347 HA SER 44 HA SER 44 -2.038 -4.511 -5.063 348 1HB SER 44 1HB SER 44 -2.662 -4.156 -7.226 349 2HB SER 44 2HB SER 44 -3.802 -5.487 -7.223 350 HG SER 44 HG SER 44 -4.910 -3.531 -7.359 351 H VAL 45 H VAL 45 -3.320 -3.058 -3.865 352 HA VAL 45 HA VAL 45 -5.850 -4.014 -2.690 353 HB VAL 45 HB VAL 45 -4.151 -4.931 -1.157 354 1HG1 VAL 45 1HG1 VAL 45 -2.495 -3.011 -1.810 355 2HG1 VAL 45 2HG1 VAL 45 -3.268 -2.135 -0.492 356 3HG1 VAL 45 3HG1 VAL 45 -2.448 -3.663 -0.174 357 1HG2 VAL 45 1HG2 VAL 45 -5.554 -2.484 -0.037 358 2HG2 VAL 45 2HG2 VAL 45 -6.257 -4.094 -0.194 359 3HG2 VAL 45 3HG2 VAL 45 -4.916 -3.822 0.919 360 H VAL 46 H VAL 46 -7.059 -2.248 -3.307 361 HA VAL 46 HA VAL 46 -5.873 0.449 -3.099 362 HB VAL 46 HB VAL 46 -8.708 -0.116 -3.936 363 1HG1 VAL 46 1HG1 VAL 46 -7.921 2.215 -3.561 364 2HG1 VAL 46 2HG1 VAL 46 -6.675 1.962 -4.784 365 3HG1 VAL 46 3HG1 VAL 46 -8.379 1.918 -5.238 366 1HG2 VAL 46 1HG2 VAL 46 -6.183 -0.404 -5.593 367 2HG2 VAL 46 2HG2 VAL 46 -7.425 -1.627 -5.323 368 3HG2 VAL 46 3HG2 VAL 46 -7.785 -0.205 -6.303 369 H LEU 47 H LEU 47 -6.048 1.525 -1.241 370 HA LEU 47 HA LEU 47 -8.193 0.756 0.677 371 1HB LEU 47 1HB LEU 47 -5.905 2.630 1.270 372 2HB LEU 47 2HB LEU 47 -6.844 1.656 2.397 373 HG LEU 47 HG LEU 47 -5.783 -0.268 0.715 374 1HD1 LEU 47 1HD1 LEU 47 -4.388 1.779 -0.167 375 2HD1 LEU 47 2HD1 LEU 47 -3.464 1.548 1.317 376 3HD1 LEU 47 3HD1 LEU 47 -3.579 0.242 0.137 377 1HD2 LEU 47 1HD2 LEU 47 -4.973 0.870 3.380 378 2HD2 LEU 47 2HD2 LEU 47 -5.722 -0.685 3.018 379 3HD2 LEU 47 3HD2 LEU 47 -4.016 -0.423 2.658 380 H GLN 48 H GLN 48 -9.368 2.499 1.788 381 HA GLN 48 HA GLN 48 -9.791 4.836 -0.019 382 1HB GLN 48 1HB GLN 48 -11.670 3.148 0.773 383 2HB GLN 48 2HB GLN 48 -11.653 4.145 2.228 384 1HG GLN 48 1HG GLN 48 -11.780 5.448 -0.480 385 2HG GLN 48 2HG GLN 48 -13.247 4.804 0.258 386 1HE2 GLN 48 2HE2 GLN 48 -12.464 7.688 -0.199 387 2HE2 GLN 48 1HE2 GLN 48 -12.526 8.411 1.335 388 H LEU 49 H LEU 49 -9.284 6.855 0.707 389 HA LEU 49 HA LEU 49 -8.031 7.190 3.318 390 1HB LEU 49 1HB LEU 49 -8.565 8.989 0.947 391 2HB LEU 49 2HB LEU 49 -7.970 9.640 2.469 392 HG LEU 49 HG LEU 49 -6.105 9.181 0.935 393 1HD1 LEU 49 1HD1 LEU 49 -6.196 8.534 3.561 394 2HD1 LEU 49 2HD1 LEU 49 -5.777 6.964 2.878 395 3HD1 LEU 49 3HD1 LEU 49 -4.744 8.359 2.574 396 1HD2 LEU 49 1HD2 LEU 49 -7.481 7.193 -0.106 397 2HD2 LEU 49 2HD2 LEU 49 -5.720 7.114 -0.073 398 3HD2 LEU 49 3HD2 LEU 49 -6.664 6.236 1.130 399 H GLU 50 H GLU 50 -9.250 7.641 5.066 400 HA GLU 50 HA GLU 50 -12.039 8.042 5.107 401 1HB GLU 50 1HB GLU 50 -10.544 7.453 7.063 402 2HB GLU 50 2HB GLU 50 -10.130 9.164 7.165 403 1HG GLU 50 1HG GLU 50 -12.292 9.790 7.788 404 2HG GLU 50 2HG GLU 50 -13.019 8.341 7.091 405 H LYS 51 H LYS 51 -9.773 10.290 3.928 406 HA LYS 51 HA LYS 51 -11.828 12.361 3.830 407 1HB LYS 51 1HB LYS 51 -9.511 13.838 4.583 408 2HB LYS 51 2HB LYS 51 -11.039 13.736 5.434 409 1HG LYS 51 1HG LYS 51 -9.937 12.788 7.148 410 2HG LYS 51 2HG LYS 51 -9.638 11.378 6.157 411 1HD LYS 51 1HD LYS 51 -7.876 13.832 6.300 412 2HD LYS 51 2HD LYS 51 -7.538 12.280 7.063 413 1HE LYS 51 1HE LYS 51 -7.966 12.578 4.081 414 2HE LYS 51 2HE LYS 51 -6.373 12.671 4.833 415 1HZ LYS 51 1HZ LYS 51 -8.227 10.381 5.187 416 2HZ LYS 51 2HZ LYS 51 -6.997 10.424 4.017 417 3HZ LYS 51 3HZ LYS 51 -6.605 10.474 5.669 418 H GLU 52 H GLU 52 -11.367 13.896 2.150 419 HA GLU 52 HA GLU 52 -9.425 12.872 0.169 420 1HB GLU 52 1HB GLU 52 -11.860 13.528 -0.378 421 2HB GLU 52 2HB GLU 52 -11.302 15.188 -0.206 422 1HG GLU 52 1HG GLU 52 -9.586 14.817 -1.924 423 2HG GLU 52 2HG GLU 52 -10.117 13.146 -2.098 424 H GLU 53 H GLU 53 -7.430 13.676 0.394 425 HA GLU 53 HA GLU 53 -7.069 16.600 0.521 426 1HB GLU 53 1HB GLU 53 -5.052 15.552 2.263 427 2HB GLU 53 2HB GLU 53 -6.313 16.715 2.641 428 1HG GLU 53 1HG GLU 53 -7.838 14.622 2.957 429 2HG GLU 53 2HG GLU 53 -6.321 13.727 3.053 430 H GLN 54 H GLN 54 -4.479 16.909 0.528 431 HA GLN 54 HA GLN 54 -3.589 15.525 -1.906 432 1HB GLN 54 1HB GLN 54 -2.186 17.624 -0.218 433 2HB GLN 54 2HB GLN 54 -1.680 17.077 -1.815 434 1HG GLN 54 1HG GLN 54 -3.553 18.041 -2.873 435 2HG GLN 54 2HG GLN 54 -4.434 18.193 -1.362 436 1HE2 GLN 54 2HE2 GLN 54 -1.011 19.124 -1.806 437 2HE2 GLN 54 1HE2 GLN 54 -1.263 20.782 -1.545 438 H ILE 55 H ILE 55 -0.896 15.224 -1.588 439 HA ILE 55 HA ILE 55 -0.492 13.618 0.881 440 HB ILE 55 HB ILE 55 0.033 12.594 -1.931 441 1HG1 ILE 55 1HG1 ILE 55 -1.624 10.788 -0.744 442 2HG1 ILE 55 2HG1 ILE 55 -2.191 12.276 0.013 443 1HG2 ILE 55 1HG2 ILE 55 0.613 11.481 0.821 444 2HG2 ILE 55 2HG2 ILE 55 0.499 10.444 -0.601 445 3HG2 ILE 55 3HG2 ILE 55 1.734 11.701 -0.522 446 1HD1 ILE 55 1HD1 ILE 55 -2.002 13.113 -2.555 447 2HD1 ILE 55 2HD1 ILE 55 -2.364 11.408 -2.821 448 3HD1 ILE 55 3HD1 ILE 55 -3.470 12.408 -1.881 449 H HIS 56 H HIS 56 1.293 14.459 1.783 450 HA HIS 56 HA HIS 56 3.408 15.621 0.038 451 1HB HIS 56 1HB HIS 56 2.441 17.013 1.903 452 2HB HIS 56 2HB HIS 56 3.097 15.841 3.047 453 HD1 HIS 56 HD1 HIS 56 4.874 17.405 4.054 454 HD2 HIS 56 HD2 HIS 56 5.185 17.010 -0.082 455 HE1 HIS 56 HE1 HIS 56 7.084 18.457 3.399 456 H SER 57 H SER 57 2.773 13.149 2.455 457 HA SER 57 HA SER 57 5.318 11.825 1.723 458 1HB SER 57 1HB SER 57 4.630 12.850 4.466 459 2HB SER 57 2HB SER 57 5.591 11.385 4.298 460 HG SER 57 HG SER 57 6.146 13.914 3.124 461 H VAL 58 H VAL 58 5.247 9.552 2.243 462 HA VAL 58 HA VAL 58 2.571 8.534 3.080 463 HB VAL 58 HB VAL 58 4.156 7.805 0.602 464 1HG1 VAL 58 1HG1 VAL 58 1.866 6.398 1.962 465 2HG1 VAL 58 2HG1 VAL 58 2.070 6.294 0.214 466 3HG1 VAL 58 3HG1 VAL 58 3.342 5.712 1.286 467 1HG2 VAL 58 1HG2 VAL 58 1.615 9.267 1.184 468 2HG2 VAL 58 2HG2 VAL 58 2.868 9.624 -0.005 469 3HG2 VAL 58 3HG2 VAL 58 1.714 8.324 -0.303 470 H ASP 59 H ASP 59 2.669 6.225 3.749 471 HA ASP 59 HA ASP 59 5.399 5.247 4.432 472 1HB ASP 59 1HB ASP 59 4.245 6.497 6.374 473 2HB ASP 59 2HB ASP 59 3.125 5.138 6.406 474 H ILE 60 H ILE 60 5.584 3.035 4.289 475 HA ILE 60 HA ILE 60 3.242 1.287 4.355 476 HB ILE 60 HB ILE 60 4.622 1.967 1.759 477 1HG1 ILE 60 1HG1 ILE 60 1.996 1.309 1.251 478 2HG1 ILE 60 2HG1 ILE 60 1.898 1.956 2.888 479 1HG2 ILE 60 1HG2 ILE 60 3.738 -0.743 2.610 480 2HG2 ILE 60 2HG2 ILE 60 3.244 -0.222 0.999 481 3HG2 ILE 60 3HG2 ILE 60 4.955 -0.278 1.422 482 1HD1 ILE 60 1HD1 ILE 60 3.557 3.777 1.688 483 2HD1 ILE 60 2HD1 ILE 60 2.495 3.335 0.351 484 3HD1 ILE 60 3HD1 ILE 60 1.811 3.973 1.846 485 H GLY 61 H GLY 61 3.922 -0.660 5.174 486 1HA GLY 61 1HA GLY 61 6.864 -1.058 5.285 487 2HA GLY 61 2HA GLY 61 5.754 -1.722 6.464 488 H ASN 62 H ASN 62 7.712 -2.695 4.224 489 HA ASN 62 HA ASN 62 6.036 -4.416 2.570 490 1HB ASN 62 1HB ASN 62 8.244 -5.339 1.806 491 2HB ASN 62 2HB ASN 62 8.106 -3.591 1.629 492 1HD2 ASN 62 2HD2 ASN 62 9.512 -2.258 2.896 493 2HD2 ASN 62 1HD2 ASN 62 10.711 -2.893 3.917 494 H ASP 63 H ASP 63 5.259 -6.382 3.200 495 HA ASP 63 HA ASP 63 6.494 -7.706 5.571 496 1HB ASP 63 1HB ASP 63 3.957 -7.313 5.387 497 2HB ASP 63 2HB ASP 63 3.966 -8.539 4.119 498 H GLY 64 H GLY 64 8.343 -8.121 4.040 499 1HA GLY 64 1HA GLY 64 9.568 -9.838 2.951 500 2HA GLY 64 2HA GLY 64 8.083 -10.783 2.830 501 H SER 65 H SER 65 7.659 -7.548 1.819 502 HA SER 65 HA SER 65 7.336 -8.379 -0.980 503 1HB SER 65 1HB SER 65 5.617 -6.938 -0.149 504 2HB SER 65 2HB SER 65 6.780 -5.845 0.578 505 HG SER 65 HG SER 65 7.051 -4.897 -1.282 506 H ALA 66 H ALA 66 8.149 -6.728 -2.628 507 HA ALA 66 HA ALA 66 10.861 -5.731 -1.916 508 1HB ALA 66 1HB ALA 66 10.931 -7.976 -3.100 509 2HB ALA 66 2HB ALA 66 10.203 -7.176 -4.493 510 3HB ALA 66 3HB ALA 66 11.796 -6.678 -3.923 511 H PHE 67 H PHE 67 8.475 -5.871 -4.578 512 HA PHE 67 HA PHE 67 9.117 -3.012 -5.164 513 1HB PHE 67 1HB PHE 67 7.490 -4.933 -6.846 514 2HB PHE 67 2HB PHE 67 8.120 -3.372 -7.336 515 HD1 PHE 67 HD1 PHE 67 10.848 -3.321 -6.386 516 HD2 PHE 67 HD2 PHE 67 8.610 -6.593 -8.034 517 HE1 PHE 67 HE1 PHE 67 12.956 -4.400 -7.097 518 HE2 PHE 67 HE2 PHE 67 10.708 -7.679 -8.738 519 HZ PHE 67 HZ PHE 67 12.894 -6.587 -8.278 520 H VAL 68 H VAL 68 7.746 -1.506 -4.452 521 HA VAL 68 HA VAL 68 4.879 -2.281 -4.028 522 HB VAL 68 HB VAL 68 6.510 -0.402 -2.294 523 1HG1 VAL 68 1HG1 VAL 68 3.840 -0.286 -2.672 524 2HG1 VAL 68 2HG1 VAL 68 3.894 -1.559 -1.454 525 3HG1 VAL 68 3HG1 VAL 68 4.585 0.025 -1.105 526 1HG2 VAL 68 1HG2 VAL 68 5.789 -3.305 -2.120 527 2HG2 VAL 68 2HG2 VAL 68 7.299 -2.504 -1.688 528 3HG2 VAL 68 3HG2 VAL 68 5.893 -2.362 -0.633 529 H GLU 69 H GLU 69 3.730 -1.218 -5.518 530 HA GLU 69 HA GLU 69 4.577 1.527 -6.334 531 1HB GLU 69 1HB GLU 69 4.298 -0.176 -8.136 532 2HB GLU 69 2HB GLU 69 2.609 -0.360 -7.668 533 1HG GLU 69 1HG GLU 69 1.988 1.609 -8.635 534 2HG GLU 69 2HG GLU 69 3.471 2.431 -8.150 535 H VAL 70 H VAL 70 3.147 3.269 -6.102 536 HA VAL 70 HA VAL 70 0.517 2.653 -4.830 537 HB VAL 70 HB VAL 70 2.319 4.939 -4.012 538 1HG1 VAL 70 1HG1 VAL 70 -0.432 4.052 -3.354 539 2HG1 VAL 70 2HG1 VAL 70 0.563 4.547 -1.984 540 3HG1 VAL 70 3HG1 VAL 70 0.270 5.669 -3.313 541 1HG2 VAL 70 1HG2 VAL 70 1.896 2.180 -2.855 542 2HG2 VAL 70 2HG2 VAL 70 3.420 2.985 -3.227 543 3HG2 VAL 70 3HG2 VAL 70 2.451 3.525 -1.857 544 H LEU 71 H LEU 71 -1.142 3.638 -5.817 545 HA LEU 71 HA LEU 71 -0.570 5.922 -7.646 546 1HB LEU 71 1HB LEU 71 -2.066 3.431 -8.008 547 2HB LEU 71 2HB LEU 71 -3.046 4.848 -8.385 548 HG LEU 71 HG LEU 71 -1.186 5.672 -9.852 549 1HD1 LEU 71 1HD1 LEU 71 0.562 4.280 -8.627 550 2HD1 LEU 71 2HD1 LEU 71 -0.054 2.885 -9.511 551 3HD1 LEU 71 3HD1 LEU 71 0.660 4.239 -10.387 552 1HD2 LEU 71 1HD2 LEU 71 -2.707 3.143 -10.298 553 2HD2 LEU 71 2HD2 LEU 71 -2.789 4.671 -11.174 554 3HD2 LEU 71 3HD2 LEU 71 -1.460 3.553 -11.476 555 H VAL 72 H VAL 72 -2.392 7.480 -7.793 556 HA VAL 72 HA VAL 72 -3.953 7.612 -5.246 557 HB VAL 72 HB VAL 72 -3.772 10.120 -5.608 558 1HG1 VAL 72 1HG1 VAL 72 -1.457 8.342 -4.884 559 2HG1 VAL 72 2HG1 VAL 72 -1.332 10.097 -4.750 560 3HG1 VAL 72 3HG1 VAL 72 -2.542 9.225 -3.809 561 1HG2 VAL 72 1HG2 VAL 72 -2.704 9.437 -8.020 562 2HG2 VAL 72 2HG2 VAL 72 -2.415 10.988 -7.234 563 3HG2 VAL 72 3HG2 VAL 72 -1.239 9.684 -7.076 564 H GLY 73 H GLY 73 -5.991 8.884 -5.443 565 1HA GLY 73 1HA GLY 73 -7.115 9.758 -7.868 566 2HA GLY 73 2HA GLY 73 -7.561 8.067 -7.677 567 H SER 74 H SER 74 -9.581 9.740 -7.687 568 HA SER 74 HA SER 74 -10.327 10.214 -4.860 569 1HB SER 74 1HB SER 74 -10.456 12.270 -6.068 570 2HB SER 74 2HB SER 74 -11.256 11.496 -7.427 571 HG SER 74 HG SER 74 -12.281 12.458 -5.083 572 H SER 75 H SER 75 -12.589 9.816 -4.355 573 HA SER 75 HA SER 75 -13.528 7.304 -5.526 574 1HB SER 75 1HB SER 75 -13.661 7.381 -3.141 575 2HB SER 75 2HB SER 75 -14.413 8.973 -3.168 576 HG SER 75 HG SER 75 -15.498 6.454 -3.636 577 H ALA 76 H ALA 76 -13.797 10.396 -6.521 578 HA ALA 76 HA ALA 76 -16.559 10.905 -6.808 579 1HB ALA 76 1HB ALA 76 -14.093 11.764 -8.260 580 2HB ALA 76 2HB ALA 76 -15.658 12.114 -8.994 581 3HB ALA 76 3HB ALA 76 -15.277 12.740 -7.390 582 H GLY 77 H GLY 77 -14.569 10.019 -9.628 583 1HA GLY 77 1HA GLY 77 -16.708 8.076 -10.407 584 2HA GLY 77 2HA GLY 77 -16.004 9.191 -11.580 585 H GLY 78 H GLY 78 -15.227 6.477 -9.429 586 1HA GLY 78 1HA GLY 78 -12.572 6.086 -10.558 587 2HA GLY 78 2HA GLY 78 -13.409 4.974 -9.475 588 H ALA 79 H ALA 79 -15.424 3.912 -10.597 589 HA ALA 79 HA ALA 79 -16.184 2.429 -12.247 590 1HB ALA 79 1HB ALA 79 -16.299 4.627 -13.524 591 2HB ALA 79 2HB ALA 79 -14.723 4.221 -14.203 592 3HB ALA 79 3HB ALA 79 -16.115 3.187 -14.525 593 H GLY 80 H GLY 80 -13.517 2.069 -10.980 594 1HA GLY 80 1HA GLY 80 -12.510 -0.235 -11.779 595 2HA GLY 80 2HA GLY 80 -11.982 0.741 -13.152 596 H GLU 81 H GLU 81 -9.995 -0.417 -11.736 597 HA GLU 81 HA GLU 81 -8.979 1.689 -9.878 598 1HB GLU 81 1HB GLU 81 -7.346 -0.079 -9.165 599 2HB GLU 81 2HB GLU 81 -9.028 -0.523 -8.868 600 1HG GLU 81 1HG GLU 81 -9.088 -1.965 -10.769 601 2HG GLU 81 2HG GLU 81 -7.566 -1.325 -11.390 602 H GLN 82 H GLN 82 -8.944 1.961 -12.786 603 HA GLN 82 HA GLN 82 -5.984 1.966 -13.221 604 1HB GLN 82 1HB GLN 82 -8.167 1.603 -15.295 605 2HB GLN 82 2HB GLN 82 -6.435 1.666 -15.627 606 1HG GLN 82 1HG GLN 82 -6.453 -0.255 -13.725 607 2HG GLN 82 2HG GLN 82 -8.053 -0.516 -14.421 608 1HE2 GLN 82 2HE2 GLN 82 -4.692 -1.103 -14.885 609 2HE2 GLN 82 1HE2 GLN 82 -4.787 -1.705 -16.469 610 H ASP 83 H ASP 83 -8.601 3.963 -12.679 611 HA ASP 83 HA ASP 83 -7.632 6.098 -14.510 612 1HB ASP 83 1HB ASP 83 -10.179 5.363 -13.940 613 2HB ASP 83 2HB ASP 83 -9.937 6.595 -12.701 614 H TYR 84 H TYR 84 -5.903 5.399 -12.425 615 HA TYR 84 HA TYR 84 -6.234 7.558 -10.399 616 1HB TYR 84 1HB TYR 84 -4.770 4.933 -10.483 617 2HB TYR 84 2HB TYR 84 -4.170 6.210 -9.431 618 HD1 TYR 84 HD1 TYR 84 -7.692 5.270 -10.338 619 HD2 TYR 84 HD2 TYR 84 -4.716 5.587 -7.256 620 HE1 TYR 84 HE1 TYR 84 -9.385 4.652 -8.637 621 HE2 TYR 84 HE2 TYR 84 -6.411 4.976 -5.556 622 HH TYR 84 HH TYR 84 -8.517 3.897 -5.371 623 H GLU 85 H GLU 85 -3.790 8.120 -9.687 624 HA GLU 85 HA GLU 85 -2.267 8.809 -12.159 625 1HB GLU 85 1HB GLU 85 -1.602 10.698 -10.105 626 2HB GLU 85 2HB GLU 85 -2.344 11.011 -11.666 627 1HG GLU 85 1HG GLU 85 -4.018 10.071 -9.339 628 2HG GLU 85 2HG GLU 85 -3.599 11.770 -9.528 629 H VAL 86 H VAL 86 -0.240 8.007 -12.115 630 HA VAL 86 HA VAL 86 0.674 6.324 -10.026 631 HB VAL 86 HB VAL 86 2.345 7.729 -12.130 632 1HG1 VAL 86 1HG1 VAL 86 2.832 5.520 -10.173 633 2HG1 VAL 86 2HG1 VAL 86 3.547 5.368 -11.779 634 3HG1 VAL 86 3HG1 VAL 86 3.940 6.757 -10.767 635 1HG2 VAL 86 1HG2 VAL 86 0.206 6.138 -12.643 636 2HG2 VAL 86 2HG2 VAL 86 1.645 6.170 -13.662 637 3HG2 VAL 86 3HG2 VAL 86 1.455 4.909 -12.445 638 H LEU 87 H LEU 87 0.501 7.538 -8.044 639 HA LEU 87 HA LEU 87 1.820 10.023 -7.533 640 1HB LEU 87 1HB LEU 87 0.124 8.692 -6.056 641 2HB LEU 87 2HB LEU 87 1.549 7.850 -5.457 642 HG LEU 87 HG LEU 87 2.559 10.105 -4.932 643 1HD1 LEU 87 1HD1 LEU 87 -0.059 10.924 -6.077 644 2HD1 LEU 87 2HD1 LEU 87 0.467 11.797 -4.639 645 3HD1 LEU 87 3HD1 LEU 87 1.485 11.775 -6.077 646 1HD2 LEU 87 1HD2 LEU 87 0.183 8.887 -3.621 647 2HD2 LEU 87 2HD2 LEU 87 1.788 9.206 -2.966 648 3HD2 LEU 87 3HD2 LEU 87 0.611 10.513 -3.089 649 H LEU 88 H LEU 88 2.864 6.662 -6.913 650 HA LEU 88 HA LEU 88 5.649 7.494 -7.419 651 1HB LEU 88 1HB LEU 88 6.469 6.390 -5.368 652 2HB LEU 88 2HB LEU 88 5.463 7.792 -5.028 653 HG LEU 88 HG LEU 88 3.743 5.520 -5.225 654 1HD1 LEU 88 1HD1 LEU 88 6.347 5.040 -3.887 655 2HD1 LEU 88 2HD1 LEU 88 4.915 4.557 -2.979 656 3HD1 LEU 88 3HD1 LEU 88 5.210 3.888 -4.584 657 1HD2 LEU 88 1HD2 LEU 88 4.611 7.501 -3.141 658 2HD2 LEU 88 2HD2 LEU 88 3.024 7.289 -3.882 659 3HD2 LEU 88 3HD2 LEU 88 3.591 6.143 -2.666 660 H VAL 89 H VAL 89 6.492 6.030 -8.793 661 HA VAL 89 HA VAL 89 5.184 3.686 -9.661 662 HB VAL 89 HB VAL 89 7.413 3.036 -10.606 663 1HG1 VAL 89 1HG1 VAL 89 5.922 4.639 -11.772 664 2HG1 VAL 89 2HG1 VAL 89 6.691 5.968 -10.904 665 3HG1 VAL 89 3HG1 VAL 89 7.622 5.010 -12.055 666 1HG2 VAL 89 1HG2 VAL 89 8.586 4.097 -8.524 667 2HG2 VAL 89 2HG2 VAL 89 9.369 4.233 -10.098 668 3HG2 VAL 89 3HG2 VAL 89 8.473 5.602 -9.438 669 H THR 90 H THR 90 6.613 1.458 -9.529 670 HA THR 90 HA THR 90 6.211 0.534 -6.856 671 HB THR 90 HB THR 90 6.249 -0.758 -9.164 672 HG1 THR 90 HG1 THR 90 6.235 -2.561 -7.963 673 1HG2 THR 90 1HG2 THR 90 8.733 -0.316 -9.496 674 2HG2 THR 90 2HG2 THR 90 9.025 -1.413 -8.147 675 3HG2 THR 90 3HG2 THR 90 8.246 -2.006 -9.613 676 H SER 91 H SER 91 7.595 0.347 -5.175 677 HA SER 91 HA SER 91 10.293 1.536 -5.492 678 1HB SER 91 1HB SER 91 10.066 1.680 -2.919 679 2HB SER 91 2HB SER 91 9.055 2.752 -3.880 680 HG SER 91 HG SER 91 7.674 1.795 -2.490 681 H SER 92 H SER 92 11.966 0.173 -5.410 682 HA SER 92 HA SER 92 11.600 -2.626 -4.576 683 1HB SER 92 1HB SER 92 14.075 -2.744 -5.233 684 2HB SER 92 2HB SER 92 12.945 -2.347 -6.525 685 HG SER 92 HG SER 92 14.177 -0.656 -6.754 686 H PHE 93 H PHE 93 11.648 -2.977 -2.390 687 HA PHE 93 HA PHE 93 13.555 -1.386 -0.742 688 1HB PHE 93 1HB PHE 93 11.231 -3.106 0.124 689 2HB PHE 93 2HB PHE 93 12.232 -2.128 1.189 690 HD1 PHE 93 HD1 PHE 93 12.576 0.377 -0.232 691 HD2 PHE 93 HD2 PHE 93 9.101 -2.147 0.026 692 HE1 PHE 93 HE1 PHE 93 11.122 2.331 -0.678 693 HE2 PHE 93 HE2 PHE 93 7.653 -0.184 -0.420 694 HZ PHE 93 HZ PHE 93 8.667 2.049 -0.772 695 H MET 94 H MET 94 12.388 -4.731 -1.150 696 HA MET 94 HA MET 94 15.022 -5.647 -0.061 697 1HB MET 94 1HB MET 94 12.232 -6.518 0.483 698 2HB MET 94 2HB MET 94 13.445 -7.794 0.369 699 1HG MET 94 1HG MET 94 14.721 -6.902 2.147 700 2HG MET 94 2HG MET 94 13.917 -5.336 2.052 701 1HE MET 94 1HE MET 94 13.520 -9.085 2.647 702 2HE MET 94 2HE MET 94 11.947 -9.262 3.418 703 3HE MET 94 3HE MET 94 12.054 -8.784 1.718 704 H SER 95 H SER 95 15.468 -7.986 -0.767 705 HA SER 95 HA SER 95 14.997 -8.190 -3.702 706 1HB SER 95 1HB SER 95 16.952 -10.058 -2.980 707 2HB SER 95 2HB SER 95 17.244 -8.481 -3.699 708 HG SER 95 HG SER 95 17.898 -9.349 -1.280 709 HA PRO 96 HA PRO 96 12.895 -12.069 -3.010 710 1HB PRO 96 1HB PRO 96 13.815 -13.667 -5.018 711 2HB PRO 96 2HB PRO 96 12.759 -12.279 -5.289 712 1HG PRO 96 1HG PRO 96 15.596 -12.606 -5.952 713 2HG PRO 96 2HG PRO 96 14.417 -11.452 -6.589 714 1HD PRO 96 1HD PRO 96 16.449 -10.990 -4.602 715 2HD PRO 96 2HD PRO 96 15.272 -9.827 -5.248 716 H SER 97 H SER 97 15.876 -11.874 -1.873 717 HA SER 97 HA SER 97 16.123 -14.798 -1.310 718 1HB SER 97 1HB SER 97 18.052 -14.085 -2.589 719 2HB SER 97 2HB SER 97 18.273 -12.674 -1.559 720 HG SER 97 HG SER 97 19.441 -13.920 -0.349 721 H GLU 98 H GLU 98 16.848 -11.550 0.019 722 HA GLU 98 HA GLU 98 17.121 -12.487 2.727 723 1HB GLU 98 1HB GLU 98 16.980 -10.094 3.337 724 2HB GLU 98 2HB GLU 98 18.093 -10.352 1.997 725 1HG GLU 98 1HG GLU 98 15.898 -9.911 0.554 726 2HG GLU 98 2HG GLU 98 15.407 -9.043 2.008 727 H SER 99 H SER 99 14.357 -12.058 0.749 728 HA SER 99 HA SER 99 12.403 -11.180 2.605 729 1HB SER 99 1HB SER 99 11.847 -11.363 0.262 730 2HB SER 99 2HB SER 99 12.198 -13.089 0.263 731 HG SER 99 HG SER 99 10.130 -13.216 0.677 732 H ARG 100 H ARG 100 14.057 -14.245 2.331 733 HA ARG 100 HA ARG 100 12.104 -15.593 4.095 734 1HB ARG 100 1HB ARG 100 14.694 -16.586 2.864 735 2HB ARG 100 2HB ARG 100 13.549 -17.577 3.769 736 1HG ARG 100 1HG ARG 100 11.853 -17.303 2.116 737 2HG ARG 100 2HG ARG 100 12.730 -15.992 1.329 738 1HD ARG 100 1HD ARG 100 13.323 -17.716 -0.083 739 2HD ARG 100 2HD ARG 100 14.608 -17.883 1.114 740 HE ARG 100 HE ARG 100 12.461 -19.453 2.036 741 1HH1 ARG 100 1HH1 ARG 100 14.584 -19.339 -0.742 742 2HH1 ARG 100 2HH1 ARG 100 14.494 -21.045 -1.006 743 1HH2 ARG 100 1HH2 ARG 100 12.375 -21.656 1.657 744 2HH2 ARG 100 2HH2 ARG 100 13.259 -22.346 0.336 745 H SER 101 H SER 101 15.683 -15.543 4.220 746 HA SER 101 HA SER 101 15.735 -14.330 6.853 747 1HB SER 101 1HB SER 101 15.095 -16.936 7.010 748 2HB SER 101 2HB SER 101 16.844 -17.104 6.868 749 HG SER 101 HG SER 101 15.294 -16.032 8.904 750 H GLY 102 H GLY 102 16.897 -13.857 4.287 751 1HA GLY 102 1HA GLY 102 19.691 -14.755 4.415 752 2HA GLY 102 2HA GLY 102 18.994 -13.701 3.184 753 H SER 103 H SER 103 17.783 -12.049 5.479 754 HA SER 103 HA SER 103 19.867 -10.962 7.063 755 1HB SER 103 1HB SER 103 20.031 -10.192 4.307 756 2HB SER 103 2HB SER 103 19.656 -8.771 5.274 757 HG SER 103 HG SER 103 21.879 -9.068 5.222 758 H ASN 104 H ASN 104 16.949 -10.316 5.312 759 HA ASN 104 HA ASN 104 15.632 -9.263 7.658 760 1HB ASN 104 1HB ASN 104 15.122 -7.009 6.447 761 2HB ASN 104 2HB ASN 104 16.654 -7.182 7.297 762 1HD2 ASN 104 2HD2 ASN 104 15.213 -7.403 4.011 763 2HD2 ASN 104 1HD2 ASN 104 16.652 -7.041 3.189 764 HA PRO 105 HA PRO 105 12.717 -10.991 4.562 765 1HB PRO 105 1HB PRO 105 11.170 -12.299 6.386 766 2HB PRO 105 2HB PRO 105 12.663 -12.970 5.719 767 1HG PRO 105 1HG PRO 105 12.139 -11.866 8.407 768 2HG PRO 105 2HG PRO 105 13.318 -13.082 7.895 769 1HD PRO 105 1HD PRO 105 13.850 -10.360 8.446 770 2HD PRO 105 2HD PRO 105 14.952 -11.513 7.661 771 H ASN 106 H ASN 106 12.197 -9.205 7.526 772 HA ASN 106 HA ASN 106 9.700 -8.060 6.340 773 1HB ASN 106 1HB ASN 106 10.125 -9.344 8.943 774 2HB ASN 106 2HB ASN 106 9.416 -7.736 9.089 775 1HD2 ASN 106 2HD2 ASN 106 8.930 -10.025 6.370 776 2HD2 ASN 106 1HD2 ASN 106 7.260 -10.207 6.618 777 H ARG 107 H ARG 107 9.995 -5.952 5.914 778 HA ARG 107 HA ARG 107 11.411 -4.237 7.868 779 1HB ARG 107 1HB ARG 107 12.820 -5.190 5.713 780 2HB ARG 107 2HB ARG 107 12.169 -3.685 5.062 781 1HG ARG 107 1HG ARG 107 13.067 -2.467 7.035 782 2HG ARG 107 2HG ARG 107 13.766 -3.975 7.625 783 1HD ARG 107 1HD ARG 107 15.425 -3.987 6.040 784 2HD ARG 107 2HD ARG 107 14.408 -3.223 4.819 785 HE ARG 107 HE ARG 107 15.156 -1.117 5.576 786 1HH1 ARG 107 1HH1 ARG 107 15.939 -3.596 7.918 787 2HH1 ARG 107 2HH1 ARG 107 16.917 -2.530 8.866 788 1HH2 ARG 107 1HH2 ARG 107 16.424 0.225 6.836 789 2HH2 ARG 107 2HH2 ARG 107 17.190 -0.391 8.263 790 H VAL 108 H VAL 108 11.183 -1.827 7.000 791 HA VAL 108 HA VAL 108 8.623 -1.543 5.524 792 HB VAL 108 HB VAL 108 7.754 0.018 7.113 793 1HG1 VAL 108 1HG1 VAL 108 8.838 -2.504 8.393 794 2HG1 VAL 108 2HG1 VAL 108 7.598 -1.486 9.125 795 3HG1 VAL 108 3HG1 VAL 108 7.276 -2.308 7.599 796 1HG2 VAL 108 1HG2 VAL 108 10.484 -0.231 8.301 797 2HG2 VAL 108 2HG2 VAL 108 9.507 1.214 8.040 798 3HG2 VAL 108 3HG2 VAL 108 9.119 0.114 9.363 799 H ARG 109 H ARG 109 8.281 0.807 4.811 800 HA ARG 109 HA ARG 109 10.709 2.444 4.676 801 1HB ARG 109 1HB ARG 109 10.370 0.571 2.678 802 2HB ARG 109 2HB ARG 109 9.609 1.999 1.977 803 1HG ARG 109 1HG ARG 109 11.742 2.549 1.381 804 2HG ARG 109 2HG ARG 109 11.869 3.098 3.049 805 1HD ARG 109 1HD ARG 109 12.497 0.596 3.537 806 2HD ARG 109 2HD ARG 109 12.883 0.556 1.816 807 HE ARG 109 HE ARG 109 14.084 2.836 3.159 808 1HH1 ARG 109 1HH1 ARG 109 14.430 -0.579 2.483 809 2HH1 ARG 109 2HH1 ARG 109 16.148 -0.542 2.663 810 1HH2 ARG 109 1HH2 ARG 109 16.309 2.838 3.382 811 2HH2 ARG 109 2HH2 ARG 109 17.203 1.371 3.166 812 H MET 110 H MET 110 10.257 4.571 3.901 813 HA MET 110 HA MET 110 7.348 5.235 3.710 814 1HB MET 110 1HB MET 110 9.492 6.898 5.059 815 2HB MET 110 2HB MET 110 7.766 7.250 5.008 816 1HG MET 110 1HG MET 110 7.296 5.799 6.681 817 2HG MET 110 2HG MET 110 8.376 4.564 6.042 818 1HE MET 110 1HE MET 110 10.215 3.885 6.768 819 2HE MET 110 2HE MET 110 11.268 4.480 8.049 820 3HE MET 110 3HE MET 110 9.684 3.822 8.455 821 H PHE 111 H PHE 111 6.878 7.175 2.494 822 HA PHE 111 HA PHE 111 9.004 7.920 0.532 823 1HB PHE 111 1HB PHE 111 6.030 8.119 0.018 824 2HB PHE 111 2HB PHE 111 7.339 8.175 -1.156 825 HD1 PHE 111 HD1 PHE 111 5.759 5.914 1.377 826 HD2 PHE 111 HD2 PHE 111 7.988 6.222 -2.282 827 HE1 PHE 111 HE1 PHE 111 5.556 3.475 1.042 828 HE2 PHE 111 HE2 PHE 111 7.785 3.774 -2.611 829 HZ PHE 111 HZ PHE 111 6.565 2.394 -0.944 830 H GLY 112 H GLY 112 8.595 10.183 -0.352 831 1HA GLY 112 1HA GLY 112 7.259 11.972 1.594 832 2HA GLY 112 2HA GLY 112 8.920 12.277 1.145 833 HA PRO 113 HA PRO 113 6.461 14.634 -1.958 834 1HB PRO 113 1HB PRO 113 8.237 16.701 -2.095 835 2HB PRO 113 2HB PRO 113 6.954 16.594 -0.881 836 1HG PRO 113 1HG PRO 113 9.869 16.096 -0.597 837 2HG PRO 113 2HG PRO 113 8.713 16.740 0.579 838 1HD PRO 113 1HD PRO 113 9.666 14.116 0.562 839 2HD PRO 113 2HD PRO 113 8.184 14.648 1.366 840 H ASP 114 H ASP 114 9.963 14.094 -1.885 841 HA ASP 114 HA ASP 114 10.445 14.499 -4.677 842 1HB ASP 114 1HB ASP 114 11.945 12.967 -2.542 843 2HB ASP 114 2HB ASP 114 12.534 13.111 -4.200 844 H LYS 115 H LYS 115 9.281 11.768 -2.826 845 HA LYS 115 HA LYS 115 9.606 9.956 -5.130 846 1HB LYS 115 1HB LYS 115 8.885 9.645 -2.249 847 2HB LYS 115 2HB LYS 115 8.308 8.423 -3.383 848 1HG LYS 115 1HG LYS 115 10.402 7.578 -2.736 849 2HG LYS 115 2HG LYS 115 10.765 8.407 -4.250 850 1HD LYS 115 1HD LYS 115 11.923 10.095 -3.211 851 2HD LYS 115 2HD LYS 115 10.910 10.042 -1.767 852 1HE LYS 115 1HE LYS 115 13.223 9.227 -1.327 853 2HE LYS 115 2HE LYS 115 12.008 7.984 -1.032 854 1HZ LYS 115 1HZ LYS 115 13.249 8.200 -3.688 855 2HZ LYS 115 2HZ LYS 115 14.097 7.434 -2.435 856 3HZ LYS 115 3HZ LYS 115 12.581 6.840 -2.919 857 H LEU 116 H LEU 116 7.384 12.313 -4.448 858 HA LEU 116 HA LEU 116 5.206 10.663 -5.681 859 1HB LEU 116 1HB LEU 116 3.590 12.284 -4.555 860 2HB LEU 116 2HB LEU 116 4.368 11.093 -3.522 861 HG LEU 116 HG LEU 116 6.145 12.967 -3.129 862 1HD1 LEU 116 1HD1 LEU 116 4.400 14.327 -4.884 863 2HD1 LEU 116 2HD1 LEU 116 4.122 15.023 -3.293 864 3HD1 LEU 116 3HD1 LEU 116 5.744 15.011 -3.978 865 1HD2 LEU 116 1HD2 LEU 116 3.334 13.133 -2.012 866 2HD2 LEU 116 2HD2 LEU 116 4.620 12.083 -1.417 867 3HD2 LEU 116 3HD2 LEU 116 4.768 13.833 -1.262 868 H VAL 117 H VAL 117 4.149 11.481 -7.382 869 HA VAL 117 HA VAL 117 5.381 13.502 -8.984 870 HB VAL 117 HB VAL 117 3.883 11.735 -9.898 871 1HG1 VAL 117 1HG1 VAL 117 2.279 11.852 -7.967 872 2HG1 VAL 117 2HG1 VAL 117 1.643 13.326 -8.675 873 3HG1 VAL 117 3HG1 VAL 117 1.507 11.805 -9.552 874 1HG2 VAL 117 1HG2 VAL 117 4.232 14.030 -11.022 875 2HG2 VAL 117 2HG2 VAL 117 2.844 13.083 -11.557 876 3HG2 VAL 117 3HG2 VAL 117 2.615 14.424 -10.434 877 H ARG 118 H ARG 118 5.173 15.724 -8.910 878 HA ARG 118 HA ARG 118 3.626 16.931 -6.765 879 1HB ARG 118 1HB ARG 118 5.517 17.863 -8.861 880 2HB ARG 118 2HB ARG 118 4.340 19.053 -8.303 881 1HG ARG 118 1HG ARG 118 5.072 18.872 -6.045 882 2HG ARG 118 2HG ARG 118 5.981 17.397 -6.380 883 1HD ARG 118 1HD ARG 118 7.715 18.536 -7.422 884 2HD ARG 118 2HD ARG 118 6.684 19.888 -7.889 885 HE ARG 118 HE ARG 118 7.001 19.664 -5.003 886 1HH1 ARG 118 1HH1 ARG 118 8.413 20.901 -7.954 887 2HH1 ARG 118 2HH1 ARG 118 9.292 22.142 -7.132 888 1HH2 ARG 118 1HH2 ARG 118 8.155 21.285 -3.981 889 2HH2 ARG 118 2HH2 ARG 118 9.149 22.360 -4.906 890 H ALA 119 H ALA 119 3.205 16.516 -10.245 891 HA ALA 119 HA ALA 119 1.023 18.324 -10.585 892 1HB ALA 119 1HB ALA 119 2.478 16.895 -12.308 893 2HB ALA 119 2HB ALA 119 1.102 15.801 -12.174 894 3HB ALA 119 3HB ALA 119 0.859 17.462 -12.716 895 H ALA 120 H ALA 120 1.187 15.188 -9.098 896 HA ALA 120 HA ALA 120 -1.795 15.087 -9.012 897 1HB ALA 120 1HB ALA 120 -0.122 13.159 -9.998 898 2HB ALA 120 2HB ALA 120 -0.295 12.633 -8.323 899 3HB ALA 120 3HB ALA 120 -1.725 12.832 -9.338 900 H ALA 121 H ALA 121 1.156 14.350 -7.084 901 HA ALA 121 HA ALA 121 0.002 13.723 -4.631 902 1HB ALA 121 1HB ALA 121 2.459 13.798 -5.186 903 2HB ALA 121 2HB ALA 121 2.396 15.542 -4.937 904 3HB ALA 121 3HB ALA 121 2.046 14.446 -3.600 905 H GLU 122 H GLU 122 0.413 16.994 -5.991 906 HA GLU 122 HA GLU 122 -0.604 18.221 -3.530 907 1HB GLU 122 1HB GLU 122 -0.425 20.347 -4.748 908 2HB GLU 122 2HB GLU 122 1.055 19.408 -4.938 909 1HG GLU 122 1HG GLU 122 0.730 19.912 -7.151 910 2HG GLU 122 2HG GLU 122 -0.325 18.500 -7.077 911 H LYS 123 H LYS 123 -2.180 16.472 -5.816 912 HA LYS 123 HA LYS 123 -4.540 18.246 -5.951 913 1HB LYS 123 1HB LYS 123 -4.126 15.505 -7.169 914 2HB LYS 123 2HB LYS 123 -5.439 16.623 -7.532 915 1HG LYS 123 1HG LYS 123 -3.499 18.277 -8.130 916 2HG LYS 123 2HG LYS 123 -2.534 16.807 -8.269 917 1HD LYS 123 1HD LYS 123 -3.455 17.332 -10.456 918 2HD LYS 123 2HD LYS 123 -4.258 15.889 -9.841 919 1HE LYS 123 1HE LYS 123 -5.634 18.317 -8.991 920 2HE LYS 123 2HE LYS 123 -5.512 18.218 -10.747 921 1HZ LYS 123 1HZ LYS 123 -6.365 15.891 -9.143 922 2HZ LYS 123 2HZ LYS 123 -7.478 17.082 -9.620 923 3HZ LYS 123 3HZ LYS 123 -6.624 16.197 -10.791 924 H ARG 124 H ARG 124 -6.352 17.829 -4.719 925 HA ARG 124 HA ARG 124 -6.102 16.143 -2.417 926 1HB ARG 124 1HB ARG 124 -8.410 17.649 -3.643 927 2HB ARG 124 2HB ARG 124 -8.619 16.652 -2.204 928 1HG ARG 124 1HG ARG 124 -6.744 17.918 -1.122 929 2HG ARG 124 2HG ARG 124 -6.717 18.990 -2.522 930 1HD ARG 124 1HD ARG 124 -9.005 19.688 -2.101 931 2HD ARG 124 2HD ARG 124 -9.163 18.509 -0.798 932 HE ARG 124 HE ARG 124 -6.962 20.141 -0.137 933 1HH1 ARG 124 1HH1 ARG 124 -10.406 20.493 -0.647 934 2HH1 ARG 124 2HH1 ARG 124 -10.532 21.824 0.449 935 1HH2 ARG 124 1HH2 ARG 124 -7.174 21.866 1.270 936 2HH2 ARG 124 2HH2 ARG 124 -8.724 22.595 1.523 937 H TRP 125 H TRP 125 -6.147 13.991 -2.488 938 HA TRP 125 HA TRP 125 -8.092 12.621 -4.318 939 1HB TRP 125 1HB TRP 125 -5.482 11.543 -3.191 940 2HB TRP 125 2HB TRP 125 -6.552 10.711 -4.314 941 HD1 TRP 125 HD1 TRP 125 -3.595 12.859 -4.225 942 HE1 TRP 125 HE1 TRP 125 -3.058 13.787 -6.565 943 HE3 TRP 125 HE3 TRP 125 -7.932 11.715 -6.655 944 HZ2 TRP 125 HZ2 TRP 125 -4.280 14.003 -9.128 945 HZ3 TRP 125 HZ3 TRP 125 -8.219 12.270 -9.045 946 HH2 TRP 125 HH2 TRP 125 -6.404 13.423 -10.289 947 H ASP 126 H ASP 126 -8.907 10.519 -3.360 948 HA ASP 126 HA ASP 126 -8.737 10.418 -0.399 949 1HB ASP 126 1HB ASP 126 -11.187 10.173 -0.179 950 2HB ASP 126 2HB ASP 126 -10.733 11.749 -0.814 951 H ARG 127 H ARG 127 -8.057 8.780 -2.990 952 HA ARG 127 HA ARG 127 -8.784 6.165 -1.804 953 1HB ARG 127 1HB ARG 127 -9.127 6.831 -4.751 954 2HB ARG 127 2HB ARG 127 -9.334 5.243 -4.028 955 1HG ARG 127 1HG ARG 127 -10.970 7.155 -2.609 956 2HG ARG 127 2HG ARG 127 -11.303 7.269 -4.334 957 1HD ARG 127 1HD ARG 127 -11.115 4.496 -3.676 958 2HD ARG 127 2HD ARG 127 -12.164 5.251 -2.490 959 HE ARG 127 HE ARG 127 -13.742 5.668 -4.192 960 1HH1 ARG 127 1HH1 ARG 127 -10.710 4.602 -5.572 961 2HH1 ARG 127 2HH1 ARG 127 -11.407 4.330 -7.130 962 1HH2 ARG 127 1HH2 ARG 127 -14.589 5.314 -6.224 963 2HH2 ARG 127 2HH2 ARG 127 -13.573 4.727 -7.499 964 H VAL 128 H VAL 128 -7.046 4.678 -2.111 965 HA VAL 128 HA VAL 128 -4.817 5.625 -3.838 966 HB VAL 128 HB VAL 128 -4.502 6.293 -1.410 967 1HG1 VAL 128 1HG1 VAL 128 -5.299 3.737 -0.836 968 2HG1 VAL 128 2HG1 VAL 128 -3.546 3.588 -0.720 969 3HG1 VAL 128 3HG1 VAL 128 -4.399 4.772 0.272 970 1HG2 VAL 128 1HG2 VAL 128 -2.669 6.079 -3.076 971 2HG2 VAL 128 2HG2 VAL 128 -2.143 5.724 -1.431 972 3HG2 VAL 128 3HG2 VAL 128 -2.439 4.406 -2.565 973 H LYS 129 H LYS 129 -3.621 4.000 -4.814 974 HA LYS 129 HA LYS 129 -4.667 1.228 -4.420 975 1HB LYS 129 1HB LYS 129 -5.059 2.238 -6.662 976 2HB LYS 129 2HB LYS 129 -3.319 2.425 -6.854 977 1HG LYS 129 1HG LYS 129 -3.546 -0.234 -6.136 978 2HG LYS 129 2HG LYS 129 -4.983 0.014 -7.129 979 1HD LYS 129 1HD LYS 129 -3.223 1.277 -8.694 980 2HD LYS 129 2HD LYS 129 -2.101 0.176 -7.891 981 1HE LYS 129 1HE LYS 129 -3.021 -1.690 -8.860 982 2HE LYS 129 2HE LYS 129 -4.648 -1.009 -8.870 983 1HZ LYS 129 1HZ LYS 129 -2.500 0.022 -10.623 984 2HZ LYS 129 2HZ LYS 129 -3.509 -1.260 -11.094 985 3HZ LYS 129 3HZ LYS 129 -4.177 0.262 -10.760 986 H ILE 130 H ILE 130 -3.262 0.106 -3.164 987 HA ILE 130 HA ILE 130 -0.332 0.599 -3.461 988 HB ILE 130 HB ILE 130 -1.895 -0.914 -1.334 989 1HG1 ILE 130 1HG1 ILE 130 -2.257 1.531 -1.281 990 2HG1 ILE 130 2HG1 ILE 130 -1.312 1.004 0.109 991 1HG2 ILE 130 1HG2 ILE 130 1.014 -0.577 -1.886 992 2HG2 ILE 130 2HG2 ILE 130 0.503 -0.439 -0.204 993 3HG2 ILE 130 3HG2 ILE 130 0.161 -1.912 -1.110 994 1HD1 ILE 130 1HD1 ILE 130 0.773 1.639 -1.140 995 2HD1 ILE 130 2HD1 ILE 130 -0.245 2.301 -2.418 996 3HD1 ILE 130 3HD1 ILE 130 -0.284 3.009 -0.804 997 H VAL 131 H VAL 131 0.904 -0.951 -4.522 998 HA VAL 131 HA VAL 131 -0.285 -3.652 -4.858 999 HB VAL 131 HB VAL 131 1.236 -2.098 -6.964 1000 1HG1 VAL 131 1HG1 VAL 131 1.375 -4.593 -6.989 1001 2HG1 VAL 131 2HG1 VAL 131 -0.383 -4.641 -7.132 1002 3HG1 VAL 131 3HG1 VAL 131 0.588 -3.913 -8.414 1003 1HG2 VAL 131 1HG2 VAL 131 -1.724 -2.542 -6.503 1004 2HG2 VAL 131 2HG2 VAL 131 -0.882 -1.011 -6.738 1005 3HG2 VAL 131 3HG2 VAL 131 -1.073 -2.129 -8.089 1006 H CYS 132 H CYS 132 1.080 -5.268 -4.316 1007 HA CYS 132 HA CYS 132 3.946 -4.622 -3.795 1008 1HB CYS 132 1HB CYS 132 2.867 -5.616 -1.888 1009 2HB CYS 132 2HB CYS 132 2.119 -6.857 -2.875 1010 HG CYS 132 HG CYS 132 5.143 -7.043 -3.023 1011 H SER 133 H SER 133 5.591 -5.950 -4.790 1012 HA SER 133 HA SER 133 4.721 -7.939 -6.793 1013 1HB SER 133 1HB SER 133 5.340 -5.228 -7.476 1014 2HB SER 133 2HB SER 133 6.608 -6.257 -8.131 1015 HG SER 133 HG SER 133 4.753 -6.016 -9.513 1016 H GLN 134 H GLN 134 5.979 -9.615 -6.523 1017 HA GLN 134 HA GLN 134 8.609 -9.988 -7.018 1018 1HB GLN 134 1HB GLN 134 8.679 -8.438 -4.699 1019 2HB GLN 134 2HB GLN 134 8.861 -10.071 -4.097 1020 1HG GLN 134 1HG GLN 134 10.564 -8.752 -6.236 1021 2HG GLN 134 2HG GLN 134 11.072 -9.202 -4.614 1022 1HE2 GLN 134 2HE2 GLN 134 9.930 -11.785 -4.413 1023 2HE2 GLN 134 1HE2 GLN 134 10.693 -12.797 -5.535 1024 HA PRO 135 HA PRO 135 6.507 -13.877 -5.915 1025 1HB PRO 135 1HB PRO 135 7.999 -15.473 -7.559 1026 2HB PRO 135 2HB PRO 135 6.627 -14.511 -8.130 1027 1HG PRO 135 1HG PRO 135 9.534 -14.042 -8.479 1028 2HG PRO 135 2HG PRO 135 8.183 -13.605 -9.535 1029 1HD PRO 135 1HD PRO 135 9.537 -11.850 -7.825 1030 2HD PRO 135 2HD PRO 135 7.945 -11.554 -8.555 1031 H TYR 136 H TYR 136 7.319 -14.052 -3.775 1032 HA TYR 136 HA TYR 136 10.125 -14.982 -3.503 1033 1HB TYR 136 1HB TYR 136 9.210 -14.564 -0.903 1034 2HB TYR 136 2HB TYR 136 10.233 -13.485 -1.834 1035 HD1 TYR 136 HD1 TYR 136 6.658 -14.245 -0.994 1036 HD2 TYR 136 HD2 TYR 136 9.437 -11.344 -2.548 1037 HE1 TYR 136 HE1 TYR 136 4.921 -12.493 -0.876 1038 HE2 TYR 136 HE2 TYR 136 7.679 -9.614 -2.444 1039 HH TYR 136 HH TYR 136 5.392 -9.429 -0.816 1040 H SER 137 H SER 137 6.983 -16.253 -3.431 1041 HA SER 137 HA SER 137 8.088 -18.762 -2.297 1042 1HB SER 137 1HB SER 137 6.644 -17.168 -0.645 1043 2HB SER 137 2HB SER 137 5.347 -18.112 -1.373 1044 HG SER 137 HG SER 137 7.630 -19.017 0.039 1045 H LYS 138 H LYS 138 5.798 -20.289 -2.292 1046 HA LYS 138 HA LYS 138 4.676 -20.013 -5.044 1047 1HB LYS 138 1HB LYS 138 6.654 -21.747 -4.647 1048 2HB LYS 138 2HB LYS 138 5.343 -22.738 -4.005 1049 1HG LYS 138 1HG LYS 138 4.089 -22.072 -6.193 1050 2HG LYS 138 2HG LYS 138 5.695 -21.654 -6.791 1051 1HD LYS 138 1HD LYS 138 6.371 -24.018 -5.913 1052 2HD LYS 138 2HD LYS 138 4.637 -24.343 -5.951 1053 1HE LYS 138 1HE LYS 138 5.221 -24.987 -8.101 1054 2HE LYS 138 2HE LYS 138 4.829 -23.291 -8.378 1055 1HZ LYS 138 1HZ LYS 138 7.569 -24.081 -7.642 1056 2HZ LYS 138 2HZ LYS 138 7.046 -24.220 -9.253 1057 3HZ LYS 138 3HZ LYS 138 7.043 -22.705 -8.484 1058 H ASP 139 H ASP 139 4.440 -21.767 -1.934 1059 HA ASP 139 HA ASP 139 1.509 -21.979 -2.374 1060 1HB ASP 139 1HB ASP 139 1.643 -23.710 -0.552 1061 2HB ASP 139 2HB ASP 139 2.520 -24.136 -2.016 1062 H SER 140 H SER 140 3.830 -20.300 -0.514 1063 HA SER 140 HA SER 140 1.929 -19.781 1.675 1064 1HB SER 140 1HB SER 140 3.793 -18.947 2.865 1065 2HB SER 140 2HB SER 140 4.408 -20.346 2.010 1066 HG SER 140 HG SER 140 5.157 -17.772 1.839 1067 HA PRO 141 HA PRO 141 1.053 -15.785 -0.256 1068 1HB PRO 141 1HB PRO 141 -0.690 -14.900 1.645 1069 2HB PRO 141 2HB PRO 141 -1.109 -16.126 0.443 1070 1HG PRO 141 1HG PRO 141 -0.693 -16.423 3.324 1071 2HG PRO 141 2HG PRO 141 -1.512 -17.502 2.188 1072 1HD PRO 141 1HD PRO 141 1.155 -17.753 3.270 1073 2HD PRO 141 2HD PRO 141 0.305 -18.854 2.163 1074 H PHE 142 H PHE 142 0.801 -13.394 0.768 1075 HA PHE 142 HA PHE 142 2.109 -12.590 3.126 1076 1HB PHE 142 1HB PHE 142 3.958 -13.477 1.075 1077 2HB PHE 142 2HB PHE 142 4.186 -11.758 1.375 1078 HD1 PHE 142 HD1 PHE 142 4.197 -11.061 3.940 1079 HD2 PHE 142 HD2 PHE 142 5.020 -15.008 2.469 1080 HE1 PHE 142 HE1 PHE 142 5.400 -11.594 6.043 1081 HE2 PHE 142 HE2 PHE 142 6.226 -15.542 4.571 1082 HZ PHE 142 HZ PHE 142 6.414 -13.834 6.358 1083 H GLY 143 H GLY 143 3.351 -10.184 2.240 1084 1HA GLY 143 1HA GLY 143 2.343 -8.732 0.163 1085 2HA GLY 143 2HA GLY 143 0.976 -8.759 1.272 1086 H LEU 144 H LEU 144 0.874 -7.104 2.641 1087 HA LEU 144 HA LEU 144 3.409 -5.656 3.305 1088 1HB LEU 144 1HB LEU 144 0.788 -4.699 2.334 1089 2HB LEU 144 2HB LEU 144 1.446 -3.777 3.681 1090 HG LEU 144 HG LEU 144 3.573 -3.514 2.440 1091 1HD1 LEU 144 1HD1 LEU 144 2.112 -5.283 0.528 1092 2HD1 LEU 144 2HD1 LEU 144 3.145 -4.027 -0.156 1093 3HD1 LEU 144 3HD1 LEU 144 3.830 -5.239 0.927 1094 1HD2 LEU 144 1HD2 LEU 144 1.002 -2.623 1.121 1095 2HD2 LEU 144 2HD2 LEU 144 2.034 -1.703 2.217 1096 3HD2 LEU 144 3HD2 LEU 144 2.581 -2.058 0.579 1097 H SER 145 H SER 145 3.360 -4.477 5.368 1098 HA SER 145 HA SER 145 1.940 -6.053 7.444 1099 1HB SER 145 1HB SER 145 4.153 -4.025 7.821 1100 2HB SER 145 2HB SER 145 3.582 -5.210 8.992 1101 HG SER 145 HG SER 145 5.539 -5.756 7.757 1102 H PHE 146 H PHE 146 2.174 -2.838 6.071 1103 HA PHE 146 HA PHE 146 -0.322 -1.983 7.186 1104 1HB PHE 146 1HB PHE 146 0.487 -0.315 8.823 1105 2HB PHE 146 2HB PHE 146 0.996 -1.936 9.304 1106 HD1 PHE 146 HD1 PHE 146 3.326 -2.662 9.027 1107 HD2 PHE 146 HD2 PHE 146 2.080 1.312 7.995 1108 HE1 PHE 146 HE1 PHE 146 5.689 -1.971 8.840 1109 HE2 PHE 146 HE2 PHE 146 4.443 2.024 7.822 1110 HZ PHE 146 HZ PHE 146 6.268 0.363 8.219 1111 H VAL 147 H VAL 147 -0.569 0.475 6.876 1112 HA VAL 147 HA VAL 147 1.320 1.677 4.953 1113 HB VAL 147 HB VAL 147 -0.482 2.171 3.319 1114 1HG1 VAL 147 1HG1 VAL 147 1.011 0.031 3.333 1115 2HG1 VAL 147 2HG1 VAL 147 -0.482 -0.804 3.764 1116 3HG1 VAL 147 3HG1 VAL 147 -0.378 0.088 2.246 1117 1HG2 VAL 147 1HG2 VAL 147 -2.085 0.644 5.348 1118 2HG2 VAL 147 2HG2 VAL 147 -2.522 2.097 4.449 1119 3HG2 VAL 147 3HG2 VAL 147 -2.532 0.526 3.647 1120 H ARG 148 H ARG 148 1.566 3.769 5.607 1121 HA ARG 148 HA ARG 148 -0.762 5.104 6.933 1122 1HB ARG 148 1HB ARG 148 2.002 5.814 7.835 1123 2HB ARG 148 2HB ARG 148 0.501 5.818 8.737 1124 1HG ARG 148 1HG ARG 148 0.761 3.154 8.232 1125 2HG ARG 148 2HG ARG 148 2.452 3.632 8.346 1126 1HD ARG 148 1HD ARG 148 0.747 4.806 10.441 1127 2HD ARG 148 2HD ARG 148 0.839 3.045 10.499 1128 HE ARG 148 HE ARG 148 3.478 3.881 10.178 1129 1HH1 ARG 148 1HH1 ARG 148 0.915 4.474 12.483 1130 2HH1 ARG 148 2HH1 ARG 148 2.015 4.732 13.791 1131 1HH2 ARG 148 1HH2 ARG 148 4.864 4.221 11.899 1132 2HH2 ARG 148 2HH2 ARG 148 4.228 4.591 13.466 1133 H PHE 149 H PHE 149 -1.342 6.724 5.552 1134 HA PHE 149 HA PHE 149 0.710 8.108 3.923 1135 1HB PHE 149 1HB PHE 149 -2.308 8.429 4.038 1136 2HB PHE 149 2HB PHE 149 -1.246 9.246 2.895 1137 HD1 PHE 149 HD1 PHE 149 0.276 7.740 1.422 1138 HD2 PHE 149 HD2 PHE 149 -3.184 6.315 3.524 1139 HE1 PHE 149 HE1 PHE 149 0.168 5.777 -0.089 1140 HE2 PHE 149 HE2 PHE 149 -3.296 4.353 2.009 1141 HZ PHE 149 HZ PHE 149 -1.620 4.084 0.205 1142 H HIS 150 H HIS 150 0.716 10.550 3.927 1143 HA HIS 150 HA HIS 150 -0.515 11.882 6.221 1144 1HB HIS 150 1HB HIS 150 2.254 12.620 6.470 1145 2HB HIS 150 2HB HIS 150 1.186 11.933 7.684 1146 HD1 HIS 150 HD1 HIS 150 1.383 9.413 8.163 1147 HD2 HIS 150 HD2 HIS 150 3.923 10.710 5.131 1148 HE1 HIS 150 HE1 HIS 150 3.007 7.520 7.730 1149 H SER 151 H SER 151 -0.824 14.005 5.823 1150 HA SER 151 HA SER 151 0.040 15.028 3.194 1151 1HB SER 151 1HB SER 151 -1.762 16.491 3.356 1152 2HB SER 151 2HB SER 151 -2.338 15.177 4.368 1153 HG SER 151 HG SER 151 -2.585 16.937 5.615 Start of MODEL 18 1 H MET 1 H MET 1 -6.869 16.282 12.676 2 HA MET 1 HA MET 1 -4.565 16.378 13.447 3 1HB MET 1 1HB MET 1 -5.565 14.001 11.882 4 2HB MET 1 2HB MET 1 -4.021 13.941 12.735 5 1HG MET 1 1HG MET 1 -5.127 14.502 14.844 6 2HG MET 1 2HG MET 1 -6.674 14.663 14.013 7 1HE MET 1 1HE MET 1 -7.638 13.185 12.646 8 2HE MET 1 2HE MET 1 -6.845 11.720 12.052 9 3HE MET 1 3HE MET 1 -8.094 11.611 13.290 10 HA PRO 2 HA PRO 2 -1.429 17.013 10.329 11 1HB PRO 2 1HB PRO 2 0.763 16.222 11.748 12 2HB PRO 2 2HB PRO 2 -0.136 17.705 12.102 13 1HG PRO 2 1HG PRO 2 0.033 15.230 13.653 14 2HG PRO 2 2HG PRO 2 -0.526 16.831 14.153 15 1HD PRO 2 1HD PRO 2 -2.122 14.524 13.405 16 2HD PRO 2 2HD PRO 2 -2.674 16.098 14.022 17 H GLU 3 H GLU 3 -2.763 14.380 10.078 18 HA GLU 3 HA GLU 3 -0.690 13.002 8.542 19 1HB GLU 3 1HB GLU 3 -0.430 12.217 10.970 20 2HB GLU 3 2HB GLU 3 -2.012 11.459 10.785 21 1HG GLU 3 1HG GLU 3 -1.243 9.911 9.231 22 2HG GLU 3 2HG GLU 3 0.088 10.944 8.707 23 H ILE 4 H ILE 4 -1.666 11.066 7.419 24 HA ILE 4 HA ILE 4 -4.576 11.537 6.948 25 HB ILE 4 HB ILE 4 -2.366 10.550 5.120 26 1HG1 ILE 4 1HG1 ILE 4 -4.322 12.862 4.940 27 2HG1 ILE 4 2HG1 ILE 4 -2.642 12.998 5.453 28 1HG2 ILE 4 1HG2 ILE 4 -5.353 10.624 4.570 29 2HG2 ILE 4 2HG2 ILE 4 -4.101 10.274 3.377 30 3HG2 ILE 4 3HG2 ILE 4 -4.374 9.165 4.722 31 1HD1 ILE 4 1HD1 ILE 4 -3.430 11.833 2.778 32 2HD1 ILE 4 2HD1 ILE 4 -3.108 13.551 3.006 33 3HD1 ILE 4 3HD1 ILE 4 -1.832 12.369 3.298 34 H ARG 5 H ARG 5 -5.872 9.969 7.687 35 HA ARG 5 HA ARG 5 -4.691 7.293 8.274 36 1HB ARG 5 1HB ARG 5 -6.129 8.937 9.916 37 2HB ARG 5 2HB ARG 5 -7.414 7.923 9.259 38 1HG ARG 5 1HG ARG 5 -6.604 6.816 11.232 39 2HG ARG 5 2HG ARG 5 -5.980 5.911 9.853 40 1HD ARG 5 1HD ARG 5 -3.962 7.658 10.131 41 2HD ARG 5 2HD ARG 5 -4.526 7.633 11.803 42 HE ARG 5 HE ARG 5 -3.115 5.494 10.465 43 1HH1 ARG 5 1HH1 ARG 5 -5.594 6.167 12.839 44 2HH1 ARG 5 2HH1 ARG 5 -5.341 4.674 13.673 45 1HH2 ARG 5 1HH2 ARG 5 -2.820 3.574 11.574 46 2HH2 ARG 5 2HH2 ARG 5 -3.788 3.220 12.967 47 H LEU 6 H LEU 6 -6.241 5.431 7.935 48 HA LEU 6 HA LEU 6 -7.639 5.788 5.328 49 1HB LEU 6 1HB LEU 6 -6.005 3.677 6.541 50 2HB LEU 6 2HB LEU 6 -7.509 3.060 5.865 51 HG LEU 6 HG LEU 6 -7.001 4.026 3.695 52 1HD1 LEU 6 1HD1 LEU 6 -5.845 6.078 4.533 53 2HD1 LEU 6 2HD1 LEU 6 -4.456 5.085 4.975 54 3HD1 LEU 6 3HD1 LEU 6 -4.918 5.253 3.281 55 1HD2 LEU 6 1HD2 LEU 6 -4.619 2.601 4.914 56 2HD2 LEU 6 2HD2 LEU 6 -6.032 1.836 4.187 57 3HD2 LEU 6 3HD2 LEU 6 -4.919 2.767 3.184 58 H ARG 7 H ARG 7 -9.681 4.603 5.049 59 HA ARG 7 HA ARG 7 -11.234 4.487 7.601 60 1HB ARG 7 1HB ARG 7 -11.886 6.159 5.756 61 2HB ARG 7 2HB ARG 7 -12.410 4.750 4.832 62 1HG ARG 7 1HG ARG 7 -14.377 5.346 5.943 63 2HG ARG 7 2HG ARG 7 -13.702 4.131 7.031 64 1HD ARG 7 1HD ARG 7 -13.160 5.674 8.642 65 2HD ARG 7 2HD ARG 7 -12.822 6.941 7.463 66 HE ARG 7 HE ARG 7 -15.056 7.637 7.674 67 1HH1 ARG 7 1HH1 ARG 7 -14.733 4.336 8.786 68 2HH1 ARG 7 2HH1 ARG 7 -16.375 4.248 9.318 69 1HH2 ARG 7 1HH2 ARG 7 -17.174 7.480 8.379 70 2HH2 ARG 7 2HH2 ARG 7 -17.744 6.007 9.090 71 H HIS 8 H HIS 8 -11.107 2.999 4.373 72 HA HIS 8 HA HIS 8 -11.223 0.315 5.512 73 1HB HIS 8 1HB HIS 8 -13.322 -0.297 4.285 74 2HB HIS 8 2HB HIS 8 -13.594 0.829 5.613 75 HD1 HIS 8 HD1 HIS 8 -14.656 3.038 5.045 76 HD2 HIS 8 HD2 HIS 8 -13.279 1.048 1.651 77 HE1 HIS 8 HE1 HIS 8 -15.457 4.382 3.053 78 H VAL 9 H VAL 9 -11.150 -1.337 3.706 79 HA VAL 9 HA VAL 9 -9.358 -0.372 1.606 80 HB VAL 9 HB VAL 9 -8.946 -2.539 2.701 81 1HG1 VAL 9 1HG1 VAL 9 -11.685 -2.871 2.560 82 2HG1 VAL 9 2HG1 VAL 9 -11.101 -3.985 1.324 83 3HG1 VAL 9 3HG1 VAL 9 -10.527 -4.131 2.985 84 1HG2 VAL 9 1HG2 VAL 9 -8.499 -2.035 0.158 85 2HG2 VAL 9 2HG2 VAL 9 -8.292 -3.676 0.769 86 3HG2 VAL 9 3HG2 VAL 9 -9.759 -3.239 -0.107 87 H VAL 10 H VAL 10 -10.617 0.949 0.245 88 HA VAL 10 HA VAL 10 -13.213 0.414 -0.708 89 HB VAL 10 HB VAL 10 -12.350 2.591 -1.124 90 1HG1 VAL 10 1HG1 VAL 10 -9.899 1.375 -1.501 91 2HG1 VAL 10 2HG1 VAL 10 -10.296 1.936 -3.120 92 3HG1 VAL 10 3HG1 VAL 10 -10.242 3.077 -1.778 93 1HG2 VAL 10 1HG2 VAL 10 -13.814 1.733 -2.933 94 2HG2 VAL 10 2HG2 VAL 10 -12.625 2.878 -3.555 95 3HG2 VAL 10 3HG2 VAL 10 -12.392 1.148 -3.797 96 H SER 11 H SER 11 -10.159 -0.323 -2.494 97 HA SER 11 HA SER 11 -11.713 -2.482 -3.844 98 1HB SER 11 1HB SER 11 -10.364 -0.283 -5.012 99 2HB SER 11 2HB SER 11 -9.399 -1.709 -5.381 100 HG SER 11 HG SER 11 -12.146 -1.243 -5.903 101 H CYS 12 H CYS 12 -10.520 -4.469 -4.248 102 HA CYS 12 HA CYS 12 -7.838 -4.674 -2.988 103 1HB CYS 12 1HB CYS 12 -8.560 -6.731 -1.756 104 2HB CYS 12 2HB CYS 12 -9.351 -5.265 -1.179 105 HG CYS 12 HG CYS 12 -11.460 -6.488 -1.624 106 H SER 13 H SER 13 -6.532 -5.775 -4.345 107 HA SER 13 HA SER 13 -7.777 -7.778 -6.185 108 1HB SER 13 1HB SER 13 -6.528 -5.435 -6.944 109 2HB SER 13 2HB SER 13 -5.228 -6.615 -7.075 110 HG SER 13 HG SER 13 -6.499 -7.828 -8.441 111 H SER 14 H SER 14 -6.918 -8.564 -3.700 112 HA SER 14 HA SER 14 -5.524 -10.845 -3.868 113 1HB SER 14 1HB SER 14 -3.579 -8.591 -4.042 114 2HB SER 14 2HB SER 14 -3.143 -9.980 -3.055 115 HG SER 14 HG SER 14 -4.065 -10.100 -5.740 116 H GLN 15 H GLN 15 -7.112 -10.763 -2.078 117 HA GLN 15 HA GLN 15 -5.746 -10.142 0.478 118 1HB GLN 15 1HB GLN 15 -6.981 -8.285 0.812 119 2HB GLN 15 2HB GLN 15 -7.863 -8.560 -0.671 120 1HG GLN 15 1HG GLN 15 -8.669 -10.073 1.805 121 2HG GLN 15 2HG GLN 15 -9.139 -8.390 1.617 122 1HE2 GLN 15 2HE2 GLN 15 -8.829 -10.499 -1.235 123 2HE2 GLN 15 1HE2 GLN 15 -10.492 -10.557 -1.568 124 H ASP 16 H ASP 16 -6.322 -11.554 2.149 125 HA ASP 16 HA ASP 16 -7.841 -13.952 1.310 126 1HB ASP 16 1HB ASP 16 -5.538 -13.643 2.779 127 2HB ASP 16 2HB ASP 16 -6.741 -13.856 4.048 128 H SER 17 H SER 17 -8.768 -14.768 3.856 129 HA SER 17 HA SER 17 -11.033 -12.882 4.183 130 1HB SER 17 1HB SER 17 -11.995 -14.854 5.518 131 2HB SER 17 2HB SER 17 -11.798 -15.101 3.786 132 HG SER 17 HG SER 17 -10.665 -16.764 4.400 133 H THR 18 H THR 18 -8.953 -14.903 6.295 134 HA THR 18 HA THR 18 -9.612 -13.422 8.679 135 HB THR 18 HB THR 18 -7.230 -14.575 9.293 136 HG1 THR 18 HG1 THR 18 -6.630 -15.798 7.723 137 1HG2 THR 18 1HG2 THR 18 -9.421 -15.009 10.358 138 2HG2 THR 18 2HG2 THR 18 -9.867 -16.035 8.995 139 3HG2 THR 18 3HG2 THR 18 -8.539 -16.506 10.055 140 H HIS 19 H HIS 19 -6.482 -13.611 6.945 141 HA HIS 19 HA HIS 19 -5.769 -10.949 8.034 142 1HB HIS 19 1HB HIS 19 -4.154 -12.929 6.393 143 2HB HIS 19 2HB HIS 19 -3.529 -11.434 7.089 144 HD1 HIS 19 HD1 HIS 19 -3.578 -11.284 9.767 145 HD2 HIS 19 HD2 HIS 19 -4.263 -15.076 8.175 146 HE1 HIS 19 HE1 HIS 19 -3.271 -12.927 11.670 147 H CYS 20 H CYS 20 -7.664 -10.211 6.538 148 HA CYS 20 HA CYS 20 -7.000 -10.038 3.686 149 1HB CYS 20 1HB CYS 20 -9.078 -8.669 3.543 150 2HB CYS 20 2HB CYS 20 -9.349 -10.231 4.301 151 HG CYS 20 HG CYS 20 -10.456 -8.626 5.945 152 H ALA 21 H ALA 21 -7.191 -7.770 2.676 153 HA ALA 21 HA ALA 21 -5.032 -6.156 3.618 154 1HB ALA 21 1HB ALA 21 -7.071 -6.012 1.468 155 2HB ALA 21 2HB ALA 21 -6.378 -4.470 1.971 156 3HB ALA 21 3HB ALA 21 -5.328 -5.760 1.384 157 H GLU 22 H GLU 22 -8.443 -6.181 4.365 158 HA GLU 22 HA GLU 22 -8.709 -3.495 5.306 159 1HB GLU 22 1HB GLU 22 -10.427 -5.584 5.023 160 2HB GLU 22 2HB GLU 22 -10.192 -5.606 6.771 161 1HG GLU 22 1HG GLU 22 -10.700 -3.139 6.799 162 2HG GLU 22 2HG GLU 22 -11.117 -3.259 5.090 163 H ASN 23 H ASN 23 -7.000 -6.225 6.615 164 HA ASN 23 HA ASN 23 -7.084 -5.492 9.397 165 1HB ASN 23 1HB ASN 23 -5.230 -7.144 7.710 166 2HB ASN 23 2HB ASN 23 -4.826 -6.791 9.389 167 1HD2 ASN 23 2HD2 ASN 23 -7.191 -8.432 7.302 168 2HD2 ASN 23 1HD2 ASN 23 -7.899 -9.354 8.539 169 H LEU 24 H LEU 24 -5.529 -4.108 6.678 170 HA LEU 24 HA LEU 24 -3.253 -2.915 7.942 171 1HB LEU 24 1HB LEU 24 -4.828 -1.892 5.556 172 2HB LEU 24 2HB LEU 24 -3.156 -1.506 5.960 173 HG LEU 24 HG LEU 24 -4.046 -4.356 5.496 174 1HD1 LEU 24 1HD1 LEU 24 -3.548 -2.195 3.532 175 2HD1 LEU 24 2HD1 LEU 24 -2.761 -3.739 3.206 176 3HD1 LEU 24 3HD1 LEU 24 -4.514 -3.661 3.376 177 1HD2 LEU 24 1HD2 LEU 24 -1.748 -3.361 6.540 178 2HD2 LEU 24 2HD2 LEU 24 -1.827 -4.863 5.618 179 3HD2 LEU 24 3HD2 LEU 24 -1.338 -3.366 4.824 180 H LEU 25 H LEU 25 -6.673 -2.168 7.855 181 HA LEU 25 HA LEU 25 -6.573 0.583 8.583 182 1HB LEU 25 1HB LEU 25 -8.562 -1.653 8.924 183 2HB LEU 25 2HB LEU 25 -8.851 -0.095 9.679 184 HG LEU 25 HG LEU 25 -9.933 -0.218 7.466 185 1HD1 LEU 25 1HD1 LEU 25 -8.857 1.926 8.391 186 2HD1 LEU 25 2HD1 LEU 25 -7.560 1.633 7.233 187 3HD1 LEU 25 3HD1 LEU 25 -9.208 1.891 6.663 188 1HD2 LEU 25 1HD2 LEU 25 -8.253 -1.821 6.495 189 2HD2 LEU 25 2HD2 LEU 25 -8.623 -0.458 5.439 190 3HD2 LEU 25 3HD2 LEU 25 -7.120 -0.475 6.361 191 H LYS 26 H LYS 26 -5.785 -2.308 10.337 192 HA LYS 26 HA LYS 26 -5.794 -0.752 12.891 193 1HB LYS 26 1HB LYS 26 -5.558 -3.763 12.777 194 2HB LYS 26 2HB LYS 26 -6.101 -2.746 14.108 195 1HG LYS 26 1HG LYS 26 -8.129 -3.589 13.341 196 2HG LYS 26 2HG LYS 26 -8.025 -2.078 12.437 197 1HD LYS 26 1HD LYS 26 -7.598 -3.139 10.440 198 2HD LYS 26 2HD LYS 26 -6.762 -4.486 11.214 199 1HE LYS 26 1HE LYS 26 -9.729 -4.077 11.577 200 2HE LYS 26 2HE LYS 26 -9.091 -4.955 10.187 201 1HZ LYS 26 1HZ LYS 26 -8.169 -5.654 12.888 202 2HZ LYS 26 2HZ LYS 26 -9.679 -6.219 12.353 203 3HZ LYS 26 3HZ LYS 26 -8.266 -6.626 11.501 204 H ALA 27 H ALA 27 -3.772 0.097 11.725 205 HA ALA 27 HA ALA 27 -1.440 -1.373 11.229 206 1HB ALA 27 1HB ALA 27 -1.987 1.425 12.120 207 2HB ALA 27 2HB ALA 27 -0.324 0.845 12.201 208 3HB ALA 27 3HB ALA 27 -1.182 0.847 10.660 209 H ASP 28 H ASP 28 -2.494 0.005 14.360 210 HA ASP 28 HA ASP 28 -0.249 -1.298 15.757 211 1HB ASP 28 1HB ASP 28 -1.520 1.004 16.284 212 2HB ASP 28 2HB ASP 28 -2.530 -0.074 17.249 213 H THR 29 H THR 29 -0.988 -3.483 15.034 214 HA THR 29 HA THR 29 -2.620 -4.758 17.086 215 HB THR 29 HB THR 29 -3.572 -5.319 14.307 216 HG1 THR 29 HG1 THR 29 -4.425 -3.076 15.812 217 1HG2 THR 29 1HG2 THR 29 -4.489 -5.578 17.089 218 2HG2 THR 29 2HG2 THR 29 -5.734 -5.026 15.970 219 3HG2 THR 29 3HG2 THR 29 -4.894 -6.547 15.672 220 H TYR 30 H TYR 30 -3.018 -7.161 15.415 221 HA TYR 30 HA TYR 30 -0.182 -7.866 14.836 222 1HB TYR 30 1HB TYR 30 -0.553 -10.045 15.936 223 2HB TYR 30 2HB TYR 30 -0.795 -8.701 17.055 224 HD1 TYR 30 HD1 TYR 30 -3.138 -7.923 17.575 225 HD2 TYR 30 HD2 TYR 30 -2.337 -11.544 15.407 226 HE1 TYR 30 HE1 TYR 30 -5.442 -8.711 18.041 227 HE2 TYR 30 HE2 TYR 30 -4.642 -12.332 15.873 228 HH TYR 30 HH TYR 30 -7.082 -10.310 17.001 229 H ARG 31 H ARG 31 -2.235 -7.106 12.989 230 HA ARG 31 HA ARG 31 -2.320 -9.583 11.352 231 1HB ARG 31 1HB ARG 31 -4.710 -7.785 11.877 232 2HB ARG 31 2HB ARG 31 -4.669 -9.098 10.699 233 1HG ARG 31 1HG ARG 31 -3.830 -10.455 12.862 234 2HG ARG 31 2HG ARG 31 -4.800 -9.223 13.670 235 1HD ARG 31 1HD ARG 31 -6.016 -10.507 11.279 236 2HD ARG 31 2HD ARG 31 -5.864 -11.512 12.719 237 HE ARG 31 HE ARG 31 -6.969 -8.962 13.434 238 1HH1 ARG 31 1HH1 ARG 31 -7.785 -11.957 11.821 239 2HH1 ARG 31 2HH1 ARG 31 -9.467 -11.815 12.191 240 1HH2 ARG 31 1HH2 ARG 31 -9.154 -8.820 13.893 241 2HH2 ARG 31 2HH2 ARG 31 -10.236 -10.060 13.351 242 H LYS 32 H LYS 32 -1.404 -9.056 9.424 243 HA LYS 32 HA LYS 32 -1.576 -6.203 8.534 244 1HB LYS 32 1HB LYS 32 0.466 -7.981 7.295 245 2HB LYS 32 2HB LYS 32 0.576 -6.286 7.753 246 1HG LYS 32 1HG LYS 32 0.584 -8.573 9.748 247 2HG LYS 32 2HG LYS 32 2.043 -7.810 9.119 248 1HD LYS 32 1HD LYS 32 1.784 -5.957 10.403 249 2HD LYS 32 2HD LYS 32 0.041 -5.903 10.139 250 1HE LYS 32 1HE LYS 32 -0.014 -6.510 12.348 251 2HE LYS 32 2HE LYS 32 0.194 -8.125 11.674 252 1HZ LYS 32 1HZ LYS 32 2.507 -6.412 12.345 253 2HZ LYS 32 2HZ LYS 32 1.777 -7.415 13.506 254 3HZ LYS 32 3HZ LYS 32 2.471 -8.091 12.110 255 H TRP 33 H TRP 33 -0.777 -6.565 5.872 256 HA TRP 33 HA TRP 33 -3.248 -7.657 4.726 257 1HB TRP 33 1HB TRP 33 -2.220 -5.571 3.800 258 2HB TRP 33 2HB TRP 33 -0.807 -6.495 3.354 259 HD1 TRP 33 HD1 TRP 33 -4.324 -7.900 2.878 260 HE1 TRP 33 HE1 TRP 33 -4.759 -8.187 0.340 261 HE3 TRP 33 HE3 TRP 33 -0.156 -5.650 1.068 262 HZ2 TRP 33 HZ2 TRP 33 -3.463 -7.503 -2.141 263 HZ3 TRP 33 HZ3 TRP 33 0.244 -5.487 -1.379 264 HH2 TRP 33 HH2 TRP 33 -1.407 -6.402 -2.974 265 H ARG 34 H ARG 34 -3.408 -9.543 3.560 266 HA ARG 34 HA ARG 34 -0.935 -11.066 2.967 267 1HB ARG 34 1HB ARG 34 -2.581 -11.685 5.167 268 2HB ARG 34 2HB ARG 34 -3.044 -12.844 3.923 269 1HG ARG 34 1HG ARG 34 -1.240 -14.028 4.633 270 2HG ARG 34 2HG ARG 34 -0.303 -12.860 3.704 271 1HD ARG 34 1HD ARG 34 0.713 -12.247 5.618 272 2HD ARG 34 2HD ARG 34 -0.832 -11.613 6.185 273 HE ARG 34 HE ARG 34 -0.869 -14.397 6.656 274 1HH1 ARG 34 1HH1 ARG 34 0.944 -11.592 7.690 275 2HH1 ARG 34 2HH1 ARG 34 1.306 -12.272 9.238 276 1HH2 ARG 34 1HH2 ARG 34 -0.377 -15.238 8.669 277 2HH2 ARG 34 2HH2 ARG 34 0.567 -14.313 9.788 278 H ALA 35 H ALA 35 -1.073 -11.754 0.889 279 HA ALA 35 HA ALA 35 -3.223 -11.219 -0.845 280 1HB ALA 35 1HB ALA 35 -0.864 -11.869 -1.499 281 2HB ALA 35 2HB ALA 35 -1.292 -13.542 -1.147 282 3HB ALA 35 3HB ALA 35 -2.124 -12.672 -2.435 283 H ALA 36 H ALA 36 -4.893 -12.483 -1.698 284 HA ALA 36 HA ALA 36 -6.292 -14.170 0.102 285 1HB ALA 36 1HB ALA 36 -6.979 -12.871 -2.131 286 2HB ALA 36 2HB ALA 36 -6.747 -14.474 -2.827 287 3HB ALA 36 3HB ALA 36 -7.915 -14.238 -1.527 288 H LYS 37 H LYS 37 -3.702 -14.901 -2.093 289 HA LYS 37 HA LYS 37 -3.942 -17.762 -1.354 290 1HB LYS 37 1HB LYS 37 -3.275 -18.356 -3.698 291 2HB LYS 37 2HB LYS 37 -4.869 -17.612 -3.602 292 1HG LYS 37 1HG LYS 37 -3.815 -15.406 -4.145 293 2HG LYS 37 2HG LYS 37 -2.280 -16.241 -4.379 294 1HD LYS 37 1HD LYS 37 -3.505 -17.728 -6.061 295 2HD LYS 37 2HD LYS 37 -4.827 -16.562 -5.974 296 1HE LYS 37 1HE LYS 37 -3.441 -14.790 -6.791 297 2HE LYS 37 2HE LYS 37 -1.978 -15.753 -6.590 298 1HZ LYS 37 1HZ LYS 37 -4.162 -16.650 -8.360 299 2HZ LYS 37 2HZ LYS 37 -2.984 -15.562 -8.914 300 3HZ LYS 37 3HZ LYS 37 -2.525 -17.107 -8.373 301 H ALA 38 H ALA 38 -1.726 -18.735 -2.529 302 HA ALA 38 HA ALA 38 0.459 -17.173 -1.247 303 1HB ALA 38 1HB ALA 38 0.074 -19.601 -0.635 304 2HB ALA 38 2HB ALA 38 0.541 -20.023 -2.282 305 3HB ALA 38 3HB ALA 38 1.703 -19.244 -1.209 306 H GLY 39 H GLY 39 2.612 -18.292 -2.711 307 1HA GLY 39 1HA GLY 39 3.842 -17.935 -4.680 308 2HA GLY 39 2HA GLY 39 2.311 -18.043 -5.553 309 H GLU 40 H GLU 40 3.294 -15.752 -3.044 310 HA GLU 40 HA GLU 40 2.125 -13.460 -4.051 311 1HB GLU 40 1HB GLU 40 4.763 -13.646 -2.582 312 2HB GLU 40 2HB GLU 40 3.781 -12.189 -2.743 313 1HG GLU 40 1HG GLU 40 2.156 -14.399 -1.798 314 2HG GLU 40 2HG GLU 40 3.561 -14.179 -0.769 315 H LYS 41 H LYS 41 2.324 -13.350 -6.245 316 HA LYS 41 HA LYS 41 5.022 -12.793 -7.395 317 1HB LYS 41 1HB LYS 41 3.309 -14.493 -8.419 318 2HB LYS 41 2HB LYS 41 2.496 -13.048 -9.016 319 1HG LYS 41 1HG LYS 41 3.925 -13.301 -10.781 320 2HG LYS 41 2HG LYS 41 5.055 -12.469 -9.713 321 1HD LYS 41 1HD LYS 41 6.336 -14.320 -10.211 322 2HD LYS 41 2HD LYS 41 5.452 -14.964 -8.826 323 1HE LYS 41 1HE LYS 41 3.681 -15.537 -10.782 324 2HE LYS 41 2HE LYS 41 5.177 -15.610 -11.714 325 1HZ LYS 41 1HZ LYS 41 6.054 -17.070 -9.892 326 2HZ LYS 41 2HZ LYS 41 4.467 -17.161 -9.293 327 3HZ LYS 41 3HZ LYS 41 4.828 -17.753 -10.844 328 H THR 42 H THR 42 1.682 -11.557 -7.437 329 HA THR 42 HA THR 42 2.628 -8.798 -7.221 330 HB THR 42 HB THR 42 1.280 -8.154 -9.324 331 HG1 THR 42 HG1 THR 42 1.118 -9.818 -10.846 332 1HG2 THR 42 1HG2 THR 42 3.910 -8.505 -8.952 333 2HG2 THR 42 2HG2 THR 42 3.647 -9.755 -10.167 334 3HG2 THR 42 3HG2 THR 42 3.238 -8.078 -10.526 335 H ILE 43 H ILE 43 1.228 -8.064 -5.691 336 HA ILE 43 HA ILE 43 -1.644 -8.903 -5.918 337 HB ILE 43 HB ILE 43 -1.705 -8.454 -3.405 338 1HG1 ILE 43 1HG1 ILE 43 1.297 -8.660 -3.737 339 2HG1 ILE 43 2HG1 ILE 43 0.411 -7.195 -3.309 340 1HG2 ILE 43 1HG2 ILE 43 -1.298 -10.724 -4.776 341 2HG2 ILE 43 2HG2 ILE 43 0.196 -10.684 -3.845 342 3HG2 ILE 43 3HG2 ILE 43 -1.356 -10.675 -3.016 343 1HD1 ILE 43 1HD1 ILE 43 -0.594 -8.793 -1.420 344 2HD1 ILE 43 2HD1 ILE 43 0.935 -9.638 -1.666 345 3HD1 ILE 43 3HD1 ILE 43 0.932 -7.941 -1.182 346 H SER 44 H SER 44 -3.227 -7.281 -5.505 347 HA SER 44 HA SER 44 -2.106 -4.516 -5.277 348 1HB SER 44 1HB SER 44 -4.647 -4.662 -6.712 349 2HB SER 44 2HB SER 44 -3.176 -3.804 -7.131 350 HG SER 44 HG SER 44 -3.817 -5.585 -8.556 351 H VAL 45 H VAL 45 -3.324 -3.057 -4.039 352 HA VAL 45 HA VAL 45 -5.866 -3.938 -2.854 353 HB VAL 45 HB VAL 45 -4.199 -4.966 -1.342 354 1HG1 VAL 45 1HG1 VAL 45 -2.466 -3.102 -1.884 355 2HG1 VAL 45 2HG1 VAL 45 -3.260 -2.205 -0.593 356 3HG1 VAL 45 3HG1 VAL 45 -2.505 -3.760 -0.253 357 1HG2 VAL 45 1HG2 VAL 45 -5.688 -2.558 -0.270 358 2HG2 VAL 45 2HG2 VAL 45 -6.233 -4.235 -0.292 359 3HG2 VAL 45 3HG2 VAL 45 -4.909 -3.752 0.768 360 H VAL 46 H VAL 46 -7.010 -2.138 -3.399 361 HA VAL 46 HA VAL 46 -5.740 0.520 -3.138 362 HB VAL 46 HB VAL 46 -8.557 -0.064 -4.060 363 1HG1 VAL 46 1HG1 VAL 46 -7.676 2.289 -3.430 364 2HG1 VAL 46 2HG1 VAL 46 -6.728 2.170 -4.911 365 3HG1 VAL 46 3HG1 VAL 46 -8.488 2.101 -4.984 366 1HG2 VAL 46 1HG2 VAL 46 -5.945 -0.442 -5.442 367 2HG2 VAL 46 2HG2 VAL 46 -7.480 -1.268 -5.704 368 3HG2 VAL 46 3HG2 VAL 46 -7.222 0.343 -6.370 369 H LEU 47 H LEU 47 -5.948 1.615 -1.288 370 HA LEU 47 HA LEU 47 -8.075 0.803 0.624 371 1HB LEU 47 1HB LEU 47 -5.835 2.744 1.194 372 2HB LEU 47 2HB LEU 47 -6.769 1.778 2.333 373 HG LEU 47 HG LEU 47 -5.583 -0.090 0.561 374 1HD1 LEU 47 1HD1 LEU 47 -4.092 1.982 0.042 375 2HD1 LEU 47 2HD1 LEU 47 -3.418 1.701 1.647 376 3HD1 LEU 47 3HD1 LEU 47 -3.302 0.450 0.411 377 1HD2 LEU 47 1HD2 LEU 47 -6.003 0.096 3.205 378 2HD2 LEU 47 2HD2 LEU 47 -4.821 -1.025 2.528 379 3HD2 LEU 47 3HD2 LEU 47 -4.292 0.524 3.184 380 H GLN 48 H GLN 48 -9.258 2.547 1.756 381 HA GLN 48 HA GLN 48 -9.772 4.829 -0.094 382 1HB GLN 48 1HB GLN 48 -11.533 3.011 1.030 383 2HB GLN 48 2HB GLN 48 -11.694 4.408 2.093 384 1HG GLN 48 1HG GLN 48 -11.734 4.752 -0.900 385 2HG GLN 48 2HG GLN 48 -13.197 4.291 -0.031 386 1HE2 GLN 48 2HE2 GLN 48 -13.118 5.793 2.276 387 2HE2 GLN 48 1HE2 GLN 48 -13.062 7.450 1.918 388 H LEU 49 H LEU 49 -9.346 6.872 0.598 389 HA LEU 49 HA LEU 49 -8.097 7.283 3.204 390 1HB LEU 49 1HB LEU 49 -8.657 9.035 0.802 391 2HB LEU 49 2HB LEU 49 -8.090 9.723 2.321 392 HG LEU 49 HG LEU 49 -6.202 9.282 0.805 393 1HD1 LEU 49 1HD1 LEU 49 -6.304 8.694 3.444 394 2HD1 LEU 49 2HD1 LEU 49 -5.840 7.117 2.803 395 3HD1 LEU 49 3HD1 LEU 49 -4.837 8.531 2.477 396 1HD2 LEU 49 1HD2 LEU 49 -7.417 7.315 -0.314 397 2HD2 LEU 49 2HD2 LEU 49 -5.689 7.111 -0.026 398 3HD2 LEU 49 3HD2 LEU 49 -6.858 6.340 1.045 399 H GLU 50 H GLU 50 -9.102 8.276 4.902 400 HA GLU 50 HA GLU 50 -12.019 8.519 4.828 401 1HB GLU 50 1HB GLU 50 -11.751 9.136 7.244 402 2HB GLU 50 2HB GLU 50 -10.999 7.597 6.827 403 1HG GLU 50 1HG GLU 50 -8.889 8.377 7.197 404 2HG GLU 50 2HG GLU 50 -9.249 9.963 6.512 405 H LYS 51 H LYS 51 -10.709 10.422 3.102 406 HA LYS 51 HA LYS 51 -12.075 12.771 3.392 407 1HB LYS 51 1HB LYS 51 -10.258 14.332 4.328 408 2HB LYS 51 2HB LYS 51 -11.117 13.356 5.515 409 1HG LYS 51 1HG LYS 51 -9.276 12.091 6.005 410 2HG LYS 51 2HG LYS 51 -8.704 12.097 4.336 411 1HD LYS 51 1HD LYS 51 -7.922 14.411 4.591 412 2HD LYS 51 2HD LYS 51 -8.526 14.443 6.248 413 1HE LYS 51 1HE LYS 51 -6.518 12.389 5.312 414 2HE LYS 51 2HE LYS 51 -6.028 13.951 5.967 415 1HZ LYS 51 1HZ LYS 51 -7.565 13.349 7.899 416 2HZ LYS 51 2HZ LYS 51 -7.477 11.760 7.312 417 3HZ LYS 51 3HZ LYS 51 -6.062 12.560 7.805 418 H GLU 52 H GLU 52 -11.703 13.861 1.481 419 HA GLU 52 HA GLU 52 -9.585 12.918 -0.282 420 1HB GLU 52 1HB GLU 52 -11.997 13.866 -0.852 421 2HB GLU 52 2HB GLU 52 -11.143 15.404 -0.833 422 1HG GLU 52 1HG GLU 52 -9.656 14.731 -2.565 423 2HG GLU 52 2HG GLU 52 -10.149 13.045 -2.426 424 H GLU 53 H GLU 53 -7.569 13.550 0.231 425 HA GLU 53 HA GLU 53 -7.048 16.457 0.572 426 1HB GLU 53 1HB GLU 53 -5.139 15.528 2.220 427 2HB GLU 53 2HB GLU 53 -6.736 15.975 2.808 428 1HG GLU 53 1HG GLU 53 -5.973 13.768 3.681 429 2HG GLU 53 2HG GLU 53 -7.453 13.639 2.736 430 H GLN 54 H GLN 54 -4.488 16.675 0.598 431 HA GLN 54 HA GLN 54 -3.578 15.391 -1.905 432 1HB GLN 54 1HB GLN 54 -2.307 17.569 -0.210 433 2HB GLN 54 2HB GLN 54 -1.719 17.021 -1.778 434 1HG GLN 54 1HG GLN 54 -3.596 17.870 -2.919 435 2HG GLN 54 2HG GLN 54 -4.537 18.008 -1.444 436 1HE2 GLN 54 2HE2 GLN 54 -1.149 19.093 -1.797 437 2HE2 GLN 54 1HE2 GLN 54 -1.488 20.741 -1.575 438 H ILE 55 H ILE 55 -1.073 14.819 -1.812 439 HA ILE 55 HA ILE 55 -0.502 13.418 0.767 440 HB ILE 55 HB ILE 55 0.007 12.288 -2.002 441 1HG1 ILE 55 1HG1 ILE 55 -1.775 10.599 -0.815 442 2HG1 ILE 55 2HG1 ILE 55 -2.313 12.142 -0.153 443 1HG2 ILE 55 1HG2 ILE 55 0.549 11.380 0.810 444 2HG2 ILE 55 2HG2 ILE 55 0.228 10.178 -0.440 445 3HG2 ILE 55 3HG2 ILE 55 1.590 11.286 -0.611 446 1HD1 ILE 55 1HD1 ILE 55 -2.007 12.886 -2.716 447 2HD1 ILE 55 2HD1 ILE 55 -2.344 11.173 -2.971 448 3HD1 ILE 55 3HD1 ILE 55 -3.510 12.184 -2.116 449 H HIS 56 H HIS 56 1.380 14.186 1.570 450 HA HIS 56 HA HIS 56 3.430 15.214 -0.347 451 1HB HIS 56 1HB HIS 56 2.364 16.713 1.513 452 2HB HIS 56 2HB HIS 56 3.428 15.820 2.600 453 HD1 HIS 56 HD1 HIS 56 3.663 17.822 -0.639 454 HD2 HIS 56 HD2 HIS 56 6.019 16.797 2.644 455 HE1 HIS 56 HE1 HIS 56 5.846 19.080 -0.902 456 H SER 57 H SER 57 2.824 13.006 2.315 457 HA SER 57 HA SER 57 5.422 11.705 1.741 458 1HB SER 57 1HB SER 57 4.621 12.866 4.399 459 2HB SER 57 2HB SER 57 5.680 11.463 4.326 460 HG SER 57 HG SER 57 6.708 13.607 4.312 461 H VAL 58 H VAL 58 5.429 9.471 2.445 462 HA VAL 58 HA VAL 58 2.772 8.417 3.296 463 HB VAL 58 HB VAL 58 4.376 7.650 0.843 464 1HG1 VAL 58 1HG1 VAL 58 2.140 6.164 2.217 465 2HG1 VAL 58 2HG1 VAL 58 2.501 5.952 0.505 466 3HG1 VAL 58 3HG1 VAL 58 3.713 5.551 1.717 467 1HG2 VAL 58 1HG2 VAL 58 1.737 8.940 1.404 468 2HG2 VAL 58 2HG2 VAL 58 2.953 9.356 0.195 469 3HG2 VAL 58 3HG2 VAL 58 1.903 7.960 -0.053 470 H ASP 59 H ASP 59 2.949 6.102 4.017 471 HA ASP 59 HA ASP 59 5.686 5.212 4.794 472 1HB ASP 59 1HB ASP 59 3.527 6.184 6.587 473 2HB ASP 59 2HB ASP 59 4.334 4.704 7.098 474 H ILE 60 H ILE 60 5.795 3.010 4.344 475 HA ILE 60 HA ILE 60 3.423 1.313 4.801 476 HB ILE 60 HB ILE 60 4.624 1.851 2.086 477 1HG1 ILE 60 1HG1 ILE 60 2.062 1.372 1.621 478 2HG1 ILE 60 2HG1 ILE 60 1.917 1.700 3.345 479 1HG2 ILE 60 1HG2 ILE 60 3.672 -0.802 3.087 480 2HG2 ILE 60 2HG2 ILE 60 3.194 -0.313 1.461 481 3HG2 ILE 60 3HG2 ILE 60 4.902 -0.437 1.879 482 1HD1 ILE 60 1HD1 ILE 60 3.612 3.708 2.329 483 2HD1 ILE 60 2HD1 ILE 60 2.288 3.562 1.173 484 3HD1 ILE 60 3HD1 ILE 60 1.944 3.893 2.871 485 H GLY 61 H GLY 61 4.027 -0.710 5.467 486 1HA GLY 61 1HA GLY 61 6.946 -1.209 5.607 487 2HA GLY 61 2HA GLY 61 5.778 -1.941 6.687 488 H ASN 62 H ASN 62 7.782 -2.737 4.385 489 HA ASN 62 HA ASN 62 6.075 -4.358 2.640 490 1HB ASN 62 1HB ASN 62 8.275 -5.143 1.712 491 2HB ASN 62 2HB ASN 62 8.075 -3.391 1.676 492 1HD2 ASN 62 2HD2 ASN 62 9.810 -6.040 3.265 493 2HD2 ASN 62 1HD2 ASN 62 10.940 -5.055 4.062 494 H ASP 63 H ASP 63 5.385 -6.390 3.167 495 HA ASP 63 HA ASP 63 6.732 -7.823 5.403 496 1HB ASP 63 1HB ASP 63 4.095 -7.509 4.943 497 2HB ASP 63 2HB ASP 63 4.359 -8.975 4.000 498 H GLY 64 H GLY 64 8.585 -8.012 3.800 499 1HA GLY 64 1HA GLY 64 9.894 -9.596 2.608 500 2HA GLY 64 2HA GLY 64 8.470 -10.628 2.469 501 H SER 65 H SER 65 7.662 -7.464 1.600 502 HA SER 65 HA SER 65 7.338 -8.159 -1.206 503 1HB SER 65 1HB SER 65 6.956 -5.555 0.298 504 2HB SER 65 2HB SER 65 6.464 -5.835 -1.366 505 HG SER 65 HG SER 65 5.425 -6.842 1.030 506 H ALA 66 H ALA 66 8.158 -6.656 -2.904 507 HA ALA 66 HA ALA 66 10.864 -5.595 -2.235 508 1HB ALA 66 1HB ALA 66 10.508 -7.850 -3.694 509 2HB ALA 66 2HB ALA 66 10.419 -6.643 -4.976 510 3HB ALA 66 3HB ALA 66 11.851 -6.740 -3.953 511 H PHE 67 H PHE 67 8.368 -5.627 -4.800 512 HA PHE 67 HA PHE 67 9.001 -2.750 -5.306 513 1HB PHE 67 1HB PHE 67 7.365 -4.651 -7.007 514 2HB PHE 67 2HB PHE 67 7.898 -3.040 -7.458 515 HD1 PHE 67 HD1 PHE 67 10.642 -2.851 -6.663 516 HD2 PHE 67 HD2 PHE 67 8.534 -6.246 -8.234 517 HE1 PHE 67 HE1 PHE 67 12.778 -3.792 -7.484 518 HE2 PHE 67 HE2 PHE 67 10.663 -7.194 -9.049 519 HZ PHE 67 HZ PHE 67 12.794 -5.970 -8.681 520 H VAL 68 H VAL 68 7.647 -1.293 -4.431 521 HA VAL 68 HA VAL 68 4.811 -2.153 -3.957 522 HB VAL 68 HB VAL 68 6.435 -0.193 -2.311 523 1HG1 VAL 68 1HG1 VAL 68 3.574 -1.136 -2.260 524 2HG1 VAL 68 2HG1 VAL 68 4.371 -0.664 -0.759 525 3HG1 VAL 68 3HG1 VAL 68 4.202 0.501 -2.072 526 1HG2 VAL 68 1HG2 VAL 68 7.049 -2.643 -2.149 527 2HG2 VAL 68 2HG2 VAL 68 6.479 -1.930 -0.640 528 3HG2 VAL 68 3HG2 VAL 68 5.403 -2.947 -1.596 529 H GLU 69 H GLU 69 3.748 -1.286 -5.629 530 HA GLU 69 HA GLU 69 4.368 1.417 -6.632 531 1HB GLU 69 1HB GLU 69 3.772 -0.469 -8.172 532 2HB GLU 69 2HB GLU 69 2.156 -0.473 -7.467 533 1HG GLU 69 1HG GLU 69 1.537 1.451 -8.532 534 2HG GLU 69 2HG GLU 69 3.140 2.171 -8.381 535 H VAL 70 H VAL 70 2.970 3.180 -6.515 536 HA VAL 70 HA VAL 70 0.559 2.886 -4.792 537 HB VAL 70 HB VAL 70 2.689 5.029 -4.483 538 1HG1 VAL 70 1HG1 VAL 70 0.144 4.473 -2.920 539 2HG1 VAL 70 2HG1 VAL 70 1.345 5.698 -2.510 540 3HG1 VAL 70 3HG1 VAL 70 0.410 5.842 -3.999 541 1HG2 VAL 70 1HG2 VAL 70 2.062 2.480 -3.021 542 2HG2 VAL 70 2HG2 VAL 70 3.632 3.156 -3.459 543 3HG2 VAL 70 3HG2 VAL 70 2.713 3.851 -2.122 544 H LEU 71 H LEU 71 -1.123 3.675 -5.930 545 HA LEU 71 HA LEU 71 -0.640 5.884 -7.876 546 1HB LEU 71 1HB LEU 71 -2.021 3.338 -8.116 547 2HB LEU 71 2HB LEU 71 -3.124 4.670 -8.454 548 HG LEU 71 HG LEU 71 -1.271 5.588 -9.979 549 1HD1 LEU 71 1HD1 LEU 71 0.379 3.879 -8.884 550 2HD1 LEU 71 2HD1 LEU 71 -0.314 2.738 -10.037 551 3HD1 LEU 71 3HD1 LEU 71 0.498 4.192 -10.616 552 1HD2 LEU 71 1HD2 LEU 71 -2.568 2.930 -10.659 553 2HD2 LEU 71 2HD2 LEU 71 -3.331 4.513 -10.821 554 3HD2 LEU 71 3HD2 LEU 71 -1.945 4.094 -11.829 555 H VAL 72 H VAL 72 -2.585 7.338 -8.091 556 HA VAL 72 HA VAL 72 -4.049 7.580 -5.494 557 HB VAL 72 HB VAL 72 -3.877 10.056 -5.893 558 1HG1 VAL 72 1HG1 VAL 72 -1.326 8.477 -5.496 559 2HG1 VAL 72 2HG1 VAL 72 -1.528 10.177 -5.072 560 3HG1 VAL 72 3HG1 VAL 72 -2.470 8.942 -4.237 561 1HG2 VAL 72 1HG2 VAL 72 -3.323 9.933 -8.294 562 2HG2 VAL 72 2HG2 VAL 72 -2.076 10.811 -7.409 563 3HG2 VAL 72 3HG2 VAL 72 -1.800 9.140 -7.897 564 H GLY 73 H GLY 73 -6.077 8.884 -5.694 565 1HA GLY 73 1HA GLY 73 -7.252 9.685 -8.106 566 2HA GLY 73 2HA GLY 73 -7.691 7.995 -7.878 567 H SER 74 H SER 74 -9.672 9.758 -7.904 568 HA SER 74 HA SER 74 -10.428 10.180 -5.070 569 1HB SER 74 1HB SER 74 -10.448 12.285 -6.210 570 2HB SER 74 2HB SER 74 -11.266 11.595 -7.602 571 HG SER 74 HG SER 74 -12.259 12.410 -5.150 572 H SER 75 H SER 75 -12.697 9.800 -4.597 573 HA SER 75 HA SER 75 -13.740 7.461 -6.065 574 1HB SER 75 1HB SER 75 -13.567 7.651 -3.474 575 2HB SER 75 2HB SER 75 -14.992 8.678 -3.607 576 HG SER 75 HG SER 75 -16.123 6.995 -4.453 577 H ALA 76 H ALA 76 -13.881 10.583 -6.721 578 HA ALA 76 HA ALA 76 -16.596 11.360 -6.677 579 1HB ALA 76 1HB ALA 76 -14.358 12.039 -8.595 580 2HB ALA 76 2HB ALA 76 -15.941 12.815 -8.651 581 3HB ALA 76 3HB ALA 76 -14.923 12.993 -7.222 582 H GLY 77 H GLY 77 -14.857 10.215 -9.588 583 1HA GLY 77 1HA GLY 77 -17.217 8.560 -10.301 584 2HA GLY 77 2HA GLY 77 -16.694 9.791 -11.454 585 H GLY 78 H GLY 78 -15.014 7.367 -9.418 586 1HA GLY 78 1HA GLY 78 -12.906 6.929 -11.307 587 2HA GLY 78 2HA GLY 78 -13.308 5.854 -9.968 588 H ALA 79 H ALA 79 -13.956 6.582 -13.349 589 HA ALA 79 HA ALA 79 -15.776 4.296 -13.660 590 1HB ALA 79 1HB ALA 79 -16.048 6.368 -15.015 591 2HB ALA 79 2HB ALA 79 -14.482 6.057 -15.765 592 3HB ALA 79 3HB ALA 79 -15.820 4.939 -16.024 593 H GLY 80 H GLY 80 -14.318 2.598 -12.942 594 1HA GLY 80 1HA GLY 80 -13.193 0.671 -13.935 595 2HA GLY 80 2HA GLY 80 -12.431 1.761 -15.094 596 H GLU 81 H GLU 81 -10.814 0.022 -13.721 597 HA GLU 81 HA GLU 81 -9.734 1.255 -11.307 598 1HB GLU 81 1HB GLU 81 -8.648 -0.953 -13.079 599 2HB GLU 81 2HB GLU 81 -7.982 -0.495 -11.511 600 1HG GLU 81 1HG GLU 81 -9.805 -1.331 -10.337 601 2HG GLU 81 2HG GLU 81 -10.903 -1.140 -11.704 602 H GLN 82 H GLN 82 -9.485 2.146 -14.528 603 HA GLN 82 HA GLN 82 -6.649 2.986 -14.320 604 1HB GLN 82 1HB GLN 82 -6.968 3.682 -16.705 605 2HB GLN 82 2HB GLN 82 -7.284 1.968 -16.434 606 1HG GLN 82 1HG GLN 82 -9.640 2.280 -16.512 607 2HG GLN 82 2HG GLN 82 -9.491 4.030 -16.350 608 1HE2 GLN 82 2HE2 GLN 82 -8.044 5.025 -18.247 609 2HE2 GLN 82 1HE2 GLN 82 -8.391 4.432 -19.799 610 H ASP 83 H ASP 83 -8.943 4.221 -12.761 611 HA ASP 83 HA ASP 83 -8.944 6.967 -13.911 612 1HB ASP 83 1HB ASP 83 -11.004 5.571 -12.861 613 2HB ASP 83 2HB ASP 83 -10.421 6.368 -11.400 614 H TYR 84 H TYR 84 -6.656 5.551 -12.410 615 HA TYR 84 HA TYR 84 -6.278 7.619 -10.305 616 1HB TYR 84 1HB TYR 84 -5.382 4.722 -10.420 617 2HB TYR 84 2HB TYR 84 -4.652 5.888 -9.323 618 HD1 TYR 84 HD1 TYR 84 -8.167 5.018 -10.385 619 HD2 TYR 84 HD2 TYR 84 -5.440 5.756 -7.153 620 HE1 TYR 84 HE1 TYR 84 -9.996 4.647 -8.763 621 HE2 TYR 84 HE2 TYR 84 -7.273 5.388 -5.528 622 HH TYR 84 HH TYR 84 -9.530 4.035 -5.587 623 H GLU 85 H GLU 85 -4.022 8.331 -10.128 624 HA GLU 85 HA GLU 85 -2.509 7.905 -12.662 625 1HB GLU 85 1HB GLU 85 -1.977 10.142 -12.831 626 2HB GLU 85 2HB GLU 85 -3.551 10.266 -12.065 627 1HG GLU 85 1HG GLU 85 -2.481 11.591 -10.567 628 2HG GLU 85 2HG GLU 85 -1.894 10.080 -9.886 629 H VAL 86 H VAL 86 -0.268 7.578 -12.516 630 HA VAL 86 HA VAL 86 0.609 6.176 -10.184 631 HB VAL 86 HB VAL 86 2.291 7.313 -12.437 632 1HG1 VAL 86 1HG1 VAL 86 3.551 6.559 -10.416 633 2HG1 VAL 86 2HG1 VAL 86 2.788 4.976 -10.564 634 3HG1 VAL 86 3HG1 VAL 86 3.876 5.552 -11.827 635 1HG2 VAL 86 1HG2 VAL 86 0.213 5.613 -12.771 636 2HG2 VAL 86 2HG2 VAL 86 1.686 5.514 -13.734 637 3HG2 VAL 86 3HG2 VAL 86 1.469 4.452 -12.344 638 H LEU 87 H LEU 87 0.413 7.578 -8.394 639 HA LEU 87 HA LEU 87 1.753 10.157 -8.258 640 1HB LEU 87 1HB LEU 87 -0.192 9.572 -6.833 641 2HB LEU 87 2HB LEU 87 0.753 8.304 -6.067 642 HG LEU 87 HG LEU 87 2.382 10.534 -5.792 643 1HD1 LEU 87 1HD1 LEU 87 -0.385 11.414 -6.137 644 2HD1 LEU 87 2HD1 LEU 87 0.258 11.879 -4.563 645 3HD1 LEU 87 3HD1 LEU 87 1.090 12.374 -6.036 646 1HD2 LEU 87 1HD2 LEU 87 0.422 9.108 -4.005 647 2HD2 LEU 87 2HD2 LEU 87 2.185 9.081 -3.963 648 3HD2 LEU 87 3HD2 LEU 87 1.311 10.502 -3.390 649 H LEU 88 H LEU 88 2.377 7.036 -6.638 650 HA LEU 88 HA LEU 88 5.257 7.770 -6.571 651 1HB LEU 88 1HB LEU 88 4.952 7.681 -4.353 652 2HB LEU 88 2HB LEU 88 3.414 6.880 -4.531 653 HG LEU 88 HG LEU 88 4.628 4.709 -4.846 654 1HD1 LEU 88 1HD1 LEU 88 6.748 6.012 -5.580 655 2HD1 LEU 88 2HD1 LEU 88 7.069 6.157 -3.851 656 3HD1 LEU 88 3HD1 LEU 88 6.958 4.563 -4.597 657 1HD2 LEU 88 1HD2 LEU 88 3.790 5.544 -2.613 658 2HD2 LEU 88 2HD2 LEU 88 5.155 4.432 -2.495 659 3HD2 LEU 88 3HD2 LEU 88 5.410 6.167 -2.303 660 H VAL 89 H VAL 89 6.413 6.552 -7.973 661 HA VAL 89 HA VAL 89 5.390 4.266 -9.353 662 HB VAL 89 HB VAL 89 8.350 4.727 -8.965 663 1HG1 VAL 89 1HG1 VAL 89 6.551 3.486 -11.004 664 2HG1 VAL 89 2HG1 VAL 89 8.063 4.209 -11.554 665 3HG1 VAL 89 3HG1 VAL 89 8.090 2.907 -10.365 666 1HG2 VAL 89 1HG2 VAL 89 6.376 6.412 -10.503 667 2HG2 VAL 89 2HG2 VAL 89 7.709 6.939 -9.475 668 3HG2 VAL 89 3HG2 VAL 89 8.040 6.252 -11.064 669 H THR 90 H THR 90 6.620 2.049 -9.251 670 HA THR 90 HA THR 90 6.201 0.954 -6.653 671 HB THR 90 HB THR 90 6.209 -0.173 -9.056 672 HG1 THR 90 HG1 THR 90 6.049 -2.032 -7.975 673 1HG2 THR 90 1HG2 THR 90 8.820 0.193 -9.093 674 2HG2 THR 90 2HG2 THR 90 8.837 -1.248 -8.077 675 3HG2 THR 90 3HG2 THR 90 8.136 -1.318 -9.693 676 H SER 91 H SER 91 7.527 0.688 -4.968 677 HA SER 91 HA SER 91 10.260 1.801 -5.184 678 1HB SER 91 1HB SER 91 9.983 1.375 -2.553 679 2HB SER 91 2HB SER 91 9.326 2.811 -3.332 680 HG SER 91 HG SER 91 7.996 1.075 -1.965 681 H SER 92 H SER 92 11.889 0.418 -5.391 682 HA SER 92 HA SER 92 11.525 -2.459 -4.866 683 1HB SER 92 1HB SER 92 13.795 -2.658 -5.848 684 2HB SER 92 2HB SER 92 12.708 -1.762 -6.904 685 HG SER 92 HG SER 92 14.832 -0.855 -5.302 686 H PHE 93 H PHE 93 11.441 -2.578 -2.578 687 HA PHE 93 HA PHE 93 13.547 -1.326 -0.966 688 1HB PHE 93 1HB PHE 93 11.296 -3.198 -0.236 689 2HB PHE 93 2HB PHE 93 12.392 -2.471 0.932 690 HD1 PHE 93 HD1 PHE 93 12.731 0.261 -0.083 691 HD2 PHE 93 HD2 PHE 93 9.196 -2.186 0.088 692 HE1 PHE 93 HE1 PHE 93 11.324 2.298 -0.042 693 HE2 PHE 93 HE2 PHE 93 7.794 -0.140 0.130 694 HZ PHE 93 HZ PHE 93 8.860 2.097 0.066 695 H MET 94 H MET 94 12.499 -4.691 -1.576 696 HA MET 94 HA MET 94 15.287 -5.548 -0.881 697 1HB MET 94 1HB MET 94 12.769 -7.203 -0.571 698 2HB MET 94 2HB MET 94 14.383 -7.602 0.009 699 1HG MET 94 1HG MET 94 14.277 -6.086 1.763 700 2HG MET 94 2HG MET 94 13.106 -5.055 0.944 701 1HE MET 94 1HE MET 94 13.823 -8.538 1.984 702 2HE MET 94 2HE MET 94 12.411 -9.145 2.845 703 3HE MET 94 3HE MET 94 12.426 -9.111 1.076 704 H SER 95 H SER 95 15.220 -8.128 -1.703 705 HA SER 95 HA SER 95 14.636 -7.953 -4.631 706 1HB SER 95 1HB SER 95 16.610 -9.177 -5.070 707 2HB SER 95 2HB SER 95 17.100 -8.105 -3.766 708 HG SER 95 HG SER 95 17.450 -9.804 -2.597 709 HA PRO 96 HA PRO 96 12.284 -11.703 -4.049 710 1HB PRO 96 1HB PRO 96 12.833 -13.138 -6.305 711 2HB PRO 96 2HB PRO 96 11.874 -11.650 -6.305 712 1HG PRO 96 1HG PRO 96 14.584 -12.116 -7.332 713 2HG PRO 96 2HG PRO 96 13.444 -10.817 -7.710 714 1HD PRO 96 1HD PRO 96 15.717 -10.714 -5.942 715 2HD PRO 96 2HD PRO 96 14.571 -9.411 -6.325 716 H SER 97 H SER 97 15.418 -11.864 -3.326 717 HA SER 97 HA SER 97 15.436 -14.841 -3.065 718 1HB SER 97 1HB SER 97 17.854 -14.784 -3.236 719 2HB SER 97 2HB SER 97 17.184 -13.917 -4.615 720 HG SER 97 HG SER 97 18.327 -12.299 -3.937 721 H GLU 98 H GLU 98 16.269 -11.743 -1.530 722 HA GLU 98 HA GLU 98 17.041 -13.059 0.966 723 1HB GLU 98 1HB GLU 98 17.558 -10.856 1.750 724 2HB GLU 98 2HB GLU 98 18.050 -10.904 0.066 725 1HG GLU 98 1HG GLU 98 15.531 -10.024 -0.274 726 2HG GLU 98 2HG GLU 98 15.827 -9.387 1.344 727 H SER 99 H SER 99 14.140 -11.692 -0.405 728 HA SER 99 HA SER 99 12.679 -11.077 1.940 729 1HB SER 99 1HB SER 99 10.672 -11.391 0.551 730 2HB SER 99 2HB SER 99 11.913 -10.507 -0.334 731 HG SER 99 HG SER 99 11.844 -12.055 -1.741 732 H ARG 100 H ARG 100 13.617 -14.180 0.676 733 HA ARG 100 HA ARG 100 11.518 -15.723 1.917 734 1HB ARG 100 1HB ARG 100 14.282 -16.409 0.904 735 2HB ARG 100 2HB ARG 100 13.243 -17.617 1.663 736 1HG ARG 100 1HG ARG 100 11.470 -17.118 0.005 737 2HG ARG 100 2HG ARG 100 12.538 -15.948 -0.771 738 1HD ARG 100 1HD ARG 100 13.201 -17.694 -2.060 739 2HD ARG 100 2HD ARG 100 14.135 -18.194 -0.650 740 HE ARG 100 HE ARG 100 11.410 -19.168 -0.520 741 1HH1 ARG 100 1HH1 ARG 100 14.549 -19.742 -1.955 742 2HH1 ARG 100 2HH1 ARG 100 14.256 -21.433 -2.163 743 1HH2 ARG 100 1HH2 ARG 100 11.074 -21.363 -0.808 744 2HH2 ARG 100 2HH2 ARG 100 12.312 -22.343 -1.522 745 H SER 101 H SER 101 14.914 -16.180 2.874 746 HA SER 101 HA SER 101 14.480 -15.213 5.586 747 1HB SER 101 1HB SER 101 13.428 -17.654 5.260 748 2HB SER 101 2HB SER 101 15.106 -18.134 5.495 749 HG SER 101 HG SER 101 15.086 -17.264 7.487 750 H GLY 102 H GLY 102 16.359 -14.681 3.506 751 1HA GLY 102 1HA GLY 102 18.852 -15.875 4.651 752 2HA GLY 102 2HA GLY 102 18.697 -15.381 2.966 753 H SER 103 H SER 103 17.105 -12.921 4.102 754 HA SER 103 HA SER 103 18.926 -11.381 5.663 755 1HB SER 103 1HB SER 103 19.602 -11.631 2.848 756 2HB SER 103 2HB SER 103 19.291 -9.950 3.272 757 HG SER 103 HG SER 103 21.023 -9.946 4.480 758 H ASN 104 H ASN 104 17.657 -9.880 6.504 759 HA ASN 104 HA ASN 104 15.756 -8.565 6.897 760 1HB ASN 104 1HB ASN 104 15.632 -6.658 5.368 761 2HB ASN 104 2HB ASN 104 17.314 -7.062 5.696 762 1HD2 ASN 104 2HD2 ASN 104 18.520 -8.218 3.935 763 2HD2 ASN 104 1HD2 ASN 104 17.976 -8.113 2.328 764 HA PRO 105 HA PRO 105 12.908 -11.033 4.116 765 1HB PRO 105 1HB PRO 105 11.695 -12.460 6.107 766 2HB PRO 105 2HB PRO 105 13.159 -12.999 5.274 767 1HG PRO 105 1HG PRO 105 12.852 -11.856 7.993 768 2HG PRO 105 2HG PRO 105 14.026 -13.035 7.389 769 1HD PRO 105 1HD PRO 105 14.542 -10.321 7.826 770 2HD PRO 105 2HD PRO 105 15.528 -11.406 6.820 771 H ASN 106 H ASN 106 12.469 -9.356 7.179 772 HA ASN 106 HA ASN 106 9.849 -8.335 6.169 773 1HB ASN 106 1HB ASN 106 10.285 -9.953 8.480 774 2HB ASN 106 2HB ASN 106 9.880 -8.336 9.052 775 1HD2 ASN 106 1HD2 ASN 106 8.737 -9.990 6.069 776 2HD2 ASN 106 2HD2 ASN 106 7.093 -9.932 6.487 777 H ARG 107 H ARG 107 10.460 -6.274 5.607 778 HA ARG 107 HA ARG 107 11.703 -4.616 7.759 779 1HB ARG 107 1HB ARG 107 12.805 -5.237 5.195 780 2HB ARG 107 2HB ARG 107 12.346 -3.534 5.171 781 1HG ARG 107 1HG ARG 107 13.534 -3.342 7.439 782 2HG ARG 107 2HG ARG 107 14.217 -4.931 7.092 783 1HD ARG 107 1HD ARG 107 15.405 -4.143 5.212 784 2HD ARG 107 2HD ARG 107 14.414 -2.689 5.086 785 HE ARG 107 HE ARG 107 15.840 -1.659 6.647 786 1HH1 ARG 107 1HH1 ARG 107 16.186 -5.135 6.829 787 2HH1 ARG 107 2HH1 ARG 107 17.487 -5.047 7.965 788 1HH2 ARG 107 1HH2 ARG 107 17.527 -1.592 8.117 789 2HH2 ARG 107 2HH2 ARG 107 18.240 -3.066 8.686 790 H VAL 108 H VAL 108 11.339 -2.162 7.120 791 HA VAL 108 HA VAL 108 8.700 -1.791 5.827 792 HB VAL 108 HB VAL 108 7.708 -0.728 7.660 793 1HG1 VAL 108 1HG1 VAL 108 9.368 -3.029 8.713 794 2HG1 VAL 108 2HG1 VAL 108 8.007 -2.321 9.578 795 3HG1 VAL 108 3HG1 VAL 108 7.747 -3.118 8.026 796 1HG2 VAL 108 1HG2 VAL 108 10.504 -0.485 8.722 797 2HG2 VAL 108 2HG2 VAL 108 9.286 0.774 8.508 798 3HG2 VAL 108 3HG2 VAL 108 9.124 -0.397 9.817 799 H ARG 109 H ARG 109 8.522 0.218 4.741 800 HA ARG 109 HA ARG 109 10.815 2.088 5.079 801 1HB ARG 109 1HB ARG 109 9.709 0.946 2.506 802 2HB ARG 109 2HB ARG 109 10.733 2.379 2.552 803 1HG ARG 109 1HG ARG 109 11.910 0.255 4.143 804 2HG ARG 109 2HG ARG 109 11.573 -0.319 2.511 805 1HD ARG 109 1HD ARG 109 12.750 1.691 1.604 806 2HD ARG 109 2HD ARG 109 13.173 2.146 3.254 807 HE ARG 109 HE ARG 109 14.447 0.065 1.683 808 1HH1 ARG 109 1HH1 ARG 109 13.594 1.056 4.927 809 2HH1 ARG 109 2HH1 ARG 109 14.861 0.129 5.651 810 1HH2 ARG 109 1HH2 ARG 109 16.075 -1.117 2.662 811 2HH2 ARG 109 2HH2 ARG 109 16.254 -1.086 4.385 812 H MET 110 H MET 110 10.283 4.132 3.694 813 HA MET 110 HA MET 110 7.396 4.826 3.817 814 1HB MET 110 1HB MET 110 9.546 6.581 5.032 815 2HB MET 110 2HB MET 110 7.803 6.846 5.075 816 1HG MET 110 1HG MET 110 7.472 4.928 6.490 817 2HG MET 110 2HG MET 110 9.136 4.422 6.273 818 1HE MET 110 1HE MET 110 9.944 4.129 8.200 819 2HE MET 110 2HE MET 110 11.185 5.361 7.992 820 3HE MET 110 3HE MET 110 10.291 5.271 9.506 821 H PHE 111 H PHE 111 7.233 7.247 2.975 822 HA PHE 111 HA PHE 111 9.189 7.751 0.798 823 1HB PHE 111 1HB PHE 111 6.227 7.934 0.245 824 2HB PHE 111 2HB PHE 111 7.553 7.902 -0.907 825 HD1 PHE 111 HD1 PHE 111 6.031 5.753 1.787 826 HD2 PHE 111 HD2 PHE 111 8.010 5.918 -2.025 827 HE1 PHE 111 HE1 PHE 111 5.741 3.317 1.526 828 HE2 PHE 111 HE2 PHE 111 7.728 3.467 -2.274 829 HZ PHE 111 HZ PHE 111 6.589 2.163 -0.496 830 H GLY 112 H GLY 112 8.626 9.954 -0.229 831 1HA GLY 112 1HA GLY 112 7.349 11.811 1.696 832 2HA GLY 112 2HA GLY 112 8.975 12.132 1.147 833 HA PRO 113 HA PRO 113 6.326 14.271 -1.950 834 1HB PRO 113 1HB PRO 113 8.057 16.356 -2.296 835 2HB PRO 113 2HB PRO 113 6.842 16.299 -1.009 836 1HG PRO 113 1HG PRO 113 9.777 15.859 -0.856 837 2HG PRO 113 2HG PRO 113 8.674 16.548 0.344 838 1HD PRO 113 1HD PRO 113 9.670 13.939 0.415 839 2HD PRO 113 2HD PRO 113 8.228 14.495 1.271 840 H ASP 114 H ASP 114 9.819 13.673 -2.016 841 HA ASP 114 HA ASP 114 10.192 13.958 -4.840 842 1HB ASP 114 1HB ASP 114 11.887 13.621 -2.757 843 2HB ASP 114 2HB ASP 114 11.866 11.975 -3.389 844 H LYS 115 H LYS 115 9.112 11.307 -2.804 845 HA LYS 115 HA LYS 115 9.240 9.351 -4.973 846 1HB LYS 115 1HB LYS 115 8.385 9.340 -2.116 847 2HB LYS 115 2HB LYS 115 7.759 8.076 -3.177 848 1HG LYS 115 1HG LYS 115 10.701 8.760 -3.005 849 2HG LYS 115 2HG LYS 115 9.945 7.523 -2.005 850 1HD LYS 115 1HD LYS 115 9.677 6.072 -3.752 851 2HD LYS 115 2HD LYS 115 9.369 7.365 -4.911 852 1HE LYS 115 1HE LYS 115 11.601 7.666 -5.379 853 2HE LYS 115 2HE LYS 115 12.110 7.214 -3.752 854 1HZ LYS 115 1HZ LYS 115 10.899 5.190 -5.507 855 2HZ LYS 115 2HZ LYS 115 12.530 5.612 -5.724 856 3HZ LYS 115 3HZ LYS 115 12.003 4.987 -4.235 857 H LEU 116 H LEU 116 7.206 11.923 -4.502 858 HA LEU 116 HA LEU 116 4.980 10.478 -5.871 859 1HB LEU 116 1HB LEU 116 3.411 12.124 -4.699 860 2HB LEU 116 2HB LEU 116 4.059 10.814 -3.718 861 HG LEU 116 HG LEU 116 5.948 12.572 -3.164 862 1HD1 LEU 116 1HD1 LEU 116 4.332 14.130 -4.821 863 2HD1 LEU 116 2HD1 LEU 116 3.927 14.660 -3.193 864 3HD1 LEU 116 3HD1 LEU 116 5.596 14.718 -3.747 865 1HD2 LEU 116 1HD2 LEU 116 3.140 12.507 -2.064 866 2HD2 LEU 116 2HD2 LEU 116 4.565 11.672 -1.445 867 3HD2 LEU 116 3HD2 LEU 116 4.437 13.423 -1.298 868 H VAL 117 H VAL 117 4.149 11.491 -7.628 869 HA VAL 117 HA VAL 117 5.619 13.546 -8.941 870 HB VAL 117 HB VAL 117 4.054 12.046 -10.128 871 1HG1 VAL 117 1HG1 VAL 117 2.369 12.021 -8.269 872 2HG1 VAL 117 2HG1 VAL 117 1.852 13.618 -8.797 873 3HG1 VAL 117 3HG1 VAL 117 1.674 12.235 -9.874 874 1HG2 VAL 117 1HG2 VAL 117 4.573 14.478 -10.908 875 2HG2 VAL 117 2HG2 VAL 117 3.233 13.626 -11.674 876 3HG2 VAL 117 3HG2 VAL 117 2.916 14.822 -10.417 877 H ARG 118 H ARG 118 4.768 15.812 -9.421 878 HA ARG 118 HA ARG 118 3.693 16.974 -6.903 879 1HB ARG 118 1HB ARG 118 5.581 17.849 -8.952 880 2HB ARG 118 2HB ARG 118 4.347 19.073 -8.657 881 1HG ARG 118 1HG ARG 118 5.205 19.587 -6.631 882 2HG ARG 118 2HG ARG 118 5.313 17.891 -6.163 883 1HD ARG 118 1HD ARG 118 7.554 18.849 -6.205 884 2HD ARG 118 2HD ARG 118 7.397 17.691 -7.526 885 HE ARG 118 HE ARG 118 6.720 20.370 -8.388 886 1HH1 ARG 118 1HH1 ARG 118 9.394 18.227 -7.694 887 2HH1 ARG 118 2HH1 ARG 118 10.469 19.059 -8.762 888 1HH2 ARG 118 1HH2 ARG 118 8.146 21.417 -9.758 889 2HH2 ARG 118 2HH2 ARG 118 9.773 20.846 -9.917 890 H ALA 119 H ALA 119 3.077 16.885 -10.401 891 HA ALA 119 HA ALA 119 0.824 18.625 -10.418 892 1HB ALA 119 1HB ALA 119 1.800 16.425 -12.210 893 2HB ALA 119 2HB ALA 119 0.205 17.126 -12.486 894 3HB ALA 119 3HB ALA 119 1.641 18.148 -12.549 895 H ALA 120 H ALA 120 1.172 15.416 -9.175 896 HA ALA 120 HA ALA 120 -1.797 15.103 -9.082 897 1HB ALA 120 1HB ALA 120 0.016 13.325 -10.059 898 2HB ALA 120 2HB ALA 120 -0.081 12.794 -8.380 899 3HB ALA 120 3HB ALA 120 -1.539 12.858 -9.370 900 H ALA 121 H ALA 121 1.160 14.481 -7.118 901 HA ALA 121 HA ALA 121 -0.015 13.836 -4.678 902 1HB ALA 121 1HB ALA 121 2.404 15.588 -5.162 903 2HB ALA 121 2HB ALA 121 1.991 14.856 -3.614 904 3HB ALA 121 3HB ALA 121 2.394 13.833 -4.990 905 H GLU 122 H GLU 122 0.392 17.124 -6.005 906 HA GLU 122 HA GLU 122 -0.696 18.351 -3.586 907 1HB GLU 122 1HB GLU 122 -0.619 20.452 -4.871 908 2HB GLU 122 2HB GLU 122 0.902 19.575 -5.019 909 1HG GLU 122 1HG GLU 122 0.598 19.940 -7.252 910 2HG GLU 122 2HG GLU 122 -0.463 18.536 -7.130 911 H LYS 123 H LYS 123 -2.185 16.572 -5.975 912 HA LYS 123 HA LYS 123 -4.630 18.218 -6.062 913 1HB LYS 123 1HB LYS 123 -4.121 15.486 -7.262 914 2HB LYS 123 2HB LYS 123 -5.459 16.568 -7.642 915 1HG LYS 123 1HG LYS 123 -3.551 18.264 -8.235 916 2HG LYS 123 2HG LYS 123 -2.556 16.815 -8.361 917 1HD LYS 123 1HD LYS 123 -3.450 17.257 -10.558 918 2HD LYS 123 2HD LYS 123 -4.312 15.860 -9.915 919 1HE LYS 123 1HE LYS 123 -6.265 17.079 -9.519 920 2HE LYS 123 2HE LYS 123 -5.409 18.619 -9.460 921 1HZ LYS 123 1HZ LYS 123 -5.645 16.974 -11.916 922 2HZ LYS 123 2HZ LYS 123 -6.725 18.226 -11.524 923 3HZ LYS 123 3HZ LYS 123 -5.086 18.574 -11.792 924 H ARG 124 H ARG 124 -6.373 17.777 -4.775 925 HA ARG 124 HA ARG 124 -6.078 16.035 -2.516 926 1HB ARG 124 1HB ARG 124 -8.372 17.619 -3.654 927 2HB ARG 124 2HB ARG 124 -8.620 16.529 -2.289 928 1HG ARG 124 1HG ARG 124 -6.671 17.704 -1.149 929 2HG ARG 124 2HG ARG 124 -6.761 18.912 -2.432 930 1HD ARG 124 1HD ARG 124 -9.230 19.168 -1.842 931 2HD ARG 124 2HD ARG 124 -8.892 18.208 -0.402 932 HE ARG 124 HE ARG 124 -7.072 20.461 -0.694 933 1HH1 ARG 124 1HH1 ARG 124 -10.220 19.453 0.451 934 2HH1 ARG 124 2HH1 ARG 124 -10.328 20.745 1.595 935 1HH2 ARG 124 1HH2 ARG 124 -7.255 22.117 0.802 936 2HH2 ARG 124 2HH2 ARG 124 -8.670 22.237 1.794 937 H TRP 125 H TRP 125 -6.090 13.877 -2.704 938 HA TRP 125 HA TRP 125 -8.098 12.566 -4.515 939 1HB TRP 125 1HB TRP 125 -5.513 11.415 -3.397 940 2HB TRP 125 2HB TRP 125 -6.586 10.643 -4.557 941 HD1 TRP 125 HD1 TRP 125 -3.624 12.823 -4.341 942 HE1 TRP 125 HE1 TRP 125 -3.026 13.775 -6.660 943 HE3 TRP 125 HE3 TRP 125 -7.855 11.612 -6.924 944 HZ2 TRP 125 HZ2 TRP 125 -4.170 13.973 -9.267 945 HZ3 TRP 125 HZ3 TRP 125 -8.074 12.174 -9.320 946 HH2 TRP 125 HH2 TRP 125 -6.240 13.362 -10.498 947 H ASP 126 H ASP 126 -8.972 10.477 -3.549 948 HA ASP 126 HA ASP 126 -8.834 10.472 -0.574 949 1HB ASP 126 1HB ASP 126 -11.259 10.163 -0.386 950 2HB ASP 126 2HB ASP 126 -10.876 11.695 -1.165 951 H ARG 127 H ARG 127 -8.113 8.735 -3.155 952 HA ARG 127 HA ARG 127 -8.652 6.165 -1.797 953 1HB ARG 127 1HB ARG 127 -9.102 6.579 -4.769 954 2HB ARG 127 2HB ARG 127 -9.384 5.101 -3.851 955 1HG ARG 127 1HG ARG 127 -10.937 6.813 -2.443 956 2HG ARG 127 2HG ARG 127 -11.043 7.556 -4.040 957 1HD ARG 127 1HD ARG 127 -11.416 4.587 -3.730 958 2HD ARG 127 2HD ARG 127 -12.754 5.684 -3.405 959 HE ARG 127 HE ARG 127 -11.479 6.218 -5.962 960 1HH1 ARG 127 1HH1 ARG 127 -13.845 4.251 -4.300 961 2HH1 ARG 127 2HH1 ARG 127 -14.710 3.886 -5.751 962 1HH2 ARG 127 1HH2 ARG 127 -12.639 5.732 -7.814 963 2HH2 ARG 127 2HH2 ARG 127 -14.039 4.718 -7.719 964 H VAL 128 H VAL 128 -6.868 4.793 -2.022 965 HA VAL 128 HA VAL 128 -4.740 5.714 -3.897 966 HB VAL 128 HB VAL 128 -4.393 6.392 -1.467 967 1HG1 VAL 128 1HG1 VAL 128 -4.983 3.709 -0.969 968 2HG1 VAL 128 2HG1 VAL 128 -3.243 3.827 -0.711 969 3HG1 VAL 128 3HG1 VAL 128 -4.343 4.874 0.184 970 1HG2 VAL 128 1HG2 VAL 128 -2.592 6.316 -3.144 971 2HG2 VAL 128 2HG2 VAL 128 -2.003 5.863 -1.545 972 3HG2 VAL 128 3HG2 VAL 128 -2.308 4.619 -2.757 973 H LYS 129 H LYS 129 -3.593 4.096 -4.922 974 HA LYS 129 HA LYS 129 -4.635 1.332 -4.504 975 1HB LYS 129 1HB LYS 129 -5.046 2.351 -6.732 976 2HB LYS 129 2HB LYS 129 -3.308 2.526 -6.943 977 1HG LYS 129 1HG LYS 129 -3.445 -0.108 -6.289 978 2HG LYS 129 2HG LYS 129 -4.994 0.096 -7.108 979 1HD LYS 129 1HD LYS 129 -3.502 1.398 -8.877 980 2HD LYS 129 2HD LYS 129 -2.223 0.391 -8.196 981 1HE LYS 129 1HE LYS 129 -3.266 -1.607 -8.860 982 2HE LYS 129 2HE LYS 129 -4.845 -0.838 -9.019 983 1HZ LYS 129 1HZ LYS 129 -2.540 -0.127 -10.737 984 2HZ LYS 129 2HZ LYS 129 -3.649 -1.345 -11.152 985 3HZ LYS 129 3HZ LYS 129 -4.175 0.261 -10.972 986 H ILE 130 H ILE 130 -3.256 0.099 -3.366 987 HA ILE 130 HA ILE 130 -0.321 0.585 -3.629 988 HB ILE 130 HB ILE 130 -1.904 -0.913 -1.503 989 1HG1 ILE 130 1HG1 ILE 130 -2.240 1.536 -1.443 990 2HG1 ILE 130 2HG1 ILE 130 -1.295 0.998 -0.057 991 1HG2 ILE 130 1HG2 ILE 130 1.015 -0.581 -2.044 992 2HG2 ILE 130 2HG2 ILE 130 0.490 -0.482 -0.364 993 3HG2 ILE 130 3HG2 ILE 130 0.153 -1.933 -1.308 994 1HD1 ILE 130 1HD1 ILE 130 0.792 1.605 -1.343 995 2HD1 ILE 130 2HD1 ILE 130 -0.245 2.319 -2.578 996 3HD1 ILE 130 3HD1 ILE 130 -0.233 2.984 -0.945 997 H VAL 131 H VAL 131 0.719 -0.862 -4.966 998 HA VAL 131 HA VAL 131 -0.400 -3.613 -5.139 999 HB VAL 131 HB VAL 131 0.923 -2.017 -7.346 1000 1HG1 VAL 131 1HG1 VAL 131 1.237 -4.480 -7.429 1001 2HG1 VAL 131 2HG1 VAL 131 -0.515 -4.675 -7.381 1002 3HG1 VAL 131 3HG1 VAL 131 0.246 -3.878 -8.757 1003 1HG2 VAL 131 1HG2 VAL 131 -1.904 -2.409 -6.486 1004 2HG2 VAL 131 2HG2 VAL 131 -1.156 -1.027 -7.284 1005 3HG2 VAL 131 3HG2 VAL 131 -1.578 -2.462 -8.218 1006 H CYS 132 H CYS 132 1.009 -5.027 -4.289 1007 HA CYS 132 HA CYS 132 3.885 -4.345 -4.106 1008 1HB CYS 132 1HB CYS 132 2.993 -5.274 -2.083 1009 2HB CYS 132 2HB CYS 132 2.173 -6.560 -2.944 1010 HG CYS 132 HG CYS 132 5.284 -6.549 -2.992 1011 H SER 133 H SER 133 5.479 -5.489 -5.253 1012 HA SER 133 HA SER 133 4.588 -7.615 -7.133 1013 1HB SER 133 1HB SER 133 5.152 -4.916 -7.864 1014 2HB SER 133 2HB SER 133 6.475 -5.901 -8.473 1015 HG SER 133 HG SER 133 5.108 -6.394 -9.992 1016 H GLN 134 H GLN 134 5.940 -9.278 -7.028 1017 HA GLN 134 HA GLN 134 8.611 -9.530 -7.410 1018 1HB GLN 134 1HB GLN 134 9.050 -8.008 -5.451 1019 2HB GLN 134 2HB GLN 134 8.267 -9.188 -4.407 1020 1HG GLN 134 1HG GLN 134 10.552 -9.737 -4.229 1021 2HG GLN 134 2HG GLN 134 9.968 -10.870 -5.446 1022 1HE2 GLN 134 2HE2 GLN 134 12.365 -8.542 -4.856 1023 2HE2 GLN 134 1HE2 GLN 134 12.848 -8.273 -6.459 1024 HA PRO 135 HA PRO 135 6.935 -13.627 -6.506 1025 1HB PRO 135 1HB PRO 135 8.884 -15.049 -7.784 1026 2HB PRO 135 2HB PRO 135 7.590 -14.200 -8.643 1027 1HG PRO 135 1HG PRO 135 10.449 -13.545 -8.460 1028 2HG PRO 135 2HG PRO 135 9.254 -13.047 -9.665 1029 1HD PRO 135 1HD PRO 135 10.261 -11.507 -7.464 1030 2HD PRO 135 2HD PRO 135 9.011 -11.037 -8.636 1031 H TYR 136 H TYR 136 7.346 -13.632 -4.206 1032 HA TYR 136 HA TYR 136 9.981 -14.821 -3.444 1033 1HB TYR 136 1HB TYR 136 9.603 -13.586 -1.211 1034 2HB TYR 136 2HB TYR 136 10.108 -12.619 -2.594 1035 HD1 TYR 136 HD1 TYR 136 7.139 -13.661 -0.593 1036 HD2 TYR 136 HD2 TYR 136 8.728 -10.887 -3.463 1037 HE1 TYR 136 HE1 TYR 136 5.104 -12.261 -0.368 1038 HE2 TYR 136 HE2 TYR 136 6.690 -9.488 -3.237 1039 HH TYR 136 HH TYR 136 4.518 -9.800 -0.733 1040 H SER 137 H SER 137 7.003 -15.837 -3.847 1041 HA SER 137 HA SER 137 7.121 -17.575 -1.443 1042 1HB SER 137 1HB SER 137 5.199 -15.490 -1.785 1043 2HB SER 137 2HB SER 137 4.359 -17.025 -1.969 1044 HG SER 137 HG SER 137 5.196 -17.667 0.016 1045 H LYS 138 H LYS 138 4.898 -19.091 -1.859 1046 HA LYS 138 HA LYS 138 4.374 -19.842 -4.571 1047 1HB LYS 138 1HB LYS 138 5.655 -21.989 -4.599 1048 2HB LYS 138 2HB LYS 138 6.703 -20.572 -4.607 1049 1HG LYS 138 1HG LYS 138 6.631 -20.860 -1.990 1050 2HG LYS 138 2HG LYS 138 6.168 -22.516 -2.383 1051 1HD LYS 138 1HD LYS 138 8.619 -21.124 -3.499 1052 2HD LYS 138 2HD LYS 138 8.644 -22.220 -2.118 1053 1HE LYS 138 1HE LYS 138 8.190 -24.088 -3.414 1054 2HE LYS 138 2HE LYS 138 7.349 -23.153 -4.651 1055 1HZ LYS 138 1HZ LYS 138 9.616 -22.127 -5.102 1056 2HZ LYS 138 2HZ LYS 138 10.257 -23.420 -4.205 1057 3HZ LYS 138 3HZ LYS 138 9.370 -23.723 -5.621 1058 H ASP 139 H ASP 139 4.739 -20.978 -1.228 1059 HA ASP 139 HA ASP 139 2.208 -22.507 -1.546 1060 1HB ASP 139 1HB ASP 139 3.013 -23.762 0.482 1061 2HB ASP 139 2HB ASP 139 4.007 -23.998 -0.949 1062 H SER 140 H SER 140 3.990 -20.273 0.462 1063 HA SER 140 HA SER 140 1.593 -19.833 2.155 1064 1HB SER 140 1HB SER 140 3.466 -18.362 3.356 1065 2HB SER 140 2HB SER 140 3.329 -20.090 3.643 1066 HG SER 140 HG SER 140 5.104 -20.420 2.522 1067 HA PRO 141 HA PRO 141 1.026 -15.867 0.166 1068 1HB PRO 141 1HB PRO 141 -0.669 -14.757 1.992 1069 2HB PRO 141 2HB PRO 141 -1.154 -16.037 0.870 1070 1HG PRO 141 1HG PRO 141 -0.714 -16.168 3.773 1071 2HG PRO 141 2HG PRO 141 -1.657 -17.235 2.727 1072 1HD PRO 141 1HD PRO 141 0.963 -17.709 3.787 1073 2HD PRO 141 2HD PRO 141 0.041 -18.736 2.669 1074 H PHE 142 H PHE 142 0.762 -13.402 1.186 1075 HA PHE 142 HA PHE 142 2.286 -12.594 3.422 1076 1HB PHE 142 1HB PHE 142 3.913 -13.519 1.221 1077 2HB PHE 142 2HB PHE 142 4.161 -11.787 1.416 1078 HD1 PHE 142 HD1 PHE 142 4.470 -10.968 3.916 1079 HD2 PHE 142 HD2 PHE 142 5.108 -14.995 2.571 1080 HE1 PHE 142 HE1 PHE 142 5.891 -11.406 5.900 1081 HE2 PHE 142 HE2 PHE 142 6.531 -15.434 4.554 1082 HZ PHE 142 HZ PHE 142 6.923 -13.638 6.219 1083 H GLY 143 H GLY 143 3.470 -10.200 2.306 1084 1HA GLY 143 1HA GLY 143 2.250 -8.728 0.402 1085 2HA GLY 143 2HA GLY 143 0.979 -8.783 1.618 1086 H LEU 144 H LEU 144 0.981 -7.172 3.054 1087 HA LEU 144 HA LEU 144 3.540 -5.695 3.518 1088 1HB LEU 144 1HB LEU 144 0.845 -4.763 2.728 1089 2HB LEU 144 2HB LEU 144 1.608 -3.818 4.007 1090 HG LEU 144 HG LEU 144 3.635 -3.589 2.590 1091 1HD1 LEU 144 1HD1 LEU 144 2.016 -5.384 0.848 1092 2HD1 LEU 144 2HD1 LEU 144 2.947 -4.122 0.041 1093 3HD1 LEU 144 3HD1 LEU 144 3.764 -5.306 1.062 1094 1HD2 LEU 144 1HD2 LEU 144 0.988 -2.698 1.419 1095 2HD2 LEU 144 2HD2 LEU 144 2.035 -1.789 2.510 1096 3HD2 LEU 144 3HD2 LEU 144 2.547 -2.100 0.851 1097 H SER 145 H SER 145 3.854 -4.805 5.597 1098 HA SER 145 HA SER 145 2.524 -6.286 7.768 1099 1HB SER 145 1HB SER 145 4.753 -4.233 7.844 1100 2HB SER 145 2HB SER 145 4.217 -5.214 9.205 1101 HG SER 145 HG SER 145 5.519 -5.992 6.825 1102 H PHE 146 H PHE 146 2.515 -3.080 6.353 1103 HA PHE 146 HA PHE 146 0.093 -2.332 7.689 1104 1HB PHE 146 1HB PHE 146 0.916 -0.602 9.212 1105 2HB PHE 146 2HB PHE 146 1.649 -2.145 9.646 1106 HD1 PHE 146 HD1 PHE 146 2.234 1.088 7.907 1107 HD2 PHE 146 HD2 PHE 146 4.013 -2.498 9.459 1108 HE1 PHE 146 HE1 PHE 146 4.484 2.060 7.545 1109 HE2 PHE 146 HE2 PHE 146 6.258 -1.535 9.091 1110 HZ PHE 146 HZ PHE 146 6.517 0.724 8.120 1111 H VAL 147 H VAL 147 -0.388 0.053 7.274 1112 HA VAL 147 HA VAL 147 1.248 1.251 5.127 1113 HB VAL 147 HB VAL 147 -0.718 1.576 3.661 1114 1HG1 VAL 147 1HG1 VAL 147 0.816 -0.428 3.469 1115 2HG1 VAL 147 2HG1 VAL 147 -0.389 -1.350 4.366 1116 3HG1 VAL 147 3HG1 VAL 147 -0.795 -0.666 2.791 1117 1HG2 VAL 147 1HG2 VAL 147 -2.062 0.188 5.948 1118 2HG2 VAL 147 2HG2 VAL 147 -2.658 1.499 4.930 1119 3HG2 VAL 147 3HG2 VAL 147 -2.648 -0.156 4.320 1120 H ARG 148 H ARG 148 1.093 3.487 5.107 1121 HA ARG 148 HA ARG 148 -0.972 4.832 6.744 1122 1HB ARG 148 1HB ARG 148 1.940 5.419 7.273 1123 2HB ARG 148 2HB ARG 148 0.554 5.893 8.232 1124 1HG ARG 148 1HG ARG 148 0.187 3.560 8.898 1125 2HG ARG 148 2HG ARG 148 1.535 3.049 7.881 1126 1HD ARG 148 1HD ARG 148 2.770 3.301 9.784 1127 2HD ARG 148 2HD ARG 148 2.731 5.004 9.365 1128 HE ARG 148 HE ARG 148 1.006 5.358 11.011 1129 1HH1 ARG 148 1HH1 ARG 148 2.095 2.023 10.895 1130 2HH1 ARG 148 2HH1 ARG 148 1.458 1.669 12.456 1131 1HH2 ARG 148 1HH2 ARG 148 0.177 4.825 13.006 1132 2HH2 ARG 148 2HH2 ARG 148 0.378 3.224 13.634 1133 H PHE 149 H PHE 149 -0.904 7.200 6.407 1134 HA PHE 149 HA PHE 149 0.736 8.125 4.103 1135 1HB PHE 149 1HB PHE 149 -2.287 8.344 4.284 1136 2HB PHE 149 2HB PHE 149 -1.296 9.201 3.105 1137 HD1 PHE 149 HD1 PHE 149 0.616 7.423 2.087 1138 HD2 PHE 149 HD2 PHE 149 -3.382 6.512 3.350 1139 HE1 PHE 149 HE1 PHE 149 0.603 5.428 0.612 1140 HE2 PHE 149 HE2 PHE 149 -3.394 4.521 1.868 1141 HZ PHE 149 HZ PHE 149 -1.402 3.979 0.503 1142 H HIS 150 H HIS 150 0.886 10.500 4.037 1143 HA HIS 150 HA HIS 150 -0.370 11.986 6.244 1144 1HB HIS 150 1HB HIS 150 2.413 12.702 6.416 1145 2HB HIS 150 2HB HIS 150 1.353 12.099 7.681 1146 HD1 HIS 150 HD1 HIS 150 1.474 9.579 8.246 1147 HD2 HIS 150 HD2 HIS 150 4.062 10.714 5.187 1148 HE1 HIS 150 HE1 HIS 150 3.049 7.629 7.880 1149 H SER 151 H SER 151 -0.837 13.993 5.586 1150 HA SER 151 HA SER 151 0.172 14.884 2.972 1151 1HB SER 151 1HB SER 151 -2.042 15.416 2.954 1152 2HB SER 151 2HB SER 151 -2.147 15.498 4.705 1153 HG SER 151 HG SER 151 -1.885 17.578 4.567 Start of MODEL 19 1 H MET 1 H MET 1 0.563 15.285 13.642 2 HA MET 1 HA MET 1 -1.337 16.688 14.103 3 1HB MET 1 1HB MET 1 0.705 18.755 13.663 4 2HB MET 1 2HB MET 1 -0.797 19.071 12.795 5 1HG MET 1 1HG MET 1 -0.806 18.275 15.706 6 2HG MET 1 2HG MET 1 -0.618 19.957 15.215 7 1HE MET 1 1HE MET 1 -2.063 21.402 14.727 8 2HE MET 1 2HE MET 1 -3.811 21.292 14.538 9 3HE MET 1 3HE MET 1 -3.084 21.023 16.120 10 HA PRO 2 HA PRO 2 -1.336 17.020 9.317 11 1HB PRO 2 1HB PRO 2 1.044 16.992 7.982 12 2HB PRO 2 2HB PRO 2 0.298 18.472 8.601 13 1HG PRO 2 1HG PRO 2 2.653 16.999 9.596 14 2HG PRO 2 2HG PRO 2 2.232 18.707 9.772 15 1HD PRO 2 1HD PRO 2 1.938 16.675 11.736 16 2HD PRO 2 2HD PRO 2 1.327 18.340 11.821 17 H GLU 3 H GLU 3 -2.037 14.787 9.843 18 HA GLU 3 HA GLU 3 -0.246 12.752 8.589 19 1HB GLU 3 1HB GLU 3 -1.482 12.742 11.300 20 2HB GLU 3 2HB GLU 3 -1.513 11.221 10.407 21 1HG GLU 3 1HG GLU 3 1.058 12.726 10.411 22 2HG GLU 3 2HG GLU 3 0.586 11.946 11.922 23 H ILE 4 H ILE 4 -1.601 10.710 8.074 24 HA ILE 4 HA ILE 4 -4.438 11.352 7.491 25 HB ILE 4 HB ILE 4 -2.383 10.545 5.419 26 1HG1 ILE 4 1HG1 ILE 4 -4.146 12.974 5.769 27 2HG1 ILE 4 2HG1 ILE 4 -2.407 12.921 5.983 28 1HG2 ILE 4 1HG2 ILE 4 -5.391 10.550 5.350 29 2HG2 ILE 4 2HG2 ILE 4 -4.457 10.791 3.874 30 3HG2 ILE 4 3HG2 ILE 4 -4.280 9.300 4.795 31 1HD1 ILE 4 1HD1 ILE 4 -3.468 12.021 3.338 32 2HD1 ILE 4 2HD1 ILE 4 -3.514 13.748 3.686 33 3HD1 ILE 4 3HD1 ILE 4 -1.979 12.882 3.719 34 H ARG 5 H ARG 5 -5.679 9.637 8.014 35 HA ARG 5 HA ARG 5 -4.357 6.983 8.348 36 1HB ARG 5 1HB ARG 5 -7.029 7.885 9.456 37 2HB ARG 5 2HB ARG 5 -6.121 6.445 9.909 38 1HG ARG 5 1HG ARG 5 -4.941 7.604 11.436 39 2HG ARG 5 2HG ARG 5 -4.438 8.775 10.219 40 1HD ARG 5 1HD ARG 5 -5.981 10.300 10.884 41 2HD ARG 5 2HD ARG 5 -7.244 9.080 11.055 42 HE ARG 5 HE ARG 5 -6.704 8.910 13.340 43 1HH1 ARG 5 1HH1 ARG 5 -4.130 10.529 11.610 44 2HH1 ARG 5 2HH1 ARG 5 -3.274 10.930 13.058 45 1HH2 ARG 5 1HH2 ARG 5 -5.564 9.450 15.187 46 2HH2 ARG 5 2HH2 ARG 5 -4.075 10.327 15.062 47 H LEU 6 H LEU 6 -6.144 5.147 8.051 48 HA LEU 6 HA LEU 6 -7.350 5.607 5.361 49 1HB LEU 6 1HB LEU 6 -5.870 3.417 6.604 50 2HB LEU 6 2HB LEU 6 -7.380 2.861 5.891 51 HG LEU 6 HG LEU 6 -6.778 3.812 3.734 52 1HD1 LEU 6 1HD1 LEU 6 -4.637 5.117 5.363 53 2HD1 LEU 6 2HD1 LEU 6 -4.225 4.647 3.714 54 3HD1 LEU 6 3HD1 LEU 6 -5.562 5.760 4.005 55 1HD2 LEU 6 1HD2 LEU 6 -5.871 1.572 4.439 56 2HD2 LEU 6 2HD2 LEU 6 -4.900 2.384 3.209 57 3HD2 LEU 6 3HD2 LEU 6 -4.372 2.383 4.891 58 H ARG 7 H ARG 7 -9.434 4.509 4.953 59 HA ARG 7 HA ARG 7 -11.140 4.485 7.406 60 1HB ARG 7 1HB ARG 7 -11.705 6.178 5.646 61 2HB ARG 7 2HB ARG 7 -11.992 4.851 4.521 62 1HG ARG 7 1HG ARG 7 -14.142 5.085 5.297 63 2HG ARG 7 2HG ARG 7 -13.537 4.008 6.556 64 1HD ARG 7 1HD ARG 7 -13.718 5.608 8.143 65 2HD ARG 7 2HD ARG 7 -12.939 6.817 7.122 66 HE ARG 7 HE ARG 7 -15.466 6.557 6.021 67 1HH1 ARG 7 1HH1 ARG 7 -14.239 7.228 9.227 68 2HH1 ARG 7 2HH1 ARG 7 -15.602 8.200 9.655 69 1HH2 ARG 7 1HH2 ARG 7 -17.214 7.819 6.619 70 2HH2 ARG 7 2HH2 ARG 7 -17.270 8.532 8.196 71 H HIS 8 H HIS 8 -10.999 2.962 4.191 72 HA HIS 8 HA HIS 8 -11.218 0.288 5.344 73 1HB HIS 8 1HB HIS 8 -13.348 -0.245 4.135 74 2HB HIS 8 2HB HIS 8 -13.569 0.914 5.445 75 HD1 HIS 8 HD1 HIS 8 -14.965 2.858 4.778 76 HD2 HIS 8 HD2 HIS 8 -12.820 1.351 1.537 77 HE1 HIS 8 HE1 HIS 8 -15.601 4.275 2.778 78 H VAL 9 H VAL 9 -11.188 -1.379 3.562 79 HA VAL 9 HA VAL 9 -9.404 -0.478 1.422 80 HB VAL 9 HB VAL 9 -9.015 -2.649 2.525 81 1HG1 VAL 9 1HG1 VAL 9 -11.757 -2.927 2.461 82 2HG1 VAL 9 2HG1 VAL 9 -11.241 -4.044 1.199 83 3HG1 VAL 9 3HG1 VAL 9 -10.618 -4.217 2.840 84 1HG2 VAL 9 1HG2 VAL 9 -8.513 -2.214 0.029 85 2HG2 VAL 9 2HG2 VAL 9 -8.530 -3.893 0.566 86 3HG2 VAL 9 3HG2 VAL 9 -9.916 -3.231 -0.300 87 H VAL 10 H VAL 10 -10.824 0.941 0.248 88 HA VAL 10 HA VAL 10 -13.399 0.382 -0.700 89 HB VAL 10 HB VAL 10 -12.590 2.587 -1.063 90 1HG1 VAL 10 1HG1 VAL 10 -10.116 1.417 -1.514 91 2HG1 VAL 10 2HG1 VAL 10 -10.543 2.056 -3.097 92 3HG1 VAL 10 3HG1 VAL 10 -10.491 3.127 -1.700 93 1HG2 VAL 10 1HG2 VAL 10 -13.790 1.202 -3.084 94 2HG2 VAL 10 2HG2 VAL 10 -13.447 2.931 -3.158 95 3HG2 VAL 10 3HG2 VAL 10 -12.342 1.779 -3.908 96 H SER 11 H SER 11 -10.367 -0.242 -2.554 97 HA SER 11 HA SER 11 -11.883 -2.421 -3.905 98 1HB SER 11 1HB SER 11 -11.688 -1.054 -5.731 99 2HB SER 11 2HB SER 11 -10.321 -0.177 -5.067 100 HG SER 11 HG SER 11 -10.395 -2.649 -6.428 101 H CYS 12 H CYS 12 -10.522 -4.293 -4.479 102 HA CYS 12 HA CYS 12 -7.771 -4.295 -3.386 103 1HB CYS 12 1HB CYS 12 -8.247 -6.341 -2.030 104 2HB CYS 12 2HB CYS 12 -9.095 -4.911 -1.444 105 HG CYS 12 HG CYS 12 -10.956 -6.657 -1.579 106 H SER 13 H SER 13 -6.460 -5.891 -4.289 107 HA SER 13 HA SER 13 -7.721 -7.759 -6.232 108 1HB SER 13 1HB SER 13 -6.452 -5.474 -7.060 109 2HB SER 13 2HB SER 13 -5.128 -6.634 -7.081 110 HG SER 13 HG SER 13 -6.219 -6.704 -9.044 111 H SER 14 H SER 14 -6.915 -8.513 -3.713 112 HA SER 14 HA SER 14 -5.559 -10.824 -3.825 113 1HB SER 14 1HB SER 14 -3.565 -8.609 -3.988 114 2HB SER 14 2HB SER 14 -3.175 -10.001 -2.985 115 HG SER 14 HG SER 14 -3.998 -10.063 -5.705 116 H GLN 15 H GLN 15 -6.866 -11.097 -1.967 117 HA GLN 15 HA GLN 15 -5.572 -10.361 0.547 118 1HB GLN 15 1HB GLN 15 -8.083 -9.510 1.267 119 2HB GLN 15 2HB GLN 15 -6.726 -8.458 0.904 120 1HG GLN 15 1HG GLN 15 -8.371 -7.538 -0.444 121 2HG GLN 15 2HG GLN 15 -7.628 -8.651 -1.582 122 1HE2 GLN 15 2HE2 GLN 15 -8.691 -10.996 -1.402 123 2HE2 GLN 15 1HE2 GLN 15 -10.389 -11.009 -1.330 124 H ASP 16 H ASP 16 -6.159 -11.754 2.223 125 HA ASP 16 HA ASP 16 -7.758 -14.097 1.382 126 1HB ASP 16 1HB ASP 16 -5.595 -13.568 3.289 127 2HB ASP 16 2HB ASP 16 -6.874 -14.566 3.980 128 H SER 17 H SER 17 -8.895 -15.043 3.621 129 HA SER 17 HA SER 17 -11.048 -13.108 4.125 130 1HB SER 17 1HB SER 17 -11.683 -15.416 3.683 131 2HB SER 17 2HB SER 17 -10.652 -15.986 4.992 132 HG SER 17 HG SER 17 -13.163 -14.887 5.057 133 H THR 18 H THR 18 -9.168 -15.250 6.308 134 HA THR 18 HA THR 18 -9.704 -13.714 8.660 135 HB THR 18 HB THR 18 -7.340 -14.925 9.254 136 HG1 THR 18 HG1 THR 18 -6.900 -15.818 7.334 137 1HG2 THR 18 1HG2 THR 18 -10.161 -15.957 9.133 138 2HG2 THR 18 2HG2 THR 18 -8.860 -16.992 9.722 139 3HG2 THR 18 3HG2 THR 18 -9.217 -15.472 10.543 140 H HIS 19 H HIS 19 -6.728 -13.901 6.681 141 HA HIS 19 HA HIS 19 -5.846 -11.305 7.834 142 1HB HIS 19 1HB HIS 19 -4.358 -13.184 5.969 143 2HB HIS 19 2HB HIS 19 -3.677 -11.813 6.848 144 HD1 HIS 19 HD1 HIS 19 -2.860 -14.914 7.197 145 HD2 HIS 19 HD2 HIS 19 -5.280 -12.686 9.757 146 HE1 HIS 19 HE1 HIS 19 -2.758 -16.057 9.455 147 H CYS 20 H CYS 20 -7.631 -10.240 6.598 148 HA CYS 20 HA CYS 20 -7.268 -10.154 3.662 149 1HB CYS 20 1HB CYS 20 -9.335 -8.778 3.693 150 2HB CYS 20 2HB CYS 20 -9.561 -10.312 4.524 151 HG CYS 20 HG CYS 20 -8.894 -7.789 6.229 152 H ALA 21 H ALA 21 -7.393 -7.919 2.659 153 HA ALA 21 HA ALA 21 -5.156 -6.357 3.501 154 1HB ALA 21 1HB ALA 21 -7.300 -6.136 1.445 155 2HB ALA 21 2HB ALA 21 -6.434 -4.657 1.861 156 3HB ALA 21 3HB ALA 21 -5.548 -6.056 1.256 157 H GLU 22 H GLU 22 -8.531 -6.268 4.380 158 HA GLU 22 HA GLU 22 -8.689 -3.560 5.284 159 1HB GLU 22 1HB GLU 22 -10.468 -5.618 5.108 160 2HB GLU 22 2HB GLU 22 -10.173 -5.594 6.846 161 1HG GLU 22 1HG GLU 22 -10.552 -3.053 6.708 162 2HG GLU 22 2HG GLU 22 -11.211 -3.356 5.101 163 H ASN 23 H ASN 23 -6.938 -6.269 6.554 164 HA ASN 23 HA ASN 23 -6.932 -5.556 9.338 165 1HB ASN 23 1HB ASN 23 -5.084 -7.119 7.561 166 2HB ASN 23 2HB ASN 23 -4.624 -6.767 9.226 167 1HD2 ASN 23 2HD2 ASN 23 -6.020 -9.135 7.414 168 2HD2 ASN 23 1HD2 ASN 23 -7.048 -9.831 8.574 169 H LEU 24 H LEU 24 -5.487 -4.137 6.568 170 HA LEU 24 HA LEU 24 -3.217 -2.876 7.755 171 1HB LEU 24 1HB LEU 24 -4.890 -1.924 5.408 172 2HB LEU 24 2HB LEU 24 -3.219 -1.481 5.759 173 HG LEU 24 HG LEU 24 -3.923 -4.390 5.464 174 1HD1 LEU 24 1HD1 LEU 24 -4.807 -2.872 3.508 175 2HD1 LEU 24 2HD1 LEU 24 -3.102 -2.794 3.065 176 3HD1 LEU 24 3HD1 LEU 24 -3.923 -4.354 3.145 177 1HD2 LEU 24 1HD2 LEU 24 -1.586 -2.930 5.947 178 2HD2 LEU 24 2HD2 LEU 24 -1.684 -4.626 5.483 179 3HD2 LEU 24 3HD2 LEU 24 -1.472 -3.387 4.247 180 H LEU 25 H LEU 25 -6.651 -2.209 7.791 181 HA LEU 25 HA LEU 25 -6.634 0.545 8.458 182 1HB LEU 25 1HB LEU 25 -8.468 -1.779 8.908 183 2HB LEU 25 2HB LEU 25 -8.757 -0.315 9.829 184 HG LEU 25 HG LEU 25 -10.053 -0.395 7.698 185 1HD1 LEU 25 1HD1 LEU 25 -8.149 1.738 8.451 186 2HD1 LEU 25 2HD1 LEU 25 -8.820 1.864 6.826 187 3HD1 LEU 25 3HD1 LEU 25 -9.893 1.807 8.223 188 1HD2 LEU 25 1HD2 LEU 25 -8.388 -1.617 6.341 189 2HD2 LEU 25 2HD2 LEU 25 -8.838 -0.098 5.567 190 3HD2 LEU 25 3HD2 LEU 25 -7.302 -0.229 6.422 191 H LYS 26 H LYS 26 -5.652 -2.278 10.244 192 HA LYS 26 HA LYS 26 -5.358 -0.587 12.697 193 1HB LYS 26 1HB LYS 26 -5.590 -3.612 12.628 194 2HB LYS 26 2HB LYS 26 -5.613 -2.570 14.050 195 1HG LYS 26 1HG LYS 26 -7.674 -2.414 11.836 196 2HG LYS 26 2HG LYS 26 -7.894 -3.363 13.307 197 1HD LYS 26 1HD LYS 26 -7.763 -1.400 14.691 198 2HD LYS 26 2HD LYS 26 -7.251 -0.404 13.328 199 1HE LYS 26 1HE LYS 26 -9.481 -1.066 12.227 200 2HE LYS 26 2HE LYS 26 -9.965 -1.634 13.825 201 1HZ LYS 26 1HZ LYS 26 -9.325 0.621 14.659 202 2HZ LYS 26 2HZ LYS 26 -9.186 1.115 13.039 203 3HZ LYS 26 3HZ LYS 26 -10.684 0.592 13.639 204 H ALA 27 H ALA 27 -3.348 -0.029 11.357 205 HA ALA 27 HA ALA 27 -1.245 -1.795 10.782 206 1HB ALA 27 1HB ALA 27 -1.088 1.048 11.822 207 2HB ALA 27 2HB ALA 27 0.258 0.171 11.096 208 3HB ALA 27 3HB ALA 27 -1.168 0.552 10.131 209 H ASP 28 H ASP 28 -2.353 -0.683 13.908 210 HA ASP 28 HA ASP 28 -0.068 -2.141 15.176 211 1HB ASP 28 1HB ASP 28 -1.603 0.273 16.180 212 2HB ASP 28 2HB ASP 28 -0.431 -0.628 17.143 213 H THR 29 H THR 29 -1.306 -4.116 15.171 214 HA THR 29 HA THR 29 -3.081 -4.357 17.483 215 HB THR 29 HB THR 29 -4.716 -5.640 15.718 216 HG1 THR 29 HG1 THR 29 -3.358 -4.683 14.015 217 1HG2 THR 29 1HG2 THR 29 -5.020 -3.681 17.497 218 2HG2 THR 29 2HG2 THR 29 -5.136 -2.700 16.036 219 3HG2 THR 29 3HG2 THR 29 -6.264 -4.031 16.297 220 H TYR 30 H TYR 30 -3.114 -6.530 14.672 221 HA TYR 30 HA TYR 30 -0.970 -8.225 15.489 222 1HB TYR 30 1HB TYR 30 -2.297 -10.093 16.474 223 2HB TYR 30 2HB TYR 30 -2.336 -8.640 17.474 224 HD1 TYR 30 HD1 TYR 30 -4.347 -7.193 17.523 225 HD2 TYR 30 HD2 TYR 30 -4.279 -10.894 15.344 226 HE1 TYR 30 HE1 TYR 30 -6.822 -7.151 17.375 227 HE2 TYR 30 HE2 TYR 30 -6.754 -10.854 15.198 228 HH TYR 30 HH TYR 30 -8.676 -9.384 16.992 229 H ARG 31 H ARG 31 -2.218 -7.190 13.063 230 HA ARG 31 HA ARG 31 -2.284 -9.674 11.530 231 1HB ARG 31 1HB ARG 31 -4.719 -8.886 12.518 232 2HB ARG 31 2HB ARG 31 -4.696 -8.058 10.961 233 1HG ARG 31 1HG ARG 31 -5.471 -10.065 10.186 234 2HG ARG 31 2HG ARG 31 -3.762 -10.499 10.216 235 1HD ARG 31 1HD ARG 31 -4.467 -12.220 11.531 236 2HD ARG 31 2HD ARG 31 -4.471 -11.003 12.808 237 HE ARG 31 HE ARG 31 -6.978 -10.844 11.515 238 1HH1 ARG 31 1HH1 ARG 31 -5.139 -13.150 13.395 239 2HH1 ARG 31 2HH1 ARG 31 -6.554 -13.902 14.043 240 1HH2 ARG 31 1HH2 ARG 31 -8.782 -11.849 12.375 241 2HH2 ARG 31 2HH2 ARG 31 -8.595 -13.176 13.473 242 H LYS 32 H LYS 32 -1.747 -9.279 9.370 243 HA LYS 32 HA LYS 32 -1.501 -6.406 8.567 244 1HB LYS 32 1HB LYS 32 0.445 -8.615 7.847 245 2HB LYS 32 2HB LYS 32 0.605 -6.897 7.501 246 1HG LYS 32 1HG LYS 32 1.451 -6.458 9.547 247 2HG LYS 32 2HG LYS 32 0.191 -7.391 10.348 248 1HD LYS 32 1HD LYS 32 2.262 -8.936 8.874 249 2HD LYS 32 2HD LYS 32 2.774 -8.146 10.365 250 1HE LYS 32 1HE LYS 32 0.635 -9.189 11.402 251 2HE LYS 32 2HE LYS 32 0.640 -10.242 9.987 252 1HZ LYS 32 1HZ LYS 32 2.942 -9.889 11.829 253 2HZ LYS 32 2HZ LYS 32 1.842 -11.182 11.901 254 3HZ LYS 32 3HZ LYS 32 2.833 -10.988 10.538 255 H TRP 33 H TRP 33 -0.624 -6.849 5.940 256 HA TRP 33 HA TRP 33 -3.104 -7.899 4.727 257 1HB TRP 33 1HB TRP 33 -2.099 -5.748 3.899 258 2HB TRP 33 2HB TRP 33 -0.684 -6.649 3.398 259 HD1 TRP 33 HD1 TRP 33 -4.204 -8.055 2.923 260 HE1 TRP 33 HE1 TRP 33 -4.672 -8.255 0.382 261 HE3 TRP 33 HE3 TRP 33 -0.085 -5.715 1.145 262 HZ2 TRP 33 HZ2 TRP 33 -3.409 -7.466 -2.095 263 HZ3 TRP 33 HZ3 TRP 33 0.289 -5.462 -1.302 264 HH2 TRP 33 HH2 TRP 33 -1.373 -6.324 -2.908 265 H ARG 34 H ARG 34 -3.190 -9.729 3.474 266 HA ARG 34 HA ARG 34 -0.685 -11.141 2.792 267 1HB ARG 34 1HB ARG 34 -2.711 -12.070 4.770 268 2HB ARG 34 2HB ARG 34 -2.139 -13.275 3.618 269 1HG ARG 34 1HG ARG 34 -0.049 -13.336 4.523 270 2HG ARG 34 2HG ARG 34 -0.014 -11.596 4.809 271 1HD ARG 34 1HD ARG 34 -0.689 -11.841 6.951 272 2HD ARG 34 2HD ARG 34 -1.983 -12.951 6.497 273 HE ARG 34 HE ARG 34 0.360 -14.445 6.257 274 1HH1 ARG 34 1HH1 ARG 34 -1.230 -12.638 8.796 275 2HH1 ARG 34 2HH1 ARG 34 -0.598 -13.648 10.047 276 1HH2 ARG 34 1HH2 ARG 34 1.155 -15.726 7.909 277 2HH2 ARG 34 2HH2 ARG 34 0.739 -15.377 9.554 278 H ALA 35 H ALA 35 -0.885 -11.930 0.740 279 HA ALA 35 HA ALA 35 -3.073 -11.382 -0.938 280 1HB ALA 35 1HB ALA 35 -0.726 -12.125 -1.615 281 2HB ALA 35 2HB ALA 35 -1.244 -13.778 -1.282 282 3HB ALA 35 3HB ALA 35 -2.042 -12.842 -2.546 283 H ALA 36 H ALA 36 -4.801 -12.612 -1.715 284 HA ALA 36 HA ALA 36 -6.209 -14.216 0.141 285 1HB ALA 36 1HB ALA 36 -6.767 -13.032 -2.273 286 2HB ALA 36 2HB ALA 36 -6.825 -14.743 -2.687 287 3HB ALA 36 3HB ALA 36 -7.861 -14.109 -1.409 288 H LYS 37 H LYS 37 -3.732 -15.085 -2.150 289 HA LYS 37 HA LYS 37 -3.938 -17.896 -1.237 290 1HB LYS 37 1HB LYS 37 -3.419 -18.622 -3.588 291 2HB LYS 37 2HB LYS 37 -5.017 -17.896 -3.415 292 1HG LYS 37 1HG LYS 37 -3.913 -15.680 -4.084 293 2HG LYS 37 2HG LYS 37 -2.519 -16.644 -4.570 294 1HD LYS 37 1HD LYS 37 -5.157 -17.584 -5.560 295 2HD LYS 37 2HD LYS 37 -4.568 -16.068 -6.244 296 1HE LYS 37 1HE LYS 37 -2.583 -17.083 -7.065 297 2HE LYS 37 2HE LYS 37 -2.814 -18.521 -6.071 298 1HZ LYS 37 1HZ LYS 37 -4.587 -17.674 -8.298 299 2HZ LYS 37 2HZ LYS 37 -3.420 -18.904 -8.388 300 3HZ LYS 37 3HZ LYS 37 -4.763 -19.078 -7.362 301 H ALA 38 H ALA 38 -1.835 -18.995 -2.376 302 HA ALA 38 HA ALA 38 0.448 -17.431 -1.328 303 1HB ALA 38 1HB ALA 38 0.124 -19.864 -0.748 304 2HB ALA 38 2HB ALA 38 0.426 -20.254 -2.441 305 3HB ALA 38 3HB ALA 38 1.694 -19.506 -1.468 306 H GLY 39 H GLY 39 2.520 -18.362 -2.887 307 1HA GLY 39 1HA GLY 39 3.654 -17.918 -4.899 308 2HA GLY 39 2HA GLY 39 2.104 -18.119 -5.717 309 H GLU 40 H GLU 40 3.171 -15.830 -3.252 310 HA GLU 40 HA GLU 40 1.781 -13.580 -4.175 311 1HB GLU 40 1HB GLU 40 4.331 -13.872 -2.591 312 2HB GLU 40 2HB GLU 40 3.626 -12.294 -2.934 313 1HG GLU 40 1HG GLU 40 2.446 -12.655 -1.038 314 2HG GLU 40 2HG GLU 40 1.434 -13.671 -2.058 315 H LYS 41 H LYS 41 2.087 -13.684 -6.502 316 HA LYS 41 HA LYS 41 4.745 -12.977 -7.578 317 1HB LYS 41 1HB LYS 41 2.769 -14.473 -8.640 318 2HB LYS 41 2HB LYS 41 2.313 -12.903 -9.302 319 1HG LYS 41 1HG LYS 41 4.324 -12.673 -10.486 320 2HG LYS 41 2HG LYS 41 5.168 -13.840 -9.467 321 1HD LYS 41 1HD LYS 41 3.493 -15.575 -10.392 322 2HD LYS 41 2HD LYS 41 3.135 -14.373 -11.631 323 1HE LYS 41 1HE LYS 41 5.733 -14.269 -11.921 324 2HE LYS 41 2HE LYS 41 5.711 -15.834 -11.109 325 1HZ LYS 41 1HZ LYS 41 4.017 -15.220 -13.462 326 2HZ LYS 41 2HZ LYS 41 5.571 -15.894 -13.599 327 3HZ LYS 41 3HZ LYS 41 4.349 -16.741 -12.784 328 H THR 42 H THR 42 1.457 -11.601 -7.604 329 HA THR 42 HA THR 42 2.536 -8.904 -7.201 330 HB THR 42 HB THR 42 1.344 -8.011 -9.233 331 HG1 THR 42 HG1 THR 42 1.247 -10.765 -9.904 332 1HG2 THR 42 1HG2 THR 42 3.850 -8.725 -9.079 333 2HG2 THR 42 2HG2 THR 42 3.360 -10.055 -10.126 334 3HG2 THR 42 3HG2 THR 42 3.159 -8.388 -10.664 335 H ILE 43 H ILE 43 1.196 -8.206 -5.608 336 HA ILE 43 HA ILE 43 -1.706 -8.945 -5.792 337 HB ILE 43 HB ILE 43 -1.706 -8.467 -3.287 338 1HG1 ILE 43 1HG1 ILE 43 1.289 -8.685 -3.676 339 2HG1 ILE 43 2HG1 ILE 43 0.412 -7.210 -3.271 340 1HG2 ILE 43 1HG2 ILE 43 -1.315 -10.765 -4.627 341 2HG2 ILE 43 2HG2 ILE 43 0.183 -10.706 -3.704 342 3HG2 ILE 43 3HG2 ILE 43 -1.365 -10.678 -2.867 343 1HD1 ILE 43 1HD1 ILE 43 -0.556 -8.712 -1.310 344 2HD1 ILE 43 2HD1 ILE 43 0.927 -9.628 -1.579 345 3HD1 ILE 43 3HD1 ILE 43 1.012 -7.921 -1.141 346 H SER 44 H SER 44 -3.241 -7.283 -5.430 347 HA SER 44 HA SER 44 -2.066 -4.542 -5.180 348 1HB SER 44 1HB SER 44 -4.595 -4.678 -6.663 349 2HB SER 44 2HB SER 44 -3.133 -3.780 -7.024 350 HG SER 44 HG SER 44 -3.573 -5.453 -8.549 351 H VAL 45 H VAL 45 -3.336 -3.044 -3.995 352 HA VAL 45 HA VAL 45 -5.876 -3.948 -2.825 353 HB VAL 45 HB VAL 45 -4.212 -4.930 -1.287 354 1HG1 VAL 45 1HG1 VAL 45 -2.501 -3.056 -1.851 355 2HG1 VAL 45 2HG1 VAL 45 -3.309 -2.148 -0.575 356 3HG1 VAL 45 3HG1 VAL 45 -2.536 -3.690 -0.209 357 1HG2 VAL 45 1HG2 VAL 45 -5.747 -2.532 -0.256 358 2HG2 VAL 45 2HG2 VAL 45 -6.266 -4.217 -0.263 359 3HG2 VAL 45 3HG2 VAL 45 -4.960 -3.701 0.805 360 H VAL 46 H VAL 46 -7.020 -2.194 -3.454 361 HA VAL 46 HA VAL 46 -5.835 0.506 -3.285 362 HB VAL 46 HB VAL 46 -8.668 -0.133 -4.090 363 1HG1 VAL 46 1HG1 VAL 46 -6.679 2.062 -4.690 364 2HG1 VAL 46 2HG1 VAL 46 -8.191 1.875 -5.578 365 3HG1 VAL 46 3HG1 VAL 46 -8.220 2.206 -3.845 366 1HG2 VAL 46 1HG2 VAL 46 -6.132 -0.733 -5.526 367 2HG2 VAL 46 2HG2 VAL 46 -7.711 -1.501 -5.672 368 3HG2 VAL 46 3HG2 VAL 46 -7.403 0.036 -6.479 369 H LEU 47 H LEU 47 -5.932 1.498 -1.356 370 HA LEU 47 HA LEU 47 -8.116 0.815 0.536 371 1HB LEU 47 1HB LEU 47 -5.766 2.638 1.077 372 2HB LEU 47 2HB LEU 47 -6.761 1.769 2.243 373 HG LEU 47 HG LEU 47 -5.751 -0.227 0.523 374 1HD1 LEU 47 1HD1 LEU 47 -4.124 1.795 -0.027 375 2HD1 LEU 47 2HD1 LEU 47 -3.377 1.320 1.499 376 3HD1 LEU 47 3HD1 LEU 47 -3.493 0.160 0.175 377 1HD2 LEU 47 1HD2 LEU 47 -6.076 0.062 3.161 378 2HD2 LEU 47 2HD2 LEU 47 -4.978 -1.146 2.496 379 3HD2 LEU 47 3HD2 LEU 47 -4.345 0.389 3.089 380 H GLN 48 H GLN 48 -9.132 2.653 1.736 381 HA GLN 48 HA GLN 48 -9.628 4.925 -0.138 382 1HB GLN 48 1HB GLN 48 -11.438 3.185 0.937 383 2HB GLN 48 2HB GLN 48 -11.487 4.486 2.127 384 1HG GLN 48 1HG GLN 48 -11.493 5.403 -0.683 385 2HG GLN 48 2HG GLN 48 -12.916 4.472 -0.216 386 1HE2 GLN 48 2HE2 GLN 48 -11.403 7.565 0.025 387 2HE2 GLN 48 1HE2 GLN 48 -12.489 8.254 1.133 388 H LEU 49 H LEU 49 -9.263 6.994 0.569 389 HA LEU 49 HA LEU 49 -7.892 7.371 3.131 390 1HB LEU 49 1HB LEU 49 -8.650 9.436 1.039 391 2HB LEU 49 2HB LEU 49 -7.467 9.624 2.333 392 HG LEU 49 HG LEU 49 -7.233 7.515 0.173 393 1HD1 LEU 49 1HD1 LEU 49 -6.103 10.321 0.324 394 2HD1 LEU 49 2HD1 LEU 49 -5.445 9.073 -0.735 395 3HD1 LEU 49 3HD1 LEU 49 -7.102 9.634 -0.957 396 1HD2 LEU 49 1HD2 LEU 49 -5.404 8.610 2.324 397 2HD2 LEU 49 2HD2 LEU 49 -5.938 6.943 2.102 398 3HD2 LEU 49 3HD2 LEU 49 -4.802 7.663 0.962 399 H GLU 50 H GLU 50 -8.865 8.238 4.882 400 HA GLU 50 HA GLU 50 -11.739 8.441 5.005 401 1HB GLU 50 1HB GLU 50 -10.213 7.769 6.895 402 2HB GLU 50 2HB GLU 50 -9.761 9.467 7.047 403 1HG GLU 50 1HG GLU 50 -11.842 10.095 7.839 404 2HG GLU 50 2HG GLU 50 -12.674 8.789 6.996 405 H LYS 51 H LYS 51 -10.166 10.544 3.261 406 HA LYS 51 HA LYS 51 -11.970 12.686 3.526 407 1HB LYS 51 1HB LYS 51 -10.486 14.422 4.538 408 2HB LYS 51 2HB LYS 51 -10.902 13.161 5.693 409 1HG LYS 51 1HG LYS 51 -8.626 12.126 4.553 410 2HG LYS 51 2HG LYS 51 -8.285 13.856 4.523 411 1HD LYS 51 1HD LYS 51 -9.240 13.686 7.023 412 2HD LYS 51 2HD LYS 51 -8.640 12.035 6.856 413 1HE LYS 51 1HE LYS 51 -6.413 12.818 6.328 414 2HE LYS 51 2HE LYS 51 -6.975 14.486 6.216 415 1HZ LYS 51 1HZ LYS 51 -7.716 14.160 8.617 416 2HZ LYS 51 2HZ LYS 51 -6.711 12.794 8.622 417 3HZ LYS 51 3HZ LYS 51 -6.051 14.332 8.327 418 H GLU 52 H GLU 52 -11.863 13.582 1.490 419 HA GLU 52 HA GLU 52 -9.788 13.001 -0.387 420 1HB GLU 52 1HB GLU 52 -12.236 14.032 -0.682 421 2HB GLU 52 2HB GLU 52 -11.325 15.541 -0.645 422 1HG GLU 52 1HG GLU 52 -10.011 14.930 -2.527 423 2HG GLU 52 2HG GLU 52 -10.527 13.247 -2.433 424 H GLU 53 H GLU 53 -7.747 13.551 0.240 425 HA GLU 53 HA GLU 53 -7.178 16.435 0.722 426 1HB GLU 53 1HB GLU 53 -5.468 15.705 2.424 427 2HB GLU 53 2HB GLU 53 -7.138 15.402 2.914 428 1HG GLU 53 1HG GLU 53 -6.811 13.052 1.896 429 2HG GLU 53 2HG GLU 53 -5.089 13.430 1.901 430 H GLN 54 H GLN 54 -4.596 16.551 0.830 431 HA GLN 54 HA GLN 54 -3.687 15.376 -1.744 432 1HB GLN 54 1HB GLN 54 -2.468 17.565 -0.026 433 2HB GLN 54 2HB GLN 54 -1.837 17.023 -1.579 434 1HG GLN 54 1HG GLN 54 -3.682 17.852 -2.769 435 2HG GLN 54 2HG GLN 54 -4.680 17.951 -1.328 436 1HE2 GLN 54 2HE2 GLN 54 -1.311 19.127 -1.603 437 2HE2 GLN 54 1HE2 GLN 54 -1.695 20.761 -1.353 438 H ILE 55 H ILE 55 -1.063 15.050 -1.541 439 HA ILE 55 HA ILE 55 -0.508 13.548 0.971 440 HB ILE 55 HB ILE 55 -0.032 12.445 -1.819 441 1HG1 ILE 55 1HG1 ILE 55 -1.748 10.713 -0.567 442 2HG1 ILE 55 2HG1 ILE 55 -2.309 12.258 0.069 443 1HG2 ILE 55 1HG2 ILE 55 0.450 11.379 0.973 444 2HG2 ILE 55 2HG2 ILE 55 0.408 10.338 -0.449 445 3HG2 ILE 55 3HG2 ILE 55 1.632 11.601 -0.317 446 1HD1 ILE 55 1HD1 ILE 55 -1.769 12.056 -2.868 447 2HD1 ILE 55 2HD1 ILE 55 -3.235 11.307 -2.238 448 3HD1 ILE 55 3HD1 ILE 55 -2.962 13.035 -2.013 449 H HIS 56 H HIS 56 1.386 14.263 1.759 450 HA HIS 56 HA HIS 56 3.399 15.386 -0.144 451 1HB HIS 56 1HB HIS 56 2.442 16.932 1.608 452 2HB HIS 56 2HB HIS 56 3.179 15.901 2.835 453 HD1 HIS 56 HD1 HIS 56 4.085 18.210 -0.017 454 HD2 HIS 56 HD2 HIS 56 5.962 16.214 3.125 455 HE1 HIS 56 HE1 HIS 56 6.454 19.100 0.083 456 H SER 57 H SER 57 2.836 13.091 2.460 457 HA SER 57 HA SER 57 5.416 11.797 1.811 458 1HB SER 57 1HB SER 57 4.747 13.067 4.443 459 2HB SER 57 2HB SER 57 5.655 11.559 4.445 460 HG SER 57 HG SER 57 6.341 14.086 3.464 461 H VAL 58 H VAL 58 5.349 9.579 2.242 462 HA VAL 58 HA VAL 58 2.736 8.538 3.252 463 HB VAL 58 HB VAL 58 4.336 7.705 0.820 464 1HG1 VAL 58 1HG1 VAL 58 2.072 6.321 2.249 465 2HG1 VAL 58 2HG1 VAL 58 2.339 6.093 0.521 466 3HG1 VAL 58 3HG1 VAL 58 3.591 5.638 1.674 467 1HG2 VAL 58 1HG2 VAL 58 1.762 9.130 1.324 468 2HG2 VAL 58 2HG2 VAL 58 2.986 9.427 0.089 469 3HG2 VAL 58 3HG2 VAL 58 1.862 8.080 -0.090 470 H ASP 59 H ASP 59 2.878 6.302 4.057 471 HA ASP 59 HA ASP 59 5.614 5.387 4.789 472 1HB ASP 59 1HB ASP 59 3.402 6.242 6.603 473 2HB ASP 59 2HB ASP 59 4.315 4.809 7.076 474 H ILE 60 H ILE 60 5.766 3.155 4.565 475 HA ILE 60 HA ILE 60 3.414 1.437 4.829 476 HB ILE 60 HB ILE 60 4.579 2.130 2.137 477 1HG1 ILE 60 1HG1 ILE 60 1.906 1.357 1.901 478 2HG1 ILE 60 2HG1 ILE 60 1.979 2.138 3.473 479 1HG2 ILE 60 1HG2 ILE 60 3.797 -0.608 3.022 480 2HG2 ILE 60 2HG2 ILE 60 3.216 -0.079 1.443 481 3HG2 ILE 60 3HG2 ILE 60 4.946 -0.114 1.778 482 1HD1 ILE 60 1HD1 ILE 60 3.482 3.651 1.506 483 2HD1 ILE 60 2HD1 ILE 60 1.815 3.407 0.987 484 3HD1 ILE 60 3HD1 ILE 60 2.151 4.172 2.538 485 H GLY 61 H GLY 61 4.106 -0.588 5.488 486 1HA GLY 61 1HA GLY 61 7.047 -1.014 5.411 487 2HA GLY 61 2HA GLY 61 6.026 -1.652 6.681 488 H ASN 62 H ASN 62 7.822 -2.791 4.477 489 HA ASN 62 HA ASN 62 5.969 -4.466 2.932 490 1HB ASN 62 1HB ASN 62 8.905 -3.954 2.919 491 2HB ASN 62 2HB ASN 62 8.328 -5.482 2.251 492 1HD2 ASN 62 2HD2 ASN 62 6.795 -2.230 2.192 493 2HD2 ASN 62 1HD2 ASN 62 6.705 -2.135 0.501 494 H ASP 63 H ASP 63 5.441 -6.550 3.427 495 HA ASP 63 HA ASP 63 6.894 -7.861 5.699 496 1HB ASP 63 1HB ASP 63 4.321 -7.276 5.829 497 2HB ASP 63 2HB ASP 63 4.144 -8.689 4.790 498 H GLY 64 H GLY 64 8.215 -8.119 3.483 499 1HA GLY 64 1HA GLY 64 9.118 -10.210 2.505 500 2HA GLY 64 2HA GLY 64 7.452 -10.775 2.341 501 H SER 65 H SER 65 6.608 -7.986 1.530 502 HA SER 65 HA SER 65 6.642 -8.257 -1.292 503 1HB SER 65 1HB SER 65 5.009 -6.813 -0.276 504 2HB SER 65 2HB SER 65 6.258 -5.845 0.498 505 HG SER 65 HG SER 65 6.746 -4.933 -1.395 506 H ALA 66 H ALA 66 7.659 -6.705 -2.812 507 HA ALA 66 HA ALA 66 10.351 -5.790 -1.919 508 1HB ALA 66 1HB ALA 66 10.015 -8.051 -3.421 509 2HB ALA 66 2HB ALA 66 10.164 -6.829 -4.684 510 3HB ALA 66 3HB ALA 66 11.447 -7.027 -3.495 511 H PHE 67 H PHE 67 8.167 -5.808 -4.747 512 HA PHE 67 HA PHE 67 8.897 -2.963 -5.253 513 1HB PHE 67 1HB PHE 67 7.280 -4.861 -6.980 514 2HB PHE 67 2HB PHE 67 7.900 -3.289 -7.456 515 HD1 PHE 67 HD1 PHE 67 10.609 -3.209 -6.457 516 HD2 PHE 67 HD2 PHE 67 8.443 -6.503 -8.154 517 HE1 PHE 67 HE1 PHE 67 12.743 -4.260 -7.131 518 HE2 PHE 67 HE2 PHE 67 10.570 -7.561 -8.823 519 HZ PHE 67 HZ PHE 67 12.731 -6.443 -8.319 520 H VAL 68 H VAL 68 7.561 -1.461 -4.406 521 HA VAL 68 HA VAL 68 4.652 -2.158 -4.192 522 HB VAL 68 HB VAL 68 6.274 -0.505 -2.235 523 1HG1 VAL 68 1HG1 VAL 68 3.351 -1.108 -2.551 524 2HG1 VAL 68 2HG1 VAL 68 4.016 -0.973 -0.922 525 3HG1 VAL 68 3HG1 VAL 68 4.133 0.388 -2.038 526 1HG2 VAL 68 1HG2 VAL 68 5.470 -3.365 -2.401 527 2HG2 VAL 68 2HG2 VAL 68 6.868 -2.632 -1.613 528 3HG2 VAL 68 3HG2 VAL 68 5.291 -2.592 -0.826 529 H GLU 69 H GLU 69 3.564 -0.953 -5.601 530 HA GLU 69 HA GLU 69 4.526 1.800 -6.245 531 1HB GLU 69 1HB GLU 69 4.228 0.265 -8.160 532 2HB GLU 69 2HB GLU 69 2.548 0.004 -7.695 533 1HG GLU 69 1HG GLU 69 1.868 2.032 -8.507 534 2HG GLU 69 2HG GLU 69 3.359 2.841 -8.032 535 H VAL 70 H VAL 70 3.140 3.575 -5.990 536 HA VAL 70 HA VAL 70 0.544 3.005 -4.610 537 HB VAL 70 HB VAL 70 2.188 5.486 -4.124 538 1HG1 VAL 70 1HG1 VAL 70 -0.408 4.868 -3.497 539 2HG1 VAL 70 2HG1 VAL 70 0.440 4.365 -2.035 540 3HG1 VAL 70 3HG1 VAL 70 0.588 6.024 -2.613 541 1HG2 VAL 70 1HG2 VAL 70 2.293 2.819 -2.690 542 2HG2 VAL 70 2HG2 VAL 70 3.639 3.707 -3.407 543 3HG2 VAL 70 3HG2 VAL 70 2.850 4.321 -1.953 544 H LEU 71 H LEU 71 -1.170 3.792 -5.682 545 HA LEU 71 HA LEU 71 -0.725 5.932 -7.710 546 1HB LEU 71 1HB LEU 71 -2.246 3.422 -7.737 547 2HB LEU 71 2HB LEU 71 -3.201 4.805 -8.266 548 HG LEU 71 HG LEU 71 -1.276 5.402 -9.807 549 1HD1 LEU 71 1HD1 LEU 71 -0.395 2.613 -9.007 550 2HD1 LEU 71 2HD1 LEU 71 0.289 3.547 -10.338 551 3HD1 LEU 71 3HD1 LEU 71 0.472 4.113 -8.677 552 1HD2 LEU 71 1HD2 LEU 71 -3.046 3.012 -10.026 553 2HD2 LEU 71 2HD2 LEU 71 -2.991 4.463 -11.026 554 3HD2 LEU 71 3HD2 LEU 71 -1.787 3.194 -11.248 555 H VAL 72 H VAL 72 -2.570 7.456 -7.931 556 HA VAL 72 HA VAL 72 -4.066 7.788 -5.368 557 HB VAL 72 HB VAL 72 -3.891 10.273 -5.921 558 1HG1 VAL 72 1HG1 VAL 72 -1.544 8.594 -5.042 559 2HG1 VAL 72 2HG1 VAL 72 -1.551 10.354 -4.921 560 3HG1 VAL 72 3HG1 VAL 72 -2.735 9.406 -4.024 561 1HG2 VAL 72 1HG2 VAL 72 -2.997 9.846 -8.253 562 2HG2 VAL 72 2HG2 VAL 72 -2.040 10.981 -7.302 563 3HG2 VAL 72 3HG2 VAL 72 -1.493 9.316 -7.501 564 H GLY 73 H GLY 73 -6.171 8.709 -5.556 565 1HA GLY 73 1HA GLY 73 -7.319 9.560 -8.032 566 2HA GLY 73 2HA GLY 73 -7.750 7.881 -7.716 567 H SER 74 H SER 74 -9.712 9.756 -7.783 568 HA SER 74 HA SER 74 -10.418 10.179 -4.935 569 1HB SER 74 1HB SER 74 -10.313 12.303 -6.036 570 2HB SER 74 2HB SER 74 -11.199 11.696 -7.424 571 HG SER 74 HG SER 74 -12.292 12.949 -5.569 572 H SER 75 H SER 75 -12.653 9.848 -4.392 573 HA SER 75 HA SER 75 -13.859 7.632 -5.914 574 1HB SER 75 1HB SER 75 -13.797 7.421 -3.477 575 2HB SER 75 2HB SER 75 -14.653 8.950 -3.299 576 HG SER 75 HG SER 75 -16.464 8.033 -4.116 577 H ALA 76 H ALA 76 -13.850 10.801 -6.484 578 HA ALA 76 HA ALA 76 -16.562 11.626 -6.481 579 1HB ALA 76 1HB ALA 76 -14.483 13.051 -6.903 580 2HB ALA 76 2HB ALA 76 -14.517 12.432 -8.554 581 3HB ALA 76 3HB ALA 76 -15.869 13.384 -7.940 582 H GLY 77 H GLY 77 -18.129 10.374 -7.417 583 1HA GLY 77 1HA GLY 77 -19.358 9.366 -9.150 584 2HA GLY 77 2HA GLY 77 -18.181 10.029 -10.285 585 H GLY 78 H GLY 78 -16.035 8.863 -10.356 586 1HA GLY 78 1HA GLY 78 -14.899 6.698 -9.640 587 2HA GLY 78 2HA GLY 78 -16.456 5.928 -9.947 588 H ALA 79 H ALA 79 -14.208 5.022 -11.290 589 HA ALA 79 HA ALA 79 -15.006 5.478 -14.072 590 1HB ALA 79 1HB ALA 79 -12.364 6.442 -12.981 591 2HB ALA 79 2HB ALA 79 -12.527 5.967 -14.672 592 3HB ALA 79 3HB ALA 79 -13.497 7.293 -14.031 593 H GLY 80 H GLY 80 -12.527 4.087 -11.914 594 1HA GLY 80 1HA GLY 80 -12.974 1.405 -12.368 595 2HA GLY 80 2HA GLY 80 -11.967 1.879 -13.737 596 H GLU 81 H GLU 81 -11.094 0.032 -11.775 597 HA GLU 81 HA GLU 81 -9.511 1.200 -9.702 598 1HB GLU 81 1HB GLU 81 -8.260 -0.971 -9.767 599 2HB GLU 81 2HB GLU 81 -10.010 -1.181 -9.690 600 1HG GLU 81 1HG GLU 81 -10.158 -1.741 -11.990 601 2HG GLU 81 2HG GLU 81 -8.538 -1.128 -12.326 602 H GLN 82 H GLN 82 -8.962 0.833 -13.141 603 HA GLN 82 HA GLN 82 -6.112 1.612 -12.835 604 1HB GLN 82 1HB GLN 82 -7.756 0.357 -14.976 605 2HB GLN 82 2HB GLN 82 -6.428 1.392 -15.502 606 1HG GLN 82 1HG GLN 82 -5.818 -0.534 -13.320 607 2HG GLN 82 2HG GLN 82 -6.090 -1.222 -14.921 608 1HE2 GLN 82 2HE2 GLN 82 -3.597 -0.277 -13.034 609 2HE2 GLN 82 1HE2 GLN 82 -2.525 0.318 -14.209 610 H ASP 83 H ASP 83 -8.377 3.474 -12.289 611 HA ASP 83 HA ASP 83 -7.877 5.484 -14.448 612 1HB ASP 83 1HB ASP 83 -10.293 4.617 -13.718 613 2HB ASP 83 2HB ASP 83 -10.082 5.836 -12.461 614 H TYR 84 H TYR 84 -6.160 4.869 -12.075 615 HA TYR 84 HA TYR 84 -6.413 7.400 -10.534 616 1HB TYR 84 1HB TYR 84 -5.063 4.747 -10.007 617 2HB TYR 84 2HB TYR 84 -4.583 6.190 -9.121 618 HD1 TYR 84 HD1 TYR 84 -8.006 5.100 -10.262 619 HD2 TYR 84 HD2 TYR 84 -5.398 5.904 -6.945 620 HE1 TYR 84 HE1 TYR 84 -9.894 4.773 -8.707 621 HE2 TYR 84 HE2 TYR 84 -7.298 5.579 -5.386 622 HH TYR 84 HH TYR 84 -9.825 4.031 -5.875 623 H GLU 85 H GLU 85 -3.879 7.899 -9.827 624 HA GLU 85 HA GLU 85 -2.327 7.944 -12.372 625 1HB GLU 85 1HB GLU 85 -2.458 10.194 -12.426 626 2HB GLU 85 2HB GLU 85 -3.447 10.180 -10.977 627 1HG GLU 85 1HG GLU 85 -1.581 11.604 -10.525 628 2HG GLU 85 2HG GLU 85 -1.275 10.109 -9.641 629 H VAL 86 H VAL 86 -0.173 7.419 -12.155 630 HA VAL 86 HA VAL 86 0.627 5.992 -9.806 631 HB VAL 86 HB VAL 86 2.400 7.057 -12.025 632 1HG1 VAL 86 1HG1 VAL 86 3.226 5.954 -9.709 633 2HG1 VAL 86 2HG1 VAL 86 2.893 4.478 -10.614 634 3HG1 VAL 86 3HG1 VAL 86 4.047 5.655 -11.241 635 1HG2 VAL 86 1HG2 VAL 86 0.263 5.507 -12.495 636 2HG2 VAL 86 2HG2 VAL 86 1.786 5.262 -13.346 637 3HG2 VAL 86 3HG2 VAL 86 1.377 4.249 -11.962 638 H LEU 87 H LEU 87 0.423 7.490 -8.041 639 HA LEU 87 HA LEU 87 1.714 10.028 -7.848 640 1HB LEU 87 1HB LEU 87 0.009 8.922 -6.246 641 2HB LEU 87 2HB LEU 87 1.400 8.105 -5.536 642 HG LEU 87 HG LEU 87 2.443 10.477 -5.379 643 1HD1 LEU 87 1HD1 LEU 87 -0.296 11.029 -6.331 644 2HD1 LEU 87 2HD1 LEU 87 0.182 11.974 -4.922 645 3HD1 LEU 87 3HD1 LEU 87 1.144 12.045 -6.395 646 1HD2 LEU 87 1HD2 LEU 87 1.600 9.074 -3.468 647 2HD2 LEU 87 2HD2 LEU 87 1.426 10.808 -3.195 648 3HD2 LEU 87 3HD2 LEU 87 0.025 9.843 -3.658 649 H LEU 88 H LEU 88 2.845 6.765 -6.906 650 HA LEU 88 HA LEU 88 5.604 7.702 -7.374 651 1HB LEU 88 1HB LEU 88 6.471 6.959 -5.277 652 2HB LEU 88 2HB LEU 88 5.120 8.037 -4.949 653 HG LEU 88 HG LEU 88 3.886 5.572 -5.094 654 1HD1 LEU 88 1HD1 LEU 88 6.722 5.269 -4.250 655 2HD1 LEU 88 2HD1 LEU 88 5.519 4.447 -3.258 656 3HD1 LEU 88 3HD1 LEU 88 5.635 4.089 -4.980 657 1HD2 LEU 88 1HD2 LEU 88 4.893 7.337 -2.885 658 2HD2 LEU 88 2HD2 LEU 88 3.232 7.012 -3.378 659 3HD2 LEU 88 3HD2 LEU 88 4.138 5.798 -2.472 660 H VAL 89 H VAL 89 6.536 6.287 -8.703 661 HA VAL 89 HA VAL 89 5.425 3.906 -9.649 662 HB VAL 89 HB VAL 89 7.743 3.319 -10.393 663 1HG1 VAL 89 1HG1 VAL 89 6.187 5.075 -11.487 664 2HG1 VAL 89 2HG1 VAL 89 7.265 6.274 -10.771 665 3HG1 VAL 89 3HG1 VAL 89 7.894 5.106 -11.934 666 1HG2 VAL 89 1HG2 VAL 89 8.754 4.308 -8.238 667 2HG2 VAL 89 2HG2 VAL 89 9.611 4.642 -9.744 668 3HG2 VAL 89 3HG2 VAL 89 8.582 5.879 -9.021 669 H THR 90 H THR 90 6.591 1.660 -9.407 670 HA THR 90 HA THR 90 6.147 0.788 -6.736 671 HB THR 90 HB THR 90 6.035 -0.560 -8.957 672 HG1 THR 90 HG1 THR 90 5.997 -2.304 -7.722 673 1HG2 THR 90 1HG2 THR 90 8.626 -0.095 -9.262 674 2HG2 THR 90 2HG2 THR 90 8.780 -1.499 -8.205 675 3HG2 THR 90 3HG2 THR 90 7.930 -1.642 -9.744 676 H SER 91 H SER 91 7.518 0.426 -5.062 677 HA SER 91 HA SER 91 10.288 1.455 -5.366 678 1HB SER 91 1HB SER 91 10.088 1.509 -2.774 679 2HB SER 91 2HB SER 91 9.199 2.716 -3.699 680 HG SER 91 HG SER 91 7.927 1.637 -2.089 681 H SER 92 H SER 92 11.866 -0.009 -5.336 682 HA SER 92 HA SER 92 11.318 -2.796 -4.556 683 1HB SER 92 1HB SER 92 13.553 -3.245 -5.470 684 2HB SER 92 2HB SER 92 12.611 -2.292 -6.613 685 HG SER 92 HG SER 92 14.930 -1.676 -5.855 686 H PHE 93 H PHE 93 11.338 -3.031 -2.316 687 HA PHE 93 HA PHE 93 13.497 -1.680 -0.781 688 1HB PHE 93 1HB PHE 93 11.039 -3.146 0.178 689 2HB PHE 93 2HB PHE 93 12.203 -2.344 1.222 690 HD1 PHE 93 HD1 PHE 93 12.749 0.123 -0.445 691 HD2 PHE 93 HD2 PHE 93 9.070 -1.879 0.548 692 HE1 PHE 93 HE1 PHE 93 11.514 2.250 -0.729 693 HE2 PHE 93 HE2 PHE 93 7.842 0.256 0.263 694 HZ PHE 93 HZ PHE 93 9.065 2.317 -0.375 695 H MET 94 H MET 94 12.049 -4.914 -1.198 696 HA MET 94 HA MET 94 14.606 -6.055 -0.133 697 1HB MET 94 1HB MET 94 11.751 -6.712 0.366 698 2HB MET 94 2HB MET 94 12.849 -8.082 0.221 699 1HG MET 94 1HG MET 94 14.225 -7.288 2.007 700 2HG MET 94 2HG MET 94 13.433 -5.712 2.007 701 1HE MET 94 1HE MET 94 13.013 -9.523 2.525 702 2HE MET 94 2HE MET 94 11.355 -9.670 3.101 703 3HE MET 94 3HE MET 94 11.675 -9.120 1.452 704 H SER 95 H SER 95 14.374 -8.645 -0.856 705 HA SER 95 HA SER 95 13.973 -8.622 -3.816 706 1HB SER 95 1HB SER 95 16.048 -9.642 -4.172 707 2HB SER 95 2HB SER 95 16.425 -8.588 -2.817 708 HG SER 95 HG SER 95 16.933 -10.333 -1.782 709 HA PRO 96 HA PRO 96 11.870 -12.500 -3.129 710 1HB PRO 96 1HB PRO 96 12.724 -14.113 -5.151 711 2HB PRO 96 2HB PRO 96 11.684 -12.705 -5.406 712 1HG PRO 96 1HG PRO 96 14.525 -13.075 -6.081 713 2HG PRO 96 2HG PRO 96 13.345 -11.949 -6.760 714 1HD PRO 96 1HD PRO 96 15.382 -11.380 -4.831 715 2HD PRO 96 2HD PRO 96 14.134 -10.271 -5.442 716 H SER 97 H SER 97 15.023 -12.380 -2.258 717 HA SER 97 HA SER 97 15.181 -15.298 -1.632 718 1HB SER 97 1HB SER 97 17.595 -15.028 -1.518 719 2HB SER 97 2HB SER 97 17.033 -14.369 -3.051 720 HG SER 97 HG SER 97 18.538 -13.065 -1.672 721 H GLU 98 H GLU 98 16.157 -12.108 -0.325 722 HA GLU 98 HA GLU 98 16.499 -13.013 2.365 723 1HB GLU 98 1HB GLU 98 16.331 -10.598 2.959 724 2HB GLU 98 2HB GLU 98 17.433 -10.885 1.612 725 1HG GLU 98 1HG GLU 98 15.100 -10.535 0.258 726 2HG GLU 98 2HG GLU 98 14.819 -9.488 1.648 727 H SER 99 H SER 99 13.637 -12.335 0.521 728 HA SER 99 HA SER 99 11.804 -11.578 2.535 729 1HB SER 99 1HB SER 99 11.492 -13.183 0.000 730 2HB SER 99 2HB SER 99 10.117 -12.830 1.043 731 HG SER 99 HG SER 99 11.391 -11.240 -0.723 732 H ARG 100 H ARG 100 13.260 -14.693 1.866 733 HA ARG 100 HA ARG 100 11.370 -16.114 3.617 734 1HB ARG 100 1HB ARG 100 13.906 -17.115 2.283 735 2HB ARG 100 2HB ARG 100 12.661 -18.108 3.040 736 1HG ARG 100 1HG ARG 100 11.185 -17.821 1.308 737 2HG ARG 100 2HG ARG 100 11.766 -16.200 0.937 738 1HD ARG 100 1HD ARG 100 12.587 -17.410 -0.883 739 2HD ARG 100 2HD ARG 100 13.963 -17.455 0.220 740 HE ARG 100 HE ARG 100 13.680 -19.777 0.323 741 1HH1 ARG 100 1HH1 ARG 100 10.642 -18.276 -0.554 742 2HH1 ARG 100 2HH1 ARG 100 9.829 -19.792 -0.723 743 1HH2 ARG 100 1HH2 ARG 100 12.588 -21.714 0.078 744 2HH2 ARG 100 2HH2 ARG 100 10.917 -21.717 -0.376 745 H SER 101 H SER 101 14.954 -16.217 3.637 746 HA SER 101 HA SER 101 15.129 -15.199 6.346 747 1HB SER 101 1HB SER 101 14.351 -17.762 6.353 748 2HB SER 101 2HB SER 101 16.077 -18.028 6.119 749 HG SER 101 HG SER 101 14.813 -17.471 8.359 750 H GLY 102 H GLY 102 16.266 -14.599 3.792 751 1HA GLY 102 1HA GLY 102 19.027 -15.632 3.841 752 2HA GLY 102 2HA GLY 102 18.354 -14.527 2.640 753 H SER 103 H SER 103 17.215 -12.850 4.912 754 HA SER 103 HA SER 103 19.373 -11.866 6.502 755 1HB SER 103 1HB SER 103 19.417 -11.011 3.760 756 2HB SER 103 2HB SER 103 19.144 -9.624 4.810 757 HG SER 103 HG SER 103 20.958 -10.436 6.062 758 H ASN 104 H ASN 104 17.164 -9.901 4.652 759 HA ASN 104 HA ASN 104 15.688 -9.301 7.169 760 1HB ASN 104 1HB ASN 104 15.132 -7.088 5.873 761 2HB ASN 104 2HB ASN 104 16.689 -7.250 6.677 762 1HD2 ASN 104 2HD2 ASN 104 15.306 -8.147 3.446 763 2HD2 ASN 104 1HD2 ASN 104 16.649 -7.598 2.566 764 HA PRO 105 HA PRO 105 12.587 -11.156 4.310 765 1HB PRO 105 1HB PRO 105 11.219 -12.459 6.277 766 2HB PRO 105 2HB PRO 105 12.649 -13.120 5.481 767 1HG PRO 105 1HG PRO 105 12.383 -11.941 8.186 768 2HG PRO 105 2HG PRO 105 13.455 -13.229 7.616 769 1HD PRO 105 1HD PRO 105 14.215 -10.576 8.047 770 2HD PRO 105 2HD PRO 105 15.111 -11.755 7.064 771 H ASN 106 H ASN 106 12.425 -9.181 7.143 772 HA ASN 106 HA ASN 106 9.813 -8.088 6.213 773 1HB ASN 106 1HB ASN 106 10.350 -9.466 8.731 774 2HB ASN 106 2HB ASN 106 9.738 -7.836 9.003 775 1HD2 ASN 106 2HD2 ASN 106 8.904 -9.876 6.180 776 2HD2 ASN 106 1HD2 ASN 106 7.261 -10.028 6.577 777 H ARG 107 H ARG 107 10.209 -6.005 5.727 778 HA ARG 107 HA ARG 107 11.701 -4.326 7.663 779 1HB ARG 107 1HB ARG 107 13.035 -5.290 5.488 780 2HB ARG 107 2HB ARG 107 12.360 -3.804 4.819 781 1HG ARG 107 1HG ARG 107 13.588 -2.448 6.222 782 2HG ARG 107 2HG ARG 107 13.623 -3.645 7.519 783 1HD ARG 107 1HD ARG 107 15.462 -4.726 6.660 784 2HD ARG 107 2HD ARG 107 15.031 -4.353 4.990 785 HE ARG 107 HE ARG 107 15.743 -1.939 6.372 786 1HH1 ARG 107 1HH1 ARG 107 17.136 -4.846 5.014 787 2HH1 ARG 107 2HH1 ARG 107 18.657 -4.088 4.693 788 1HH2 ARG 107 1HH2 ARG 107 17.728 -1.000 5.942 789 2HH2 ARG 107 2HH2 ARG 107 18.991 -1.934 5.212 790 H VAL 108 H VAL 108 11.283 -1.984 7.251 791 HA VAL 108 HA VAL 108 8.751 -1.586 5.726 792 HB VAL 108 HB VAL 108 8.033 0.012 7.384 793 1HG1 VAL 108 1HG1 VAL 108 9.067 -2.572 8.585 794 2HG1 VAL 108 2HG1 VAL 108 7.875 -1.523 9.352 795 3HG1 VAL 108 3HG1 VAL 108 7.494 -2.325 7.829 796 1HG2 VAL 108 1HG2 VAL 108 10.812 -0.405 8.408 797 2HG2 VAL 108 2HG2 VAL 108 9.899 1.095 8.232 798 3HG2 VAL 108 3HG2 VAL 108 9.528 -0.014 9.553 799 H ARG 109 H ARG 109 8.447 0.729 4.957 800 HA ARG 109 HA ARG 109 10.906 2.321 4.730 801 1HB ARG 109 1HB ARG 109 9.926 0.580 2.585 802 2HB ARG 109 2HB ARG 109 10.057 2.263 2.075 803 1HG ARG 109 1HG ARG 109 12.234 1.638 1.684 804 2HG ARG 109 2HG ARG 109 12.395 2.044 3.391 805 1HD ARG 109 1HD ARG 109 11.500 -0.584 3.455 806 2HD ARG 109 2HD ARG 109 12.598 -0.564 2.075 807 HE ARG 109 HE ARG 109 13.361 -0.299 4.864 808 1HH1 ARG 109 1HH1 ARG 109 14.198 0.592 1.587 809 2HH1 ARG 109 2HH1 ARG 109 15.870 0.815 1.968 810 1HH2 ARG 109 1HH2 ARG 109 15.533 -0.001 5.313 811 2HH2 ARG 109 2HH2 ARG 109 16.620 0.482 4.053 812 H MET 110 H MET 110 10.455 4.438 3.791 813 HA MET 110 HA MET 110 7.559 5.174 3.832 814 1HB MET 110 1HB MET 110 9.807 6.842 4.998 815 2HB MET 110 2HB MET 110 8.080 7.192 5.073 816 1HG MET 110 1HG MET 110 7.685 5.579 6.682 817 2HG MET 110 2HG MET 110 9.022 4.571 6.156 818 1HE MET 110 1HE MET 110 7.875 7.789 7.536 819 2HE MET 110 2HE MET 110 9.078 8.343 8.696 820 3HE MET 110 3HE MET 110 9.343 8.577 6.963 821 H PHE 111 H PHE 111 7.126 7.243 2.714 822 HA PHE 111 HA PHE 111 9.133 7.883 0.595 823 1HB PHE 111 1HB PHE 111 6.148 8.006 0.140 824 2HB PHE 111 2HB PHE 111 7.433 8.035 -1.060 825 HD1 PHE 111 HD1 PHE 111 6.030 5.826 1.635 826 HD2 PHE 111 HD2 PHE 111 7.983 6.062 -2.185 827 HE1 PHE 111 HE1 PHE 111 5.839 3.379 1.383 828 HE2 PHE 111 HE2 PHE 111 7.798 3.600 -2.429 829 HZ PHE 111 HZ PHE 111 6.720 2.255 -0.640 830 H GLY 112 H GLY 112 8.681 10.132 -0.313 831 1HA GLY 112 1HA GLY 112 7.355 11.916 1.655 832 2HA GLY 112 2HA GLY 112 8.983 12.257 1.123 833 HA PRO 113 HA PRO 113 6.316 14.523 -1.868 834 1HB PRO 113 1HB PRO 113 7.986 16.676 -2.041 835 2HB PRO 113 2HB PRO 113 6.748 16.498 -0.789 836 1HG PRO 113 1HG PRO 113 9.691 16.152 -0.597 837 2HG PRO 113 2HG PRO 113 8.537 16.711 0.623 838 1HD PRO 113 1HD PRO 113 9.636 14.141 0.518 839 2HD PRO 113 2HD PRO 113 8.170 14.585 1.402 840 H ASP 114 H ASP 114 9.831 14.081 -1.888 841 HA ASP 114 HA ASP 114 10.238 14.537 -4.688 842 1HB ASP 114 1HB ASP 114 11.952 14.322 -2.686 843 2HB ASP 114 2HB ASP 114 11.957 12.621 -3.152 844 H LYS 115 H LYS 115 9.177 11.766 -2.833 845 HA LYS 115 HA LYS 115 9.483 9.961 -5.136 846 1HB LYS 115 1HB LYS 115 8.688 9.647 -2.265 847 2HB LYS 115 2HB LYS 115 8.217 8.403 -3.423 848 1HG LYS 115 1HG LYS 115 10.382 7.727 -3.791 849 2HG LYS 115 2HG LYS 115 11.041 9.343 -3.533 850 1HD LYS 115 1HD LYS 115 10.207 8.930 -1.051 851 2HD LYS 115 2HD LYS 115 10.349 7.236 -1.521 852 1HE LYS 115 1HE LYS 115 12.696 8.069 -2.470 853 2HE LYS 115 2HE LYS 115 12.484 9.306 -1.230 854 1HZ LYS 115 1HZ LYS 115 12.055 7.483 0.368 855 2HZ LYS 115 2HZ LYS 115 12.470 6.365 -0.843 856 3HZ LYS 115 3HZ LYS 115 13.627 7.469 -0.269 857 H LEU 116 H LEU 116 7.238 12.300 -4.402 858 HA LEU 116 HA LEU 116 5.087 10.689 -5.725 859 1HB LEU 116 1HB LEU 116 3.452 12.255 -4.534 860 2HB LEU 116 2HB LEU 116 4.214 11.004 -3.561 861 HG LEU 116 HG LEU 116 5.990 12.854 -3.045 862 1HD1 LEU 116 1HD1 LEU 116 4.283 14.314 -4.733 863 2HD1 LEU 116 2HD1 LEU 116 3.935 14.893 -3.109 864 3HD1 LEU 116 3HD1 LEU 116 5.580 14.956 -3.733 865 1HD2 LEU 116 1HD2 LEU 116 3.175 12.781 -1.950 866 2HD2 LEU 116 2HD2 LEU 116 4.589 11.931 -1.327 867 3HD2 LEU 116 3HD2 LEU 116 4.482 13.685 -1.189 868 H VAL 117 H VAL 117 4.050 11.596 -7.411 869 HA VAL 117 HA VAL 117 5.328 13.680 -8.881 870 HB VAL 117 HB VAL 117 3.833 12.013 -9.927 871 1HG1 VAL 117 1HG1 VAL 117 2.215 11.885 -8.074 872 2HG1 VAL 117 2HG1 VAL 117 1.631 13.486 -8.493 873 3HG1 VAL 117 3HG1 VAL 117 1.417 12.154 -9.622 874 1HG2 VAL 117 1HG2 VAL 117 4.129 14.511 -10.762 875 2HG2 VAL 117 2HG2 VAL 117 2.970 13.439 -11.549 876 3HG2 VAL 117 3HG2 VAL 117 2.415 14.617 -10.359 877 H ARG 118 H ARG 118 5.119 15.895 -8.792 878 HA ARG 118 HA ARG 118 3.638 17.073 -6.579 879 1HB ARG 118 1HB ARG 118 5.482 18.048 -8.711 880 2HB ARG 118 2HB ARG 118 4.381 19.229 -8.000 881 1HG ARG 118 1HG ARG 118 5.413 19.164 -5.959 882 2HG ARG 118 2HG ARG 118 5.767 17.440 -6.079 883 1HD ARG 118 1HD ARG 118 7.861 18.672 -6.177 884 2HD ARG 118 2HD ARG 118 7.540 17.975 -7.765 885 HE ARG 118 HE ARG 118 7.353 20.158 -8.618 886 1HH1 ARG 118 1HH1 ARG 118 6.992 20.205 -5.139 887 2HH1 ARG 118 2HH1 ARG 118 6.964 21.932 -5.065 888 1HH2 ARG 118 1HH2 ARG 118 7.310 22.388 -8.477 889 2HH2 ARG 118 2HH2 ARG 118 7.142 23.158 -6.933 890 H ALA 119 H ALA 119 3.124 16.650 -10.025 891 HA ALA 119 HA ALA 119 0.987 18.546 -10.303 892 1HB ALA 119 1HB ALA 119 1.721 16.075 -11.889 893 2HB ALA 119 2HB ALA 119 0.429 17.181 -12.357 894 3HB ALA 119 3HB ALA 119 2.097 17.752 -12.288 895 H ALA 120 H ALA 120 1.146 15.321 -8.989 896 HA ALA 120 HA ALA 120 -1.837 15.229 -8.882 897 1HB ALA 120 1HB ALA 120 -0.194 13.314 -9.878 898 2HB ALA 120 2HB ALA 120 -0.304 12.793 -8.196 899 3HB ALA 120 3HB ALA 120 -1.769 12.976 -9.158 900 H ALA 121 H ALA 121 1.110 14.563 -6.929 901 HA ALA 121 HA ALA 121 -0.055 13.886 -4.491 902 1HB ALA 121 1HB ALA 121 2.366 15.596 -5.066 903 2HB ALA 121 2HB ALA 121 1.939 15.052 -3.445 904 3HB ALA 121 3HB ALA 121 2.324 13.873 -4.698 905 H GLU 122 H GLU 122 0.347 17.187 -5.789 906 HA GLU 122 HA GLU 122 -0.794 18.396 -3.385 907 1HB GLU 122 1HB GLU 122 -0.714 20.503 -4.668 908 2HB GLU 122 2HB GLU 122 0.819 19.640 -4.779 909 1HG GLU 122 1HG GLU 122 0.567 19.993 -7.020 910 2HG GLU 122 2HG GLU 122 -0.495 18.588 -6.922 911 H LYS 123 H LYS 123 -2.218 16.640 -5.845 912 HA LYS 123 HA LYS 123 -4.676 18.262 -5.958 913 1HB LYS 123 1HB LYS 123 -4.113 15.538 -7.164 914 2HB LYS 123 2HB LYS 123 -5.473 16.592 -7.545 915 1HG LYS 123 1HG LYS 123 -3.632 18.340 -8.137 916 2HG LYS 123 2HG LYS 123 -2.568 16.939 -8.228 917 1HD LYS 123 1HD LYS 123 -3.347 17.087 -10.428 918 2HD LYS 123 2HD LYS 123 -4.474 15.927 -9.722 919 1HE LYS 123 1HE LYS 123 -6.176 17.567 -9.477 920 2HE LYS 123 2HE LYS 123 -5.043 18.894 -9.734 921 1HZ LYS 123 1HZ LYS 123 -4.685 17.731 -12.006 922 2HZ LYS 123 2HZ LYS 123 -6.204 17.036 -11.694 923 3HZ LYS 123 3HZ LYS 123 -6.045 18.723 -11.776 924 H ARG 124 H ARG 124 -6.422 17.823 -4.690 925 HA ARG 124 HA ARG 124 -6.160 16.069 -2.443 926 1HB ARG 124 1HB ARG 124 -8.412 17.693 -3.590 927 2HB ARG 124 2HB ARG 124 -8.723 16.561 -2.274 928 1HG ARG 124 1HG ARG 124 -6.733 17.672 -1.078 929 2HG ARG 124 2HG ARG 124 -6.883 18.955 -2.279 930 1HD ARG 124 1HD ARG 124 -9.167 18.005 -0.528 931 2HD ARG 124 2HD ARG 124 -8.159 19.403 -0.156 932 HE ARG 124 HE ARG 124 -10.278 19.307 -2.142 933 1HH1 ARG 124 1HH1 ARG 124 -7.219 20.786 -1.310 934 2HH1 ARG 124 2HH1 ARG 124 -7.540 22.207 -2.242 935 1HH2 ARG 124 1HH2 ARG 124 -10.651 21.164 -3.334 936 2HH2 ARG 124 2HH2 ARG 124 -9.460 22.421 -3.377 937 H TRP 125 H TRP 125 -6.135 13.916 -2.681 938 HA TRP 125 HA TRP 125 -8.090 12.611 -4.530 939 1HB TRP 125 1HB TRP 125 -5.528 11.503 -3.316 940 2HB TRP 125 2HB TRP 125 -6.572 10.667 -4.460 941 HD1 TRP 125 HD1 TRP 125 -3.663 12.920 -4.291 942 HE1 TRP 125 HE1 TRP 125 -3.076 13.826 -6.631 943 HE3 TRP 125 HE3 TRP 125 -7.844 11.534 -6.866 944 HZ2 TRP 125 HZ2 TRP 125 -4.204 13.926 -9.249 945 HZ3 TRP 125 HZ3 TRP 125 -8.060 12.027 -9.278 946 HH2 TRP 125 HH2 TRP 125 -6.249 13.230 -10.477 947 H ASP 126 H ASP 126 -9.000 10.528 -3.598 948 HA ASP 126 HA ASP 126 -9.126 10.615 -0.626 949 1HB ASP 126 1HB ASP 126 -11.131 11.626 -0.934 950 2HB ASP 126 2HB ASP 126 -11.281 11.046 -2.574 951 H ARG 127 H ARG 127 -8.173 8.784 -3.131 952 HA ARG 127 HA ARG 127 -8.641 6.271 -1.655 953 1HB ARG 127 1HB ARG 127 -9.178 6.551 -4.628 954 2HB ARG 127 2HB ARG 127 -9.372 5.091 -3.656 955 1HG ARG 127 1HG ARG 127 -10.992 6.564 -2.227 956 2HG ARG 127 2HG ARG 127 -11.039 7.594 -3.658 957 1HD ARG 127 1HD ARG 127 -11.469 4.627 -3.907 958 2HD ARG 127 2HD ARG 127 -12.797 5.689 -3.447 959 HE ARG 127 HE ARG 127 -11.694 6.885 -5.705 960 1HH1 ARG 127 1HH1 ARG 127 -13.037 3.750 -4.934 961 2HH1 ARG 127 2HH1 ARG 127 -13.592 3.479 -6.549 962 1HH2 ARG 127 1HH2 ARG 127 -12.427 6.493 -7.782 963 2HH2 ARG 127 2HH2 ARG 127 -13.251 5.014 -8.145 964 H VAL 128 H VAL 128 -6.889 4.801 -1.987 965 HA VAL 128 HA VAL 128 -4.771 5.776 -3.842 966 HB VAL 128 HB VAL 128 -4.411 6.448 -1.423 967 1HG1 VAL 128 1HG1 VAL 128 -4.962 3.730 -0.945 968 2HG1 VAL 128 2HG1 VAL 128 -3.240 3.925 -0.621 969 3HG1 VAL 128 3HG1 VAL 128 -4.420 4.927 0.224 970 1HG2 VAL 128 1HG2 VAL 128 -2.434 4.787 -2.972 971 2HG2 VAL 128 2HG2 VAL 128 -2.555 6.544 -2.876 972 3HG2 VAL 128 3HG2 VAL 128 -1.988 5.622 -1.484 973 H LYS 129 H LYS 129 -3.597 4.191 -4.879 974 HA LYS 129 HA LYS 129 -4.619 1.412 -4.558 975 1HB LYS 129 1HB LYS 129 -4.150 3.065 -6.822 976 2HB LYS 129 2HB LYS 129 -2.954 1.774 -6.890 977 1HG LYS 129 1HG LYS 129 -4.731 0.094 -6.657 978 2HG LYS 129 2HG LYS 129 -5.938 1.376 -6.552 979 1HD LYS 129 1HD LYS 129 -5.892 1.783 -8.791 980 2HD LYS 129 2HD LYS 129 -4.146 1.557 -8.895 981 1HE LYS 129 1HE LYS 129 -4.707 -0.966 -8.469 982 2HE LYS 129 2HE LYS 129 -6.326 -0.514 -9.001 983 1HZ LYS 129 1HZ LYS 129 -5.033 0.596 -10.936 984 2HZ LYS 129 2HZ LYS 129 -3.800 -0.486 -10.504 985 3HZ LYS 129 3HZ LYS 129 -5.324 -1.077 -10.969 986 H ILE 130 H ILE 130 -3.299 0.106 -3.398 987 HA ILE 130 HA ILE 130 -0.352 0.626 -3.481 988 HB ILE 130 HB ILE 130 -1.979 -0.961 -1.465 989 1HG1 ILE 130 1HG1 ILE 130 -2.468 1.452 -1.349 990 2HG1 ILE 130 2HG1 ILE 130 -1.534 0.941 0.055 991 1HG2 ILE 130 1HG2 ILE 130 0.939 -0.403 -1.829 992 2HG2 ILE 130 2HG2 ILE 130 0.302 -0.483 -0.187 993 3HG2 ILE 130 3HG2 ILE 130 0.139 -1.870 -1.264 994 1HD1 ILE 130 1HD1 ILE 130 0.440 1.627 -1.757 995 2HD1 ILE 130 2HD1 ILE 130 -0.815 2.823 -2.080 996 3HD1 ILE 130 3HD1 ILE 130 -0.149 2.662 -0.456 997 H VAL 131 H VAL 131 0.751 -0.798 -4.803 998 HA VAL 131 HA VAL 131 -0.388 -3.536 -5.089 999 HB VAL 131 HB VAL 131 1.084 -1.934 -7.196 1000 1HG1 VAL 131 1HG1 VAL 131 -0.288 -4.617 -7.128 1001 2HG1 VAL 131 2HG1 VAL 131 0.069 -3.772 -8.635 1002 3HG1 VAL 131 3HG1 VAL 131 1.383 -4.262 -7.567 1003 1HG2 VAL 131 1HG2 VAL 131 -1.806 -2.229 -6.488 1004 2HG2 VAL 131 2HG2 VAL 131 -0.957 -0.843 -7.172 1005 3HG2 VAL 131 3HG2 VAL 131 -1.380 -2.212 -8.200 1006 H CYS 132 H CYS 132 0.969 -5.076 -4.371 1007 HA CYS 132 HA CYS 132 3.861 -4.447 -4.069 1008 1HB CYS 132 1HB CYS 132 3.189 -5.304 -2.024 1009 2HB CYS 132 2HB CYS 132 1.958 -6.324 -2.728 1010 HG CYS 132 HG CYS 132 3.616 -8.141 -2.319 1011 H SER 133 H SER 133 5.420 -5.664 -5.182 1012 HA SER 133 HA SER 133 4.472 -7.799 -7.028 1013 1HB SER 133 1HB SER 133 5.112 -5.132 -7.808 1014 2HB SER 133 2HB SER 133 6.418 -6.159 -8.385 1015 HG SER 133 HG SER 133 3.845 -5.959 -9.233 1016 H GLN 134 H GLN 134 5.774 -9.509 -6.828 1017 HA GLN 134 HA GLN 134 8.433 -9.870 -7.204 1018 1HB GLN 134 1HB GLN 134 8.944 -8.237 -5.364 1019 2HB GLN 134 2HB GLN 134 8.120 -9.301 -4.230 1020 1HG GLN 134 1HG GLN 134 10.315 -10.004 -3.966 1021 2HG GLN 134 2HG GLN 134 9.795 -11.097 -5.248 1022 1HE2 GLN 134 2HE2 GLN 134 11.484 -11.246 -6.740 1023 2HE2 GLN 134 1HE2 GLN 134 12.380 -9.931 -7.327 1024 HA PRO 135 HA PRO 135 6.518 -13.831 -6.062 1025 1HB PRO 135 1HB PRO 135 8.319 -15.419 -7.359 1026 2HB PRO 135 2HB PRO 135 7.008 -14.569 -8.191 1027 1HG PRO 135 1HG PRO 135 9.908 -13.981 -8.152 1028 2HG PRO 135 2HG PRO 135 8.699 -13.628 -9.395 1029 1HD PRO 135 1HD PRO 135 9.757 -11.791 -7.534 1030 2HD PRO 135 2HD PRO 135 8.335 -11.537 -8.566 1031 H TYR 136 H TYR 136 6.949 -14.078 -3.833 1032 HA TYR 136 HA TYR 136 9.681 -15.058 -3.164 1033 1HB TYR 136 1HB TYR 136 9.257 -13.826 -0.889 1034 2HB TYR 136 2HB TYR 136 9.845 -12.920 -2.278 1035 HD1 TYR 136 HD1 TYR 136 6.641 -13.960 -0.626 1036 HD2 TYR 136 HD2 TYR 136 8.686 -11.008 -2.983 1037 HE1 TYR 136 HE1 TYR 136 4.649 -12.490 -0.511 1038 HE2 TYR 136 HE2 TYR 136 6.690 -9.537 -2.864 1039 HH TYR 136 HH TYR 136 3.657 -10.641 -1.784 1040 H SER 137 H SER 137 6.330 -15.693 -2.885 1041 HA SER 137 HA SER 137 7.010 -17.916 -1.034 1042 1HB SER 137 1HB SER 137 5.912 -15.684 0.049 1043 2HB SER 137 2HB SER 137 4.455 -16.552 -0.415 1044 HG SER 137 HG SER 137 6.563 -17.387 1.276 1045 H LYS 138 H LYS 138 6.133 -19.758 -1.819 1046 HA LYS 138 HA LYS 138 3.875 -19.508 -3.762 1047 1HB LYS 138 1HB LYS 138 4.656 -21.740 -4.592 1048 2HB LYS 138 2HB LYS 138 5.864 -20.467 -4.772 1049 1HG LYS 138 1HG LYS 138 7.097 -21.234 -2.876 1050 2HG LYS 138 2HG LYS 138 5.782 -22.293 -2.363 1051 1HD LYS 138 1HD LYS 138 7.034 -22.670 -5.071 1052 2HD LYS 138 2HD LYS 138 7.826 -23.326 -3.638 1053 1HE LYS 138 1HE LYS 138 5.929 -24.679 -3.093 1054 2HE LYS 138 2HE LYS 138 4.914 -23.846 -4.271 1055 1HZ LYS 138 1HZ LYS 138 7.361 -25.263 -5.111 1056 2HZ LYS 138 2HZ LYS 138 5.900 -26.103 -4.900 1057 3HZ LYS 138 3HZ LYS 138 6.003 -24.846 -6.037 1058 H ASP 139 H ASP 139 4.922 -21.032 -0.782 1059 HA ASP 139 HA ASP 139 2.530 -22.757 -0.744 1060 1HB ASP 139 1HB ASP 139 3.546 -23.640 1.368 1061 2HB ASP 139 2HB ASP 139 4.578 -23.834 -0.045 1062 H SER 140 H SER 140 3.995 -20.164 1.129 1063 HA SER 140 HA SER 140 1.436 -19.836 2.598 1064 1HB SER 140 1HB SER 140 3.102 -18.286 3.977 1065 2HB SER 140 2HB SER 140 3.026 -20.020 4.254 1066 HG SER 140 HG SER 140 5.162 -19.425 3.951 1067 HA PRO 141 HA PRO 141 1.015 -15.922 0.429 1068 1HB PRO 141 1HB PRO 141 -1.126 -14.976 1.823 1069 2HB PRO 141 2HB PRO 141 -1.245 -16.275 0.628 1070 1HG PRO 141 1HG PRO 141 -1.483 -16.408 3.548 1071 2HG PRO 141 2HG PRO 141 -2.038 -17.552 2.318 1072 1HD PRO 141 1HD PRO 141 0.313 -17.742 3.973 1073 2HD PRO 141 2HD PRO 141 -0.254 -18.884 2.734 1074 H PHE 142 H PHE 142 0.991 -13.539 0.941 1075 HA PHE 142 HA PHE 142 1.476 -12.491 3.550 1076 1HB PHE 142 1HB PHE 142 3.770 -13.713 2.247 1077 2HB PHE 142 2HB PHE 142 4.045 -11.988 2.483 1078 HD1 PHE 142 HD1 PHE 142 3.390 -11.040 4.853 1079 HD2 PHE 142 HD2 PHE 142 4.149 -15.183 4.022 1080 HE1 PHE 142 HE1 PHE 142 3.828 -11.442 7.260 1081 HE2 PHE 142 HE2 PHE 142 4.588 -15.587 6.429 1082 HZ PHE 142 HZ PHE 142 4.427 -13.716 8.049 1083 H GLY 143 H GLY 143 3.093 -10.285 2.908 1084 1HA GLY 143 1HA GLY 143 2.820 -9.045 0.444 1085 2HA GLY 143 2HA GLY 143 1.267 -8.772 1.227 1086 H LEU 144 H LEU 144 1.110 -7.173 2.748 1087 HA LEU 144 HA LEU 144 3.644 -5.725 3.414 1088 1HB LEU 144 1HB LEU 144 0.982 -4.812 2.529 1089 2HB LEU 144 2HB LEU 144 1.652 -3.894 3.874 1090 HG LEU 144 HG LEU 144 3.758 -3.600 2.575 1091 1HD1 LEU 144 1HD1 LEU 144 2.192 -5.255 0.629 1092 2HD1 LEU 144 2HD1 LEU 144 3.296 -4.033 -0.002 1093 3HD1 LEU 144 3HD1 LEU 144 3.910 -5.326 1.028 1094 1HD2 LEU 144 1HD2 LEU 144 1.123 -2.653 1.444 1095 2HD2 LEU 144 2HD2 LEU 144 2.263 -1.763 2.453 1096 3HD2 LEU 144 3HD2 LEU 144 2.659 -2.110 0.770 1097 H SER 145 H SER 145 3.792 -4.753 5.515 1098 HA SER 145 HA SER 145 2.449 -6.343 7.616 1099 1HB SER 145 1HB SER 145 4.565 -4.188 7.871 1100 2HB SER 145 2HB SER 145 4.056 -5.310 9.131 1101 HG SER 145 HG SER 145 5.686 -6.407 8.315 1102 H PHE 146 H PHE 146 2.430 -3.123 6.243 1103 HA PHE 146 HA PHE 146 -0.083 -2.420 7.405 1104 1HB PHE 146 1HB PHE 146 0.658 -0.693 9.016 1105 2HB PHE 146 2HB PHE 146 1.268 -2.277 9.498 1106 HD1 PHE 146 HD1 PHE 146 2.142 0.970 7.986 1107 HD2 PHE 146 HD2 PHE 146 3.630 -2.816 9.352 1108 HE1 PHE 146 HE1 PHE 146 4.455 1.821 7.782 1109 HE2 PHE 146 HE2 PHE 146 5.947 -1.985 9.140 1110 HZ PHE 146 HZ PHE 146 6.380 0.325 8.339 1111 H VAL 147 H VAL 147 -0.637 -0.128 6.850 1112 HA VAL 147 HA VAL 147 1.245 1.134 4.935 1113 HB VAL 147 HB VAL 147 -0.579 1.508 3.311 1114 1HG1 VAL 147 1HG1 VAL 147 0.930 -0.612 3.402 1115 2HG1 VAL 147 2HG1 VAL 147 -0.538 -1.442 3.917 1116 3HG1 VAL 147 3HG1 VAL 147 -0.484 -0.634 2.349 1117 1HG2 VAL 147 1HG2 VAL 147 -2.146 0.196 5.483 1118 2HG2 VAL 147 2HG2 VAL 147 -2.637 1.456 4.351 1119 3HG2 VAL 147 3HG2 VAL 147 -2.581 -0.227 3.827 1120 H ARG 148 H ARG 148 1.149 3.362 4.962 1121 HA ARG 148 HA ARG 148 -0.987 4.706 6.527 1122 1HB ARG 148 1HB ARG 148 1.975 5.032 7.082 1123 2HB ARG 148 2HB ARG 148 0.672 5.857 7.921 1124 1HG ARG 148 1HG ARG 148 -0.160 3.376 8.343 1125 2HG ARG 148 2HG ARG 148 1.549 3.012 8.106 1126 1HD ARG 148 1HD ARG 148 1.605 3.454 10.363 1127 2HD ARG 148 2HD ARG 148 1.805 5.102 9.769 1128 HE ARG 148 HE ARG 148 -0.931 4.830 9.928 1129 1HH1 ARG 148 1HH1 ARG 148 1.688 4.266 12.176 1130 2HH1 ARG 148 2HH1 ARG 148 0.714 4.626 13.557 1131 1HH2 ARG 148 1HH2 ARG 148 -2.155 5.289 11.744 1132 2HH2 ARG 148 2HH2 ARG 148 -1.439 5.200 13.318 1133 H PHE 149 H PHE 149 -0.929 7.062 6.232 1134 HA PHE 149 HA PHE 149 0.725 8.084 3.983 1135 1HB PHE 149 1HB PHE 149 -2.303 8.303 4.133 1136 2HB PHE 149 2HB PHE 149 -1.288 9.155 2.971 1137 HD1 PHE 149 HD1 PHE 149 0.521 7.462 1.797 1138 HD2 PHE 149 HD2 PHE 149 -3.340 6.398 3.337 1139 HE1 PHE 149 HE1 PHE 149 0.474 5.475 0.309 1140 HE2 PHE 149 HE2 PHE 149 -3.387 4.414 1.846 1141 HZ PHE 149 HZ PHE 149 -1.480 3.953 0.335 1142 H HIS 150 H HIS 150 0.806 10.497 4.018 1143 HA HIS 150 HA HIS 150 -0.508 11.866 6.246 1144 1HB HIS 150 1HB HIS 150 2.050 12.715 6.821 1145 2HB HIS 150 2HB HIS 150 1.139 11.547 7.764 1146 HD1 HIS 150 HD1 HIS 150 4.261 11.938 6.008 1147 HD2 HIS 150 HD2 HIS 150 1.732 8.731 6.821 1148 HE1 HIS 150 HE1 HIS 150 5.631 9.838 5.651 1149 H SER 151 H SER 151 -0.753 14.002 5.821 1150 HA SER 151 HA SER 151 0.274 14.983 3.226 1151 1HB SER 151 1HB SER 151 -1.532 16.453 3.241 1152 2HB SER 151 2HB SER 151 -2.183 15.140 4.209 1153 HG SER 151 HG SER 151 -2.519 16.811 5.503 Start of MODEL 20 1 H MET 1 H MET 1 -0.481 18.753 14.433 2 HA MET 1 HA MET 1 1.758 17.250 13.195 3 1HB MET 1 1HB MET 1 1.219 16.960 15.762 4 2HB MET 1 2HB MET 1 -0.186 16.078 15.161 5 1HG MET 1 1HG MET 1 1.494 14.421 15.412 6 2HG MET 1 2HG MET 1 1.478 14.780 13.685 7 1HE MET 1 1HE MET 1 3.289 13.921 13.102 8 2HE MET 1 2HE MET 1 4.103 15.357 12.467 9 3HE MET 1 3HE MET 1 4.962 14.254 13.539 10 HA PRO 2 HA PRO 2 -2.080 16.700 10.706 11 1HB PRO 2 1HB PRO 2 -0.897 17.154 8.290 12 2HB PRO 2 2HB PRO 2 -1.505 18.451 9.328 13 1HG PRO 2 1HG PRO 2 1.265 17.716 8.702 14 2HG PRO 2 2HG PRO 2 0.619 19.233 9.340 15 1HD PRO 2 1HD PRO 2 1.939 17.124 10.794 16 2HD PRO 2 2HD PRO 2 1.292 18.652 11.431 17 H GLU 3 H GLU 3 -2.676 14.798 9.606 18 HA GLU 3 HA GLU 3 -0.669 13.021 8.434 19 1HB GLU 3 1HB GLU 3 -0.975 12.730 11.128 20 2HB GLU 3 2HB GLU 3 -2.226 11.632 10.543 21 1HG GLU 3 1HG GLU 3 -0.469 10.163 10.445 22 2HG GLU 3 2HG GLU 3 -0.213 10.936 8.881 23 H ILE 4 H ILE 4 -1.789 10.959 7.649 24 HA ILE 4 HA ILE 4 -4.659 11.512 7.031 25 HB ILE 4 HB ILE 4 -2.435 10.567 5.201 26 1HG1 ILE 4 1HG1 ILE 4 -4.471 12.805 4.985 27 2HG1 ILE 4 2HG1 ILE 4 -2.812 13.011 5.540 28 1HG2 ILE 4 1HG2 ILE 4 -5.427 10.533 4.675 29 2HG2 ILE 4 2HG2 ILE 4 -4.179 10.253 3.461 30 3HG2 ILE 4 3HG2 ILE 4 -4.383 9.117 4.793 31 1HD1 ILE 4 1HD1 ILE 4 -3.484 11.802 2.853 32 2HD1 ILE 4 2HD1 ILE 4 -3.233 13.533 3.078 33 3HD1 ILE 4 3HD1 ILE 4 -1.922 12.401 3.410 34 H ARG 5 H ARG 5 -5.951 9.914 7.732 35 HA ARG 5 HA ARG 5 -4.735 7.268 8.377 36 1HB ARG 5 1HB ARG 5 -6.191 8.877 9.992 37 2HB ARG 5 2HB ARG 5 -7.492 7.923 9.277 38 1HG ARG 5 1HG ARG 5 -6.574 5.879 10.064 39 2HG ARG 5 2HG ARG 5 -5.017 6.626 10.424 40 1HD ARG 5 1HD ARG 5 -5.935 7.855 12.270 41 2HD ARG 5 2HD ARG 5 -7.585 7.428 11.812 42 HE ARG 5 HE ARG 5 -5.731 5.751 13.312 43 1HH1 ARG 5 1HH1 ARG 5 -8.492 5.773 11.165 44 2HH1 ARG 5 2HH1 ARG 5 -9.058 4.234 11.714 45 1HH2 ARG 5 1HH2 ARG 5 -6.499 3.761 13.990 46 2HH2 ARG 5 2HH2 ARG 5 -7.943 3.107 13.295 47 H LEU 6 H LEU 6 -6.090 5.344 7.921 48 HA LEU 6 HA LEU 6 -7.456 5.633 5.305 49 1HB LEU 6 1HB LEU 6 -5.811 3.625 6.583 50 2HB LEU 6 2HB LEU 6 -7.340 2.908 6.087 51 HG LEU 6 HG LEU 6 -7.018 3.729 3.799 52 1HD1 LEU 6 1HD1 LEU 6 -4.499 4.946 4.967 53 2HD1 LEU 6 2HD1 LEU 6 -4.753 4.736 3.234 54 3HD1 LEU 6 3HD1 LEU 6 -5.823 5.788 4.163 55 1HD2 LEU 6 1HD2 LEU 6 -4.712 2.234 5.057 56 2HD2 LEU 6 2HD2 LEU 6 -6.095 1.566 4.190 57 3HD2 LEU 6 3HD2 LEU 6 -4.851 2.457 3.313 58 H ARG 7 H ARG 7 -9.568 4.753 4.968 59 HA ARG 7 HA ARG 7 -11.201 4.616 7.459 60 1HB ARG 7 1HB ARG 7 -11.807 6.329 5.730 61 2HB ARG 7 2HB ARG 7 -12.129 5.013 4.601 62 1HG ARG 7 1HG ARG 7 -13.743 4.084 6.344 63 2HG ARG 7 2HG ARG 7 -13.570 5.622 7.190 64 1HD ARG 7 1HD ARG 7 -14.486 6.847 5.365 65 2HD ARG 7 2HD ARG 7 -14.331 5.474 4.269 66 HE ARG 7 HE ARG 7 -16.358 4.625 5.120 67 1HH1 ARG 7 1HH1 ARG 7 -15.095 7.097 7.248 68 2HH1 ARG 7 2HH1 ARG 7 -16.523 7.130 8.221 69 1HH2 ARG 7 1HH2 ARG 7 -18.185 4.701 6.407 70 2HH2 ARG 7 2HH2 ARG 7 -18.256 5.789 7.753 71 H HIS 8 H HIS 8 -11.020 3.093 4.245 72 HA HIS 8 HA HIS 8 -11.293 0.430 5.407 73 1HB HIS 8 1HB HIS 8 -13.383 -0.108 4.140 74 2HB HIS 8 2HB HIS 8 -13.642 1.073 5.423 75 HD1 HIS 8 HD1 HIS 8 -14.884 3.109 4.709 76 HD2 HIS 8 HD2 HIS 8 -12.884 1.344 1.507 77 HE1 HIS 8 HE1 HIS 8 -15.481 4.466 2.657 78 H VAL 9 H VAL 9 -11.281 -1.245 3.598 79 HA VAL 9 HA VAL 9 -9.392 -0.359 1.534 80 HB VAL 9 HB VAL 9 -9.020 -2.495 2.698 81 1HG1 VAL 9 1HG1 VAL 9 -11.766 -2.815 2.483 82 2HG1 VAL 9 2HG1 VAL 9 -11.140 -3.983 1.321 83 3HG1 VAL 9 3HG1 VAL 9 -10.626 -4.054 3.007 84 1HG2 VAL 9 1HG2 VAL 9 -9.731 -2.824 -0.235 85 2HG2 VAL 9 2HG2 VAL 9 -8.182 -2.270 0.400 86 3HG2 VAL 9 3HG2 VAL 9 -8.713 -3.927 0.690 87 H VAL 10 H VAL 10 -10.598 0.929 0.100 88 HA VAL 10 HA VAL 10 -13.180 0.412 -0.892 89 HB VAL 10 HB VAL 10 -12.296 2.546 -1.407 90 1HG1 VAL 10 1HG1 VAL 10 -9.832 1.250 -1.646 91 2HG1 VAL 10 2HG1 VAL 10 -10.142 1.891 -3.254 92 3HG1 VAL 10 3HG1 VAL 10 -10.136 2.966 -1.859 93 1HG2 VAL 10 1HG2 VAL 10 -13.652 1.600 -3.260 94 2HG2 VAL 10 2HG2 VAL 10 -12.424 2.714 -3.860 95 3HG2 VAL 10 3HG2 VAL 10 -12.181 0.976 -4.006 96 H SER 11 H SER 11 -10.125 -0.438 -2.626 97 HA SER 11 HA SER 11 -11.680 -2.673 -3.847 98 1HB SER 11 1HB SER 11 -10.674 -0.575 -5.251 99 2HB SER 11 2HB SER 11 -9.307 -1.682 -5.315 100 HG SER 11 HG SER 11 -10.774 -3.282 -6.079 101 H CYS 12 H CYS 12 -10.396 -4.638 -4.265 102 HA CYS 12 HA CYS 12 -7.698 -4.758 -3.095 103 1HB CYS 12 1HB CYS 12 -8.355 -6.668 -1.580 104 2HB CYS 12 2HB CYS 12 -8.990 -5.099 -1.091 105 HG CYS 12 HG CYS 12 -11.335 -5.798 -1.834 106 H SER 13 H SER 13 -6.725 -5.659 -4.859 107 HA SER 13 HA SER 13 -8.026 -8.037 -6.108 108 1HB SER 13 1HB SER 13 -6.284 -5.857 -7.118 109 2HB SER 13 2HB SER 13 -5.964 -7.459 -7.775 110 HG SER 13 HG SER 13 -7.751 -7.318 -8.863 111 H SER 14 H SER 14 -7.042 -8.745 -3.781 112 HA SER 14 HA SER 14 -5.398 -10.882 -3.938 113 1HB SER 14 1HB SER 14 -3.143 -9.774 -3.108 114 2HB SER 14 2HB SER 14 -3.469 -9.970 -4.824 115 HG SER 14 HG SER 14 -4.412 -7.635 -3.603 116 H GLN 15 H GLN 15 -7.186 -10.650 -2.145 117 HA GLN 15 HA GLN 15 -5.767 -9.986 0.394 118 1HB GLN 15 1HB GLN 15 -7.739 -8.914 1.277 119 2HB GLN 15 2HB GLN 15 -7.408 -8.196 -0.288 120 1HG GLN 15 1HG GLN 15 -9.633 -8.603 -0.617 121 2HG GLN 15 2HG GLN 15 -9.033 -10.193 -1.078 122 1HE2 GLN 15 2HE2 GLN 15 -8.391 -10.463 2.101 123 2HE2 GLN 15 1HE2 GLN 15 -9.905 -10.966 2.673 124 H ASP 16 H ASP 16 -6.065 -11.469 2.047 125 HA ASP 16 HA ASP 16 -7.569 -13.939 1.358 126 1HB ASP 16 1HB ASP 16 -5.126 -13.378 2.768 127 2HB ASP 16 2HB ASP 16 -6.236 -14.176 3.879 128 H SER 17 H SER 17 -9.174 -14.781 2.763 129 HA SER 17 HA SER 17 -10.890 -12.885 4.015 130 1HB SER 17 1HB SER 17 -11.668 -15.082 3.199 131 2HB SER 17 2HB SER 17 -10.731 -15.882 4.459 132 HG SER 17 HG SER 17 -13.135 -15.222 4.734 133 H THR 18 H THR 18 -8.745 -15.330 5.547 134 HA THR 18 HA THR 18 -9.218 -14.501 8.231 135 HB THR 18 HB THR 18 -6.658 -15.430 8.334 136 HG1 THR 18 HG1 THR 18 -6.169 -15.999 6.377 137 1HG2 THR 18 1HG2 THR 18 -9.298 -16.862 8.136 138 2HG2 THR 18 2HG2 THR 18 -7.802 -17.750 8.420 139 3HG2 THR 18 3HG2 THR 18 -8.334 -16.526 9.574 140 H HIS 19 H HIS 19 -6.408 -13.760 6.149 141 HA HIS 19 HA HIS 19 -6.009 -11.264 7.748 142 1HB HIS 19 1HB HIS 19 -4.096 -13.018 6.195 143 2HB HIS 19 2HB HIS 19 -3.675 -11.367 6.651 144 HD1 HIS 19 HD1 HIS 19 -3.033 -10.939 9.070 145 HD2 HIS 19 HD2 HIS 19 -4.549 -14.777 8.477 146 HE1 HIS 19 HE1 HIS 19 -2.649 -12.204 11.231 147 H CYS 20 H CYS 20 -7.577 -10.102 6.494 148 HA CYS 20 HA CYS 20 -7.125 -9.885 3.587 149 1HB CYS 20 1HB CYS 20 -9.203 -8.538 3.605 150 2HB CYS 20 2HB CYS 20 -9.433 -10.103 4.377 151 HG CYS 20 HG CYS 20 -10.404 -8.062 5.863 152 H ALA 21 H ALA 21 -7.177 -7.654 2.638 153 HA ALA 21 HA ALA 21 -5.024 -6.071 3.625 154 1HB ALA 21 1HB ALA 21 -7.036 -5.893 1.452 155 2HB ALA 21 2HB ALA 21 -6.328 -4.363 1.969 156 3HB ALA 21 3HB ALA 21 -5.289 -5.664 1.390 157 H GLU 22 H GLU 22 -8.441 -6.069 4.342 158 HA GLU 22 HA GLU 22 -8.714 -3.383 5.283 159 1HB GLU 22 1HB GLU 22 -10.428 -5.473 5.003 160 2HB GLU 22 2HB GLU 22 -10.185 -5.504 6.749 161 1HG GLU 22 1HG GLU 22 -10.565 -2.904 6.556 162 2HG GLU 22 2HG GLU 22 -11.361 -3.332 5.041 163 H ASN 23 H ASN 23 -6.973 -6.089 6.591 164 HA ASN 23 HA ASN 23 -7.065 -5.368 9.373 165 1HB ASN 23 1HB ASN 23 -5.175 -6.968 7.674 166 2HB ASN 23 2HB ASN 23 -4.776 -6.612 9.354 167 1HD2 ASN 23 2HD2 ASN 23 -7.046 -8.348 7.259 168 2HD2 ASN 23 1HD2 ASN 23 -7.754 -9.272 8.494 169 H LEU 24 H LEU 24 -5.545 -3.937 6.656 170 HA LEU 24 HA LEU 24 -3.295 -2.694 7.902 171 1HB LEU 24 1HB LEU 24 -4.932 -1.689 5.551 172 2HB LEU 24 2HB LEU 24 -3.267 -1.254 5.937 173 HG LEU 24 HG LEU 24 -3.974 -4.150 5.549 174 1HD1 LEU 24 1HD1 LEU 24 -4.840 -2.655 3.616 175 2HD1 LEU 24 2HD1 LEU 24 -3.132 -2.414 3.242 176 3HD1 LEU 24 3HD1 LEU 24 -3.822 -4.037 3.212 177 1HD2 LEU 24 1HD2 LEU 24 -1.662 -2.800 6.202 178 2HD2 LEU 24 2HD2 LEU 24 -1.728 -4.419 5.511 179 3HD2 LEU 24 3HD2 LEU 24 -1.488 -3.023 4.461 180 H LEU 25 H LEU 25 -6.732 -2.032 7.870 181 HA LEU 25 HA LEU 25 -6.752 0.704 8.596 182 1HB LEU 25 1HB LEU 25 -8.569 -1.646 8.983 183 2HB LEU 25 2HB LEU 25 -8.890 -0.194 9.912 184 HG LEU 25 HG LEU 25 -10.146 -0.267 7.756 185 1HD1 LEU 25 1HD1 LEU 25 -8.294 1.880 8.580 186 2HD1 LEU 25 2HD1 LEU 25 -8.897 2.012 6.930 187 3HD1 LEU 25 3HD1 LEU 25 -10.027 1.935 8.279 188 1HD2 LEU 25 1HD2 LEU 25 -7.354 -0.141 6.570 189 2HD2 LEU 25 2HD2 LEU 25 -8.518 -1.451 6.375 190 3HD2 LEU 25 3HD2 LEU 25 -8.838 0.128 5.658 191 H LYS 26 H LYS 26 -5.800 -2.150 10.352 192 HA LYS 26 HA LYS 26 -5.583 -0.522 12.854 193 1HB LYS 26 1HB LYS 26 -5.645 -3.550 12.671 194 2HB LYS 26 2HB LYS 26 -5.759 -2.565 14.127 195 1HG LYS 26 1HG LYS 26 -7.781 -2.362 11.889 196 2HG LYS 26 2HG LYS 26 -7.965 -3.500 13.223 197 1HD LYS 26 1HD LYS 26 -7.503 -1.363 14.705 198 2HD LYS 26 2HD LYS 26 -8.053 -0.503 13.265 199 1HE LYS 26 1HE LYS 26 -10.204 -1.299 13.440 200 2HE LYS 26 2HE LYS 26 -9.692 -2.824 14.165 201 1HZ LYS 26 1HZ LYS 26 -9.123 -1.532 16.192 202 2HZ LYS 26 2HZ LYS 26 -9.850 -0.173 15.486 203 3HZ LYS 26 3HZ LYS 26 -10.782 -1.551 15.828 204 H ALA 27 H ALA 27 -3.593 0.170 11.508 205 HA ALA 27 HA ALA 27 -1.395 -1.449 10.905 206 1HB ALA 27 1HB ALA 27 -1.407 1.355 12.056 207 2HB ALA 27 2HB ALA 27 0.002 0.582 11.331 208 3HB ALA 27 3HB ALA 27 -1.423 0.918 10.348 209 H ASP 28 H ASP 28 -2.559 -0.499 14.068 210 HA ASP 28 HA ASP 28 -0.231 -1.931 15.287 211 1HB ASP 28 1HB ASP 28 -1.847 0.337 16.492 212 2HB ASP 28 2HB ASP 28 -0.477 -0.477 17.249 213 H THR 29 H THR 29 -1.390 -3.938 15.269 214 HA THR 29 HA THR 29 -3.184 -4.267 17.554 215 HB THR 29 HB THR 29 -4.766 -5.572 15.769 216 HG1 THR 29 HG1 THR 29 -3.412 -4.590 14.079 217 1HG2 THR 29 1HG2 THR 29 -5.178 -3.674 17.550 218 2HG2 THR 29 2HG2 THR 29 -5.209 -2.632 16.128 219 3HG2 THR 29 3HG2 THR 29 -6.359 -3.961 16.271 220 H TYR 30 H TYR 30 -3.157 -6.434 14.741 221 HA TYR 30 HA TYR 30 -0.947 -8.053 15.520 222 1HB TYR 30 1HB TYR 30 -2.188 -9.961 16.539 223 2HB TYR 30 2HB TYR 30 -2.255 -8.509 17.537 224 HD1 TYR 30 HD1 TYR 30 -4.314 -7.134 17.633 225 HD2 TYR 30 HD2 TYR 30 -4.165 -10.833 15.454 226 HE1 TYR 30 HE1 TYR 30 -6.792 -7.183 17.543 227 HE2 TYR 30 HE2 TYR 30 -6.643 -10.880 15.364 228 HH TYR 30 HH TYR 30 -8.570 -9.576 17.145 229 H ARG 31 H ARG 31 -2.248 -7.076 13.115 230 HA ARG 31 HA ARG 31 -2.354 -9.602 11.627 231 1HB ARG 31 1HB ARG 31 -4.765 -7.801 11.926 232 2HB ARG 31 2HB ARG 31 -4.574 -8.889 10.552 233 1HG ARG 31 1HG ARG 31 -4.112 -10.700 12.392 234 2HG ARG 31 2HG ARG 31 -4.940 -9.563 13.457 235 1HD ARG 31 1HD ARG 31 -6.159 -10.329 10.813 236 2HD ARG 31 2HD ARG 31 -6.358 -11.372 12.221 237 HE ARG 31 HE ARG 31 -7.017 -8.605 12.809 238 1HH1 ARG 31 1HH1 ARG 31 -8.219 -11.586 11.431 239 2HH1 ARG 31 2HH1 ARG 31 -9.871 -11.178 11.736 240 1HH2 ARG 31 1HH2 ARG 31 -9.167 -8.118 13.185 241 2HH2 ARG 31 2HH2 ARG 31 -10.404 -9.237 12.719 242 H LYS 32 H LYS 32 -1.626 -9.283 9.551 243 HA LYS 32 HA LYS 32 -1.271 -6.448 8.653 244 1HB LYS 32 1HB LYS 32 0.509 -8.859 8.195 245 2HB LYS 32 2HB LYS 32 0.764 -7.271 7.482 246 1HG LYS 32 1HG LYS 32 1.524 -6.364 9.435 247 2HG LYS 32 2HG LYS 32 0.387 -7.286 10.419 248 1HD LYS 32 1HD LYS 32 2.537 -8.820 9.043 249 2HD LYS 32 2HD LYS 32 3.017 -7.817 10.412 250 1HE LYS 32 1HE LYS 32 2.422 -9.670 11.615 251 2HE LYS 32 2HE LYS 32 0.804 -8.989 11.449 252 1HZ LYS 32 1HZ LYS 32 1.989 -10.890 9.505 253 2HZ LYS 32 2HZ LYS 32 1.005 -11.370 10.804 254 3HZ LYS 32 3HZ LYS 32 0.376 -10.368 9.585 255 H TRP 33 H TRP 33 -0.677 -6.663 6.063 256 HA TRP 33 HA TRP 33 -3.125 -7.740 4.877 257 1HB TRP 33 1HB TRP 33 -2.089 -5.635 3.982 258 2HB TRP 33 2HB TRP 33 -0.689 -6.565 3.505 259 HD1 TRP 33 HD1 TRP 33 -4.243 -7.914 3.053 260 HE1 TRP 33 HE1 TRP 33 -4.708 -8.179 0.519 261 HE3 TRP 33 HE3 TRP 33 -0.050 -5.736 1.197 262 HZ2 TRP 33 HZ2 TRP 33 -3.434 -7.516 -1.952 263 HZ3 TRP 33 HZ3 TRP 33 0.319 -5.578 -1.260 264 HH2 TRP 33 HH2 TRP 33 -1.375 -6.458 -2.833 265 H ARG 34 H ARG 34 -3.309 -9.583 3.702 266 HA ARG 34 HA ARG 34 -0.862 -11.078 2.968 267 1HB ARG 34 1HB ARG 34 -3.121 -12.117 4.706 268 2HB ARG 34 2HB ARG 34 -2.092 -13.206 3.777 269 1HG ARG 34 1HG ARG 34 -0.103 -12.029 4.889 270 2HG ARG 34 2HG ARG 34 -1.280 -11.327 6.001 271 1HD ARG 34 1HD ARG 34 -1.925 -13.455 6.834 272 2HD ARG 34 2HD ARG 34 -1.150 -14.302 5.495 273 HE ARG 34 HE ARG 34 0.721 -12.746 7.107 274 1HH1 ARG 34 1HH1 ARG 34 -0.940 -15.809 6.774 275 2HH1 ARG 34 2HH1 ARG 34 0.250 -16.666 7.688 276 1HH2 ARG 34 1HH2 ARG 34 2.232 -13.898 8.288 277 2HH2 ARG 34 2HH2 ARG 34 2.025 -15.599 8.538 278 H ALA 35 H ALA 35 -1.112 -11.782 0.904 279 HA ALA 35 HA ALA 35 -3.303 -11.075 -0.705 280 1HB ALA 35 1HB ALA 35 -0.962 -11.835 -1.431 281 2HB ALA 35 2HB ALA 35 -1.545 -13.487 -1.238 282 3HB ALA 35 3HB ALA 35 -2.301 -12.418 -2.419 283 H ALA 36 H ALA 36 -4.689 -12.618 -1.955 284 HA ALA 36 HA ALA 36 -6.265 -14.196 -0.085 285 1HB ALA 36 1HB ALA 36 -6.963 -12.724 -2.188 286 2HB ALA 36 2HB ALA 36 -6.748 -14.257 -3.032 287 3HB ALA 36 3HB ALA 36 -7.909 -14.133 -1.709 288 H LYS 37 H LYS 37 -3.949 -14.823 -2.638 289 HA LYS 37 HA LYS 37 -4.236 -17.740 -2.098 290 1HB LYS 37 1HB LYS 37 -4.678 -16.590 -4.509 291 2HB LYS 37 2HB LYS 37 -2.941 -16.852 -4.623 292 1HG LYS 37 1HG LYS 37 -3.154 -19.122 -4.680 293 2HG LYS 37 2HG LYS 37 -4.500 -19.126 -3.541 294 1HD LYS 37 1HD LYS 37 -6.029 -18.372 -5.303 295 2HD LYS 37 2HD LYS 37 -4.691 -18.284 -6.449 296 1HE LYS 37 1HE LYS 37 -5.910 -20.383 -6.769 297 2HE LYS 37 2HE LYS 37 -4.297 -20.721 -6.139 298 1HZ LYS 37 1HZ LYS 37 -6.538 -20.346 -4.272 299 2HZ LYS 37 2HZ LYS 37 -6.356 -21.836 -5.067 300 3HZ LYS 37 3HZ LYS 37 -5.112 -21.249 -4.076 301 H ALA 38 H ALA 38 -1.962 -18.658 -3.149 302 HA ALA 38 HA ALA 38 0.146 -17.314 -1.516 303 1HB ALA 38 1HB ALA 38 -0.438 -19.718 -1.012 304 2HB ALA 38 2HB ALA 38 0.147 -20.139 -2.622 305 3HB ALA 38 3HB ALA 38 1.257 -19.464 -1.429 306 H GLY 39 H GLY 39 2.388 -18.439 -2.716 307 1HA GLY 39 1HA GLY 39 3.880 -18.084 -4.492 308 2HA GLY 39 2HA GLY 39 2.492 -18.222 -5.568 309 H GLU 40 H GLU 40 3.163 -15.913 -3.002 310 HA GLU 40 HA GLU 40 2.102 -13.608 -4.016 311 1HB GLU 40 1HB GLU 40 4.579 -14.051 -2.364 312 2HB GLU 40 2HB GLU 40 4.012 -12.429 -2.763 313 1HG GLU 40 1HG GLU 40 2.846 -12.729 -0.815 314 2HG GLU 40 2HG GLU 40 1.695 -13.463 -1.928 315 H LYS 41 H LYS 41 2.378 -13.509 -6.267 316 HA LYS 41 HA LYS 41 5.119 -12.862 -7.245 317 1HB LYS 41 1HB LYS 41 4.205 -13.201 -9.511 318 2HB LYS 41 2HB LYS 41 3.931 -14.623 -8.510 319 1HG LYS 41 1HG LYS 41 1.614 -13.765 -8.039 320 2HG LYS 41 2HG LYS 41 1.910 -12.469 -9.197 321 1HD LYS 41 1HD LYS 41 1.980 -13.932 -11.018 322 2HD LYS 41 2HD LYS 41 2.362 -15.327 -10.008 323 1HE LYS 41 1HE LYS 41 -0.040 -14.662 -8.962 324 2HE LYS 41 2HE LYS 41 -0.272 -14.094 -10.615 325 1HZ LYS 41 1HZ LYS 41 0.737 -16.388 -11.210 326 2HZ LYS 41 2HZ LYS 41 0.249 -16.819 -9.641 327 3HZ LYS 41 3HZ LYS 41 -0.898 -16.280 -10.773 328 H THR 42 H THR 42 1.770 -11.687 -7.257 329 HA THR 42 HA THR 42 2.670 -8.916 -7.106 330 HB THR 42 HB THR 42 1.240 -8.301 -9.168 331 HG1 THR 42 HG1 THR 42 0.386 -9.943 -10.124 332 1HG2 THR 42 1HG2 THR 42 3.893 -8.594 -8.873 333 2HG2 THR 42 2HG2 THR 42 3.619 -9.829 -10.100 334 3HG2 THR 42 3HG2 THR 42 3.160 -8.156 -10.416 335 H ILE 43 H ILE 43 1.126 -7.808 -5.936 336 HA ILE 43 HA ILE 43 -1.662 -8.869 -5.954 337 HB ILE 43 HB ILE 43 -1.660 -8.386 -3.415 338 1HG1 ILE 43 1HG1 ILE 43 1.309 -8.775 -3.832 339 2HG1 ILE 43 2HG1 ILE 43 0.529 -7.255 -3.389 340 1HG2 ILE 43 1HG2 ILE 43 -1.532 -10.644 -4.768 341 2HG2 ILE 43 2HG2 ILE 43 0.081 -10.716 -4.056 342 3HG2 ILE 43 3HG2 ILE 43 -1.339 -10.623 -3.017 343 1HD1 ILE 43 1HD1 ILE 43 -0.545 -8.819 -1.490 344 2HD1 ILE 43 2HD1 ILE 43 0.956 -9.707 -1.746 345 3HD1 ILE 43 3HD1 ILE 43 1.006 -8.012 -1.263 346 H SER 44 H SER 44 -3.218 -7.289 -5.937 347 HA SER 44 HA SER 44 -2.219 -4.487 -5.581 348 1HB SER 44 1HB SER 44 -4.614 -4.216 -6.884 349 2HB SER 44 2HB SER 44 -3.052 -4.268 -7.681 350 HG SER 44 HG SER 44 -3.415 -6.281 -8.300 351 H VAL 45 H VAL 45 -3.322 -3.147 -4.177 352 HA VAL 45 HA VAL 45 -5.854 -4.054 -2.973 353 HB VAL 45 HB VAL 45 -4.129 -5.053 -1.509 354 1HG1 VAL 45 1HG1 VAL 45 -2.444 -3.162 -2.099 355 2HG1 VAL 45 2HG1 VAL 45 -3.216 -2.274 -0.788 356 3HG1 VAL 45 3HG1 VAL 45 -2.426 -3.817 -0.465 357 1HG2 VAL 45 1HG2 VAL 45 -5.648 -2.679 -0.405 358 2HG2 VAL 45 2HG2 VAL 45 -6.135 -4.375 -0.389 359 3HG2 VAL 45 3HG2 VAL 45 -4.796 -3.832 0.622 360 H VAL 46 H VAL 46 -7.039 -2.268 -3.501 361 HA VAL 46 HA VAL 46 -5.808 0.411 -3.287 362 HB VAL 46 HB VAL 46 -8.649 -0.226 -4.097 363 1HG1 VAL 46 1HG1 VAL 46 -7.940 2.136 -3.528 364 2HG1 VAL 46 2HG1 VAL 46 -6.826 2.051 -4.893 365 3HG1 VAL 46 3HG1 VAL 46 -8.564 1.924 -5.163 366 1HG2 VAL 46 1HG2 VAL 46 -6.096 -0.273 -5.721 367 2HG2 VAL 46 2HG2 VAL 46 -7.339 -1.519 -5.619 368 3HG2 VAL 46 3HG2 VAL 46 -7.672 -0.010 -6.468 369 H LEU 47 H LEU 47 -5.973 1.522 -1.435 370 HA LEU 47 HA LEU 47 -8.023 0.685 0.550 371 1HB LEU 47 1HB LEU 47 -5.773 2.629 1.068 372 2HB LEU 47 2HB LEU 47 -6.655 1.636 2.226 373 HG LEU 47 HG LEU 47 -5.560 -0.233 0.448 374 1HD1 LEU 47 1HD1 LEU 47 -3.580 1.987 1.036 375 2HD1 LEU 47 2HD1 LEU 47 -3.128 0.379 0.468 376 3HD1 LEU 47 3HD1 LEU 47 -4.107 1.433 -0.554 377 1HD2 LEU 47 1HD2 LEU 47 -5.753 -0.101 3.050 378 2HD2 LEU 47 2HD2 LEU 47 -4.409 -1.005 2.350 379 3HD2 LEU 47 3HD2 LEU 47 -4.147 0.625 2.969 380 H GLN 48 H GLN 48 -8.939 2.558 1.881 381 HA GLN 48 HA GLN 48 -9.649 4.802 0.035 382 1HB GLN 48 1HB GLN 48 -11.540 3.304 0.631 383 2HB GLN 48 2HB GLN 48 -11.250 3.637 2.337 384 1HG GLN 48 1HG GLN 48 -13.022 5.102 1.649 385 2HG GLN 48 2HG GLN 48 -11.576 6.100 1.796 386 1HE2 GLN 48 2HE2 GLN 48 -12.622 7.606 0.210 387 2HE2 GLN 48 1HE2 GLN 48 -12.574 7.238 -1.445 388 H LEU 49 H LEU 49 -9.694 6.914 0.909 389 HA LEU 49 HA LEU 49 -8.173 7.251 3.440 390 1HB LEU 49 1HB LEU 49 -8.810 9.291 1.281 391 2HB LEU 49 2HB LEU 49 -7.714 9.515 2.645 392 HG LEU 49 HG LEU 49 -7.297 7.269 0.679 393 1HD1 LEU 49 1HD1 LEU 49 -6.852 10.174 0.294 394 2HD1 LEU 49 2HD1 LEU 49 -5.482 9.138 -0.109 395 3HD1 LEU 49 3HD1 LEU 49 -7.036 8.894 -0.904 396 1HD2 LEU 49 1HD2 LEU 49 -6.076 7.257 2.838 397 2HD2 LEU 49 2HD2 LEU 49 -4.976 7.478 1.476 398 3HD2 LEU 49 3HD2 LEU 49 -5.434 8.859 2.473 399 H GLU 50 H GLU 50 -9.174 8.259 5.148 400 HA GLU 50 HA GLU 50 -12.082 8.561 5.044 401 1HB GLU 50 1HB GLU 50 -10.743 7.643 7.016 402 2HB GLU 50 2HB GLU 50 -10.278 9.312 7.349 403 1HG GLU 50 1HG GLU 50 -12.934 9.661 7.086 404 2HG GLU 50 2HG GLU 50 -12.928 7.988 7.644 405 H LYS 51 H LYS 51 -10.775 10.453 3.336 406 HA LYS 51 HA LYS 51 -12.112 12.811 3.635 407 1HB LYS 51 1HB LYS 51 -10.296 14.363 4.568 408 2HB LYS 51 2HB LYS 51 -11.138 13.376 5.760 409 1HG LYS 51 1HG LYS 51 -9.278 12.146 6.244 410 2HG LYS 51 2HG LYS 51 -8.747 12.108 4.564 411 1HD LYS 51 1HD LYS 51 -7.969 14.439 4.748 412 2HD LYS 51 2HD LYS 51 -8.507 14.488 6.427 413 1HE LYS 51 1HE LYS 51 -6.575 12.374 5.489 414 2HE LYS 51 2HE LYS 51 -6.004 13.973 5.966 415 1HZ LYS 51 1HZ LYS 51 -7.420 13.572 8.047 416 2HZ LYS 51 2HZ LYS 51 -7.368 11.934 7.602 417 3HZ LYS 51 3HZ LYS 51 -5.928 12.770 7.924 418 H GLU 52 H GLU 52 -11.762 13.831 1.686 419 HA GLU 52 HA GLU 52 -9.630 12.874 -0.039 420 1HB GLU 52 1HB GLU 52 -12.002 13.689 -0.730 421 2HB GLU 52 2HB GLU 52 -11.305 15.300 -0.597 422 1HG GLU 52 1HG GLU 52 -9.416 14.437 -2.106 423 2HG GLU 52 2HG GLU 52 -10.478 13.073 -2.451 424 H GLU 53 H GLU 53 -7.625 13.558 0.346 425 HA GLU 53 HA GLU 53 -7.122 16.468 0.654 426 1HB GLU 53 1HB GLU 53 -5.172 15.565 2.287 427 2HB GLU 53 2HB GLU 53 -6.751 16.056 2.889 428 1HG GLU 53 1HG GLU 53 -6.000 13.865 3.815 429 2HG GLU 53 2HG GLU 53 -7.505 13.733 2.912 430 H GLN 54 H GLN 54 -4.541 16.675 0.652 431 HA GLN 54 HA GLN 54 -3.688 15.363 -1.856 432 1HB GLN 54 1HB GLN 54 -2.357 17.541 -0.208 433 2HB GLN 54 2HB GLN 54 -1.808 16.970 -1.784 434 1HG GLN 54 1HG GLN 54 -3.697 17.835 -2.893 435 2HG GLN 54 2HG GLN 54 -4.608 17.988 -1.403 436 1HE2 GLN 54 2HE2 GLN 54 -1.218 19.051 -1.766 437 2HE2 GLN 54 1HE2 GLN 54 -1.548 20.703 -1.574 438 H ILE 55 H ILE 55 -1.133 14.866 -1.763 439 HA ILE 55 HA ILE 55 -0.596 13.379 0.775 440 HB ILE 55 HB ILE 55 -0.007 12.417 -2.046 441 1HG1 ILE 55 1HG1 ILE 55 -1.650 10.556 -0.915 442 2HG1 ILE 55 2HG1 ILE 55 -2.273 12.026 -0.167 443 1HG2 ILE 55 1HG2 ILE 55 0.653 11.399 0.703 444 2HG2 ILE 55 2HG2 ILE 55 0.378 10.245 -0.602 445 3HG2 ILE 55 3HG2 ILE 55 1.666 11.442 -0.740 446 1HD1 ILE 55 1HD1 ILE 55 -1.831 11.727 -3.149 447 2HD1 ILE 55 2HD1 ILE 55 -3.378 11.426 -2.357 448 3HD1 ILE 55 3HD1 ILE 55 -2.669 13.040 -2.321 449 H HIS 56 H HIS 56 1.154 14.269 1.692 450 HA HIS 56 HA HIS 56 3.245 15.501 -0.038 451 1HB HIS 56 1HB HIS 56 2.209 16.901 1.773 452 2HB HIS 56 2HB HIS 56 2.851 15.765 2.960 453 HD1 HIS 56 HD1 HIS 56 4.569 17.373 3.997 454 HD2 HIS 56 HD2 HIS 56 5.010 16.937 -0.122 455 HE1 HIS 56 HE1 HIS 56 6.771 18.468 3.394 456 H SER 57 H SER 57 2.649 13.020 2.383 457 HA SER 57 HA SER 57 5.271 11.809 1.728 458 1HB SER 57 1HB SER 57 4.574 13.038 4.335 459 2HB SER 57 2HB SER 57 5.260 11.420 4.429 460 HG SER 57 HG SER 57 6.545 13.662 4.082 461 H VAL 58 H VAL 58 5.339 9.559 2.436 462 HA VAL 58 HA VAL 58 2.710 8.402 3.195 463 HB VAL 58 HB VAL 58 4.347 7.659 0.755 464 1HG1 VAL 58 1HG1 VAL 58 2.069 6.262 2.149 465 2HG1 VAL 58 2HG1 VAL 58 2.298 6.086 0.409 466 3HG1 VAL 58 3HG1 VAL 58 3.568 5.578 1.520 467 1HG2 VAL 58 1HG2 VAL 58 1.707 9.013 1.227 468 2HG2 VAL 58 2HG2 VAL 58 3.012 9.473 0.134 469 3HG2 VAL 58 3HG2 VAL 58 1.971 8.106 -0.262 470 H ASP 59 H ASP 59 2.917 6.191 3.962 471 HA ASP 59 HA ASP 59 5.669 5.277 4.606 472 1HB ASP 59 1HB ASP 59 3.495 6.050 6.514 473 2HB ASP 59 2HB ASP 59 4.496 4.659 6.925 474 H ILE 60 H ILE 60 5.809 3.036 4.479 475 HA ILE 60 HA ILE 60 3.418 1.353 4.659 476 HB ILE 60 HB ILE 60 4.651 2.094 2.022 477 1HG1 ILE 60 1HG1 ILE 60 1.998 1.245 1.711 478 2HG1 ILE 60 2HG1 ILE 60 2.022 2.019 3.292 479 1HG2 ILE 60 1HG2 ILE 60 3.616 -0.671 2.682 480 2HG2 ILE 60 2HG2 ILE 60 3.628 -0.033 1.038 481 3HG2 ILE 60 3HG2 ILE 60 5.144 -0.238 1.914 482 1HD1 ILE 60 1HD1 ILE 60 3.537 3.595 1.392 483 2HD1 ILE 60 2HD1 ILE 60 1.914 3.288 0.780 484 3HD1 ILE 60 3HD1 ILE 60 2.131 4.060 2.348 485 H GLY 61 H GLY 61 4.074 -0.587 5.495 486 1HA GLY 61 1HA GLY 61 6.999 -1.088 5.486 487 2HA GLY 61 2HA GLY 61 5.896 -1.751 6.672 488 H ASN 62 H ASN 62 7.797 -2.780 4.470 489 HA ASN 62 HA ASN 62 5.982 -4.471 2.869 490 1HB ASN 62 1HB ASN 62 8.129 -5.280 1.832 491 2HB ASN 62 2HB ASN 62 7.870 -3.542 1.687 492 1HD2 ASN 62 2HD2 ASN 62 9.738 -6.013 3.448 493 2HD2 ASN 62 1HD2 ASN 62 10.923 -4.944 4.027 494 H ASP 63 H ASP 63 5.439 -6.529 3.462 495 HA ASP 63 HA ASP 63 6.943 -7.780 5.717 496 1HB ASP 63 1HB ASP 63 4.287 -7.557 5.460 497 2HB ASP 63 2HB ASP 63 4.499 -9.031 4.514 498 H GLY 64 H GLY 64 8.627 -7.886 3.828 499 1HA GLY 64 1HA GLY 64 9.916 -9.663 2.806 500 2HA GLY 64 2HA GLY 64 8.430 -10.594 2.614 501 H SER 65 H SER 65 7.188 -7.867 1.695 502 HA SER 65 HA SER 65 7.170 -8.297 -1.092 503 1HB SER 65 1HB SER 65 6.749 -5.745 0.484 504 2HB SER 65 2HB SER 65 6.332 -5.946 -1.211 505 HG SER 65 HG SER 65 5.210 -7.116 1.086 506 H ALA 66 H ALA 66 8.111 -7.030 -2.786 507 HA ALA 66 HA ALA 66 10.781 -5.908 -2.061 508 1HB ALA 66 1HB ALA 66 10.390 -8.138 -3.553 509 2HB ALA 66 2HB ALA 66 10.333 -6.912 -4.818 510 3HB ALA 66 3HB ALA 66 11.758 -7.051 -3.787 511 H PHE 67 H PHE 67 8.381 -5.871 -4.728 512 HA PHE 67 HA PHE 67 9.064 -3.000 -5.162 513 1HB PHE 67 1HB PHE 67 7.361 -4.819 -6.890 514 2HB PHE 67 2HB PHE 67 7.948 -3.225 -7.316 515 HD1 PHE 67 HD1 PHE 67 10.734 -3.252 -6.386 516 HD2 PHE 67 HD2 PHE 67 8.443 -6.329 -8.315 517 HE1 PHE 67 HE1 PHE 67 12.822 -4.255 -7.263 518 HE2 PHE 67 HE2 PHE 67 10.524 -7.337 -9.184 519 HZ PHE 67 HZ PHE 67 12.722 -6.302 -8.664 520 H VAL 68 H VAL 68 7.681 -1.424 -4.567 521 HA VAL 68 HA VAL 68 4.840 -2.175 -3.994 522 HB VAL 68 HB VAL 68 6.573 -0.341 -2.307 523 1HG1 VAL 68 1HG1 VAL 68 4.122 0.245 -2.455 524 2HG1 VAL 68 2HG1 VAL 68 3.755 -1.358 -1.817 525 3HG1 VAL 68 3HG1 VAL 68 4.652 -0.200 -0.833 526 1HG2 VAL 68 1HG2 VAL 68 7.117 -2.751 -2.086 527 2HG2 VAL 68 2HG2 VAL 68 6.375 -2.113 -0.618 528 3HG2 VAL 68 3HG2 VAL 68 5.421 -3.088 -1.737 529 H GLU 69 H GLU 69 3.672 -1.103 -5.466 530 HA GLU 69 HA GLU 69 4.518 1.643 -6.293 531 1HB GLU 69 1HB GLU 69 4.259 -0.011 -8.116 532 2HB GLU 69 2HB GLU 69 2.595 -0.302 -7.615 533 1HG GLU 69 1HG GLU 69 1.835 1.641 -8.545 534 2HG GLU 69 2HG GLU 69 3.284 2.540 -8.105 535 H VAL 70 H VAL 70 3.023 3.369 -6.163 536 HA VAL 70 HA VAL 70 0.409 2.757 -4.866 537 HB VAL 70 HB VAL 70 2.214 5.024 -3.999 538 1HG1 VAL 70 1HG1 VAL 70 -0.546 4.134 -3.375 539 2HG1 VAL 70 2HG1 VAL 70 0.439 4.619 -1.995 540 3HG1 VAL 70 3HG1 VAL 70 0.156 5.751 -3.317 541 1HG2 VAL 70 1HG2 VAL 70 1.927 2.202 -3.063 542 2HG2 VAL 70 2HG2 VAL 70 3.353 3.239 -3.071 543 3HG2 VAL 70 3HG2 VAL 70 2.114 3.455 -1.836 544 H LEU 71 H LEU 71 -1.216 3.723 -5.919 545 HA LEU 71 HA LEU 71 -0.607 6.035 -7.694 546 1HB LEU 71 1HB LEU 71 -2.093 3.559 -8.110 547 2HB LEU 71 2HB LEU 71 -3.091 4.969 -8.454 548 HG LEU 71 HG LEU 71 -1.191 5.839 -9.883 549 1HD1 LEU 71 1HD1 LEU 71 0.578 4.446 -8.837 550 2HD1 LEU 71 2HD1 LEU 71 -0.181 3.003 -9.509 551 3HD1 LEU 71 3HD1 LEU 71 0.512 4.216 -10.584 552 1HD2 LEU 71 1HD2 LEU 71 -2.704 3.305 -10.467 553 2HD2 LEU 71 2HD2 LEU 71 -2.955 4.923 -11.124 554 3HD2 LEU 71 3HD2 LEU 71 -1.583 3.955 -11.663 555 H VAL 72 H VAL 72 -2.389 7.618 -7.841 556 HA VAL 72 HA VAL 72 -3.993 7.747 -5.321 557 HB VAL 72 HB VAL 72 -3.805 10.256 -5.684 558 1HG1 VAL 72 1HG1 VAL 72 -1.506 8.476 -4.912 559 2HG1 VAL 72 2HG1 VAL 72 -1.385 10.230 -4.777 560 3HG1 VAL 72 3HG1 VAL 72 -2.613 9.358 -3.860 561 1HG2 VAL 72 1HG2 VAL 72 -2.684 9.558 -8.073 562 2HG2 VAL 72 2HG2 VAL 72 -2.426 11.116 -7.292 563 3HG2 VAL 72 3HG2 VAL 72 -1.244 9.825 -7.098 564 H GLY 73 H GLY 73 -6.064 8.891 -5.526 565 1HA GLY 73 1HA GLY 73 -7.149 9.837 -7.953 566 2HA GLY 73 2HA GLY 73 -7.562 8.134 -7.816 567 H SER 74 H SER 74 -9.607 9.795 -7.821 568 HA SER 74 HA SER 74 -10.431 10.105 -4.991 569 1HB SER 74 1HB SER 74 -10.528 12.236 -6.074 570 2HB SER 74 2HB SER 74 -11.291 11.550 -7.498 571 HG SER 74 HG SER 74 -12.360 11.845 -4.888 572 H SER 75 H SER 75 -12.668 9.561 -4.545 573 HA SER 75 HA SER 75 -13.520 7.123 -5.841 574 1HB SER 75 1HB SER 75 -15.226 8.758 -3.978 575 2HB SER 75 2HB SER 75 -15.206 7.011 -4.190 576 HG SER 75 HG SER 75 -13.831 8.479 -2.467 577 H ALA 76 H ALA 76 -13.844 10.337 -6.726 578 HA ALA 76 HA ALA 76 -16.523 10.539 -7.598 579 1HB ALA 76 1HB ALA 76 -14.667 12.337 -7.570 580 2HB ALA 76 2HB ALA 76 -14.209 11.693 -9.146 581 3HB ALA 76 3HB ALA 76 -15.817 12.376 -8.906 582 H GLY 77 H GLY 77 -17.433 10.203 -9.733 583 1HA GLY 77 1HA GLY 77 -17.788 8.972 -11.700 584 2HA GLY 77 2HA GLY 77 -16.033 8.928 -11.880 585 H GLY 78 H GLY 78 -18.810 7.264 -10.504 586 1HA GLY 78 1HA GLY 78 -17.468 5.143 -9.172 587 2HA GLY 78 2HA GLY 78 -19.092 5.027 -9.853 588 H ALA 79 H ALA 79 -17.231 2.881 -9.933 589 HA ALA 79 HA ALA 79 -16.381 1.302 -11.444 590 1HB ALA 79 1HB ALA 79 -18.652 1.884 -12.527 591 2HB ALA 79 2HB ALA 79 -17.720 2.886 -13.640 592 3HB ALA 79 3HB ALA 79 -17.431 1.147 -13.565 593 H GLY 80 H GLY 80 -14.777 3.597 -10.790 594 1HA GLY 80 1HA GLY 80 -13.543 4.656 -13.195 595 2HA GLY 80 2HA GLY 80 -12.914 4.819 -11.555 596 H GLU 81 H GLU 81 -11.305 3.434 -10.877 597 HA GLU 81 HA GLU 81 -9.620 1.814 -11.011 598 1HB GLU 81 1HB GLU 81 -11.959 0.569 -12.299 599 2HB GLU 81 2HB GLU 81 -10.422 -0.075 -12.871 600 1HG GLU 81 1HG GLU 81 -9.820 -0.876 -10.774 601 2HG GLU 81 2HG GLU 81 -10.826 0.297 -9.923 602 H GLN 82 H GLN 82 -7.750 1.607 -12.229 603 HA GLN 82 HA GLN 82 -6.232 2.092 -13.950 604 1HB GLN 82 1HB GLN 82 -8.681 1.701 -15.699 605 2HB GLN 82 2HB GLN 82 -7.002 1.670 -16.243 606 1HG GLN 82 1HG GLN 82 -6.673 -0.198 -14.482 607 2HG GLN 82 2HG GLN 82 -8.434 -0.305 -14.468 608 1HE2 GLN 82 2HE2 GLN 82 -5.724 -1.592 -15.970 609 2HE2 GLN 82 1HE2 GLN 82 -6.447 -2.126 -17.410 610 H ASP 83 H ASP 83 -8.062 4.254 -12.742 611 HA ASP 83 HA ASP 83 -7.479 6.314 -14.819 612 1HB ASP 83 1HB ASP 83 -9.980 5.608 -14.542 613 2HB ASP 83 2HB ASP 83 -9.895 6.519 -13.034 614 H TYR 84 H TYR 84 -5.954 5.494 -12.474 615 HA TYR 84 HA TYR 84 -6.327 7.770 -10.606 616 1HB TYR 84 1HB TYR 84 -4.955 5.096 -10.459 617 2HB TYR 84 2HB TYR 84 -4.421 6.395 -9.397 618 HD1 TYR 84 HD1 TYR 84 -7.841 5.439 -10.640 619 HD2 TYR 84 HD2 TYR 84 -5.247 5.969 -7.255 620 HE1 TYR 84 HE1 TYR 84 -9.739 4.981 -9.113 621 HE2 TYR 84 HE2 TYR 84 -7.148 5.513 -5.729 622 HH TYR 84 HH TYR 84 -10.137 4.243 -6.847 623 H GLU 85 H GLU 85 -3.863 8.250 -9.746 624 HA GLU 85 HA GLU 85 -2.264 8.888 -12.184 625 1HB GLU 85 1HB GLU 85 -1.572 10.738 -10.102 626 2HB GLU 85 2HB GLU 85 -2.271 11.085 -11.676 627 1HG GLU 85 1HG GLU 85 -4.012 10.189 -9.377 628 2HG GLU 85 2HG GLU 85 -3.550 11.877 -9.569 629 H VAL 86 H VAL 86 -0.206 8.172 -12.132 630 HA VAL 86 HA VAL 86 0.672 6.407 -10.075 631 HB VAL 86 HB VAL 86 2.366 7.831 -12.144 632 1HG1 VAL 86 1HG1 VAL 86 3.479 6.577 -10.192 633 2HG1 VAL 86 2HG1 VAL 86 2.796 5.110 -10.894 634 3HG1 VAL 86 3HG1 VAL 86 3.944 6.078 -11.818 635 1HG2 VAL 86 1HG2 VAL 86 0.493 5.490 -12.257 636 2HG2 VAL 86 2HG2 VAL 86 0.776 6.752 -13.457 637 3HG2 VAL 86 3HG2 VAL 86 1.953 5.455 -13.245 638 H LEU 87 H LEU 87 0.446 7.646 -8.106 639 HA LEU 87 HA LEU 87 1.774 10.099 -7.548 640 1HB LEU 87 1HB LEU 87 0.069 8.789 -6.097 641 2HB LEU 87 2HB LEU 87 1.461 7.878 -5.522 642 HG LEU 87 HG LEU 87 2.549 10.092 -4.942 643 1HD1 LEU 87 1HD1 LEU 87 -0.050 11.013 -6.036 644 2HD1 LEU 87 2HD1 LEU 87 0.480 11.809 -4.556 645 3HD1 LEU 87 3HD1 LEU 87 1.507 11.837 -5.989 646 1HD2 LEU 87 1HD2 LEU 87 0.887 8.511 -3.478 647 2HD2 LEU 87 2HD2 LEU 87 1.690 9.937 -2.824 648 3HD2 LEU 87 3HD2 LEU 87 0.022 10.043 -3.383 649 H LEU 88 H LEU 88 2.827 6.785 -6.681 650 HA LEU 88 HA LEU 88 5.617 7.628 -7.233 651 1HB LEU 88 1HB LEU 88 6.426 6.580 -5.178 652 2HB LEU 88 2HB LEU 88 5.302 7.888 -4.823 653 HG LEU 88 HG LEU 88 3.708 5.577 -5.100 654 1HD1 LEU 88 1HD1 LEU 88 6.375 5.046 -3.897 655 2HD1 LEU 88 2HD1 LEU 88 4.980 4.413 -3.022 656 3HD1 LEU 88 3HD1 LEU 88 5.260 3.938 -4.697 657 1HD2 LEU 88 1HD2 LEU 88 4.698 7.154 -2.708 658 2HD2 LEU 88 2HD2 LEU 88 3.196 7.400 -3.600 659 3HD2 LEU 88 3HD2 LEU 88 3.410 5.953 -2.614 660 H VAL 89 H VAL 89 6.452 6.221 -8.657 661 HA VAL 89 HA VAL 89 5.203 3.885 -9.593 662 HB VAL 89 HB VAL 89 7.454 3.280 -10.512 663 1HG1 VAL 89 1HG1 VAL 89 5.934 4.940 -11.612 664 2HG1 VAL 89 2HG1 VAL 89 6.779 6.226 -10.752 665 3HG1 VAL 89 3HG1 VAL 89 7.641 5.244 -11.937 666 1HG2 VAL 89 1HG2 VAL 89 8.698 4.141 -8.481 667 2HG2 VAL 89 2HG2 VAL 89 9.364 4.677 -10.024 668 3HG2 VAL 89 3HG2 VAL 89 8.377 5.777 -9.061 669 H THR 90 H THR 90 6.519 1.645 -9.493 670 HA THR 90 HA THR 90 6.161 0.683 -6.826 671 HB THR 90 HB THR 90 6.086 -0.559 -9.164 672 HG1 THR 90 HG1 THR 90 5.542 -1.979 -7.765 673 1HG2 THR 90 1HG2 THR 90 8.554 -0.221 -9.586 674 2HG2 THR 90 2HG2 THR 90 8.870 -1.302 -8.227 675 3HG2 THR 90 3HG2 THR 90 8.027 -1.903 -9.655 676 H SER 91 H SER 91 7.583 0.457 -5.182 677 HA SER 91 HA SER 91 10.339 1.478 -5.612 678 1HB SER 91 1HB SER 91 10.208 1.726 -3.038 679 2HB SER 91 2HB SER 91 9.254 2.839 -4.010 680 HG SER 91 HG SER 91 8.333 0.407 -2.865 681 H SER 92 H SER 92 11.951 0.058 -5.452 682 HA SER 92 HA SER 92 11.461 -2.710 -4.591 683 1HB SER 92 1HB SER 92 13.697 -3.149 -5.398 684 2HB SER 92 2HB SER 92 12.898 -2.109 -6.576 685 HG SER 92 HG SER 92 14.923 -1.269 -6.133 686 H PHE 93 H PHE 93 11.875 -3.447 -2.563 687 HA PHE 93 HA PHE 93 13.598 -1.755 -0.798 688 1HB PHE 93 1HB PHE 93 11.238 -3.464 -0.009 689 2HB PHE 93 2HB PHE 93 12.227 -2.521 1.093 690 HD1 PHE 93 HD1 PHE 93 12.601 -0.026 -0.557 691 HD2 PHE 93 HD2 PHE 93 9.112 -2.438 0.183 692 HE1 PHE 93 HE1 PHE 93 11.153 1.943 -0.959 693 HE2 PHE 93 HE2 PHE 93 7.672 -0.460 -0.222 694 HZ PHE 93 HZ PHE 93 8.693 1.724 -0.792 695 H MET 94 H MET 94 12.403 -5.072 -1.309 696 HA MET 94 HA MET 94 14.986 -6.050 -0.139 697 1HB MET 94 1HB MET 94 12.218 -7.264 0.003 698 2HB MET 94 2HB MET 94 13.684 -8.089 0.529 699 1HG MET 94 1HG MET 94 14.117 -6.378 2.193 700 2HG MET 94 2HG MET 94 12.770 -5.405 1.597 701 1HE MET 94 1HE MET 94 13.891 -8.771 2.604 702 2HE MET 94 2HE MET 94 12.669 -9.455 3.673 703 3HE MET 94 3HE MET 94 12.435 -9.489 1.920 704 H SER 95 H SER 95 15.113 -8.558 -0.771 705 HA SER 95 HA SER 95 14.725 -8.755 -3.729 706 1HB SER 95 1HB SER 95 16.838 -9.814 -3.936 707 2HB SER 95 2HB SER 95 17.142 -8.503 -2.804 708 HG SER 95 HG SER 95 17.975 -10.260 -1.827 709 HA PRO 96 HA PRO 96 12.751 -12.642 -2.791 710 1HB PRO 96 1HB PRO 96 13.505 -14.228 -4.873 711 2HB PRO 96 2HB PRO 96 12.403 -12.864 -5.047 712 1HG PRO 96 1HG PRO 96 15.179 -13.135 -5.961 713 2HG PRO 96 2HG PRO 96 13.913 -12.033 -6.517 714 1HD PRO 96 1HD PRO 96 16.095 -11.445 -4.747 715 2HD PRO 96 2HD PRO 96 14.796 -10.350 -5.269 716 H SER 97 H SER 97 15.960 -12.410 -2.168 717 HA SER 97 HA SER 97 16.211 -15.308 -1.475 718 1HB SER 97 1HB SER 97 18.529 -13.428 -1.938 719 2HB SER 97 2HB SER 97 18.561 -15.186 -1.852 720 HG SER 97 HG SER 97 18.603 -14.544 -4.003 721 H GLU 98 H GLU 98 16.773 -11.969 -0.417 722 HA GLU 98 HA GLU 98 17.818 -12.830 2.176 723 1HB GLU 98 1HB GLU 98 17.979 -10.462 2.669 724 2HB GLU 98 2HB GLU 98 18.554 -10.727 1.030 725 1HG GLU 98 1HG GLU 98 15.940 -10.270 0.511 726 2HG GLU 98 2HG GLU 98 16.122 -9.299 1.973 727 H SER 99 H SER 99 14.696 -12.135 0.819 728 HA SER 99 HA SER 99 13.262 -11.323 3.120 729 1HB SER 99 1HB SER 99 11.271 -12.200 1.960 730 2HB SER 99 2HB SER 99 12.303 -11.302 0.852 731 HG SER 99 HG SER 99 12.979 -13.168 -0.044 732 H ARG 100 H ARG 100 14.602 -14.436 2.322 733 HA ARG 100 HA ARG 100 12.867 -16.027 3.980 734 1HB ARG 100 1HB ARG 100 15.700 -16.472 2.996 735 2HB ARG 100 2HB ARG 100 14.781 -17.683 3.891 736 1HG ARG 100 1HG ARG 100 12.985 -17.531 2.151 737 2HG ARG 100 2HG ARG 100 14.022 -16.444 1.230 738 1HD ARG 100 1HD ARG 100 15.010 -18.240 0.301 739 2HD ARG 100 2HD ARG 100 15.619 -18.695 1.892 740 HE ARG 100 HE ARG 100 12.970 -19.600 1.816 741 1HH1 ARG 100 1HH1 ARG 100 15.904 -20.130 -0.013 742 2HH1 ARG 100 2HH1 ARG 100 15.465 -21.748 -0.436 743 1HH2 ARG 100 1HH2 ARG 100 12.443 -21.697 1.243 744 2HH2 ARG 100 2HH2 ARG 100 13.529 -22.628 0.266 745 H SER 101 H SER 101 16.336 -15.713 4.724 746 HA SER 101 HA SER 101 15.865 -14.370 7.263 747 1HB SER 101 1HB SER 101 15.253 -16.957 7.460 748 2HB SER 101 2HB SER 101 17.003 -17.124 7.582 749 HG SER 101 HG SER 101 15.178 -16.003 9.332 750 H GLY 102 H GLY 102 17.501 -13.900 4.975 751 1HA GLY 102 1HA GLY 102 20.233 -14.453 6.057 752 2HA GLY 102 2HA GLY 102 19.885 -14.218 4.345 753 H SER 103 H SER 103 17.965 -11.945 5.169 754 HA SER 103 HA SER 103 19.519 -9.912 6.455 755 1HB SER 103 1HB SER 103 20.139 -10.428 3.657 756 2HB SER 103 2HB SER 103 19.594 -8.772 3.901 757 HG SER 103 HG SER 103 21.325 -8.372 5.056 758 H ASN 104 H ASN 104 17.942 -8.659 7.214 759 HA ASN 104 HA ASN 104 15.836 -7.685 7.500 760 1HB ASN 104 1HB ASN 104 15.306 -6.089 5.555 761 2HB ASN 104 2HB ASN 104 16.837 -5.858 6.390 762 1HD2 ASN 104 2HD2 ASN 104 15.433 -7.368 3.441 763 2HD2 ASN 104 1HD2 ASN 104 16.861 -7.270 2.526 764 HA PRO 105 HA PRO 105 13.390 -10.729 5.025 765 1HB PRO 105 1HB PRO 105 12.284 -12.010 7.168 766 2HB PRO 105 2HB PRO 105 13.846 -12.456 6.471 767 1HG PRO 105 1HG PRO 105 13.252 -11.065 9.005 768 2HG PRO 105 2HG PRO 105 14.653 -12.048 8.559 769 1HD PRO 105 1HD PRO 105 14.535 -9.216 8.649 770 2HD PRO 105 2HD PRO 105 15.849 -10.204 7.974 771 H ASN 106 H ASN 106 12.644 -8.682 7.783 772 HA ASN 106 HA ASN 106 10.036 -8.001 6.532 773 1HB ASN 106 1HB ASN 106 10.391 -9.480 9.022 774 2HB ASN 106 2HB ASN 106 9.507 -7.979 9.292 775 1HD2 ASN 106 2HD2 ASN 106 9.433 -9.924 6.282 776 2HD2 ASN 106 1HD2 ASN 106 7.786 -10.317 6.391 777 H ARG 107 H ARG 107 10.894 -5.957 5.990 778 HA ARG 107 HA ARG 107 11.498 -4.186 8.327 779 1HB ARG 107 1HB ARG 107 12.875 -4.500 5.693 780 2HB ARG 107 2HB ARG 107 12.767 -2.876 6.372 781 1HG ARG 107 1HG ARG 107 13.547 -4.149 8.585 782 2HG ARG 107 2HG ARG 107 14.228 -5.267 7.403 783 1HD ARG 107 1HD ARG 107 15.373 -3.362 6.293 784 2HD ARG 107 2HD ARG 107 14.741 -2.282 7.535 785 HE ARG 107 HE ARG 107 16.975 -4.119 7.845 786 1HH1 ARG 107 1HH1 ARG 107 14.379 -2.465 9.506 787 2HH1 ARG 107 2HH1 ARG 107 15.186 -2.522 11.034 788 1HH2 ARG 107 1HH2 ARG 107 17.983 -4.169 9.841 789 2HH2 ARG 107 2HH2 ARG 107 17.205 -3.475 11.224 790 H VAL 108 H VAL 108 11.323 -1.736 7.296 791 HA VAL 108 HA VAL 108 8.792 -1.621 5.734 792 HB VAL 108 HB VAL 108 7.857 0.020 7.208 793 1HG1 VAL 108 1HG1 VAL 108 8.976 -2.398 8.648 794 2HG1 VAL 108 2HG1 VAL 108 7.716 -1.360 9.315 795 3HG1 VAL 108 3HG1 VAL 108 7.415 -2.273 7.837 796 1HG2 VAL 108 1HG2 VAL 108 10.414 -0.276 8.798 797 2HG2 VAL 108 2HG2 VAL 108 9.908 1.157 7.902 798 3HG2 VAL 108 3HG2 VAL 108 8.995 0.633 9.318 799 H ARG 109 H ARG 109 8.473 0.488 4.646 800 HA ARG 109 HA ARG 109 10.891 2.191 4.483 801 1HB ARG 109 1HB ARG 109 9.896 0.391 2.402 802 2HB ARG 109 2HB ARG 109 9.958 2.063 1.847 803 1HG ARG 109 1HG ARG 109 12.136 1.474 1.394 804 2HG ARG 109 2HG ARG 109 12.342 1.960 3.077 805 1HD ARG 109 1HD ARG 109 12.042 -0.381 3.795 806 2HD ARG 109 2HD ARG 109 11.837 -0.870 2.115 807 HE ARG 109 HE ARG 109 14.172 -0.714 1.836 808 1HH1 ARG 109 1HH1 ARG 109 13.189 0.939 4.757 809 2HH1 ARG 109 2HH1 ARG 109 14.817 1.202 5.276 810 1HH2 ARG 109 1HH2 ARG 109 16.263 -0.352 2.547 811 2HH2 ARG 109 2HH2 ARG 109 16.541 0.480 4.040 812 H MET 110 H MET 110 10.378 4.291 3.503 813 HA MET 110 HA MET 110 7.474 4.957 3.515 814 1HB MET 110 1HB MET 110 9.613 6.618 4.874 815 2HB MET 110 2HB MET 110 7.879 6.944 4.853 816 1HG MET 110 1HG MET 110 7.407 5.005 6.171 817 2HG MET 110 2HG MET 110 9.038 4.385 5.959 818 1HE MET 110 1HE MET 110 10.970 5.355 6.500 819 2HE MET 110 2HE MET 110 11.065 7.085 6.819 820 3HE MET 110 3HE MET 110 11.293 5.939 8.138 821 H PHE 111 H PHE 111 7.077 7.137 2.548 822 HA PHE 111 HA PHE 111 9.109 7.850 0.481 823 1HB PHE 111 1HB PHE 111 6.132 7.977 -0.023 824 2HB PHE 111 2HB PHE 111 7.437 8.045 -1.198 825 HD1 PHE 111 HD1 PHE 111 6.036 5.738 1.425 826 HD2 PHE 111 HD2 PHE 111 7.968 6.115 -2.397 827 HE1 PHE 111 HE1 PHE 111 5.849 3.301 1.085 828 HE2 PHE 111 HE2 PHE 111 7.789 3.663 -2.724 829 HZ PHE 111 HZ PHE 111 6.727 2.251 -0.980 830 H GLY 112 H GLY 112 8.561 10.112 -0.420 831 1HA GLY 112 1HA GLY 112 7.217 11.843 1.569 832 2HA GLY 112 2HA GLY 112 8.865 12.198 1.112 833 HA PRO 113 HA PRO 113 6.331 14.556 -1.928 834 1HB PRO 113 1HB PRO 113 8.079 16.647 -2.064 835 2HB PRO 113 2HB PRO 113 6.818 16.507 -0.832 836 1HG PRO 113 1HG PRO 113 9.743 16.038 -0.603 837 2HG PRO 113 2HG PRO 113 8.600 16.656 0.600 838 1HD PRO 113 1HD PRO 113 9.579 14.045 0.540 839 2HD PRO 113 2HD PRO 113 8.101 14.548 1.368 840 H ASP 114 H ASP 114 9.843 14.053 -1.921 841 HA ASP 114 HA ASP 114 10.268 14.505 -4.717 842 1HB ASP 114 1HB ASP 114 11.822 12.978 -2.620 843 2HB ASP 114 2HB ASP 114 12.375 13.114 -4.289 844 H LYS 115 H LYS 115 9.192 11.728 -2.875 845 HA LYS 115 HA LYS 115 9.490 9.939 -5.191 846 1HB LYS 115 1HB LYS 115 8.579 9.575 -2.344 847 2HB LYS 115 2HB LYS 115 8.318 8.314 -3.550 848 1HG LYS 115 1HG LYS 115 10.401 7.659 -2.829 849 2HG LYS 115 2HG LYS 115 10.906 8.826 -4.052 850 1HD LYS 115 1HD LYS 115 10.751 10.569 -2.125 851 2HD LYS 115 2HD LYS 115 10.797 9.163 -1.061 852 1HE LYS 115 1HE LYS 115 12.829 9.474 -3.261 853 2HE LYS 115 2HE LYS 115 13.051 10.296 -1.717 854 1HZ LYS 115 1HZ LYS 115 12.406 7.423 -1.792 855 2HZ LYS 115 2HZ LYS 115 14.006 7.945 -2.022 856 3HZ LYS 115 3HZ LYS 115 13.190 8.310 -0.578 857 H LEU 116 H LEU 116 7.265 12.289 -4.465 858 HA LEU 116 HA LEU 116 5.095 10.676 -5.751 859 1HB LEU 116 1HB LEU 116 3.475 12.276 -4.589 860 2HB LEU 116 2HB LEU 116 4.233 11.042 -3.593 861 HG LEU 116 HG LEU 116 6.025 12.901 -3.133 862 1HD1 LEU 116 1HD1 LEU 116 4.305 14.324 -4.834 863 2HD1 LEU 116 2HD1 LEU 116 3.948 14.927 -3.220 864 3HD1 LEU 116 3HD1 LEU 116 5.594 14.995 -3.841 865 1HD2 LEU 116 1HD2 LEU 116 3.220 12.975 -1.995 866 2HD2 LEU 116 2HD2 LEU 116 4.539 11.944 -1.440 867 3HD2 LEU 116 3HD2 LEU 116 4.637 13.692 -1.231 868 H VAL 117 H VAL 117 4.081 11.530 -7.451 869 HA VAL 117 HA VAL 117 5.316 13.587 -8.988 870 HB VAL 117 HB VAL 117 3.822 11.843 -9.946 871 1HG1 VAL 117 1HG1 VAL 117 2.207 11.925 -8.024 872 2HG1 VAL 117 2HG1 VAL 117 1.575 13.411 -8.712 873 3HG1 VAL 117 3HG1 VAL 117 1.446 11.906 -9.616 874 1HG2 VAL 117 1HG2 VAL 117 4.180 14.168 -11.016 875 2HG2 VAL 117 2HG2 VAL 117 2.806 13.224 -11.590 876 3HG2 VAL 117 3HG2 VAL 117 2.553 14.538 -10.443 877 H ARG 118 H ARG 118 5.119 15.808 -8.861 878 HA ARG 118 HA ARG 118 3.555 16.974 -6.706 879 1HB ARG 118 1HB ARG 118 5.489 17.930 -8.742 880 2HB ARG 118 2HB ARG 118 4.295 19.119 -8.221 881 1HG ARG 118 1HG ARG 118 5.114 17.881 -5.844 882 2HG ARG 118 2HG ARG 118 6.600 18.057 -6.776 883 1HD ARG 118 1HD ARG 118 5.433 20.494 -7.194 884 2HD ARG 118 2HD ARG 118 4.884 20.131 -5.558 885 HE ARG 118 HE ARG 118 7.104 20.387 -4.809 886 1HH1 ARG 118 1HH1 ARG 118 7.037 20.025 -8.287 887 2HH1 ARG 118 2HH1 ARG 118 8.718 20.391 -8.457 888 1HH2 ARG 118 1HH2 ARG 118 9.275 20.851 -5.075 889 2HH2 ARG 118 2HH2 ARG 118 9.973 20.854 -6.661 890 H ALA 119 H ALA 119 3.163 16.627 -10.195 891 HA ALA 119 HA ALA 119 0.993 18.455 -10.516 892 1HB ALA 119 1HB ALA 119 2.293 17.500 -12.405 893 2HB ALA 119 2HB ALA 119 1.566 15.926 -12.084 894 3HB ALA 119 3HB ALA 119 0.557 17.271 -12.614 895 H ALA 120 H ALA 120 1.134 15.284 -9.103 896 HA ALA 120 HA ALA 120 -1.848 15.186 -9.064 897 1HB ALA 120 1HB ALA 120 -0.161 13.280 -10.074 898 2HB ALA 120 2HB ALA 120 -0.374 12.707 -8.420 899 3HB ALA 120 3HB ALA 120 -1.779 12.944 -9.460 900 H ALA 121 H ALA 121 1.079 14.411 -7.117 901 HA ALA 121 HA ALA 121 -0.102 13.710 -4.697 902 1HB ALA 121 1HB ALA 121 2.361 13.807 -5.215 903 2HB ALA 121 2HB ALA 121 2.289 15.544 -4.930 904 3HB ALA 121 3HB ALA 121 1.927 14.420 -3.621 905 H GLU 122 H GLU 122 0.340 17.022 -5.950 906 HA GLU 122 HA GLU 122 -0.716 18.191 -3.484 907 1HB GLU 122 1HB GLU 122 -0.552 20.338 -4.666 908 2HB GLU 122 2HB GLU 122 0.936 19.416 -4.863 909 1HG GLU 122 1HG GLU 122 0.641 19.897 -7.075 910 2HG GLU 122 2HG GLU 122 -0.475 18.533 -7.018 911 H LYS 123 H LYS 123 -2.252 16.508 -5.880 912 HA LYS 123 HA LYS 123 -4.633 18.249 -5.970 913 1HB LYS 123 1HB LYS 123 -4.181 15.525 -7.213 914 2HB LYS 123 2HB LYS 123 -5.513 16.623 -7.566 915 1HG LYS 123 1HG LYS 123 -3.582 18.315 -8.125 916 2HG LYS 123 2HG LYS 123 -2.615 16.853 -8.306 917 1HD LYS 123 1HD LYS 123 -3.468 17.230 -10.477 918 2HD LYS 123 2HD LYS 123 -4.546 16.004 -9.809 919 1HE LYS 123 1HE LYS 123 -6.050 17.570 -10.700 920 2HE LYS 123 2HE LYS 123 -5.967 18.041 -9.002 921 1HZ LYS 123 1HZ LYS 123 -4.025 19.517 -9.831 922 2HZ LYS 123 2HZ LYS 123 -4.765 19.338 -11.350 923 3HZ LYS 123 3HZ LYS 123 -5.628 20.031 -10.064 924 H ARG 124 H ARG 124 -6.439 17.814 -4.734 925 HA ARG 124 HA ARG 124 -6.171 16.075 -2.468 926 1HB ARG 124 1HB ARG 124 -8.515 17.594 -3.619 927 2HB ARG 124 2HB ARG 124 -8.647 16.618 -2.156 928 1HG ARG 124 1HG ARG 124 -7.129 17.965 -0.965 929 2HG ARG 124 2HG ARG 124 -6.459 18.670 -2.437 930 1HD ARG 124 1HD ARG 124 -8.834 19.631 -2.815 931 2HD ARG 124 2HD ARG 124 -9.108 19.249 -1.115 932 HE ARG 124 HE ARG 124 -6.657 20.764 -1.557 933 1HH1 ARG 124 1HH1 ARG 124 -10.116 20.971 -1.078 934 2HH1 ARG 124 2HH1 ARG 124 -10.035 22.583 -0.459 935 1HH2 ARG 124 1HH2 ARG 124 -6.599 22.850 -0.751 936 2HH2 ARG 124 2HH2 ARG 124 -8.066 23.638 -0.275 937 H TRP 125 H TRP 125 -6.238 13.936 -2.591 938 HA TRP 125 HA TRP 125 -8.202 12.612 -4.431 939 1HB TRP 125 1HB TRP 125 -5.614 11.491 -3.296 940 2HB TRP 125 2HB TRP 125 -6.677 10.693 -4.448 941 HD1 TRP 125 HD1 TRP 125 -3.709 12.832 -4.279 942 HE1 TRP 125 HE1 TRP 125 -3.136 13.798 -6.598 943 HE3 TRP 125 HE3 TRP 125 -8.010 11.732 -6.792 944 HZ2 TRP 125 HZ2 TRP 125 -4.320 14.055 -9.174 945 HZ3 TRP 125 HZ3 TRP 125 -8.261 12.328 -9.178 946 HH2 TRP 125 HH2 TRP 125 -6.427 13.498 -10.375 947 H ASP 126 H ASP 126 -8.995 10.471 -3.478 948 HA ASP 126 HA ASP 126 -8.904 10.438 -0.510 949 1HB ASP 126 1HB ASP 126 -11.374 10.122 -0.405 950 2HB ASP 126 2HB ASP 126 -10.903 11.713 -0.985 951 H ARG 127 H ARG 127 -8.090 8.755 -3.024 952 HA ARG 127 HA ARG 127 -8.756 6.154 -1.786 953 1HB ARG 127 1HB ARG 127 -9.239 6.826 -4.710 954 2HB ARG 127 2HB ARG 127 -9.244 5.191 -4.057 955 1HG ARG 127 1HG ARG 127 -10.975 6.464 -2.347 956 2HG ARG 127 2HG ARG 127 -11.304 7.295 -3.867 957 1HD ARG 127 1HD ARG 127 -11.716 5.169 -4.990 958 2HD ARG 127 2HD ARG 127 -11.265 4.284 -3.541 959 HE ARG 127 HE ARG 127 -13.309 5.806 -2.604 960 1HH1 ARG 127 1HH1 ARG 127 -13.030 3.860 -5.504 961 2HH1 ARG 127 2HH1 ARG 127 -14.721 3.513 -5.547 962 1HH2 ARG 127 1HH2 ARG 127 -15.485 5.316 -2.703 963 2HH2 ARG 127 2HH2 ARG 127 -16.095 4.322 -3.982 964 H VAL 128 H VAL 128 -7.054 4.622 -2.216 965 HA VAL 128 HA VAL 128 -4.824 5.641 -3.898 966 HB VAL 128 HB VAL 128 -4.510 6.204 -1.440 967 1HG1 VAL 128 1HG1 VAL 128 -5.299 3.643 -0.955 968 2HG1 VAL 128 2HG1 VAL 128 -3.546 3.458 -0.909 969 3HG1 VAL 128 3HG1 VAL 128 -4.341 4.604 0.171 970 1HG2 VAL 128 1HG2 VAL 128 -2.614 4.710 -3.184 971 2HG2 VAL 128 2HG2 VAL 128 -2.542 6.374 -2.608 972 3HG2 VAL 128 3HG2 VAL 128 -2.114 5.049 -1.527 973 H LYS 129 H LYS 129 -3.662 4.053 -4.962 974 HA LYS 129 HA LYS 129 -4.717 1.274 -4.660 975 1HB LYS 129 1HB LYS 129 -5.125 2.368 -6.858 976 2HB LYS 129 2HB LYS 129 -3.385 2.550 -7.059 977 1HG LYS 129 1HG LYS 129 -3.592 -0.124 -6.451 978 2HG LYS 129 2HG LYS 129 -5.069 0.152 -7.375 979 1HD LYS 129 1HD LYS 129 -3.440 1.448 -9.002 980 2HD LYS 129 2HD LYS 129 -2.214 0.432 -8.241 981 1HE LYS 129 1HE LYS 129 -3.037 -1.496 -9.171 982 2HE LYS 129 2HE LYS 129 -4.709 -0.938 -9.102 983 1HZ LYS 129 1HZ LYS 129 -2.768 0.309 -10.942 984 2HZ LYS 129 2HZ LYS 129 -3.585 -1.116 -11.376 985 3HZ LYS 129 3HZ LYS 129 -4.465 0.292 -11.033 986 H ILE 130 H ILE 130 -3.314 0.143 -3.411 987 HA ILE 130 HA ILE 130 -0.383 0.592 -3.747 988 HB ILE 130 HB ILE 130 -1.935 -0.920 -1.612 989 1HG1 ILE 130 1HG1 ILE 130 -2.295 1.524 -1.536 990 2HG1 ILE 130 2HG1 ILE 130 -1.334 0.986 -0.160 991 1HG2 ILE 130 1HG2 ILE 130 0.997 -0.442 -2.089 992 2HG2 ILE 130 2HG2 ILE 130 0.392 -0.597 -0.439 993 3HG2 ILE 130 3HG2 ILE 130 0.178 -1.920 -1.586 994 1HD1 ILE 130 1HD1 ILE 130 0.736 1.645 -1.401 995 2HD1 ILE 130 2HD1 ILE 130 -0.280 2.280 -2.695 996 3HD1 ILE 130 3HD1 ILE 130 -0.336 3.011 -1.092 997 H VAL 131 H VAL 131 0.790 -0.951 -4.873 998 HA VAL 131 HA VAL 131 -0.395 -3.662 -5.127 999 HB VAL 131 HB VAL 131 0.911 -2.030 -7.323 1000 1HG1 VAL 131 1HG1 VAL 131 -0.257 -4.816 -7.226 1001 2HG1 VAL 131 2HG1 VAL 131 0.090 -3.957 -8.728 1002 3HG1 VAL 131 3HG1 VAL 131 1.402 -4.365 -7.622 1003 1HG2 VAL 131 1HG2 VAL 131 -1.928 -2.666 -6.574 1004 2HG2 VAL 131 2HG2 VAL 131 -1.239 -1.138 -7.126 1005 3HG2 VAL 131 3HG2 VAL 131 -1.505 -2.452 -8.272 1006 H CYS 132 H CYS 132 1.019 -5.037 -4.193 1007 HA CYS 132 HA CYS 132 3.895 -4.366 -4.038 1008 1HB CYS 132 1HB CYS 132 3.069 -5.321 -2.016 1009 2HB CYS 132 2HB CYS 132 2.168 -6.559 -2.865 1010 HG CYS 132 HG CYS 132 4.240 -7.975 -3.069 1011 H SER 133 H SER 133 5.521 -5.692 -5.076 1012 HA SER 133 HA SER 133 4.567 -7.711 -7.020 1013 1HB SER 133 1HB SER 133 5.133 -5.003 -7.735 1014 2HB SER 133 2HB SER 133 6.410 -6.003 -8.413 1015 HG SER 133 HG SER 133 3.660 -5.990 -8.910 1016 H GLN 134 H GLN 134 5.869 -9.377 -6.931 1017 HA GLN 134 HA GLN 134 8.488 -9.708 -7.465 1018 1HB GLN 134 1HB GLN 134 8.760 -8.145 -5.288 1019 2HB GLN 134 2HB GLN 134 8.640 -9.703 -4.494 1020 1HG GLN 134 1HG GLN 134 10.366 -9.883 -6.827 1021 2HG GLN 134 2HG GLN 134 10.927 -8.617 -5.743 1022 1HE2 GLN 134 2HE2 GLN 134 11.998 -9.273 -3.863 1023 2HE2 GLN 134 1HE2 GLN 134 12.066 -10.875 -3.325 1024 HA PRO 135 HA PRO 135 6.752 -13.730 -6.395 1025 1HB PRO 135 1HB PRO 135 8.531 -15.226 -7.819 1026 2HB PRO 135 2HB PRO 135 7.201 -14.332 -8.569 1027 1HG PRO 135 1HG PRO 135 10.088 -13.784 -8.633 1028 2HG PRO 135 2HG PRO 135 8.814 -13.247 -9.736 1029 1HD PRO 135 1HD PRO 135 10.060 -11.736 -7.640 1030 2HD PRO 135 2HD PRO 135 8.732 -11.227 -8.706 1031 H TYR 136 H TYR 136 7.335 -13.809 -4.128 1032 HA TYR 136 HA TYR 136 10.006 -15.036 -3.619 1033 1HB TYR 136 1HB TYR 136 9.601 -14.007 -1.217 1034 2HB TYR 136 2HB TYR 136 10.308 -13.039 -2.505 1035 HD1 TYR 136 HD1 TYR 136 6.940 -13.956 -1.099 1036 HD2 TYR 136 HD2 TYR 136 9.374 -10.974 -2.993 1037 HE1 TYR 136 HE1 TYR 136 5.090 -12.322 -0.900 1038 HE2 TYR 136 HE2 TYR 136 7.519 -9.341 -2.807 1039 HH TYR 136 HH TYR 136 4.336 -10.267 -1.967 1040 H SER 137 H SER 137 6.605 -15.395 -3.203 1041 HA SER 137 HA SER 137 7.120 -17.590 -1.240 1042 1HB SER 137 1HB SER 137 5.265 -15.530 -1.122 1043 2HB SER 137 2HB SER 137 4.310 -16.892 -1.701 1044 HG SER 137 HG SER 137 6.007 -16.842 0.581 1045 H LYS 138 H LYS 138 5.554 -19.477 -1.544 1046 HA LYS 138 HA LYS 138 4.531 -19.955 -4.239 1047 1HB LYS 138 1HB LYS 138 7.171 -20.397 -4.083 1048 2HB LYS 138 2HB LYS 138 6.612 -21.937 -3.432 1049 1HG LYS 138 1HG LYS 138 6.062 -22.664 -5.491 1050 2HG LYS 138 2HG LYS 138 5.026 -21.261 -5.748 1051 1HD LYS 138 1HD LYS 138 6.603 -21.005 -7.452 1052 2HD LYS 138 2HD LYS 138 7.293 -20.007 -6.173 1053 1HE LYS 138 1HE LYS 138 9.147 -21.280 -6.733 1054 2HE LYS 138 2HE LYS 138 8.445 -22.295 -5.474 1055 1HZ LYS 138 1HZ LYS 138 7.165 -23.368 -7.386 1056 2HZ LYS 138 2HZ LYS 138 8.311 -22.633 -8.402 1057 3HZ LYS 138 3HZ LYS 138 8.813 -23.748 -7.227 1058 H ASP 139 H ASP 139 3.755 -20.099 -1.295 1059 HA ASP 139 HA ASP 139 2.134 -22.444 -1.441 1060 1HB ASP 139 1HB ASP 139 3.213 -23.266 0.823 1061 2HB ASP 139 2HB ASP 139 3.840 -23.840 -0.713 1062 H SER 140 H SER 140 3.693 -20.157 0.715 1063 HA SER 140 HA SER 140 1.157 -19.836 2.218 1064 1HB SER 140 1HB SER 140 2.899 -18.412 3.652 1065 2HB SER 140 2HB SER 140 2.757 -20.153 3.839 1066 HG SER 140 HG SER 140 4.676 -20.368 3.010 1067 HA PRO 141 HA PRO 141 0.771 -15.784 0.315 1068 1HB PRO 141 1HB PRO 141 -1.284 -14.870 1.849 1069 2HB PRO 141 2HB PRO 141 -1.482 -16.091 0.587 1070 1HG PRO 141 1HG PRO 141 -1.617 -16.394 3.495 1071 2HG PRO 141 2HG PRO 141 -2.248 -17.444 2.222 1072 1HD PRO 141 1HD PRO 141 0.152 -17.803 3.771 1073 2HD PRO 141 2HD PRO 141 -0.491 -18.846 2.484 1074 H PHE 142 H PHE 142 0.728 -13.432 0.994 1075 HA PHE 142 HA PHE 142 1.362 -12.500 3.599 1076 1HB PHE 142 1HB PHE 142 3.582 -13.739 2.208 1077 2HB PHE 142 2HB PHE 142 3.904 -12.018 2.408 1078 HD1 PHE 142 HD1 PHE 142 3.419 -11.024 4.787 1079 HD2 PHE 142 HD2 PHE 142 3.987 -15.205 3.985 1080 HE1 PHE 142 HE1 PHE 142 3.973 -11.406 7.173 1081 HE2 PHE 142 HE2 PHE 142 4.542 -15.587 6.372 1082 HZ PHE 142 HZ PHE 142 4.535 -13.687 7.966 1083 H GLY 143 H GLY 143 3.028 -10.296 2.921 1084 1HA GLY 143 1HA GLY 143 2.654 -9.011 0.502 1085 2HA GLY 143 2HA GLY 143 1.136 -8.737 1.350 1086 H LEU 144 H LEU 144 1.041 -7.104 2.791 1087 HA LEU 144 HA LEU 144 3.613 -5.719 3.450 1088 1HB LEU 144 1HB LEU 144 0.990 -4.738 2.518 1089 2HB LEU 144 2HB LEU 144 1.674 -3.816 3.853 1090 HG LEU 144 HG LEU 144 3.797 -3.604 2.576 1091 1HD1 LEU 144 1HD1 LEU 144 2.164 -4.965 0.413 1092 2HD1 LEU 144 2HD1 LEU 144 3.707 -4.160 0.131 1093 3HD1 LEU 144 3HD1 LEU 144 3.632 -5.584 1.168 1094 1HD2 LEU 144 1HD2 LEU 144 2.021 -1.860 2.470 1095 2HD2 LEU 144 2HD2 LEU 144 2.956 -1.950 0.977 1096 3HD2 LEU 144 3HD2 LEU 144 1.347 -2.666 1.053 1097 H SER 145 H SER 145 3.786 -4.726 5.527 1098 HA SER 145 HA SER 145 2.399 -6.233 7.643 1099 1HB SER 145 1HB SER 145 4.562 -4.118 7.814 1100 2HB SER 145 2HB SER 145 3.987 -5.108 9.152 1101 HG SER 145 HG SER 145 5.746 -6.152 8.357 1102 H PHE 146 H PHE 146 2.406 -3.025 6.226 1103 HA PHE 146 HA PHE 146 -0.119 -2.299 7.357 1104 1HB PHE 146 1HB PHE 146 0.624 -0.562 8.971 1105 2HB PHE 146 2HB PHE 146 1.173 -2.161 9.477 1106 HD1 PHE 146 HD1 PHE 146 2.180 1.070 8.038 1107 HD2 PHE 146 HD2 PHE 146 3.518 -2.803 9.309 1108 HE1 PHE 146 HE1 PHE 146 4.525 1.840 7.865 1109 HE2 PHE 146 HE2 PHE 146 5.862 -2.057 9.126 1110 HZ PHE 146 HZ PHE 146 6.388 0.259 8.382 1111 H VAL 147 H VAL 147 -0.568 0.085 6.954 1112 HA VAL 147 HA VAL 147 1.284 1.353 5.019 1113 HB VAL 147 HB VAL 147 -0.546 1.789 3.429 1114 1HG1 VAL 147 1HG1 VAL 147 0.915 -0.431 3.580 1115 2HG1 VAL 147 2HG1 VAL 147 -0.664 -1.166 3.859 1116 3HG1 VAL 147 3HG1 VAL 147 -0.363 -0.260 2.376 1117 1HG2 VAL 147 1HG2 VAL 147 -2.120 0.540 5.608 1118 2HG2 VAL 147 2HG2 VAL 147 -2.621 1.720 4.397 1119 3HG2 VAL 147 3HG2 VAL 147 -2.549 0.006 3.983 1120 H ARG 148 H ARG 148 1.406 3.526 5.421 1121 HA ARG 148 HA ARG 148 -0.825 4.843 6.907 1122 1HB ARG 148 1HB ARG 148 2.068 5.320 7.641 1123 2HB ARG 148 2HB ARG 148 0.634 5.724 8.565 1124 1HG ARG 148 1HG ARG 148 0.298 3.062 8.423 1125 2HG ARG 148 2HG ARG 148 2.058 3.130 8.320 1126 1HD ARG 148 1HD ARG 148 1.867 4.766 10.346 1127 2HD ARG 148 2HD ARG 148 0.259 4.071 10.543 1128 HE ARG 148 HE ARG 148 2.343 2.050 10.287 1129 1HH1 ARG 148 1HH1 ARG 148 0.656 4.175 12.496 1130 2HH1 ARG 148 2HH1 ARG 148 0.999 3.183 13.868 1131 1HH2 ARG 148 1HH2 ARG 148 2.764 0.799 12.092 1132 2HH2 ARG 148 2HH2 ARG 148 2.179 1.291 13.645 1133 H PHE 149 H PHE 149 -1.385 6.676 5.791 1134 HA PHE 149 HA PHE 149 0.674 7.947 4.033 1135 1HB PHE 149 1HB PHE 149 -2.349 8.232 4.052 1136 2HB PHE 149 2HB PHE 149 -1.261 9.044 2.927 1137 HD1 PHE 149 HD1 PHE 149 0.480 7.388 1.724 1138 HD2 PHE 149 HD2 PHE 149 -3.323 6.240 3.357 1139 HE1 PHE 149 HE1 PHE 149 0.447 5.392 0.252 1140 HE2 PHE 149 HE2 PHE 149 -3.355 4.247 1.881 1141 HZ PHE 149 HZ PHE 149 -1.469 3.822 0.332 1142 H HIS 150 H HIS 150 0.818 10.338 4.057 1143 HA HIS 150 HA HIS 150 -0.531 11.717 6.279 1144 1HB HIS 150 1HB HIS 150 2.241 12.479 6.521 1145 2HB HIS 150 2HB HIS 150 1.152 11.866 7.754 1146 HD1 HIS 150 HD1 HIS 150 2.388 10.052 8.910 1147 HD2 HIS 150 HD2 HIS 150 2.871 9.799 4.786 1148 HE1 HIS 150 HE1 HIS 150 3.731 7.952 8.474 1149 H SER 151 H SER 151 -0.982 13.756 5.746 1150 HA SER 151 HA SER 151 -0.099 14.756 3.129 1151 1HB SER 151 1HB SER 151 -2.419 14.994 4.685 1152 2HB SER 151 2HB SER 151 -1.707 16.604 4.706 1153 HG SER 151 HG SER 151 -3.158 15.858 2.858 Start of MODEL 21 1 H MET 1 H MET 1 -5.104 15.830 15.155 2 HA MET 1 HA MET 1 -3.295 14.304 14.139 3 1HB MET 1 1HB MET 1 -5.070 13.260 12.704 4 2HB MET 1 2HB MET 1 -5.623 13.638 14.335 5 1HG MET 1 1HG MET 1 -6.319 15.940 13.196 6 2HG MET 1 2HG MET 1 -6.335 14.948 11.739 7 1HE MET 1 1HE MET 1 -8.201 15.003 11.025 8 2HE MET 1 2HE MET 1 -8.977 13.438 11.254 9 3HE MET 1 3HE MET 1 -9.778 14.915 11.806 10 HA PRO 2 HA PRO 2 -2.101 16.769 10.427 11 1HB PRO 2 1HB PRO 2 0.580 16.758 10.938 12 2HB PRO 2 2HB PRO 2 -0.532 17.955 11.619 13 1HG PRO 2 1HG PRO 2 0.867 15.745 12.950 14 2HG PRO 2 2HG PRO 2 0.143 17.201 13.646 15 1HD PRO 2 1HD PRO 2 -0.950 14.537 13.599 16 2HD PRO 2 2HD PRO 2 -1.679 16.003 14.288 17 H GLU 3 H GLU 3 -2.843 14.231 10.001 18 HA GLU 3 HA GLU 3 -0.763 13.175 8.236 19 1HB GLU 3 1HB GLU 3 -0.792 10.901 9.301 20 2HB GLU 3 2HB GLU 3 -0.031 12.133 10.308 21 1HG GLU 3 1HG GLU 3 -2.333 12.441 11.399 22 2HG GLU 3 2HG GLU 3 -2.791 10.938 10.597 23 H ILE 4 H ILE 4 -1.676 10.963 7.315 24 HA ILE 4 HA ILE 4 -4.613 11.330 6.890 25 HB ILE 4 HB ILE 4 -2.427 10.480 4.969 26 1HG1 ILE 4 1HG1 ILE 4 -4.500 12.686 4.848 27 2HG1 ILE 4 2HG1 ILE 4 -2.829 12.913 5.363 28 1HG2 ILE 4 1HG2 ILE 4 -4.397 9.013 4.651 29 2HG2 ILE 4 2HG2 ILE 4 -5.426 10.439 4.516 30 3HG2 ILE 4 3HG2 ILE 4 -4.195 10.122 3.294 31 1HD1 ILE 4 1HD1 ILE 4 -3.583 11.746 2.675 32 2HD1 ILE 4 2HD1 ILE 4 -3.285 13.466 2.930 33 3HD1 ILE 4 3HD1 ILE 4 -1.992 12.298 3.199 34 H ARG 5 H ARG 5 -5.803 9.647 7.594 35 HA ARG 5 HA ARG 5 -4.409 7.083 8.201 36 1HB ARG 5 1HB ARG 5 -6.807 8.483 9.337 37 2HB ARG 5 2HB ARG 5 -6.694 6.728 9.474 38 1HG ARG 5 1HG ARG 5 -4.453 6.971 10.515 39 2HG ARG 5 2HG ARG 5 -4.620 8.725 10.428 40 1HD ARG 5 1HD ARG 5 -5.356 8.289 12.602 41 2HD ARG 5 2HD ARG 5 -6.875 8.298 11.705 42 HE ARG 5 HE ARG 5 -6.096 5.654 11.602 43 1HH1 ARG 5 1HH1 ARG 5 -6.527 7.967 14.190 44 2HH1 ARG 5 2HH1 ARG 5 -6.953 6.750 15.342 45 1HH2 ARG 5 1HH2 ARG 5 -6.653 4.112 13.125 46 2HH2 ARG 5 2HH2 ARG 5 -7.024 4.591 14.747 47 H LEU 6 H LEU 6 -5.736 5.089 7.861 48 HA LEU 6 HA LEU 6 -7.094 5.214 5.239 49 1HB LEU 6 1HB LEU 6 -5.131 3.589 6.018 50 2HB LEU 6 2HB LEU 6 -6.467 2.663 6.692 51 HG LEU 6 HG LEU 6 -5.922 1.896 4.418 52 1HD1 LEU 6 1HD1 LEU 6 -8.309 2.048 5.391 53 2HD1 LEU 6 2HD1 LEU 6 -8.531 3.386 4.268 54 3HD1 LEU 6 3HD1 LEU 6 -8.144 1.782 3.655 55 1HD2 LEU 6 1HD2 LEU 6 -5.694 4.715 3.926 56 2HD2 LEU 6 2HD2 LEU 6 -5.332 3.383 2.831 57 3HD2 LEU 6 3HD2 LEU 6 -6.952 4.076 2.870 58 H ARG 7 H ARG 7 -9.301 5.016 5.140 59 HA ARG 7 HA ARG 7 -10.807 4.579 7.615 60 1HB ARG 7 1HB ARG 7 -11.494 6.249 5.865 61 2HB ARG 7 2HB ARG 7 -11.864 4.897 4.794 62 1HG ARG 7 1HG ARG 7 -13.785 4.386 5.898 63 2HG ARG 7 2HG ARG 7 -13.059 4.659 7.481 64 1HD ARG 7 1HD ARG 7 -13.642 6.881 7.522 65 2HD ARG 7 2HD ARG 7 -13.515 7.058 5.772 66 HE ARG 7 HE ARG 7 -15.693 5.427 6.014 67 1HH1 ARG 7 1HH1 ARG 7 -14.825 8.438 7.574 68 2HH1 ARG 7 2HH1 ARG 7 -16.471 8.902 7.812 69 1HH2 ARG 7 1HH2 ARG 7 -17.805 6.077 6.334 70 2HH2 ARG 7 2HH2 ARG 7 -18.141 7.585 7.117 71 H HIS 8 H HIS 8 -10.802 3.001 4.411 72 HA HIS 8 HA HIS 8 -10.918 0.353 5.629 73 1HB HIS 8 1HB HIS 8 -13.091 -0.251 4.539 74 2HB HIS 8 2HB HIS 8 -13.270 0.931 5.834 75 HD1 HIS 8 HD1 HIS 8 -14.905 2.676 5.156 76 HD2 HIS 8 HD2 HIS 8 -12.566 1.450 1.930 77 HE1 HIS 8 HE1 HIS 8 -15.629 4.076 3.174 78 H VAL 9 H VAL 9 -10.980 -1.356 3.877 79 HA VAL 9 HA VAL 9 -9.299 -0.489 1.638 80 HB VAL 9 HB VAL 9 -8.817 -2.613 2.792 81 1HG1 VAL 9 1HG1 VAL 9 -11.567 -2.940 2.834 82 2HG1 VAL 9 2HG1 VAL 9 -11.052 -4.116 1.626 83 3HG1 VAL 9 3HG1 VAL 9 -10.383 -4.176 3.255 84 1HG2 VAL 9 1HG2 VAL 9 -8.346 -2.297 0.317 85 2HG2 VAL 9 2HG2 VAL 9 -8.485 -3.976 0.839 86 3HG2 VAL 9 3HG2 VAL 9 -9.826 -3.201 -0.005 87 H VAL 10 H VAL 10 -10.720 0.820 0.382 88 HA VAL 10 HA VAL 10 -13.341 0.167 -0.423 89 HB VAL 10 HB VAL 10 -12.626 2.377 -0.890 90 1HG1 VAL 10 1HG1 VAL 10 -10.124 1.260 -1.402 91 2HG1 VAL 10 2HG1 VAL 10 -10.619 1.913 -2.957 92 3HG1 VAL 10 3HG1 VAL 10 -10.553 2.959 -1.542 93 1HG2 VAL 10 1HG2 VAL 10 -13.773 0.849 -2.872 94 2HG2 VAL 10 2HG2 VAL 10 -13.603 2.603 -2.932 95 3HG2 VAL 10 3HG2 VAL 10 -12.408 1.573 -3.720 96 H SER 11 H SER 11 -10.364 -0.425 -2.381 97 HA SER 11 HA SER 11 -11.903 -2.621 -3.687 98 1HB SER 11 1HB SER 11 -10.706 -0.399 -4.883 99 2HB SER 11 2HB SER 11 -9.583 -1.717 -5.201 100 HG SER 11 HG SER 11 -12.172 -1.306 -6.087 101 H CYS 12 H CYS 12 -10.852 -4.632 -3.897 102 HA CYS 12 HA CYS 12 -8.112 -4.823 -2.721 103 1HB CYS 12 1HB CYS 12 -8.817 -6.967 -1.647 104 2HB CYS 12 2HB CYS 12 -9.676 -5.566 -1.008 105 HG CYS 12 HG CYS 12 -11.785 -6.628 -1.733 106 H SER 13 H SER 13 -6.743 -5.791 -4.112 107 HA SER 13 HA SER 13 -7.871 -7.708 -6.113 108 1HB SER 13 1HB SER 13 -6.011 -5.391 -6.453 109 2HB SER 13 2HB SER 13 -5.749 -6.816 -7.455 110 HG SER 13 HG SER 13 -7.233 -5.181 -8.305 111 H SER 14 H SER 14 -6.889 -8.498 -3.615 112 HA SER 14 HA SER 14 -5.388 -10.706 -3.910 113 1HB SER 14 1HB SER 14 -3.589 -8.338 -4.109 114 2HB SER 14 2HB SER 14 -3.036 -9.695 -3.140 115 HG SER 14 HG SER 14 -3.197 -11.011 -4.906 116 H GLN 15 H GLN 15 -6.933 -10.722 -2.061 117 HA GLN 15 HA GLN 15 -5.483 -10.196 0.460 118 1HB GLN 15 1HB GLN 15 -6.663 -8.337 0.937 119 2HB GLN 15 2HB GLN 15 -7.577 -8.500 -0.543 120 1HG GLN 15 1HG GLN 15 -8.398 -10.122 1.857 121 2HG GLN 15 2HG GLN 15 -8.810 -8.416 1.771 122 1HE2 GLN 15 2HE2 GLN 15 -8.615 -10.397 -1.182 123 2HE2 GLN 15 1HE2 GLN 15 -10.282 -10.370 -1.500 124 H ASP 16 H ASP 16 -6.008 -11.698 2.068 125 HA ASP 16 HA ASP 16 -7.652 -13.994 1.183 126 1HB ASP 16 1HB ASP 16 -5.357 -13.610 2.903 127 2HB ASP 16 2HB ASP 16 -6.626 -14.445 3.793 128 H SER 17 H SER 17 -8.546 -14.942 3.668 129 HA SER 17 HA SER 17 -10.695 -12.980 4.221 130 1HB SER 17 1HB SER 17 -10.655 -15.730 5.405 131 2HB SER 17 2HB SER 17 -12.029 -14.771 4.862 132 HG SER 17 HG SER 17 -11.295 -16.611 3.496 133 H THR 18 H THR 18 -8.822 -15.304 6.215 134 HA THR 18 HA THR 18 -9.256 -13.905 8.669 135 HB THR 18 HB THR 18 -6.876 -15.212 9.080 136 HG1 THR 18 HG1 THR 18 -6.629 -16.766 7.670 137 1HG2 THR 18 1HG2 THR 18 -9.717 -16.236 9.073 138 2HG2 THR 18 2HG2 THR 18 -8.370 -17.178 9.712 139 3HG2 THR 18 3HG2 THR 18 -8.788 -15.628 10.444 140 H HIS 19 H HIS 19 -6.463 -13.915 6.445 141 HA HIS 19 HA HIS 19 -5.469 -11.449 7.804 142 1HB HIS 19 1HB HIS 19 -4.064 -13.419 5.970 143 2HB HIS 19 2HB HIS 19 -3.323 -11.955 6.617 144 HD1 HIS 19 HD1 HIS 19 -3.128 -11.834 9.292 145 HD2 HIS 19 HD2 HIS 19 -4.080 -15.582 7.736 146 HE1 HIS 19 HE1 HIS 19 -2.704 -13.508 11.145 147 H CYS 20 H CYS 20 -7.286 -10.350 6.568 148 HA CYS 20 HA CYS 20 -6.813 -10.089 3.665 149 1HB CYS 20 1HB CYS 20 -8.867 -8.683 3.699 150 2HB CYS 20 2HB CYS 20 -9.136 -10.289 4.359 151 HG CYS 20 HG CYS 20 -9.380 -9.315 6.690 152 H ALA 21 H ALA 21 -6.927 -7.814 2.780 153 HA ALA 21 HA ALA 21 -4.743 -6.275 3.794 154 1HB ALA 21 1HB ALA 21 -6.327 -6.357 1.460 155 2HB ALA 21 2HB ALA 21 -6.508 -4.724 2.103 156 3HB ALA 21 3HB ALA 21 -4.901 -5.359 1.743 157 H GLU 22 H GLU 22 -8.156 -6.266 4.517 158 HA GLU 22 HA GLU 22 -8.363 -3.585 5.505 159 1HB GLU 22 1HB GLU 22 -10.130 -5.654 5.177 160 2HB GLU 22 2HB GLU 22 -9.945 -5.636 6.931 161 1HG GLU 22 1HG GLU 22 -10.260 -3.046 6.681 162 2HG GLU 22 2HG GLU 22 -10.965 -3.460 5.117 163 H ASN 23 H ASN 23 -6.696 -6.360 6.741 164 HA ASN 23 HA ASN 23 -6.795 -5.731 9.550 165 1HB ASN 23 1HB ASN 23 -4.853 -7.254 7.827 166 2HB ASN 23 2HB ASN 23 -4.581 -7.035 9.554 167 1HD2 ASN 23 2HD2 ASN 23 -5.571 -9.372 7.626 168 2HD2 ASN 23 1HD2 ASN 23 -6.840 -10.054 8.526 169 H LEU 24 H LEU 24 -5.224 -4.268 6.883 170 HA LEU 24 HA LEU 24 -2.954 -3.112 8.171 171 1HB LEU 24 1HB LEU 24 -4.554 -2.033 5.826 172 2HB LEU 24 2HB LEU 24 -2.883 -1.636 6.232 173 HG LEU 24 HG LEU 24 -3.744 -4.489 5.698 174 1HD1 LEU 24 1HD1 LEU 24 -3.346 -2.269 3.790 175 2HD1 LEU 24 2HD1 LEU 24 -2.432 -3.733 3.426 176 3HD1 LEU 24 3HD1 LEU 24 -4.187 -3.805 3.578 177 1HD2 LEU 24 1HD2 LEU 24 -1.227 -3.009 6.187 178 2HD2 LEU 24 2HD2 LEU 24 -1.633 -4.689 6.530 179 3HD2 LEU 24 3HD2 LEU 24 -1.156 -4.211 4.902 180 H LEU 25 H LEU 25 -6.372 -2.389 8.169 181 HA LEU 25 HA LEU 25 -6.353 0.336 8.939 182 1HB LEU 25 1HB LEU 25 -8.191 -2.005 9.342 183 2HB LEU 25 2HB LEU 25 -8.501 -0.520 10.224 184 HG LEU 25 HG LEU 25 -9.752 -0.578 8.095 185 1HD1 LEU 25 1HD1 LEU 25 -8.742 1.558 9.111 186 2HD1 LEU 25 2HD1 LEU 25 -7.538 1.450 7.828 187 3HD1 LEU 25 3HD1 LEU 25 -9.242 1.629 7.423 188 1HD2 LEU 25 1HD2 LEU 25 -8.155 -1.970 6.816 189 2HD2 LEU 25 2HD2 LEU 25 -8.517 -0.473 5.959 190 3HD2 LEU 25 3HD2 LEU 25 -6.992 -0.644 6.828 191 H LYS 26 H LYS 26 -5.431 -2.567 10.638 192 HA LYS 26 HA LYS 26 -5.307 -1.045 13.211 193 1HB LYS 26 1HB LYS 26 -4.959 -4.038 12.898 194 2HB LYS 26 2HB LYS 26 -5.318 -3.134 14.364 195 1HG LYS 26 1HG LYS 26 -7.516 -3.443 13.992 196 2HG LYS 26 2HG LYS 26 -7.376 -2.492 12.514 197 1HD LYS 26 1HD LYS 26 -7.068 -4.398 11.169 198 2HD LYS 26 2HD LYS 26 -6.593 -5.402 12.539 199 1HE LYS 26 1HE LYS 26 -8.943 -5.099 13.444 200 2HE LYS 26 2HE LYS 26 -9.362 -4.361 11.898 201 1HZ LYS 26 1HZ LYS 26 -8.135 -7.048 12.137 202 2HZ LYS 26 2HZ LYS 26 -9.814 -6.795 12.069 203 3HZ LYS 26 3HZ LYS 26 -8.831 -6.348 10.758 204 H ALA 27 H ALA 27 -3.408 -0.110 11.779 205 HA ALA 27 HA ALA 27 -1.026 -1.472 11.228 206 1HB ALA 27 1HB ALA 27 -1.754 1.080 10.987 207 2HB ALA 27 2HB ALA 27 -0.813 1.236 12.471 208 3HB ALA 27 3HB ALA 27 -0.055 0.608 11.008 209 H ASP 28 H ASP 28 -2.321 -0.584 14.360 210 HA ASP 28 HA ASP 28 0.195 -1.592 15.629 211 1HB ASP 28 1HB ASP 28 -1.765 0.530 16.499 212 2HB ASP 28 2HB ASP 28 -0.697 -0.259 17.659 213 H THR 29 H THR 29 -0.844 -3.765 15.305 214 HA THR 29 HA THR 29 -2.318 -4.516 17.723 215 HB THR 29 HB THR 29 -4.075 -5.736 16.247 216 HG1 THR 29 HG1 THR 29 -4.009 -5.294 14.213 217 1HG2 THR 29 1HG2 THR 29 -4.298 -3.584 17.714 218 2HG2 THR 29 2HG2 THR 29 -4.344 -2.744 16.164 219 3HG2 THR 29 3HG2 THR 29 -5.565 -3.957 16.545 220 H TYR 30 H TYR 30 -2.513 -6.505 14.812 221 HA TYR 30 HA TYR 30 -0.017 -7.842 15.011 222 1HB TYR 30 1HB TYR 30 -0.675 -9.915 16.167 223 2HB TYR 30 2HB TYR 30 -0.834 -8.532 17.244 224 HD1 TYR 30 HD1 TYR 30 -3.145 -7.484 17.553 225 HD2 TYR 30 HD2 TYR 30 -2.530 -11.279 15.638 226 HE1 TYR 30 HE1 TYR 30 -5.533 -8.051 17.909 227 HE2 TYR 30 HE2 TYR 30 -4.915 -11.846 15.995 228 HH TYR 30 HH TYR 30 -6.753 -11.218 17.456 229 H ARG 31 H ARG 31 -1.875 -6.953 13.009 230 HA ARG 31 HA ARG 31 -2.208 -9.507 11.530 231 1HB ARG 31 1HB ARG 31 -4.363 -7.407 11.918 232 2HB ARG 31 2HB ARG 31 -4.434 -8.664 10.683 233 1HG ARG 31 1HG ARG 31 -3.953 -10.268 12.726 234 2HG ARG 31 2HG ARG 31 -4.620 -8.929 13.661 235 1HD ARG 31 1HD ARG 31 -6.574 -8.958 11.986 236 2HD ARG 31 2HD ARG 31 -5.958 -10.531 11.478 237 HE ARG 31 HE ARG 31 -7.385 -9.977 13.942 238 1HH1 ARG 31 1HH1 ARG 31 -4.935 -11.996 12.476 239 2HH1 ARG 31 2HH1 ARG 31 -5.181 -13.285 13.601 240 1HH2 ARG 31 1HH2 ARG 31 -7.674 -11.671 15.374 241 2HH2 ARG 31 2HH2 ARG 31 -6.717 -13.107 15.223 242 H LYS 32 H LYS 32 -1.649 -9.273 9.370 243 HA LYS 32 HA LYS 32 -1.127 -6.487 8.414 244 1HB LYS 32 1HB LYS 32 0.574 -8.963 8.049 245 2HB LYS 32 2HB LYS 32 0.881 -7.413 7.283 246 1HG LYS 32 1HG LYS 32 1.475 -6.379 9.281 247 2HG LYS 32 2HG LYS 32 0.517 -7.498 10.251 248 1HD LYS 32 1HD LYS 32 2.303 -9.224 9.147 249 2HD LYS 32 2HD LYS 32 3.291 -7.768 9.247 250 1HE LYS 32 1HE LYS 32 1.648 -8.660 11.608 251 2HE LYS 32 2HE LYS 32 3.236 -9.366 11.304 252 1HZ LYS 32 1HZ LYS 32 3.961 -6.915 11.086 253 2HZ LYS 32 2HZ LYS 32 2.539 -6.583 11.954 254 3HZ LYS 32 3HZ LYS 32 3.734 -7.575 12.635 255 H TRP 33 H TRP 33 -0.559 -6.726 5.868 256 HA TRP 33 HA TRP 33 -3.000 -7.818 4.659 257 1HB TRP 33 1HB TRP 33 -1.993 -5.659 3.842 258 2HB TRP 33 2HB TRP 33 -0.590 -6.558 3.317 259 HD1 TRP 33 HD1 TRP 33 -4.133 -7.915 2.859 260 HE1 TRP 33 HE1 TRP 33 -4.629 -8.087 0.323 261 HE3 TRP 33 HE3 TRP 33 0.015 -5.635 1.041 262 HZ2 TRP 33 HZ2 TRP 33 -3.389 -7.321 -2.155 263 HZ3 TRP 33 HZ3 TRP 33 0.361 -5.373 -1.404 264 HH2 TRP 33 HH2 TRP 33 -1.339 -6.207 -3.000 265 H ARG 34 H ARG 34 -3.111 -9.622 3.367 266 HA ARG 34 HA ARG 34 -0.619 -11.021 2.634 267 1HB ARG 34 1HB ARG 34 -2.234 -11.827 4.856 268 2HB ARG 34 2HB ARG 34 -2.492 -13.009 3.574 269 1HG ARG 34 1HG ARG 34 -0.359 -13.802 3.700 270 2HG ARG 34 2HG ARG 34 0.324 -12.197 3.954 271 1HD ARG 34 1HD ARG 34 0.475 -12.577 6.165 272 2HD ARG 34 2HD ARG 34 -1.256 -12.907 6.254 273 HE ARG 34 HE ARG 34 -0.100 -15.231 5.199 274 1HH1 ARG 34 1HH1 ARG 34 0.188 -13.329 8.121 275 2HH1 ARG 34 2HH1 ARG 34 0.622 -14.696 9.086 276 1HH2 ARG 34 1HH2 ARG 34 0.464 -16.972 6.487 277 2HH2 ARG 34 2HH2 ARG 34 0.777 -16.736 8.175 278 H ALA 35 H ALA 35 -0.837 -11.760 0.578 279 HA ALA 35 HA ALA 35 -3.002 -11.166 -1.096 280 1HB ALA 35 1HB ALA 35 -0.698 -11.938 -1.802 281 2HB ALA 35 2HB ALA 35 -1.196 -13.585 -1.420 282 3HB ALA 35 3HB ALA 35 -2.017 -12.688 -2.699 283 H ALA 36 H ALA 36 -4.722 -12.384 -1.958 284 HA ALA 36 HA ALA 36 -6.170 -14.011 -0.121 285 1HB ALA 36 1HB ALA 36 -6.787 -12.680 -2.411 286 2HB ALA 36 2HB ALA 36 -6.771 -14.341 -3.001 287 3HB ALA 36 3HB ALA 36 -7.839 -13.888 -1.673 288 H LYS 37 H LYS 37 -3.792 -14.782 -2.557 289 HA LYS 37 HA LYS 37 -4.088 -17.664 -1.862 290 1HB LYS 37 1HB LYS 37 -3.303 -18.155 -4.196 291 2HB LYS 37 2HB LYS 37 -4.868 -17.345 -4.155 292 1HG LYS 37 1HG LYS 37 -2.478 -15.579 -4.260 293 2HG LYS 37 2HG LYS 37 -2.833 -16.503 -5.719 294 1HD LYS 37 1HD LYS 37 -5.311 -15.651 -5.222 295 2HD LYS 37 2HD LYS 37 -4.439 -14.357 -4.399 296 1HE LYS 37 1HE LYS 37 -3.436 -15.106 -7.095 297 2HE LYS 37 2HE LYS 37 -4.999 -14.289 -7.041 298 1HZ LYS 37 1HZ LYS 37 -2.756 -13.234 -5.461 299 2HZ LYS 37 2HZ LYS 37 -2.825 -12.909 -7.125 300 3HZ LYS 37 3HZ LYS 37 -4.095 -12.415 -6.110 301 H ALA 38 H ALA 38 -1.795 -18.606 -3.007 302 HA ALA 38 HA ALA 38 0.309 -17.139 -1.485 303 1HB ALA 38 1HB ALA 38 0.190 -20.009 -2.467 304 2HB ALA 38 2HB ALA 38 1.562 -19.299 -1.615 305 3HB ALA 38 3HB ALA 38 0.005 -19.461 -0.801 306 H GLY 39 H GLY 39 2.604 -17.663 -2.594 307 1HA GLY 39 1HA GLY 39 3.883 -17.783 -4.649 308 2HA GLY 39 2HA GLY 39 2.415 -17.413 -5.550 309 H GLU 40 H GLU 40 1.695 -15.216 -3.723 310 HA GLU 40 HA GLU 40 1.823 -12.882 -3.875 311 1HB GLU 40 1HB GLU 40 4.639 -13.598 -3.080 312 2HB GLU 40 2HB GLU 40 3.861 -12.029 -2.854 313 1HG GLU 40 1HG GLU 40 2.478 -14.464 -1.822 314 2HG GLU 40 2HG GLU 40 3.847 -13.823 -0.926 315 H LYS 41 H LYS 41 2.428 -14.193 -6.430 316 HA LYS 41 HA LYS 41 4.646 -13.142 -7.821 317 1HB LYS 41 1HB LYS 41 2.865 -14.737 -8.715 318 2HB LYS 41 2HB LYS 41 1.864 -13.314 -9.008 319 1HG LYS 41 1HG LYS 41 4.601 -13.006 -10.028 320 2HG LYS 41 2HG LYS 41 3.745 -14.357 -10.767 321 1HD LYS 41 1HD LYS 41 2.142 -12.999 -11.731 322 2HD LYS 41 2HD LYS 41 2.284 -11.767 -10.478 323 1HE LYS 41 1HE LYS 41 3.290 -10.783 -12.386 324 2HE LYS 41 2HE LYS 41 4.649 -11.344 -11.413 325 1HZ LYS 41 1HZ LYS 41 4.588 -13.422 -12.759 326 2HZ LYS 41 2HZ LYS 41 3.454 -12.673 -13.780 327 3HZ LYS 41 3HZ LYS 41 5.023 -12.035 -13.634 328 H THR 42 H THR 42 1.410 -11.673 -7.516 329 HA THR 42 HA THR 42 2.541 -8.995 -7.285 330 HB THR 42 HB THR 42 1.122 -8.169 -9.276 331 HG1 THR 42 HG1 THR 42 0.576 -9.666 -10.774 332 1HG2 THR 42 1HG2 THR 42 3.726 -8.635 -9.102 333 2HG2 THR 42 2HG2 THR 42 3.351 -9.894 -10.278 334 3HG2 THR 42 3HG2 THR 42 2.986 -8.207 -10.645 335 H ILE 43 H ILE 43 1.153 -7.883 -5.949 336 HA ILE 43 HA ILE 43 -1.703 -8.782 -5.898 337 HB ILE 43 HB ILE 43 -1.615 -8.304 -3.400 338 1HG1 ILE 43 1HG1 ILE 43 1.364 -8.546 -3.875 339 2HG1 ILE 43 2HG1 ILE 43 0.527 -7.050 -3.456 340 1HG2 ILE 43 1HG2 ILE 43 -1.243 -10.593 -4.791 341 2HG2 ILE 43 2HG2 ILE 43 0.255 -10.543 -3.866 342 3HG2 ILE 43 3HG2 ILE 43 -1.294 -10.518 -3.033 343 1HD1 ILE 43 1HD1 ILE 43 -0.430 -8.547 -1.474 344 2HD1 ILE 43 2HD1 ILE 43 1.048 -9.466 -1.766 345 3HD1 ILE 43 3HD1 ILE 43 1.141 -7.758 -1.335 346 H SER 44 H SER 44 -3.237 -7.154 -5.665 347 HA SER 44 HA SER 44 -2.146 -4.389 -5.352 348 1HB SER 44 1HB SER 44 -4.191 -5.401 -7.314 349 2HB SER 44 2HB SER 44 -4.054 -3.697 -6.906 350 HG SER 44 HG SER 44 -2.496 -5.248 -8.503 351 H VAL 45 H VAL 45 -3.326 -3.035 -4.034 352 HA VAL 45 HA VAL 45 -5.966 -3.936 -3.053 353 HB VAL 45 HB VAL 45 -4.351 -4.953 -1.479 354 1HG1 VAL 45 1HG1 VAL 45 -2.620 -3.082 -1.890 355 2HG1 VAL 45 2HG1 VAL 45 -3.515 -2.168 -0.680 356 3HG1 VAL 45 3HG1 VAL 45 -2.768 -3.705 -0.251 357 1HG2 VAL 45 1HG2 VAL 45 -6.001 -2.624 -0.485 358 2HG2 VAL 45 2HG2 VAL 45 -6.425 -4.336 -0.485 359 3HG2 VAL 45 3HG2 VAL 45 -5.182 -3.735 0.612 360 H VAL 46 H VAL 46 -7.166 -2.164 -3.510 361 HA VAL 46 HA VAL 46 -5.952 0.521 -3.309 362 HB VAL 46 HB VAL 46 -8.832 -0.004 -4.022 363 1HG1 VAL 46 1HG1 VAL 46 -7.975 2.313 -3.684 364 2HG1 VAL 46 2HG1 VAL 46 -6.808 2.036 -4.976 365 3HG1 VAL 46 3HG1 VAL 46 -8.535 2.027 -5.333 366 1HG2 VAL 46 1HG2 VAL 46 -6.404 -0.315 -5.815 367 2HG2 VAL 46 2HG2 VAL 46 -7.619 -1.541 -5.458 368 3HG2 VAL 46 3HG2 VAL 46 -8.048 -0.129 -6.423 369 H LEU 47 H LEU 47 -6.080 1.611 -1.434 370 HA LEU 47 HA LEU 47 -8.136 0.795 0.556 371 1HB LEU 47 1HB LEU 47 -5.806 2.669 1.022 372 2HB LEU 47 2HB LEU 47 -6.754 1.790 2.222 373 HG LEU 47 HG LEU 47 -5.873 -0.297 0.744 374 1HD1 LEU 47 1HD1 LEU 47 -4.007 1.995 0.285 375 2HD1 LEU 47 2HD1 LEU 47 -3.313 0.393 0.531 376 3HD1 LEU 47 3HD1 LEU 47 -4.443 0.670 -0.794 377 1HD2 LEU 47 1HD2 LEU 47 -5.648 0.037 3.203 378 2HD2 LEU 47 2HD2 LEU 47 -4.176 -0.617 2.486 379 3HD2 LEU 47 3HD2 LEU 47 -4.265 1.091 2.913 380 H GLN 48 H GLN 48 -9.313 2.494 1.700 381 HA GLN 48 HA GLN 48 -9.944 4.778 -0.099 382 1HB GLN 48 1HB GLN 48 -11.795 3.285 0.654 383 2HB GLN 48 2HB GLN 48 -11.445 3.730 2.321 384 1HG GLN 48 1HG GLN 48 -13.203 5.185 1.714 385 2HG GLN 48 2HG GLN 48 -11.756 6.176 1.522 386 1HE2 GLN 48 2HE2 GLN 48 -12.458 7.509 -0.219 387 2HE2 GLN 48 1HE2 GLN 48 -12.876 6.900 -1.747 388 H LEU 49 H LEU 49 -9.871 6.917 0.661 389 HA LEU 49 HA LEU 49 -8.270 7.345 3.115 390 1HB LEU 49 1HB LEU 49 -8.921 9.073 0.714 391 2HB LEU 49 2HB LEU 49 -8.241 9.756 2.186 392 HG LEU 49 HG LEU 49 -6.461 9.254 0.570 393 1HD1 LEU 49 1HD1 LEU 49 -6.368 8.724 3.189 394 2HD1 LEU 49 2HD1 LEU 49 -6.111 7.085 2.590 395 3HD1 LEU 49 3HD1 LEU 49 -5.006 8.378 2.124 396 1HD2 LEU 49 1HD2 LEU 49 -7.916 7.234 -0.333 397 2HD2 LEU 49 2HD2 LEU 49 -6.156 7.184 -0.440 398 3HD2 LEU 49 3HD2 LEU 49 -6.986 6.315 0.851 399 H GLU 50 H GLU 50 -9.169 8.472 4.817 400 HA GLU 50 HA GLU 50 -12.082 8.647 4.911 401 1HB GLU 50 1HB GLU 50 -10.593 7.964 6.848 402 2HB GLU 50 2HB GLU 50 -10.130 9.660 6.987 403 1HG GLU 50 1HG GLU 50 -12.249 10.326 7.671 404 2HG GLU 50 2HG GLU 50 -13.042 8.962 6.882 405 H LYS 51 H LYS 51 -10.798 10.502 2.994 406 HA LYS 51 HA LYS 51 -12.302 12.781 3.111 407 1HB LYS 51 1HB LYS 51 -10.608 14.500 3.993 408 2HB LYS 51 2HB LYS 51 -11.434 13.542 5.217 409 1HG LYS 51 1HG LYS 51 -9.528 12.426 5.817 410 2HG LYS 51 2HG LYS 51 -8.923 12.367 4.162 411 1HD LYS 51 1HD LYS 51 -8.212 14.684 4.276 412 2HD LYS 51 2HD LYS 51 -8.959 14.876 5.862 413 1HE LYS 51 1HE LYS 51 -6.821 12.802 5.362 414 2HE LYS 51 2HE LYS 51 -6.418 14.458 5.817 415 1HZ LYS 51 1HZ LYS 51 -7.927 14.166 7.753 416 2HZ LYS 51 2HZ LYS 51 -8.061 12.523 7.352 417 3HZ LYS 51 3HZ LYS 51 -6.552 13.170 7.791 418 H GLU 52 H GLU 52 -11.872 13.956 1.228 419 HA GLU 52 HA GLU 52 -9.748 12.975 -0.521 420 1HB GLU 52 1HB GLU 52 -12.145 14.063 -1.064 421 2HB GLU 52 2HB GLU 52 -11.165 15.526 -1.109 422 1HG GLU 52 1HG GLU 52 -9.794 14.708 -2.851 423 2HG GLU 52 2HG GLU 52 -10.329 13.047 -2.603 424 H GLU 53 H GLU 53 -7.735 13.539 0.225 425 HA GLU 53 HA GLU 53 -7.184 16.437 0.603 426 1HB GLU 53 1HB GLU 53 -5.306 15.445 2.238 427 2HB GLU 53 2HB GLU 53 -6.911 15.868 2.818 428 1HG GLU 53 1HG GLU 53 -6.143 13.631 3.616 429 2HG GLU 53 2HG GLU 53 -7.623 13.540 2.671 430 H GLN 54 H GLN 54 -4.844 16.916 0.371 431 HA GLN 54 HA GLN 54 -3.824 15.708 -2.071 432 1HB GLN 54 1HB GLN 54 -2.514 17.712 -0.206 433 2HB GLN 54 2HB GLN 54 -1.996 17.335 -1.850 434 1HG GLN 54 1HG GLN 54 -3.851 18.377 -2.814 435 2HG GLN 54 2HG GLN 54 -4.822 18.221 -1.352 436 1HE2 GLN 54 2HE2 GLN 54 -1.485 19.515 -1.654 437 2HE2 GLN 54 1HE2 GLN 54 -1.868 21.061 -1.068 438 H ILE 55 H ILE 55 -1.196 15.353 -1.883 439 HA ILE 55 HA ILE 55 -0.744 13.551 0.465 440 HB ILE 55 HB ILE 55 0.533 12.834 -2.132 441 1HG1 ILE 55 1HG1 ILE 55 -1.785 13.224 -2.844 442 2HG1 ILE 55 2HG1 ILE 55 -1.417 11.501 -2.849 443 1HG2 ILE 55 1HG2 ILE 55 -0.333 11.518 0.389 444 2HG2 ILE 55 2HG2 ILE 55 -0.303 10.529 -1.072 445 3HG2 ILE 55 3HG2 ILE 55 1.168 11.332 -0.519 446 1HD1 ILE 55 1HD1 ILE 55 -2.412 12.370 -0.258 447 2HD1 ILE 55 2HD1 ILE 55 -3.555 12.734 -1.550 448 3HD1 ILE 55 3HD1 ILE 55 -2.996 11.080 -1.308 449 H HIS 56 H HIS 56 1.746 12.987 0.507 450 HA HIS 56 HA HIS 56 3.604 14.880 -0.608 451 1HB HIS 56 1HB HIS 56 2.213 16.128 1.289 452 2HB HIS 56 2HB HIS 56 3.354 15.293 2.342 453 HD1 HIS 56 HD1 HIS 56 3.028 18.370 0.593 454 HD2 HIS 56 HD2 HIS 56 6.193 15.721 1.186 455 HE1 HIS 56 HE1 HIS 56 5.149 19.673 0.128 456 H SER 57 H SER 57 2.882 12.729 2.139 457 HA SER 57 HA SER 57 5.425 11.299 1.596 458 1HB SER 57 1HB SER 57 4.747 12.754 4.132 459 2HB SER 57 2HB SER 57 5.641 11.243 4.233 460 HG SER 57 HG SER 57 6.984 13.122 4.022 461 H VAL 58 H VAL 58 5.284 9.119 2.164 462 HA VAL 58 HA VAL 58 2.636 8.227 3.226 463 HB VAL 58 HB VAL 58 4.205 7.155 0.870 464 1HG1 VAL 58 1HG1 VAL 58 1.755 6.083 2.280 465 2HG1 VAL 58 2HG1 VAL 58 2.173 5.632 0.626 466 3HG1 VAL 58 3HG1 VAL 58 3.269 5.249 1.951 467 1HG2 VAL 58 1HG2 VAL 58 1.773 8.840 1.222 468 2HG2 VAL 58 2HG2 VAL 58 3.010 8.901 -0.033 469 3HG2 VAL 58 3HG2 VAL 58 1.756 7.662 -0.090 470 H ASP 59 H ASP 59 2.695 5.989 4.059 471 HA ASP 59 HA ASP 59 5.397 5.097 4.971 472 1HB ASP 59 1HB ASP 59 3.841 6.368 6.703 473 2HB ASP 59 2HB ASP 59 2.999 4.820 6.746 474 H ILE 60 H ILE 60 5.675 2.919 4.647 475 HA ILE 60 HA ILE 60 3.377 1.105 4.729 476 HB ILE 60 HB ILE 60 4.656 1.904 2.146 477 1HG1 ILE 60 1HG1 ILE 60 2.097 0.835 1.750 478 2HG1 ILE 60 2HG1 ILE 60 2.002 1.610 3.330 479 1HG2 ILE 60 1HG2 ILE 60 4.010 -0.935 2.888 480 2HG2 ILE 60 2HG2 ILE 60 3.683 -0.379 1.247 481 3HG2 ILE 60 3HG2 ILE 60 5.324 -0.318 1.886 482 1HD1 ILE 60 1HD1 ILE 60 3.428 3.248 1.367 483 2HD1 ILE 60 2HD1 ILE 60 1.769 2.891 0.884 484 3HD1 ILE 60 3HD1 ILE 60 2.088 3.675 2.430 485 H GLY 61 H GLY 61 4.032 -0.777 5.595 486 1HA GLY 61 1HA GLY 61 6.949 -1.177 5.859 487 2HA GLY 61 2HA GLY 61 5.752 -1.937 6.886 488 H ASN 62 H ASN 62 7.890 -2.616 4.609 489 HA ASN 62 HA ASN 62 6.376 -4.316 2.813 490 1HB ASN 62 1HB ASN 62 8.685 -5.190 2.185 491 2HB ASN 62 2HB ASN 62 8.446 -3.457 1.970 492 1HD2 ASN 62 2HD2 ASN 62 9.654 -2.015 3.327 493 2HD2 ASN 62 1HD2 ASN 62 10.855 -2.554 4.398 494 H ASP 63 H ASP 63 5.503 -6.238 3.398 495 HA ASP 63 HA ASP 63 6.760 -7.756 5.644 496 1HB ASP 63 1HB ASP 63 4.262 -7.164 5.678 497 2HB ASP 63 2HB ASP 63 4.077 -8.297 4.338 498 H GLY 64 H GLY 64 8.467 -8.261 3.995 499 1HA GLY 64 1HA GLY 64 9.471 -9.980 2.713 500 2HA GLY 64 2HA GLY 64 7.923 -10.831 2.706 501 H SER 65 H SER 65 7.929 -7.477 1.813 502 HA SER 65 HA SER 65 7.199 -8.214 -0.961 503 1HB SER 65 1HB SER 65 6.676 -5.635 -0.939 504 2HB SER 65 2HB SER 65 5.580 -6.764 -0.147 505 HG SER 65 HG SER 65 6.831 -4.736 0.925 506 H ALA 66 H ALA 66 8.180 -7.153 -2.754 507 HA ALA 66 HA ALA 66 10.896 -6.065 -2.154 508 1HB ALA 66 1HB ALA 66 10.254 -8.276 -3.682 509 2HB ALA 66 2HB ALA 66 10.423 -7.010 -4.897 510 3HB ALA 66 3HB ALA 66 11.757 -7.366 -3.800 511 H PHE 67 H PHE 67 8.302 -5.907 -4.630 512 HA PHE 67 HA PHE 67 9.109 -3.068 -5.123 513 1HB PHE 67 1HB PHE 67 7.396 -4.885 -6.846 514 2HB PHE 67 2HB PHE 67 7.951 -3.279 -7.275 515 HD1 PHE 67 HD1 PHE 67 10.713 -3.158 -6.495 516 HD2 PHE 67 HD2 PHE 67 8.526 -6.471 -8.136 517 HE1 PHE 67 HE1 PHE 67 12.823 -4.115 -7.374 518 HE2 PHE 67 HE2 PHE 67 10.635 -7.429 -9.011 519 HZ PHE 67 HZ PHE 67 12.785 -6.252 -8.633 520 H VAL 68 H VAL 68 7.718 -1.443 -4.582 521 HA VAL 68 HA VAL 68 4.874 -2.170 -4.001 522 HB VAL 68 HB VAL 68 6.617 -0.388 -2.273 523 1HG1 VAL 68 1HG1 VAL 68 4.149 0.192 -2.448 524 2HG1 VAL 68 2HG1 VAL 68 3.802 -1.403 -1.778 525 3HG1 VAL 68 3HG1 VAL 68 4.697 -0.220 -0.823 526 1HG2 VAL 68 1HG2 VAL 68 7.131 -2.816 -2.105 527 2HG2 VAL 68 2HG2 VAL 68 6.413 -2.187 -0.622 528 3HG2 VAL 68 3HG2 VAL 68 5.433 -3.129 -1.746 529 H GLU 69 H GLU 69 3.724 -1.053 -5.452 530 HA GLU 69 HA GLU 69 4.602 1.704 -6.207 531 1HB GLU 69 1HB GLU 69 4.404 0.108 -8.080 532 2HB GLU 69 2HB GLU 69 2.734 -0.224 -7.629 533 1HG GLU 69 1HG GLU 69 1.969 1.802 -8.429 534 2HG GLU 69 2HG GLU 69 3.489 2.629 -8.103 535 H VAL 70 H VAL 70 3.102 3.423 -6.091 536 HA VAL 70 HA VAL 70 0.470 2.785 -4.842 537 HB VAL 70 HB VAL 70 2.240 5.082 -3.981 538 1HG1 VAL 70 1HG1 VAL 70 -0.513 4.144 -3.345 539 2HG1 VAL 70 2HG1 VAL 70 0.458 4.744 -2.002 540 3HG1 VAL 70 3HG1 VAL 70 0.134 5.785 -3.389 541 1HG2 VAL 70 1HG2 VAL 70 1.785 2.327 -2.827 542 2HG2 VAL 70 2HG2 VAL 70 3.320 3.125 -3.169 543 3HG2 VAL 70 3HG2 VAL 70 2.322 3.675 -1.823 544 H LEU 71 H LEU 71 -1.176 3.760 -5.860 545 HA LEU 71 HA LEU 71 -0.596 6.040 -7.701 546 1HB LEU 71 1HB LEU 71 -2.093 3.544 -8.032 547 2HB LEU 71 2HB LEU 71 -3.060 4.954 -8.443 548 HG LEU 71 HG LEU 71 -1.186 5.732 -9.913 549 1HD1 LEU 71 1HD1 LEU 71 0.507 4.294 -8.601 550 2HD1 LEU 71 2HD1 LEU 71 -0.073 2.945 -9.578 551 3HD1 LEU 71 3HD1 LEU 71 0.682 4.337 -10.355 552 1HD2 LEU 71 1HD2 LEU 71 -2.651 3.151 -10.328 553 2HD2 LEU 71 2HD2 LEU 71 -2.846 4.692 -11.163 554 3HD2 LEU 71 3HD2 LEU 71 -1.466 3.658 -11.533 555 H VAL 72 H VAL 72 -2.351 7.629 -7.830 556 HA VAL 72 HA VAL 72 -3.948 7.765 -5.303 557 HB VAL 72 HB VAL 72 -3.790 10.268 -5.692 558 1HG1 VAL 72 1HG1 VAL 72 -1.393 8.569 -5.017 559 2HG1 VAL 72 2HG1 VAL 72 -1.400 10.319 -4.804 560 3HG1 VAL 72 3HG1 VAL 72 -2.539 9.316 -3.905 561 1HG2 VAL 72 1HG2 VAL 72 -2.996 9.974 -8.086 562 2HG2 VAL 72 2HG2 VAL 72 -2.028 11.087 -7.119 563 3HG2 VAL 72 3HG2 VAL 72 -1.449 9.449 -7.425 564 H GLY 73 H GLY 73 -6.052 8.773 -5.481 565 1HA GLY 73 1HA GLY 73 -7.168 9.672 -7.948 566 2HA GLY 73 2HA GLY 73 -7.616 7.989 -7.674 567 H SER 74 H SER 74 -9.641 9.673 -7.717 568 HA SER 74 HA SER 74 -10.323 10.231 -4.888 569 1HB SER 74 1HB SER 74 -10.413 12.272 -6.133 570 2HB SER 74 2HB SER 74 -11.272 11.500 -7.455 571 HG SER 74 HG SER 74 -12.899 12.350 -6.359 572 H SER 75 H SER 75 -12.472 9.732 -4.226 573 HA SER 75 HA SER 75 -13.480 7.239 -5.184 574 1HB SER 75 1HB SER 75 -15.262 7.532 -3.606 575 2HB SER 75 2HB SER 75 -13.832 8.247 -2.867 576 HG SER 75 HG SER 75 -16.137 9.404 -3.359 577 H ALA 76 H ALA 76 -13.825 10.409 -6.381 578 HA ALA 76 HA ALA 76 -16.448 10.282 -7.479 579 1HB ALA 76 1HB ALA 76 -13.987 11.790 -8.393 580 2HB ALA 76 2HB ALA 76 -15.600 12.041 -9.059 581 3HB ALA 76 3HB ALA 76 -15.279 12.404 -7.363 582 H GLY 77 H GLY 77 -17.111 9.702 -9.623 583 1HA GLY 77 1HA GLY 77 -16.433 8.921 -11.898 584 2HA GLY 77 2HA GLY 77 -15.148 8.003 -11.113 585 H GLY 78 H GLY 78 -15.642 6.009 -10.168 586 1HA GLY 78 1HA GLY 78 -18.191 5.036 -9.457 587 2HA GLY 78 2HA GLY 78 -17.950 4.615 -11.154 588 H ALA 79 H ALA 79 -16.231 3.163 -11.703 589 HA ALA 79 HA ALA 79 -15.740 1.093 -9.770 590 1HB ALA 79 1HB ALA 79 -14.771 1.699 -12.542 591 2HB ALA 79 2HB ALA 79 -13.930 0.469 -11.599 592 3HB ALA 79 3HB ALA 79 -15.650 0.289 -11.950 593 H GLY 80 H GLY 80 -13.491 3.440 -11.282 594 1HA GLY 80 1HA GLY 80 -11.695 4.589 -10.232 595 2HA GLY 80 2HA GLY 80 -12.034 3.704 -8.744 596 H GLU 81 H GLU 81 -11.217 2.657 -12.069 597 HA GLU 81 HA GLU 81 -9.084 0.936 -10.871 598 1HB GLU 81 1HB GLU 81 -10.726 0.645 -13.400 599 2HB GLU 81 2HB GLU 81 -9.304 -0.343 -13.061 600 1HG GLU 81 1HG GLU 81 -11.584 -0.106 -11.094 601 2HG GLU 81 2HG GLU 81 -11.576 -1.324 -12.369 602 H GLN 82 H GLN 82 -9.753 2.519 -14.018 603 HA GLN 82 HA GLN 82 -6.843 3.112 -14.239 604 1HB GLN 82 1HB GLN 82 -8.270 1.950 -16.097 605 2HB GLN 82 2HB GLN 82 -8.859 3.579 -16.425 606 1HG GLN 82 1HG GLN 82 -7.021 3.628 -17.798 607 2HG GLN 82 2HG GLN 82 -6.220 4.099 -16.298 608 1HE2 GLN 82 2HE2 GLN 82 -4.487 2.797 -15.672 609 2HE2 GLN 82 1HE2 GLN 82 -4.200 1.224 -16.242 610 H ASP 83 H ASP 83 -8.694 4.626 -12.492 611 HA ASP 83 HA ASP 83 -8.561 7.288 -13.852 612 1HB ASP 83 1HB ASP 83 -10.856 6.356 -13.140 613 2HB ASP 83 2HB ASP 83 -10.318 6.636 -11.483 614 H TYR 84 H TYR 84 -6.410 5.903 -12.342 615 HA TYR 84 HA TYR 84 -6.091 7.859 -10.126 616 1HB TYR 84 1HB TYR 84 -5.148 4.989 -10.344 617 2HB TYR 84 2HB TYR 84 -4.485 6.121 -9.167 618 HD1 TYR 84 HD1 TYR 84 -7.908 5.184 -10.433 619 HD2 TYR 84 HD2 TYR 84 -5.398 5.971 -7.040 620 HE1 TYR 84 HE1 TYR 84 -9.820 4.753 -8.923 621 HE2 TYR 84 HE2 TYR 84 -7.314 5.541 -5.526 622 HH TYR 84 HH TYR 84 -9.751 3.945 -6.060 623 H GLU 85 H GLU 85 -3.933 8.668 -9.881 624 HA GLU 85 HA GLU 85 -2.371 8.536 -12.411 625 1HB GLU 85 1HB GLU 85 -2.359 10.790 -12.318 626 2HB GLU 85 2HB GLU 85 -3.279 10.740 -10.826 627 1HG GLU 85 1HG GLU 85 -1.327 12.015 -10.346 628 2HG GLU 85 2HG GLU 85 -1.030 10.435 -9.622 629 H VAL 86 H VAL 86 -0.144 8.081 -12.300 630 HA VAL 86 HA VAL 86 0.650 6.341 -10.156 631 HB VAL 86 HB VAL 86 2.378 7.610 -12.298 632 1HG1 VAL 86 1HG1 VAL 86 2.731 5.278 -10.408 633 2HG1 VAL 86 2HG1 VAL 86 3.645 5.393 -11.911 634 3HG1 VAL 86 3HG1 VAL 86 3.818 6.641 -10.676 635 1HG2 VAL 86 1HG2 VAL 86 0.263 6.254 -12.977 636 2HG2 VAL 86 2HG2 VAL 86 1.805 5.802 -13.704 637 3HG2 VAL 86 3HG2 VAL 86 1.150 4.856 -12.369 638 H LEU 87 H LEU 87 0.437 7.683 -8.256 639 HA LEU 87 HA LEU 87 1.835 10.125 -7.797 640 1HB LEU 87 1HB LEU 87 0.074 8.817 -6.339 641 2HB LEU 87 2HB LEU 87 1.496 8.047 -5.643 642 HG LEU 87 HG LEU 87 2.422 10.377 -5.228 643 1HD1 LEU 87 1HD1 LEU 87 -0.129 11.031 -6.543 644 2HD1 LEU 87 2HD1 LEU 87 0.127 11.908 -5.036 645 3HD1 LEU 87 3HD1 LEU 87 1.314 12.021 -6.334 646 1HD2 LEU 87 1HD2 LEU 87 0.221 8.995 -3.847 647 2HD2 LEU 87 2HD2 LEU 87 1.702 9.684 -3.187 648 3HD2 LEU 87 3HD2 LEU 87 0.301 10.715 -3.469 649 H LEU 88 H LEU 88 2.827 6.818 -6.781 650 HA LEU 88 HA LEU 88 5.628 7.634 -7.346 651 1HB LEU 88 1HB LEU 88 6.431 6.637 -5.275 652 2HB LEU 88 2HB LEU 88 5.278 7.923 -4.933 653 HG LEU 88 HG LEU 88 3.666 5.673 -5.167 654 1HD1 LEU 88 1HD1 LEU 88 6.202 4.641 -4.892 655 2HD1 LEU 88 2HD1 LEU 88 5.665 4.727 -3.217 656 3HD1 LEU 88 3HD1 LEU 88 4.726 3.816 -4.396 657 1HD2 LEU 88 1HD2 LEU 88 4.854 7.210 -2.864 658 2HD2 LEU 88 2HD2 LEU 88 3.201 7.243 -3.480 659 3HD2 LEU 88 3HD2 LEU 88 3.771 5.851 -2.559 660 H VAL 89 H VAL 89 6.501 6.199 -8.716 661 HA VAL 89 HA VAL 89 5.254 3.851 -9.638 662 HB VAL 89 HB VAL 89 7.520 3.229 -10.513 663 1HG1 VAL 89 1HG1 VAL 89 6.325 5.961 -10.827 664 2HG1 VAL 89 2HG1 VAL 89 7.851 5.603 -11.635 665 3HG1 VAL 89 3HG1 VAL 89 6.417 4.641 -11.994 666 1HG2 VAL 89 1HG2 VAL 89 8.730 4.132 -8.478 667 2HG2 VAL 89 2HG2 VAL 89 9.423 4.630 -10.021 668 3HG2 VAL 89 3HG2 VAL 89 8.423 5.754 -9.100 669 H THR 90 H THR 90 6.620 1.617 -9.477 670 HA THR 90 HA THR 90 6.222 0.731 -6.778 671 HB THR 90 HB THR 90 6.094 -0.594 -9.052 672 HG1 THR 90 HG1 THR 90 6.150 -2.416 -7.834 673 1HG2 THR 90 1HG2 THR 90 8.627 -0.223 -9.430 674 2HG2 THR 90 2HG2 THR 90 8.855 -1.454 -8.188 675 3HG2 THR 90 3HG2 THR 90 7.995 -1.851 -9.675 676 H SER 91 H SER 91 7.653 0.497 -5.139 677 HA SER 91 HA SER 91 10.400 1.523 -5.585 678 1HB SER 91 1HB SER 91 10.342 1.731 -3.031 679 2HB SER 91 2HB SER 91 9.274 2.809 -3.922 680 HG SER 91 HG SER 91 7.562 1.542 -3.397 681 H SER 92 H SER 92 12.039 0.136 -5.445 682 HA SER 92 HA SER 92 11.551 -2.669 -4.726 683 1HB SER 92 1HB SER 92 13.860 -3.024 -5.498 684 2HB SER 92 2HB SER 92 12.946 -2.104 -6.688 685 HG SER 92 HG SER 92 15.199 -1.417 -5.680 686 H PHE 93 H PHE 93 11.287 -2.716 -2.469 687 HA PHE 93 HA PHE 93 13.282 -1.416 -0.738 688 1HB PHE 93 1HB PHE 93 10.814 -3.053 -0.202 689 2HB PHE 93 2HB PHE 93 11.906 -2.569 1.088 690 HD1 PHE 93 HD1 PHE 93 12.704 0.146 0.346 691 HD2 PHE 93 HD2 PHE 93 8.875 -1.775 -0.002 692 HE1 PHE 93 HE1 PHE 93 11.585 2.356 0.440 693 HE2 PHE 93 HE2 PHE 93 7.760 0.435 0.098 694 HZ PHE 93 HZ PHE 93 9.115 2.502 0.317 695 H MET 94 H MET 94 12.110 -4.744 -1.286 696 HA MET 94 HA MET 94 14.769 -5.717 -0.315 697 1HB MET 94 1HB MET 94 11.992 -6.573 0.282 698 2HB MET 94 2HB MET 94 13.155 -7.873 0.026 699 1HG MET 94 1HG MET 94 14.558 -7.111 1.788 700 2HG MET 94 2HG MET 94 13.736 -5.553 1.871 701 1HE MET 94 1HE MET 94 12.030 -8.956 1.261 702 2HE MET 94 2HE MET 94 13.379 -9.406 2.301 703 3HE MET 94 3HE MET 94 11.728 -9.569 2.892 704 H SER 95 H SER 95 14.749 -8.276 -1.086 705 HA SER 95 HA SER 95 14.305 -8.199 -4.043 706 1HB SER 95 1HB SER 95 16.389 -9.208 -4.394 707 2HB SER 95 2HB SER 95 16.738 -8.181 -3.013 708 HG SER 95 HG SER 95 17.300 -10.583 -3.015 709 HA PRO 96 HA PRO 96 12.229 -12.119 -3.518 710 1HB PRO 96 1HB PRO 96 13.087 -13.602 -5.641 711 2HB PRO 96 2HB PRO 96 12.021 -12.199 -5.800 712 1HG PRO 96 1HG PRO 96 14.844 -12.487 -6.555 713 2HG PRO 96 2HG PRO 96 13.645 -11.312 -7.108 714 1HD PRO 96 1HD PRO 96 15.727 -10.918 -5.162 715 2HD PRO 96 2HD PRO 96 14.504 -9.747 -5.703 716 H SER 97 H SER 97 15.312 -12.006 -2.548 717 HA SER 97 HA SER 97 15.498 -14.956 -2.096 718 1HB SER 97 1HB SER 97 17.665 -12.895 -2.531 719 2HB SER 97 2HB SER 97 17.999 -14.460 -1.796 720 HG SER 97 HG SER 97 17.977 -13.989 -4.303 721 H GLU 98 H GLU 98 16.496 -11.807 -0.712 722 HA GLU 98 HA GLU 98 16.929 -12.819 1.931 723 1HB GLU 98 1HB GLU 98 16.783 -10.437 2.627 724 2HB GLU 98 2HB GLU 98 17.829 -10.655 1.226 725 1HG GLU 98 1HG GLU 98 15.495 -10.236 -0.051 726 2HG GLU 98 2HG GLU 98 15.173 -9.324 1.423 727 H SER 99 H SER 99 14.006 -12.231 0.198 728 HA SER 99 HA SER 99 12.216 -11.463 2.237 729 1HB SER 99 1HB SER 99 11.860 -11.862 -0.333 730 2HB SER 99 2HB SER 99 11.409 -13.488 0.174 731 HG SER 99 HG SER 99 10.288 -11.023 1.032 732 H ARG 100 H ARG 100 13.856 -14.507 1.806 733 HA ARG 100 HA ARG 100 11.916 -15.939 3.504 734 1HB ARG 100 1HB ARG 100 13.857 -17.760 3.387 735 2HB ARG 100 2HB ARG 100 12.729 -17.530 2.059 736 1HG ARG 100 1HG ARG 100 14.313 -16.476 0.719 737 2HG ARG 100 2HG ARG 100 15.276 -15.938 2.093 738 1HD ARG 100 1HD ARG 100 16.627 -17.689 1.573 739 2HD ARG 100 2HD ARG 100 15.395 -18.676 2.359 740 HE ARG 100 HE ARG 100 14.791 -18.183 -0.441 741 1HH1 ARG 100 1HH1 ARG 100 16.614 -20.182 1.774 742 2HH1 ARG 100 2HH1 ARG 100 16.688 -21.511 0.672 743 1HH2 ARG 100 1HH2 ARG 100 14.912 -19.927 -1.837 744 2HH2 ARG 100 2HH2 ARG 100 15.736 -21.370 -1.352 745 H SER 101 H SER 101 15.428 -16.220 4.006 746 HA SER 101 HA SER 101 15.358 -14.754 6.516 747 1HB SER 101 1HB SER 101 14.257 -16.843 7.223 748 2HB SER 101 2HB SER 101 15.588 -17.782 6.554 749 HG SER 101 HG SER 101 16.522 -17.481 8.403 750 H GLY 102 H GLY 102 16.894 -14.664 4.115 751 1HA GLY 102 1HA GLY 102 19.523 -15.824 4.856 752 2HA GLY 102 2HA GLY 102 19.123 -15.095 3.299 753 H SER 103 H SER 103 17.775 -12.820 4.901 754 HA SER 103 HA SER 103 20.039 -11.512 6.208 755 1HB SER 103 1HB SER 103 19.366 -10.968 3.397 756 2HB SER 103 2HB SER 103 19.548 -9.537 4.409 757 HG SER 103 HG SER 103 21.589 -10.314 5.023 758 H ASN 104 H ASN 104 17.404 -10.038 4.464 759 HA ASN 104 HA ASN 104 16.060 -9.390 7.033 760 1HB ASN 104 1HB ASN 104 15.567 -7.084 5.874 761 2HB ASN 104 2HB ASN 104 17.109 -7.330 6.686 762 1HD2 ASN 104 2HD2 ASN 104 15.749 -7.985 3.386 763 2HD2 ASN 104 1HD2 ASN 104 17.118 -7.417 2.558 764 HA PRO 105 HA PRO 105 12.963 -10.942 3.997 765 1HB PRO 105 1HB PRO 105 11.610 -12.480 5.794 766 2HB PRO 105 2HB PRO 105 13.045 -13.028 4.926 767 1HG PRO 105 1HG PRO 105 12.759 -12.228 7.757 768 2HG PRO 105 2HG PRO 105 13.888 -13.372 7.015 769 1HD PRO 105 1HD PRO 105 14.480 -10.732 7.802 770 2HD PRO 105 2HD PRO 105 15.485 -11.768 6.765 771 H ASN 106 H ASN 106 12.749 -9.359 7.078 772 HA ASN 106 HA ASN 106 10.095 -8.246 6.276 773 1HB ASN 106 1HB ASN 106 10.722 -9.822 8.618 774 2HB ASN 106 2HB ASN 106 10.222 -8.206 9.113 775 1HD2 ASN 106 2HD2 ASN 106 9.107 -9.979 6.199 776 2HD2 ASN 106 1HD2 ASN 106 7.479 -10.050 6.674 777 H ARG 107 H ARG 107 10.072 -6.072 6.238 778 HA ARG 107 HA ARG 107 11.685 -4.471 8.087 779 1HB ARG 107 1HB ARG 107 12.958 -5.211 5.774 780 2HB ARG 107 2HB ARG 107 12.207 -3.697 5.278 781 1HG ARG 107 1HG ARG 107 13.172 -2.650 7.379 782 2HG ARG 107 2HG ARG 107 14.092 -4.135 7.606 783 1HD ARG 107 1HD ARG 107 14.388 -3.212 4.880 784 2HD ARG 107 2HD ARG 107 14.797 -1.916 6.002 785 HE ARG 107 HE ARG 107 16.339 -4.326 5.566 786 1HH1 ARG 107 1HH1 ARG 107 15.408 -1.972 7.979 787 2HH1 ARG 107 2HH1 ARG 107 16.822 -2.244 8.936 788 1HH2 ARG 107 1HH2 ARG 107 18.155 -4.646 6.834 789 2HH2 ARG 107 2HH2 ARG 107 18.362 -3.741 8.296 790 H VAL 108 H VAL 108 11.286 -2.019 7.475 791 HA VAL 108 HA VAL 108 8.675 -1.678 6.126 792 HB VAL 108 HB VAL 108 7.613 -0.647 7.923 793 1HG1 VAL 108 1HG1 VAL 108 9.298 -2.894 9.047 794 2HG1 VAL 108 2HG1 VAL 108 7.864 -2.236 9.835 795 3HG1 VAL 108 3HG1 VAL 108 7.720 -3.045 8.273 796 1HG2 VAL 108 1HG2 VAL 108 10.372 -0.307 9.033 797 2HG2 VAL 108 2HG2 VAL 108 9.089 0.891 8.849 798 3HG2 VAL 108 3HG2 VAL 108 8.990 -0.320 10.128 799 H ARG 109 H ARG 109 8.538 0.239 4.940 800 HA ARG 109 HA ARG 109 10.692 2.247 5.395 801 1HB ARG 109 1HB ARG 109 9.786 1.132 2.725 802 2HB ARG 109 2HB ARG 109 10.922 2.465 2.933 803 1HG ARG 109 1HG ARG 109 11.721 0.176 4.540 804 2HG ARG 109 2HG ARG 109 11.536 -0.284 2.850 805 1HD ARG 109 1HD ARG 109 13.833 0.520 3.366 806 2HD ARG 109 2HD ARG 109 13.029 1.521 2.155 807 HE ARG 109 HE ARG 109 12.538 2.628 4.742 808 1HH1 ARG 109 1HH1 ARG 109 15.125 2.180 2.432 809 2HH1 ARG 109 2HH1 ARG 109 15.989 3.575 2.977 810 1HH2 ARG 109 1HH2 ARG 109 13.686 4.427 5.413 811 2HH2 ARG 109 2HH2 ARG 109 15.185 4.835 4.647 812 H MET 110 H MET 110 10.136 4.177 3.797 813 HA MET 110 HA MET 110 7.216 4.746 3.786 814 1HB MET 110 1HB MET 110 9.254 6.699 4.893 815 2HB MET 110 2HB MET 110 7.501 6.878 4.884 816 1HG MET 110 1HG MET 110 7.226 5.127 6.478 817 2HG MET 110 2HG MET 110 8.897 4.616 6.309 818 1HE MET 110 1HE MET 110 10.206 4.815 8.196 819 2HE MET 110 2HE MET 110 10.978 5.985 7.129 820 3HE MET 110 3HE MET 110 10.772 6.363 8.837 821 H PHE 111 H PHE 111 6.973 7.074 2.746 822 HA PHE 111 HA PHE 111 8.969 7.434 0.559 823 1HB PHE 111 1HB PHE 111 5.974 7.548 0.140 824 2HB PHE 111 2HB PHE 111 7.222 7.710 -1.089 825 HD1 PHE 111 HD1 PHE 111 6.041 5.313 1.543 826 HD2 PHE 111 HD2 PHE 111 7.872 5.837 -2.308 827 HE1 PHE 111 HE1 PHE 111 5.997 2.873 1.183 828 HE2 PHE 111 HE2 PHE 111 7.839 3.382 -2.657 829 HZ PHE 111 HZ PHE 111 6.896 1.897 -0.912 830 H GLY 112 H GLY 112 8.627 9.600 -0.509 831 1HA GLY 112 1HA GLY 112 7.283 11.624 1.168 832 2HA GLY 112 2HA GLY 112 8.994 11.820 0.853 833 HA PRO 113 HA PRO 113 6.866 13.880 -2.701 834 1HB PRO 113 1HB PRO 113 8.591 15.994 -2.788 835 2HB PRO 113 2HB PRO 113 7.160 15.945 -1.747 836 1HG PRO 113 1HG PRO 113 10.023 15.592 -1.039 837 2HG PRO 113 2HG PRO 113 8.696 16.269 -0.081 838 1HD PRO 113 1HD PRO 113 9.743 13.692 0.225 839 2HD PRO 113 2HD PRO 113 8.162 14.221 0.814 840 H ASP 114 H ASP 114 10.205 13.073 -2.086 841 HA ASP 114 HA ASP 114 11.425 13.480 -4.571 842 1HB ASP 114 1HB ASP 114 12.227 12.418 -2.254 843 2HB ASP 114 2HB ASP 114 11.976 10.921 -3.152 844 H LYS 115 H LYS 115 9.452 10.697 -3.532 845 HA LYS 115 HA LYS 115 9.550 9.665 -6.320 846 1HB LYS 115 1HB LYS 115 8.681 8.284 -3.781 847 2HB LYS 115 2HB LYS 115 8.827 7.540 -5.374 848 1HG LYS 115 1HG LYS 115 11.092 8.807 -3.802 849 2HG LYS 115 2HG LYS 115 10.819 7.087 -4.011 850 1HD LYS 115 1HD LYS 115 11.423 9.058 -6.230 851 2HD LYS 115 2HD LYS 115 12.535 7.853 -5.584 852 1HE LYS 115 1HE LYS 115 10.776 6.105 -6.221 853 2HE LYS 115 2HE LYS 115 9.993 7.385 -7.147 854 1HZ LYS 115 1HZ LYS 115 12.863 6.764 -7.487 855 2HZ LYS 115 2HZ LYS 115 11.666 5.921 -8.350 856 3HZ LYS 115 3HZ LYS 115 11.831 7.600 -8.541 857 H LEU 116 H LEU 116 7.612 11.749 -4.743 858 HA LEU 116 HA LEU 116 5.134 10.524 -5.880 859 1HB LEU 116 1HB LEU 116 4.193 10.731 -3.872 860 2HB LEU 116 2HB LEU 116 5.711 11.304 -3.241 861 HG LEU 116 HG LEU 116 4.698 13.617 -4.318 862 1HD1 LEU 116 1HD1 LEU 116 2.485 11.724 -3.699 863 2HD1 LEU 116 2HD1 LEU 116 2.290 13.383 -3.149 864 3HD1 LEU 116 3HD1 LEU 116 2.528 13.044 -4.863 865 1HD2 LEU 116 1HD2 LEU 116 5.469 12.725 -1.867 866 2HD2 LEU 116 2HD2 LEU 116 4.739 14.304 -2.139 867 3HD2 LEU 116 3HD2 LEU 116 3.744 12.956 -1.589 868 H VAL 117 H VAL 117 4.363 11.474 -7.586 869 HA VAL 117 HA VAL 117 5.532 13.609 -8.952 870 HB VAL 117 HB VAL 117 3.901 12.077 -9.957 871 1HG1 VAL 117 1HG1 VAL 117 2.467 11.922 -7.958 872 2HG1 VAL 117 2HG1 VAL 117 1.872 13.540 -8.282 873 3HG1 VAL 117 3HG1 VAL 117 1.540 12.237 -9.420 874 1HG2 VAL 117 1HG2 VAL 117 2.984 14.969 -10.014 875 2HG2 VAL 117 2HG2 VAL 117 4.178 14.239 -11.085 876 3HG2 VAL 117 3HG2 VAL 117 2.489 13.739 -11.175 877 H ARG 118 H ARG 118 5.445 15.827 -8.820 878 HA ARG 118 HA ARG 118 4.288 17.085 -6.490 879 1HB ARG 118 1HB ARG 118 5.883 17.907 -8.833 880 2HB ARG 118 2HB ARG 118 4.788 19.155 -8.239 881 1HG ARG 118 1HG ARG 118 5.815 19.251 -6.146 882 2HG ARG 118 2HG ARG 118 6.476 17.622 -6.286 883 1HD ARG 118 1HD ARG 118 7.901 18.534 -8.217 884 2HD ARG 118 2HD ARG 118 7.427 20.139 -7.661 885 HE ARG 118 HE ARG 118 9.348 18.392 -6.370 886 1HH1 ARG 118 1HH1 ARG 118 6.940 20.865 -5.804 887 2HH1 ARG 118 2HH1 ARG 118 7.671 21.378 -4.324 888 1HH2 ARG 118 1HH2 ARG 118 10.261 19.091 -4.451 889 2HH2 ARG 118 2HH2 ARG 118 9.529 20.387 -3.564 890 H ALA 119 H ALA 119 3.355 16.914 -9.916 891 HA ALA 119 HA ALA 119 1.172 18.711 -9.855 892 1HB ALA 119 1HB ALA 119 1.694 16.234 -11.505 893 2HB ALA 119 2HB ALA 119 0.287 17.266 -11.767 894 3HB ALA 119 3HB ALA 119 1.912 17.919 -11.978 895 H ALA 120 H ALA 120 1.293 15.253 -9.012 896 HA ALA 120 HA ALA 120 -1.589 15.313 -8.329 897 1HB ALA 120 1HB ALA 120 -0.096 13.337 -9.435 898 2HB ALA 120 2HB ALA 120 0.000 12.884 -7.733 899 3HB ALA 120 3HB ALA 120 -1.571 13.038 -8.518 900 H ALA 121 H ALA 121 1.599 15.051 -6.769 901 HA ALA 121 HA ALA 121 0.953 14.349 -4.161 902 1HB ALA 121 1HB ALA 121 2.798 16.590 -5.036 903 2HB ALA 121 2HB ALA 121 2.794 15.863 -3.432 904 3HB ALA 121 3HB ALA 121 3.255 14.905 -4.834 905 H GLU 122 H GLU 122 0.220 17.392 -5.767 906 HA GLU 122 HA GLU 122 -0.936 18.381 -3.210 907 1HB GLU 122 1HB GLU 122 -1.027 20.608 -4.411 908 2HB GLU 122 2HB GLU 122 0.599 19.977 -4.155 909 1HG GLU 122 1HG GLU 122 0.980 19.719 -6.378 910 2HG GLU 122 2HG GLU 122 -0.634 19.076 -6.675 911 H LYS 123 H LYS 123 -2.098 16.468 -5.388 912 HA LYS 123 HA LYS 123 -4.536 17.991 -6.091 913 1HB LYS 123 1HB LYS 123 -3.262 15.465 -7.030 914 2HB LYS 123 2HB LYS 123 -5.009 15.612 -7.190 915 1HG LYS 123 1HG LYS 123 -3.737 18.056 -8.047 916 2HG LYS 123 2HG LYS 123 -3.002 16.688 -8.869 917 1HD LYS 123 1HD LYS 123 -5.346 15.883 -9.416 918 2HD LYS 123 2HD LYS 123 -5.933 17.435 -8.818 919 1HE LYS 123 1HE LYS 123 -3.823 17.200 -10.975 920 2HE LYS 123 2HE LYS 123 -5.547 17.321 -11.330 921 1HZ LYS 123 1HZ LYS 123 -4.118 19.279 -9.626 922 2HZ LYS 123 2HZ LYS 123 -4.281 19.472 -11.307 923 3HZ LYS 123 3HZ LYS 123 -5.661 19.429 -10.322 924 H ARG 124 H ARG 124 -6.419 17.651 -4.962 925 HA ARG 124 HA ARG 124 -6.372 16.177 -2.506 926 1HB ARG 124 1HB ARG 124 -8.530 17.535 -4.096 927 2HB ARG 124 2HB ARG 124 -8.952 16.547 -2.694 928 1HG ARG 124 1HG ARG 124 -7.225 17.871 -1.383 929 2HG ARG 124 2HG ARG 124 -7.138 18.968 -2.760 930 1HD ARG 124 1HD ARG 124 -9.167 19.901 -2.307 931 2HD ARG 124 2HD ARG 124 -9.879 18.361 -1.825 932 HE ARG 124 HE ARG 124 -8.150 18.901 0.242 933 1HH1 ARG 124 1HH1 ARG 124 -10.668 20.752 -1.329 934 2HH1 ARG 124 2HH1 ARG 124 -11.020 21.666 0.095 935 1HH2 ARG 124 1HH2 ARG 124 -8.644 20.102 2.059 936 2HH2 ARG 124 2HH2 ARG 124 -9.891 21.303 1.994 937 H TRP 125 H TRP 125 -6.073 14.017 -2.618 938 HA TRP 125 HA TRP 125 -7.802 12.427 -4.467 939 1HB TRP 125 1HB TRP 125 -5.242 11.632 -3.031 940 2HB TRP 125 2HB TRP 125 -6.139 10.631 -4.168 941 HD1 TRP 125 HD1 TRP 125 -3.291 12.844 -4.079 942 HE1 TRP 125 HE1 TRP 125 -2.715 13.767 -6.417 943 HE3 TRP 125 HE3 TRP 125 -7.573 11.646 -6.580 944 HZ2 TRP 125 HZ2 TRP 125 -3.910 13.956 -9.009 945 HZ3 TRP 125 HZ3 TRP 125 -7.829 12.198 -8.979 946 HH2 TRP 125 HH2 TRP 125 -6.005 13.356 -10.198 947 H ASP 126 H ASP 126 -8.941 10.642 -3.585 948 HA ASP 126 HA ASP 126 -9.106 10.556 -0.616 949 1HB ASP 126 1HB ASP 126 -11.021 11.768 -1.222 950 2HB ASP 126 2HB ASP 126 -11.303 10.771 -2.615 951 H ARG 127 H ARG 127 -8.206 8.824 -3.243 952 HA ARG 127 HA ARG 127 -8.773 6.252 -1.889 953 1HB ARG 127 1HB ARG 127 -9.306 6.843 -4.819 954 2HB ARG 127 2HB ARG 127 -9.242 5.219 -4.139 955 1HG ARG 127 1HG ARG 127 -10.986 6.654 -2.451 956 2HG ARG 127 2HG ARG 127 -11.424 7.139 -4.089 957 1HD ARG 127 1HD ARG 127 -11.226 4.534 -4.552 958 2HD ARG 127 2HD ARG 127 -11.528 4.432 -2.822 959 HE ARG 127 HE ARG 127 -13.528 6.080 -3.565 960 1HH1 ARG 127 1HH1 ARG 127 -12.393 3.098 -5.009 961 2HH1 ARG 127 2HH1 ARG 127 -13.936 2.732 -5.692 962 1HH2 ARG 127 1HH2 ARG 127 -15.506 5.547 -4.452 963 2HH2 ARG 127 2HH2 ARG 127 -15.678 4.095 -5.381 964 H VAL 128 H VAL 128 -7.087 4.701 -2.331 965 HA VAL 128 HA VAL 128 -4.864 5.691 -4.029 966 HB VAL 128 HB VAL 128 -4.586 6.371 -1.591 967 1HG1 VAL 128 1HG1 VAL 128 -5.229 3.728 -1.078 968 2HG1 VAL 128 2HG1 VAL 128 -3.480 3.760 -0.858 969 3HG1 VAL 128 3HG1 VAL 128 -4.508 4.850 0.072 970 1HG2 VAL 128 1HG2 VAL 128 -2.511 4.642 -2.946 971 2HG2 VAL 128 2HG2 VAL 128 -2.720 6.386 -3.119 972 3HG2 VAL 128 3HG2 VAL 128 -2.178 5.711 -1.582 973 H LYS 129 H LYS 129 -3.722 4.084 -5.048 974 HA LYS 129 HA LYS 129 -4.741 1.307 -4.660 975 1HB LYS 129 1HB LYS 129 -4.877 2.542 -6.928 976 2HB LYS 129 2HB LYS 129 -3.139 2.281 -7.013 977 1HG LYS 129 1HG LYS 129 -3.408 0.128 -7.604 978 2HG LYS 129 2HG LYS 129 -4.479 -0.169 -6.235 979 1HD LYS 129 1HD LYS 129 -6.376 0.743 -7.495 980 2HD LYS 129 2HD LYS 129 -5.313 1.104 -8.855 981 1HE LYS 129 1HE LYS 129 -5.219 -1.694 -7.880 982 2HE LYS 129 2HE LYS 129 -6.732 -1.207 -8.643 983 1HZ LYS 129 1HZ LYS 129 -5.338 -0.311 -10.498 984 2HZ LYS 129 2HZ LYS 129 -4.005 -1.095 -9.796 985 3HZ LYS 129 3HZ LYS 129 -5.328 -2.002 -10.346 986 H ILE 130 H ILE 130 -3.396 0.034 -3.502 987 HA ILE 130 HA ILE 130 -0.460 0.589 -3.614 988 HB ILE 130 HB ILE 130 -2.108 -0.931 -1.551 989 1HG1 ILE 130 1HG1 ILE 130 -2.450 1.510 -1.478 990 2HG1 ILE 130 2HG1 ILE 130 -1.523 0.977 -0.078 991 1HG2 ILE 130 1HG2 ILE 130 0.860 -0.371 -1.792 992 2HG2 ILE 130 2HG2 ILE 130 0.101 -0.746 -0.245 993 3HG2 ILE 130 3HG2 ILE 130 0.060 -1.926 -1.556 994 1HD1 ILE 130 1HD1 ILE 130 0.579 1.600 -1.324 995 2HD1 ILE 130 2HD1 ILE 130 -0.438 2.300 -2.582 996 3HD1 ILE 130 3HD1 ILE 130 -0.463 2.972 -0.952 997 H VAL 131 H VAL 131 0.508 -0.749 -5.116 998 HA VAL 131 HA VAL 131 -0.451 -3.562 -5.243 999 HB VAL 131 HB VAL 131 0.815 -1.923 -7.449 1000 1HG1 VAL 131 1HG1 VAL 131 -0.292 -4.714 -7.237 1001 2HG1 VAL 131 2HG1 VAL 131 -0.157 -3.886 -8.788 1002 3HG1 VAL 131 3HG1 VAL 131 1.290 -4.206 -7.830 1003 1HG2 VAL 131 1HG2 VAL 131 -2.013 -2.440 -6.622 1004 2HG2 VAL 131 2HG2 VAL 131 -1.304 -0.991 -7.332 1005 3HG2 VAL 131 3HG2 VAL 131 -1.648 -2.391 -8.347 1006 H CYS 132 H CYS 132 1.002 -4.966 -4.473 1007 HA CYS 132 HA CYS 132 3.862 -4.174 -4.321 1008 1HB CYS 132 1HB CYS 132 2.837 -5.051 -2.254 1009 2HB CYS 132 2HB CYS 132 2.381 -6.528 -3.094 1010 HG CYS 132 HG CYS 132 4.603 -7.298 -2.254 1011 H SER 133 H SER 133 5.495 -5.518 -5.302 1012 HA SER 133 HA SER 133 4.526 -7.660 -7.123 1013 1HB SER 133 1HB SER 133 5.180 -5.039 -7.972 1014 2HB SER 133 2HB SER 133 6.520 -6.060 -8.478 1015 HG SER 133 HG SER 133 4.504 -5.853 -9.856 1016 H GLN 134 H GLN 134 5.829 -9.358 -7.138 1017 HA GLN 134 HA GLN 134 8.411 -9.859 -7.474 1018 1HB GLN 134 1HB GLN 134 9.099 -8.256 -5.682 1019 2HB GLN 134 2HB GLN 134 8.250 -9.245 -4.502 1020 1HG GLN 134 1HG GLN 134 10.330 -10.192 -4.282 1021 2HG GLN 134 2HG GLN 134 9.791 -11.141 -5.665 1022 1HE2 GLN 134 2HE2 GLN 134 10.342 -10.086 -7.890 1023 2HE2 GLN 134 1HE2 GLN 134 11.831 -9.281 -8.004 1024 HA PRO 135 HA PRO 135 6.410 -13.710 -6.237 1025 1HB PRO 135 1HB PRO 135 8.122 -15.382 -7.548 1026 2HB PRO 135 2HB PRO 135 6.861 -14.454 -8.372 1027 1HG PRO 135 1HG PRO 135 9.776 -14.079 -8.405 1028 2HG PRO 135 2HG PRO 135 8.555 -13.529 -9.561 1029 1HD PRO 135 1HD PRO 135 9.850 -11.982 -7.525 1030 2HD PRO 135 2HD PRO 135 8.571 -11.455 -8.640 1031 H TYR 136 H TYR 136 6.872 -13.867 -3.997 1032 HA TYR 136 HA TYR 136 9.471 -15.176 -3.337 1033 1HB TYR 136 1HB TYR 136 9.238 -13.873 -1.086 1034 2HB TYR 136 2HB TYR 136 9.900 -13.050 -2.494 1035 HD1 TYR 136 HD1 TYR 136 6.501 -13.747 -0.969 1036 HD2 TYR 136 HD2 TYR 136 9.077 -10.941 -2.970 1037 HE1 TYR 136 HE1 TYR 136 4.772 -11.993 -0.768 1038 HE2 TYR 136 HE2 TYR 136 7.322 -9.203 -2.779 1039 HH TYR 136 HH TYR 136 4.142 -9.886 -1.995 1040 H SER 137 H SER 137 7.019 -16.540 -3.760 1041 HA SER 137 HA SER 137 6.899 -18.104 -1.365 1042 1HB SER 137 1HB SER 137 5.225 -15.794 -1.366 1043 2HB SER 137 2HB SER 137 4.184 -17.202 -1.525 1044 HG SER 137 HG SER 137 4.670 -17.754 0.443 1045 H LYS 138 H LYS 138 4.458 -19.316 -1.599 1046 HA LYS 138 HA LYS 138 3.554 -19.825 -4.261 1047 1HB LYS 138 1HB LYS 138 6.002 -21.200 -3.452 1048 2HB LYS 138 2HB LYS 138 4.720 -22.347 -3.839 1049 1HG LYS 138 1HG LYS 138 5.057 -20.057 -5.709 1050 2HG LYS 138 2HG LYS 138 6.329 -21.280 -5.723 1051 1HD LYS 138 1HD LYS 138 4.949 -22.906 -6.562 1052 2HD LYS 138 2HD LYS 138 3.535 -22.293 -5.703 1053 1HE LYS 138 1HE LYS 138 3.742 -20.260 -7.338 1054 2HE LYS 138 2HE LYS 138 4.701 -21.371 -8.316 1055 1HZ LYS 138 1HZ LYS 138 2.026 -22.085 -7.271 1056 2HZ LYS 138 2HZ LYS 138 2.239 -21.319 -8.773 1057 3HZ LYS 138 3HZ LYS 138 2.910 -22.854 -8.497 1058 H ASP 139 H ASP 139 4.174 -21.218 -1.057 1059 HA ASP 139 HA ASP 139 1.500 -22.509 -1.148 1060 1HB ASP 139 1HB ASP 139 2.353 -23.774 0.855 1061 2HB ASP 139 2HB ASP 139 3.256 -24.091 -0.622 1062 H SER 140 H SER 140 3.557 -20.339 0.640 1063 HA SER 140 HA SER 140 1.304 -19.644 2.441 1064 1HB SER 140 1HB SER 140 3.361 -18.351 3.534 1065 2HB SER 140 2HB SER 140 3.075 -20.055 3.860 1066 HG SER 140 HG SER 140 5.097 -18.825 2.487 1067 HA PRO 141 HA PRO 141 1.147 -15.754 0.189 1068 1HB PRO 141 1HB PRO 141 -0.704 -14.518 1.766 1069 2HB PRO 141 2HB PRO 141 -1.105 -15.799 0.614 1070 1HG PRO 141 1HG PRO 141 -1.077 -15.879 3.541 1071 2HG PRO 141 2HG PRO 141 -1.887 -16.950 2.392 1072 1HD PRO 141 1HD PRO 141 0.563 -17.433 3.826 1073 2HD PRO 141 2HD PRO 141 -0.257 -18.499 2.664 1074 H PHE 142 H PHE 142 0.993 -13.274 0.989 1075 HA PHE 142 HA PHE 142 2.215 -12.426 3.405 1076 1HB PHE 142 1HB PHE 142 4.060 -13.521 1.448 1077 2HB PHE 142 2HB PHE 142 4.394 -11.809 1.695 1078 HD1 PHE 142 HD1 PHE 142 4.389 -11.016 4.229 1079 HD2 PHE 142 HD2 PHE 142 4.953 -15.069 2.937 1080 HE1 PHE 142 HE1 PHE 142 5.485 -11.552 6.388 1081 HE2 PHE 142 HE2 PHE 142 6.050 -15.607 5.095 1082 HZ PHE 142 HZ PHE 142 6.315 -13.846 6.822 1083 H GLY 143 H GLY 143 3.642 -10.138 2.392 1084 1HA GLY 143 1HA GLY 143 2.833 -8.707 0.262 1085 2HA GLY 143 2HA GLY 143 1.361 -8.674 1.227 1086 H LEU 144 H LEU 144 1.165 -7.018 2.608 1087 HA LEU 144 HA LEU 144 3.647 -5.520 3.339 1088 1HB LEU 144 1HB LEU 144 0.971 -4.662 2.439 1089 2HB LEU 144 2HB LEU 144 1.592 -3.753 3.812 1090 HG LEU 144 HG LEU 144 3.695 -3.346 2.559 1091 1HD1 LEU 144 1HD1 LEU 144 2.262 -5.056 0.559 1092 2HD1 LEU 144 2HD1 LEU 144 3.313 -3.771 -0.035 1093 3HD1 LEU 144 3HD1 LEU 144 3.970 -5.042 0.997 1094 1HD2 LEU 144 1HD2 LEU 144 1.036 -2.497 1.428 1095 2HD2 LEU 144 2HD2 LEU 144 2.177 -1.557 2.389 1096 3HD2 LEU 144 3HD2 LEU 144 2.537 -1.924 0.702 1097 H SER 145 H SER 145 3.664 -4.486 5.455 1098 HA SER 145 HA SER 145 2.327 -6.163 7.499 1099 1HB SER 145 1HB SER 145 4.779 -4.465 7.423 1100 2HB SER 145 2HB SER 145 3.970 -4.679 8.971 1101 HG SER 145 HG SER 145 5.618 -6.333 7.825 1102 H PHE 146 H PHE 146 2.444 -2.871 6.286 1103 HA PHE 146 HA PHE 146 -0.041 -2.152 7.523 1104 1HB PHE 146 1HB PHE 146 0.722 -0.576 9.233 1105 2HB PHE 146 2HB PHE 146 1.387 -2.171 9.583 1106 HD1 PHE 146 HD1 PHE 146 2.146 1.192 8.239 1107 HD2 PHE 146 HD2 PHE 146 3.756 -2.608 9.421 1108 HE1 PHE 146 HE1 PHE 146 4.432 2.125 8.083 1109 HE2 PHE 146 HE2 PHE 146 6.043 -1.686 9.254 1110 HZ PHE 146 HZ PHE 146 6.405 0.665 8.570 1111 H VAL 147 H VAL 147 -0.370 0.337 7.343 1112 HA VAL 147 HA VAL 147 1.397 1.637 5.370 1113 HB VAL 147 HB VAL 147 -0.395 2.066 3.762 1114 1HG1 VAL 147 1HG1 VAL 147 0.999 -0.069 3.691 1115 2HG1 VAL 147 2HG1 VAL 147 -0.394 -0.892 4.391 1116 3HG1 VAL 147 3HG1 VAL 147 -0.528 -0.122 2.810 1117 1HG2 VAL 147 1HG2 VAL 147 -2.038 0.752 5.891 1118 2HG2 VAL 147 2HG2 VAL 147 -2.449 2.103 4.833 1119 3HG2 VAL 147 3HG2 VAL 147 -2.492 0.453 4.214 1120 H ARG 148 H ARG 148 1.385 3.857 5.640 1121 HA ARG 148 HA ARG 148 -0.822 5.121 7.166 1122 1HB ARG 148 1HB ARG 148 1.969 5.876 7.969 1123 2HB ARG 148 2HB ARG 148 0.491 5.943 8.900 1124 1HG ARG 148 1HG ARG 148 1.654 3.269 8.138 1125 2HG ARG 148 2HG ARG 148 2.265 4.153 9.531 1126 1HD ARG 148 1HD ARG 148 -0.690 3.684 9.159 1127 2HD ARG 148 2HD ARG 148 0.341 2.489 9.950 1128 HE ARG 148 HE ARG 148 -0.501 5.035 11.076 1129 1HH1 ARG 148 1HH1 ARG 148 2.009 2.600 11.071 1130 2HH1 ARG 148 2HH1 ARG 148 2.558 3.019 12.656 1131 1HH2 ARG 148 1HH2 ARG 148 0.242 5.545 13.124 1132 2HH2 ARG 148 2HH2 ARG 148 1.570 4.668 13.808 1133 H PHE 149 H PHE 149 -1.438 6.648 5.671 1134 HA PHE 149 HA PHE 149 0.562 7.968 3.950 1135 1HB PHE 149 1HB PHE 149 -2.449 8.254 4.175 1136 2HB PHE 149 2HB PHE 149 -1.459 9.149 3.024 1137 HD1 PHE 149 HD1 PHE 149 0.306 7.540 1.724 1138 HD2 PHE 149 HD2 PHE 149 -3.481 6.335 3.348 1139 HE1 PHE 149 HE1 PHE 149 0.243 5.619 0.156 1140 HE2 PHE 149 HE2 PHE 149 -3.545 4.421 1.770 1141 HZ PHE 149 HZ PHE 149 -1.682 4.063 0.180 1142 H HIS 150 H HIS 150 0.813 10.318 3.921 1143 HA HIS 150 HA HIS 150 -0.417 11.873 6.081 1144 1HB HIS 150 1HB HIS 150 2.182 12.629 6.588 1145 2HB HIS 150 2HB HIS 150 1.236 11.545 7.596 1146 HD1 HIS 150 HD1 HIS 150 4.358 11.722 5.818 1147 HD2 HIS 150 HD2 HIS 150 1.679 8.668 6.739 1148 HE1 HIS 150 HE1 HIS 150 5.622 9.547 5.525 1149 H SER 151 H SER 151 -0.829 13.831 5.277 1150 HA SER 151 HA SER 151 0.424 14.647 2.742 1151 1HB SER 151 1HB SER 151 -2.116 14.948 3.787 1152 2HB SER 151 2HB SER 151 -1.426 16.554 3.995 1153 HG SER 151 HG SER 151 -2.461 15.957 1.886 Start of MODEL 22 1 H MET 1 H MET 1 -5.735 17.753 8.970 2 HA MET 1 HA MET 1 -4.915 18.081 6.559 3 1HB MET 1 1HB MET 1 -4.600 19.643 9.027 4 2HB MET 1 2HB MET 1 -3.476 20.125 7.757 5 1HG MET 1 1HG MET 1 -5.430 20.250 6.176 6 2HG MET 1 2HG MET 1 -6.495 19.963 7.551 7 1HE MET 1 1HE MET 1 -7.743 21.592 7.098 8 2HE MET 1 2HE MET 1 -7.662 22.780 8.398 9 3HE MET 1 3HE MET 1 -7.362 23.282 6.736 10 HA PRO 2 HA PRO 2 -0.181 17.780 7.276 11 1HB PRO 2 1HB PRO 2 0.750 17.125 9.755 12 2HB PRO 2 2HB PRO 2 0.405 18.789 9.258 13 1HG PRO 2 1HG PRO 2 -1.089 17.032 11.097 14 2HG PRO 2 2HG PRO 2 -1.029 18.798 11.022 15 1HD PRO 2 1HD PRO 2 -3.109 17.124 10.048 16 2HD PRO 2 2HD PRO 2 -2.936 18.873 9.793 17 H GLU 3 H GLU 3 -2.165 15.468 9.043 18 HA GLU 3 HA GLU 3 -0.460 13.256 7.962 19 1HB GLU 3 1HB GLU 3 -1.386 13.790 10.657 20 2HB GLU 3 2HB GLU 3 -2.034 12.250 10.097 21 1HG GLU 3 1HG GLU 3 0.833 12.765 9.499 22 2HG GLU 3 2HG GLU 3 0.424 12.487 11.192 23 H ILE 4 H ILE 4 -1.773 11.197 7.678 24 HA ILE 4 HA ILE 4 -4.616 11.704 6.981 25 HB ILE 4 HB ILE 4 -2.501 10.636 5.079 26 1HG1 ILE 4 1HG1 ILE 4 -4.337 13.047 4.913 27 2HG1 ILE 4 2HG1 ILE 4 -2.627 13.109 5.334 28 1HG2 ILE 4 1HG2 ILE 4 -5.516 10.744 4.844 29 2HG2 ILE 4 2HG2 ILE 4 -4.447 10.557 3.454 30 3HG2 ILE 4 3HG2 ILE 4 -4.478 9.324 4.714 31 1HD1 ILE 4 1HD1 ILE 4 -3.640 11.919 2.743 32 2HD1 ILE 4 2HD1 ILE 4 -3.151 13.605 2.902 33 3HD1 ILE 4 3HD1 ILE 4 -1.975 12.317 3.163 34 H ARG 5 H ARG 5 -5.891 9.790 7.087 35 HA ARG 5 HA ARG 5 -4.445 7.353 8.048 36 1HB ARG 5 1HB ARG 5 -6.418 8.969 9.409 37 2HB ARG 5 2HB ARG 5 -7.068 7.352 9.148 38 1HG ARG 5 1HG ARG 5 -5.923 7.157 11.199 39 2HG ARG 5 2HG ARG 5 -4.771 6.518 10.027 40 1HD ARG 5 1HD ARG 5 -3.346 8.299 10.253 41 2HD ARG 5 2HD ARG 5 -4.658 9.447 10.514 42 HE ARG 5 HE ARG 5 -3.232 7.977 12.585 43 1HH1 ARG 5 1HH1 ARG 5 -6.247 9.526 11.725 44 2HH1 ARG 5 2HH1 ARG 5 -6.692 9.801 13.372 45 1HH2 ARG 5 1HH2 ARG 5 -3.847 8.351 14.702 46 2HH2 ARG 5 2HH2 ARG 5 -5.350 9.143 15.042 47 H LEU 6 H LEU 6 -5.837 5.346 7.804 48 HA LEU 6 HA LEU 6 -7.113 5.382 5.140 49 1HB LEU 6 1HB LEU 6 -5.291 3.681 6.222 50 2HB LEU 6 2HB LEU 6 -6.778 2.842 6.655 51 HG LEU 6 HG LEU 6 -5.959 2.059 4.475 52 1HD1 LEU 6 1HD1 LEU 6 -8.510 2.748 5.082 53 2HD1 LEU 6 2HD1 LEU 6 -8.260 3.711 3.628 54 3HD1 LEU 6 3HD1 LEU 6 -8.047 1.964 3.572 55 1HD2 LEU 6 1HD2 LEU 6 -5.122 4.658 4.109 56 2HD2 LEU 6 2HD2 LEU 6 -5.216 3.448 2.833 57 3HD2 LEU 6 3HD2 LEU 6 -6.541 4.587 3.066 58 H ARG 7 H ARG 7 -9.293 4.967 4.870 59 HA ARG 7 HA ARG 7 -10.947 4.809 7.322 60 1HB ARG 7 1HB ARG 7 -11.476 6.448 5.476 61 2HB ARG 7 2HB ARG 7 -11.852 5.069 4.443 62 1HG ARG 7 1HG ARG 7 -13.555 4.323 6.090 63 2HG ARG 7 2HG ARG 7 -13.212 5.752 7.065 64 1HD ARG 7 1HD ARG 7 -13.894 7.210 5.219 65 2HD ARG 7 2HD ARG 7 -14.175 5.804 4.190 66 HE ARG 7 HE ARG 7 -15.779 5.330 6.393 67 1HH1 ARG 7 1HH1 ARG 7 -15.415 7.988 4.149 68 2HH1 ARG 7 2HH1 ARG 7 -17.067 8.472 4.299 69 1HH2 ARG 7 1HH2 ARG 7 -17.909 5.992 6.557 70 2HH2 ARG 7 2HH2 ARG 7 -18.466 7.356 5.647 71 H HIS 8 H HIS 8 -10.812 3.175 4.164 72 HA HIS 8 HA HIS 8 -11.076 0.551 5.399 73 1HB HIS 8 1HB HIS 8 -13.207 -0.001 4.207 74 2HB HIS 8 2HB HIS 8 -13.419 1.205 5.473 75 HD1 HIS 8 HD1 HIS 8 -14.732 3.188 4.750 76 HD2 HIS 8 HD2 HIS 8 -12.723 1.446 1.540 77 HE1 HIS 8 HE1 HIS 8 -15.373 4.522 2.695 78 H VAL 9 H VAL 9 -11.019 -1.168 3.680 79 HA VAL 9 HA VAL 9 -9.225 -0.354 1.530 80 HB VAL 9 HB VAL 9 -8.867 -2.480 2.709 81 1HG1 VAL 9 1HG1 VAL 9 -11.617 -2.732 2.613 82 2HG1 VAL 9 2HG1 VAL 9 -11.082 -3.919 1.424 83 3HG1 VAL 9 3HG1 VAL 9 -10.493 -4.007 3.084 84 1HG2 VAL 9 1HG2 VAL 9 -8.285 -2.173 0.238 85 2HG2 VAL 9 2HG2 VAL 9 -8.427 -3.841 0.792 86 3HG2 VAL 9 3HG2 VAL 9 -9.741 -3.102 -0.122 87 H VAL 10 H VAL 10 -10.488 0.968 0.163 88 HA VAL 10 HA VAL 10 -13.091 0.519 -0.763 89 HB VAL 10 HB VAL 10 -12.066 2.609 -1.319 90 1HG1 VAL 10 1HG1 VAL 10 -9.712 1.486 -1.490 91 2HG1 VAL 10 2HG1 VAL 10 -10.109 1.312 -3.195 92 3HG1 VAL 10 3HG1 VAL 10 -10.049 2.912 -2.462 93 1HG2 VAL 10 1HG2 VAL 10 -13.661 1.780 -3.025 94 2HG2 VAL 10 2HG2 VAL 10 -12.395 2.761 -3.762 95 3HG2 VAL 10 3HG2 VAL 10 -12.331 1.007 -3.888 96 H SER 11 H SER 11 -10.107 -0.548 -2.482 97 HA SER 11 HA SER 11 -11.815 -2.640 -3.741 98 1HB SER 11 1HB SER 11 -10.527 -0.613 -5.075 99 2HB SER 11 2HB SER 11 -9.350 -1.918 -5.185 100 HG SER 11 HG SER 11 -10.653 -2.374 -6.827 101 H CYS 12 H CYS 12 -10.742 -4.713 -4.089 102 HA CYS 12 HA CYS 12 -8.140 -5.043 -2.678 103 1HB CYS 12 1HB CYS 12 -9.016 -7.133 -1.622 104 2HB CYS 12 2HB CYS 12 -9.828 -5.679 -1.045 105 HG CYS 12 HG CYS 12 -11.965 -6.459 -2.048 106 H SER 13 H SER 13 -6.760 -6.002 -4.052 107 HA SER 13 HA SER 13 -7.855 -7.947 -6.042 108 1HB SER 13 1HB SER 13 -5.974 -5.654 -6.371 109 2HB SER 13 2HB SER 13 -5.658 -7.108 -7.316 110 HG SER 13 HG SER 13 -7.559 -6.875 -8.329 111 H SER 14 H SER 14 -6.970 -8.698 -3.505 112 HA SER 14 HA SER 14 -5.536 -10.949 -3.678 113 1HB SER 14 1HB SER 14 -3.658 -8.684 -4.022 114 2HB SER 14 2HB SER 14 -3.160 -9.928 -2.883 115 HG SER 14 HG SER 14 -3.847 -10.188 -5.617 116 H GLN 15 H GLN 15 -7.163 -10.734 -1.886 117 HA GLN 15 HA GLN 15 -5.752 -10.081 0.650 118 1HB GLN 15 1HB GLN 15 -7.071 -8.279 0.956 119 2HB GLN 15 2HB GLN 15 -7.973 -8.638 -0.498 120 1HG GLN 15 1HG GLN 15 -8.650 -10.139 2.022 121 2HG GLN 15 2HG GLN 15 -9.186 -8.476 1.836 122 1HE2 GLN 15 2HE2 GLN 15 -8.873 -10.640 -0.977 123 2HE2 GLN 15 1HE2 GLN 15 -10.539 -10.745 -1.281 124 H ASP 16 H ASP 16 -6.177 -11.518 2.329 125 HA ASP 16 HA ASP 16 -7.670 -13.968 1.583 126 1HB ASP 16 1HB ASP 16 -5.387 -13.342 3.268 127 2HB ASP 16 2HB ASP 16 -6.588 -14.252 4.181 128 H SER 17 H SER 17 -8.489 -14.848 4.098 129 HA SER 17 HA SER 17 -10.658 -12.905 4.681 130 1HB SER 17 1HB SER 17 -10.956 -15.478 4.063 131 2HB SER 17 2HB SER 17 -10.652 -15.687 5.785 132 HG SER 17 HG SER 17 -12.497 -14.726 6.235 133 H THR 18 H THR 18 -8.546 -15.202 6.454 134 HA THR 18 HA THR 18 -9.036 -14.063 9.035 135 HB THR 18 HB THR 18 -6.567 -15.133 9.323 136 HG1 THR 18 HG1 THR 18 -6.174 -15.642 7.244 137 1HG2 THR 18 1HG2 THR 18 -8.980 -15.816 10.147 138 2HG2 THR 18 2HG2 THR 18 -8.830 -17.042 8.888 139 3HG2 THR 18 3HG2 THR 18 -7.659 -16.981 10.204 140 H HIS 19 H HIS 19 -6.516 -13.498 6.599 141 HA HIS 19 HA HIS 19 -5.780 -10.996 8.069 142 1HB HIS 19 1HB HIS 19 -3.993 -12.741 6.343 143 2HB HIS 19 2HB HIS 19 -3.507 -11.253 7.154 144 HD1 HIS 19 HD1 HIS 19 -3.072 -11.353 9.682 145 HD2 HIS 19 HD2 HIS 19 -4.450 -14.964 8.119 146 HE1 HIS 19 HE1 HIS 19 -2.777 -13.083 11.508 147 H CYS 20 H CYS 20 -7.501 -9.995 6.750 148 HA CYS 20 HA CYS 20 -7.015 -9.891 3.839 149 1HB CYS 20 1HB CYS 20 -9.113 -8.554 3.780 150 2HB CYS 20 2HB CYS 20 -9.335 -10.118 4.552 151 HG CYS 20 HG CYS 20 -9.843 -8.987 6.714 152 H ALA 21 H ALA 21 -7.177 -7.673 2.816 153 HA ALA 21 HA ALA 21 -5.027 -6.033 3.703 154 1HB ALA 21 1HB ALA 21 -7.056 -5.982 1.564 155 2HB ALA 21 2HB ALA 21 -6.476 -4.390 2.054 156 3HB ALA 21 3HB ALA 21 -5.335 -5.610 1.491 157 H GLU 22 H GLU 22 -8.428 -6.025 4.520 158 HA GLU 22 HA GLU 22 -8.656 -3.315 5.405 159 1HB GLU 22 1HB GLU 22 -10.372 -5.457 5.253 160 2HB GLU 22 2HB GLU 22 -10.140 -5.313 6.994 161 1HG GLU 22 1HG GLU 22 -10.660 -2.858 6.793 162 2HG GLU 22 2HG GLU 22 -11.063 -3.134 5.098 163 H ASN 23 H ASN 23 -6.913 -6.002 6.740 164 HA ASN 23 HA ASN 23 -6.926 -5.215 9.508 165 1HB ASN 23 1HB ASN 23 -5.045 -6.832 7.808 166 2HB ASN 23 2HB ASN 23 -4.680 -6.487 9.498 167 1HD2 ASN 23 2HD2 ASN 23 -5.940 -8.865 7.649 168 2HD2 ASN 23 1HD2 ASN 23 -7.073 -9.530 8.726 169 H LEU 24 H LEU 24 -5.464 -3.866 6.722 170 HA LEU 24 HA LEU 24 -3.161 -2.630 7.862 171 1HB LEU 24 1HB LEU 24 -4.869 -1.648 5.554 172 2HB LEU 24 2HB LEU 24 -3.184 -1.233 5.871 173 HG LEU 24 HG LEU 24 -3.964 -4.123 5.551 174 1HD1 LEU 24 1HD1 LEU 24 -4.779 -2.523 3.618 175 2HD1 LEU 24 2HD1 LEU 24 -3.070 -2.525 3.182 176 3HD1 LEU 24 3HD1 LEU 24 -3.968 -4.042 3.235 177 1HD2 LEU 24 1HD2 LEU 24 -1.522 -2.469 5.620 178 2HD2 LEU 24 2HD2 LEU 24 -1.745 -4.169 6.030 179 3HD2 LEU 24 3HD2 LEU 24 -1.542 -3.688 4.347 180 H LEU 25 H LEU 25 -6.585 -1.928 7.958 181 HA LEU 25 HA LEU 25 -6.550 0.826 8.598 182 1HB LEU 25 1HB LEU 25 -8.363 -1.497 9.148 183 2HB LEU 25 2HB LEU 25 -8.636 -0.006 10.033 184 HG LEU 25 HG LEU 25 -9.983 -0.117 7.953 185 1HD1 LEU 25 1HD1 LEU 25 -8.082 2.003 8.638 186 2HD1 LEU 25 2HD1 LEU 25 -8.588 2.056 6.949 187 3HD1 LEU 25 3HD1 LEU 25 -9.789 2.110 8.235 188 1HD2 LEU 25 1HD2 LEU 25 -8.148 -1.441 6.723 189 2HD2 LEU 25 2HD2 LEU 25 -8.987 -0.199 5.795 190 3HD2 LEU 25 3HD2 LEU 25 -7.376 0.120 6.438 191 H LYS 26 H LYS 26 -5.544 -1.982 10.404 192 HA LYS 26 HA LYS 26 -5.173 -0.254 12.824 193 1HB LYS 26 1HB LYS 26 -5.336 -3.284 12.810 194 2HB LYS 26 2HB LYS 26 -5.379 -2.211 14.206 195 1HG LYS 26 1HG LYS 26 -7.638 -2.456 14.013 196 2HG LYS 26 2HG LYS 26 -7.468 -1.222 12.766 197 1HD LYS 26 1HD LYS 26 -7.754 -2.720 11.046 198 2HD LYS 26 2HD LYS 26 -7.007 -4.046 11.938 199 1HE LYS 26 1HE LYS 26 -9.189 -3.662 13.478 200 2HE LYS 26 2HE LYS 26 -9.836 -3.131 11.925 201 1HZ LYS 26 1HZ LYS 26 -8.763 -5.283 11.055 202 2HZ LYS 26 2HZ LYS 26 -8.770 -5.770 12.683 203 3HZ LYS 26 3HZ LYS 26 -10.229 -5.388 11.902 204 H ALA 27 H ALA 27 -3.219 0.274 11.316 205 HA ALA 27 HA ALA 27 -1.110 -1.512 10.796 206 1HB ALA 27 1HB ALA 27 -1.115 1.434 11.463 207 2HB ALA 27 2HB ALA 27 0.365 0.572 11.041 208 3HB ALA 27 3HB ALA 27 -0.958 0.677 9.879 209 H ASP 28 H ASP 28 -2.123 -0.157 13.852 210 HA ASP 28 HA ASP 28 0.259 -1.423 15.149 211 1HB ASP 28 1HB ASP 28 -1.349 1.015 15.954 212 2HB ASP 28 2HB ASP 28 -0.206 0.215 17.033 213 H THR 29 H THR 29 -1.014 -3.437 15.173 214 HA THR 29 HA THR 29 -2.591 -3.661 17.628 215 HB THR 29 HB THR 29 -4.455 -4.869 16.215 216 HG1 THR 29 HG1 THR 29 -4.247 -4.588 14.166 217 1HG2 THR 29 1HG2 THR 29 -4.456 -2.624 17.577 218 2HG2 THR 29 2HG2 THR 29 -4.469 -1.877 15.979 219 3HG2 THR 29 3HG2 THR 29 -5.775 -2.962 16.456 220 H TYR 30 H TYR 30 -2.793 -5.808 14.798 221 HA TYR 30 HA TYR 30 -0.631 -7.532 15.507 222 1HB TYR 30 1HB TYR 30 -1.928 -9.400 16.528 223 2HB TYR 30 2HB TYR 30 -1.920 -7.957 17.543 224 HD1 TYR 30 HD1 TYR 30 -3.921 -6.509 17.700 225 HD2 TYR 30 HD2 TYR 30 -3.958 -10.176 15.461 226 HE1 TYR 30 HE1 TYR 30 -6.401 -6.457 17.654 227 HE2 TYR 30 HE2 TYR 30 -6.436 -10.123 15.415 228 HH TYR 30 HH TYR 30 -8.279 -8.757 17.261 229 H ARG 31 H ARG 31 -1.950 -6.472 13.138 230 HA ARG 31 HA ARG 31 -2.149 -8.969 11.616 231 1HB ARG 31 1HB ARG 31 -4.531 -7.171 12.068 232 2HB ARG 31 2HB ARG 31 -4.393 -8.153 10.609 233 1HG ARG 31 1HG ARG 31 -3.827 -10.055 12.402 234 2HG ARG 31 2HG ARG 31 -4.798 -9.010 13.439 235 1HD ARG 31 1HD ARG 31 -5.834 -9.640 10.703 236 2HD ARG 31 2HD ARG 31 -5.942 -10.888 11.944 237 HE ARG 31 HE ARG 31 -6.919 -8.460 13.057 238 1HH1 ARG 31 1HH1 ARG 31 -7.760 -10.803 10.599 239 2HH1 ARG 31 2HH1 ARG 31 -9.456 -10.506 10.755 240 1HH2 ARG 31 1HH2 ARG 31 -9.121 -8.106 13.223 241 2HH2 ARG 31 2HH2 ARG 31 -10.220 -8.996 12.224 242 H LYS 32 H LYS 32 -2.446 -8.429 9.222 243 HA LYS 32 HA LYS 32 -1.917 -5.682 8.401 244 1HB LYS 32 1HB LYS 32 0.289 -6.087 7.457 245 2HB LYS 32 2HB LYS 32 0.313 -6.406 9.183 246 1HG LYS 32 1HG LYS 32 -0.400 -8.853 7.954 247 2HG LYS 32 2HG LYS 32 0.925 -8.202 6.997 248 1HD LYS 32 1HD LYS 32 2.195 -9.219 8.610 249 2HD LYS 32 2HD LYS 32 1.884 -7.714 9.477 250 1HE LYS 32 1HE LYS 32 -0.220 -8.855 10.395 251 2HE LYS 32 2HE LYS 32 0.457 -10.362 9.777 252 1HZ LYS 32 1HZ LYS 32 1.851 -8.525 11.647 253 2HZ LYS 32 2HZ LYS 32 1.036 -9.938 12.111 254 3HZ LYS 32 3HZ LYS 32 2.407 -10.040 11.114 255 H TRP 33 H TRP 33 -0.732 -6.416 5.815 256 HA TRP 33 HA TRP 33 -3.197 -7.568 4.623 257 1HB TRP 33 1HB TRP 33 -2.132 -5.455 3.677 258 2HB TRP 33 2HB TRP 33 -0.800 -6.471 3.167 259 HD1 TRP 33 HD1 TRP 33 -4.364 -7.796 2.949 260 HE1 TRP 33 HE1 TRP 33 -4.968 -8.110 0.445 261 HE3 TRP 33 HE3 TRP 33 -0.331 -5.578 0.823 262 HZ2 TRP 33 HZ2 TRP 33 -3.845 -7.477 -2.117 263 HZ3 TRP 33 HZ3 TRP 33 -0.099 -5.448 -1.647 264 HH2 TRP 33 HH2 TRP 33 -1.857 -6.387 -3.109 265 H ARG 34 H ARG 34 -3.248 -9.443 3.498 266 HA ARG 34 HA ARG 34 -0.747 -10.870 2.883 267 1HB ARG 34 1HB ARG 34 -2.973 -12.082 4.570 268 2HB ARG 34 2HB ARG 34 -1.572 -12.958 3.952 269 1HG ARG 34 1HG ARG 34 -0.212 -11.053 5.159 270 2HG ARG 34 2HG ARG 34 -1.695 -10.856 6.093 271 1HD ARG 34 1HD ARG 34 -1.292 -12.728 7.283 272 2HD ARG 34 2HD ARG 34 -0.965 -13.667 5.825 273 HE ARG 34 HE ARG 34 1.283 -12.013 6.256 274 1HH1 ARG 34 1HH1 ARG 34 -0.381 -14.638 7.860 275 2HH1 ARG 34 2HH1 ARG 34 1.059 -15.221 8.616 276 1HH2 ARG 34 1HH2 ARG 34 3.121 -12.800 7.257 277 2HH2 ARG 34 2HH2 ARG 34 3.021 -14.193 8.281 278 H ALA 35 H ALA 35 -1.012 -11.565 0.806 279 HA ALA 35 HA ALA 35 -3.268 -11.170 -0.783 280 1HB ALA 35 1HB ALA 35 -0.947 -11.811 -1.556 281 2HB ALA 35 2HB ALA 35 -1.346 -13.482 -1.158 282 3HB ALA 35 3HB ALA 35 -2.255 -12.631 -2.407 283 H ALA 36 H ALA 36 -4.859 -12.568 -1.659 284 HA ALA 36 HA ALA 36 -6.198 -14.202 0.276 285 1HB ALA 36 1HB ALA 36 -6.985 -12.913 -1.954 286 2HB ALA 36 2HB ALA 36 -6.830 -14.544 -2.608 287 3HB ALA 36 3HB ALA 36 -7.912 -14.237 -1.249 288 H LYS 37 H LYS 37 -3.942 -14.905 -2.311 289 HA LYS 37 HA LYS 37 -4.070 -17.782 -1.554 290 1HB LYS 37 1HB LYS 37 -4.745 -16.843 -4.006 291 2HB LYS 37 2HB LYS 37 -3.014 -17.063 -4.235 292 1HG LYS 37 1HG LYS 37 -3.147 -19.338 -4.074 293 2HG LYS 37 2HG LYS 37 -4.424 -19.280 -2.859 294 1HD LYS 37 1HD LYS 37 -5.436 -20.178 -4.833 295 2HD LYS 37 2HD LYS 37 -5.983 -18.504 -4.724 296 1HE LYS 37 1HE LYS 37 -4.002 -17.909 -6.229 297 2HE LYS 37 2HE LYS 37 -3.831 -19.640 -6.519 298 1HZ LYS 37 1HZ LYS 37 -6.162 -19.674 -7.247 299 2HZ LYS 37 2HZ LYS 37 -6.236 -17.987 -7.065 300 3HZ LYS 37 3HZ LYS 37 -5.197 -18.668 -8.219 301 H ALA 38 H ALA 38 -1.850 -18.690 -2.713 302 HA ALA 38 HA ALA 38 0.318 -17.186 -1.324 303 1HB ALA 38 1HB ALA 38 -0.127 -19.618 -0.751 304 2HB ALA 38 2HB ALA 38 0.399 -20.027 -2.384 305 3HB ALA 38 3HB ALA 38 1.526 -19.272 -1.257 306 H GLY 39 H GLY 39 2.491 -18.313 -2.722 307 1HA GLY 39 1HA GLY 39 3.785 -17.990 -4.657 308 2HA GLY 39 2HA GLY 39 2.276 -18.024 -5.575 309 H GLU 40 H GLU 40 3.262 -15.826 -2.987 310 HA GLU 40 HA GLU 40 2.209 -13.474 -3.979 311 1HB GLU 40 1HB GLU 40 4.777 -13.815 -2.424 312 2HB GLU 40 2HB GLU 40 3.915 -12.291 -2.626 313 1HG GLU 40 1HG GLU 40 2.182 -14.481 -1.726 314 2HG GLU 40 2HG GLU 40 3.484 -14.115 -0.608 315 H LYS 41 H LYS 41 2.461 -13.263 -6.138 316 HA LYS 41 HA LYS 41 5.211 -12.679 -7.147 317 1HB LYS 41 1HB LYS 41 4.296 -13.108 -9.416 318 2HB LYS 41 2HB LYS 41 4.146 -14.518 -8.373 319 1HG LYS 41 1HG LYS 41 1.782 -13.827 -7.882 320 2HG LYS 41 2HG LYS 41 1.958 -12.540 -9.073 321 1HD LYS 41 1HD LYS 41 2.034 -14.012 -10.860 322 2HD LYS 41 2HD LYS 41 2.663 -15.335 -9.877 323 1HE LYS 41 1HE LYS 41 0.498 -16.077 -10.050 324 2HE LYS 41 2HE LYS 41 0.277 -15.003 -8.669 325 1HZ LYS 41 1HZ LYS 41 -0.091 -14.184 -11.499 326 2HZ LYS 41 2HZ LYS 41 -1.357 -14.655 -10.468 327 3HZ LYS 41 3HZ LYS 41 -0.450 -13.266 -10.116 328 H THR 42 H THR 42 1.819 -11.622 -7.267 329 HA THR 42 HA THR 42 2.631 -8.821 -7.205 330 HB THR 42 HB THR 42 1.249 -8.309 -9.313 331 HG1 THR 42 HG1 THR 42 0.330 -10.321 -9.606 332 1HG2 THR 42 1HG2 THR 42 3.890 -8.541 -8.982 333 2HG2 THR 42 2HG2 THR 42 3.662 -9.866 -10.124 334 3HG2 THR 42 3HG2 THR 42 3.179 -8.228 -10.566 335 H ILE 43 H ILE 43 1.165 -7.974 -5.806 336 HA ILE 43 HA ILE 43 -1.667 -8.947 -5.987 337 HB ILE 43 HB ILE 43 -1.753 -8.475 -3.473 338 1HG1 ILE 43 1HG1 ILE 43 1.244 -8.759 -3.717 339 2HG1 ILE 43 2HG1 ILE 43 0.407 -7.226 -3.459 340 1HG2 ILE 43 1HG2 ILE 43 -1.270 -10.763 -4.854 341 2HG2 ILE 43 2HG2 ILE 43 0.142 -10.714 -3.803 342 3HG2 ILE 43 3HG2 ILE 43 -1.472 -10.699 -3.107 343 1HD1 ILE 43 1HD1 ILE 43 -0.755 -8.602 -1.495 344 2HD1 ILE 43 2HD1 ILE 43 0.735 -9.539 -1.594 345 3HD1 ILE 43 3HD1 ILE 43 0.801 -7.810 -1.256 346 H SER 44 H SER 44 -3.276 -7.336 -5.633 347 HA SER 44 HA SER 44 -2.189 -4.567 -5.316 348 1HB SER 44 1HB SER 44 -4.205 -5.559 -7.311 349 2HB SER 44 2HB SER 44 -4.073 -3.860 -6.890 350 HG SER 44 HG SER 44 -2.294 -5.546 -8.243 351 H VAL 45 H VAL 45 -3.501 -3.132 -4.176 352 HA VAL 45 HA VAL 45 -6.119 -4.011 -3.159 353 HB VAL 45 HB VAL 45 -4.535 -5.074 -1.582 354 1HG1 VAL 45 1HG1 VAL 45 -2.754 -3.256 -1.957 355 2HG1 VAL 45 2HG1 VAL 45 -3.656 -2.298 -0.784 356 3HG1 VAL 45 3HG1 VAL 45 -2.956 -3.844 -0.307 357 1HG2 VAL 45 1HG2 VAL 45 -6.280 -2.801 -0.684 358 2HG2 VAL 45 2HG2 VAL 45 -6.526 -4.536 -0.495 359 3HG2 VAL 45 3HG2 VAL 45 -5.338 -3.700 0.504 360 H VAL 46 H VAL 46 -7.324 -2.179 -3.410 361 HA VAL 46 HA VAL 46 -5.959 0.447 -3.277 362 HB VAL 46 HB VAL 46 -8.852 -0.032 -4.008 363 1HG1 VAL 46 1HG1 VAL 46 -7.901 2.281 -3.490 364 2HG1 VAL 46 2HG1 VAL 46 -6.921 2.093 -4.945 365 3HG1 VAL 46 3HG1 VAL 46 -8.681 2.098 -5.061 366 1HG2 VAL 46 1HG2 VAL 46 -6.430 -0.053 -5.844 367 2HG2 VAL 46 2HG2 VAL 46 -7.427 -1.454 -5.457 368 3HG2 VAL 46 3HG2 VAL 46 -8.114 -0.109 -6.368 369 H LEU 47 H LEU 47 -6.204 1.777 -1.562 370 HA LEU 47 HA LEU 47 -8.097 0.943 0.578 371 1HB LEU 47 1HB LEU 47 -5.826 2.931 0.764 372 2HB LEU 47 2HB LEU 47 -6.722 2.210 2.098 373 HG LEU 47 HG LEU 47 -5.447 0.275 0.237 374 1HD1 LEU 47 1HD1 LEU 47 -3.843 2.089 2.062 375 2HD1 LEU 47 2HD1 LEU 47 -3.233 0.582 1.378 376 3HD1 LEU 47 3HD1 LEU 47 -3.667 1.920 0.315 377 1HD2 LEU 47 1HD2 LEU 47 -6.105 0.589 3.128 378 2HD2 LEU 47 2HD2 LEU 47 -6.307 -0.810 2.073 379 3HD2 LEU 47 3HD2 LEU 47 -4.718 -0.426 2.733 380 H GLN 48 H GLN 48 -9.096 2.833 1.811 381 HA GLN 48 HA GLN 48 -9.840 5.019 -0.096 382 1HB GLN 48 1HB GLN 48 -11.580 3.159 0.638 383 2HB GLN 48 2HB GLN 48 -11.691 4.149 2.093 384 1HG GLN 48 1HG GLN 48 -11.833 5.481 -0.589 385 2HG GLN 48 2HG GLN 48 -13.262 4.657 0.036 386 1HE2 GLN 48 2HE2 GLN 48 -12.398 7.672 -0.242 387 2HE2 GLN 48 1HE2 GLN 48 -12.791 8.316 1.278 388 H LEU 49 H LEU 49 -9.105 6.951 0.638 389 HA LEU 49 HA LEU 49 -8.147 7.355 3.316 390 1HB LEU 49 1HB LEU 49 -8.641 9.179 0.953 391 2HB LEU 49 2HB LEU 49 -8.122 9.814 2.510 392 HG LEU 49 HG LEU 49 -6.186 9.451 1.046 393 1HD1 LEU 49 1HD1 LEU 49 -6.353 8.733 3.642 394 2HD1 LEU 49 2HD1 LEU 49 -5.885 7.184 2.941 395 3HD1 LEU 49 3HD1 LEU 49 -4.863 8.602 2.707 396 1HD2 LEU 49 1HD2 LEU 49 -7.325 7.568 -0.240 397 2HD2 LEU 49 2HD2 LEU 49 -5.626 7.302 0.149 398 3HD2 LEU 49 3HD2 LEU 49 -6.883 6.506 1.097 399 H GLU 50 H GLU 50 -9.214 8.295 4.985 400 HA GLU 50 HA GLU 50 -12.132 8.526 4.821 401 1HB GLU 50 1HB GLU 50 -10.666 7.667 6.820 402 2HB GLU 50 2HB GLU 50 -10.523 9.381 7.212 403 1HG GLU 50 1HG GLU 50 -13.062 9.505 7.056 404 2HG GLU 50 2HG GLU 50 -13.057 7.742 7.006 405 H LYS 51 H LYS 51 -10.678 10.470 3.201 406 HA LYS 51 HA LYS 51 -12.091 12.821 3.555 407 1HB LYS 51 1HB LYS 51 -10.302 14.342 4.544 408 2HB LYS 51 2HB LYS 51 -11.074 13.269 5.705 409 1HG LYS 51 1HG LYS 51 -9.179 11.671 5.444 410 2HG LYS 51 2HG LYS 51 -8.399 12.814 4.350 411 1HD LYS 51 1HD LYS 51 -8.918 14.447 6.462 412 2HD LYS 51 2HD LYS 51 -8.679 12.913 7.300 413 1HE LYS 51 1HE LYS 51 -6.595 12.808 5.586 414 2HE LYS 51 2HE LYS 51 -6.734 14.557 5.769 415 1HZ LYS 51 1HZ LYS 51 -6.826 14.088 8.242 416 2HZ LYS 51 2HZ LYS 51 -6.276 12.525 7.868 417 3HZ LYS 51 3HZ LYS 51 -5.322 13.873 7.481 418 H GLU 52 H GLU 52 -11.773 13.872 1.624 419 HA GLU 52 HA GLU 52 -9.641 12.996 -0.142 420 1HB GLU 52 1HB GLU 52 -12.053 13.826 -0.749 421 2HB GLU 52 2HB GLU 52 -11.316 15.422 -0.653 422 1HG GLU 52 1HG GLU 52 -9.700 14.877 -2.347 423 2HG GLU 52 2HG GLU 52 -10.184 13.181 -2.335 424 H GLU 53 H GLU 53 -7.644 13.689 0.278 425 HA GLU 53 HA GLU 53 -7.152 16.594 0.577 426 1HB GLU 53 1HB GLU 53 -5.233 15.636 2.274 427 2HB GLU 53 2HB GLU 53 -6.777 16.285 2.815 428 1HG GLU 53 1HG GLU 53 -6.264 14.103 3.877 429 2HG GLU 53 2HG GLU 53 -7.721 14.017 2.891 430 H GLN 54 H GLN 54 -4.623 16.884 0.534 431 HA GLN 54 HA GLN 54 -3.694 15.491 -1.890 432 1HB GLN 54 1HB GLN 54 -2.377 17.675 -0.238 433 2HB GLN 54 2HB GLN 54 -1.804 17.082 -1.798 434 1HG GLN 54 1HG GLN 54 -3.647 17.974 -2.953 435 2HG GLN 54 2HG GLN 54 -4.605 18.126 -1.490 436 1HE2 GLN 54 2HE2 GLN 54 -1.201 19.170 -1.811 437 2HE2 GLN 54 1HE2 GLN 54 -1.521 20.821 -1.591 438 H ILE 55 H ILE 55 -1.034 15.180 -1.603 439 HA ILE 55 HA ILE 55 -0.544 13.741 0.956 440 HB ILE 55 HB ILE 55 -0.051 12.499 -1.775 441 1HG1 ILE 55 1HG1 ILE 55 -1.810 10.842 -0.593 442 2HG1 ILE 55 2HG1 ILE 55 -2.326 12.355 0.149 443 1HG2 ILE 55 1HG2 ILE 55 0.440 11.636 1.075 444 2HG2 ILE 55 2HG2 ILE 55 0.240 10.445 -0.211 445 3HG2 ILE 55 3HG2 ILE 55 1.557 11.614 -0.290 446 1HD1 ILE 55 1HD1 ILE 55 -2.184 13.254 -2.336 447 2HD1 ILE 55 2HD1 ILE 55 -2.369 11.547 -2.737 448 3HD1 ILE 55 3HD1 ILE 55 -3.608 12.369 -1.791 449 H HIS 56 H HIS 56 1.435 14.153 1.688 450 HA HIS 56 HA HIS 56 3.465 15.283 -0.188 451 1HB HIS 56 1HB HIS 56 2.341 16.713 1.763 452 2HB HIS 56 2HB HIS 56 3.557 15.893 2.739 453 HD1 HIS 56 HD1 HIS 56 3.180 18.350 -0.075 454 HD2 HIS 56 HD2 HIS 56 6.245 16.642 2.175 455 HE1 HIS 56 HE1 HIS 56 5.276 19.671 -0.599 456 H SER 57 H SER 57 2.771 12.971 2.362 457 HA SER 57 HA SER 57 5.371 11.676 1.842 458 1HB SER 57 1HB SER 57 4.575 12.908 4.458 459 2HB SER 57 2HB SER 57 5.509 11.417 4.468 460 HG SER 57 HG SER 57 6.576 13.658 4.348 461 H VAL 58 H VAL 58 5.187 9.484 2.060 462 HA VAL 58 HA VAL 58 2.577 8.431 3.066 463 HB VAL 58 HB VAL 58 4.179 7.685 0.608 464 1HG1 VAL 58 1HG1 VAL 58 1.972 6.185 2.008 465 2HG1 VAL 58 2HG1 VAL 58 2.221 6.030 0.269 466 3HG1 VAL 58 3HG1 VAL 58 3.504 5.574 1.386 467 1HG2 VAL 58 1HG2 VAL 58 1.538 8.977 1.171 468 2HG2 VAL 58 2HG2 VAL 58 2.772 9.421 -0.009 469 3HG2 VAL 58 3HG2 VAL 58 1.726 8.033 -0.308 470 H ASP 59 H ASP 59 2.729 6.152 3.832 471 HA ASP 59 HA ASP 59 5.480 5.279 4.564 472 1HB ASP 59 1HB ASP 59 3.287 6.124 6.391 473 2HB ASP 59 2HB ASP 59 4.179 4.674 6.854 474 H ILE 60 H ILE 60 5.697 3.065 4.404 475 HA ILE 60 HA ILE 60 3.382 1.285 4.685 476 HB ILE 60 HB ILE 60 4.657 1.835 1.995 477 1HG1 ILE 60 1HG1 ILE 60 2.023 1.261 1.584 478 2HG1 ILE 60 2HG1 ILE 60 1.965 1.896 3.225 479 1HG2 ILE 60 1HG2 ILE 60 3.269 -0.737 2.808 480 2HG2 ILE 60 2HG2 ILE 60 3.620 -0.270 1.144 481 3HG2 ILE 60 3HG2 ILE 60 4.941 -0.576 2.271 482 1HD1 ILE 60 1HD1 ILE 60 3.612 3.711 2.039 483 2HD1 ILE 60 2HD1 ILE 60 2.557 3.286 0.691 484 3HD1 ILE 60 3HD1 ILE 60 1.866 3.913 2.189 485 H GLY 61 H GLY 61 4.140 -0.626 5.568 486 1HA GLY 61 1HA GLY 61 7.099 -0.944 5.527 487 2HA GLY 61 2HA GLY 61 6.100 -1.555 6.815 488 H ASN 62 H ASN 62 7.875 -2.487 4.339 489 HA ASN 62 HA ASN 62 6.225 -4.405 2.963 490 1HB ASN 62 1HB ASN 62 9.129 -3.787 3.120 491 2HB ASN 62 2HB ASN 62 8.684 -5.399 2.556 492 1HD2 ASN 62 2HD2 ASN 62 6.821 -2.379 2.068 493 2HD2 ASN 62 1HD2 ASN 62 6.943 -2.391 0.377 494 H ASP 63 H ASP 63 5.947 -6.588 3.311 495 HA ASP 63 HA ASP 63 7.187 -7.765 5.765 496 1HB ASP 63 1HB ASP 63 4.780 -7.221 6.162 497 2HB ASP 63 2HB ASP 63 4.349 -8.212 4.769 498 H GLY 64 H GLY 64 8.512 -8.083 3.532 499 1HA GLY 64 1HA GLY 64 9.409 -10.210 2.628 500 2HA GLY 64 2HA GLY 64 7.742 -10.777 2.490 501 H SER 65 H SER 65 6.860 -8.057 1.567 502 HA SER 65 HA SER 65 6.948 -8.431 -1.251 503 1HB SER 65 1HB SER 65 5.238 -7.001 -0.393 504 2HB SER 65 2HB SER 65 6.399 -6.010 0.478 505 HG SER 65 HG SER 65 6.349 -4.823 -1.251 506 H ALA 66 H ALA 66 7.891 -6.759 -2.764 507 HA ALA 66 HA ALA 66 10.578 -5.829 -1.880 508 1HB ALA 66 1HB ALA 66 9.932 -7.887 -3.846 509 2HB ALA 66 2HB ALA 66 10.910 -6.597 -4.542 510 3HB ALA 66 3HB ALA 66 11.488 -7.489 -3.137 511 H PHE 67 H PHE 67 8.341 -5.844 -4.683 512 HA PHE 67 HA PHE 67 9.023 -2.971 -5.131 513 1HB PHE 67 1HB PHE 67 7.432 -4.852 -6.901 514 2HB PHE 67 2HB PHE 67 7.967 -3.233 -7.320 515 HD1 PHE 67 HD1 PHE 67 10.713 -3.098 -6.385 516 HD2 PHE 67 HD2 PHE 67 8.615 -6.372 -8.207 517 HE1 PHE 67 HE1 PHE 67 12.863 -4.021 -7.201 518 HE2 PHE 67 HE2 PHE 67 10.757 -7.298 -9.019 519 HZ PHE 67 HZ PHE 67 12.888 -6.124 -8.520 520 H VAL 68 H VAL 68 7.532 -1.392 -4.715 521 HA VAL 68 HA VAL 68 4.706 -2.244 -4.259 522 HB VAL 68 HB VAL 68 6.314 -0.431 -2.432 523 1HG1 VAL 68 1HG1 VAL 68 3.388 -1.153 -2.586 524 2HG1 VAL 68 2HG1 VAL 68 4.127 -0.743 -1.037 525 3HG1 VAL 68 3HG1 VAL 68 4.121 0.434 -2.350 526 1HG2 VAL 68 1HG2 VAL 68 5.500 -3.297 -2.403 527 2HG2 VAL 68 2HG2 VAL 68 6.936 -2.529 -1.726 528 3HG2 VAL 68 3HG2 VAL 68 5.393 -2.422 -0.876 529 H GLU 69 H GLU 69 3.685 -1.241 -5.875 530 HA GLU 69 HA GLU 69 4.451 1.535 -6.626 531 1HB GLU 69 1HB GLU 69 4.177 -0.151 -8.439 532 2HB GLU 69 2HB GLU 69 2.503 -0.390 -7.944 533 1HG GLU 69 1HG GLU 69 1.844 1.732 -8.676 534 2HG GLU 69 2HG GLU 69 3.482 2.377 -8.596 535 H VAL 70 H VAL 70 3.190 3.242 -5.971 536 HA VAL 70 HA VAL 70 0.483 2.575 -4.887 537 HB VAL 70 HB VAL 70 2.320 4.758 -3.879 538 1HG1 VAL 70 1HG1 VAL 70 -0.488 3.980 -3.386 539 2HG1 VAL 70 2HG1 VAL 70 0.471 4.275 -1.935 540 3HG1 VAL 70 3HG1 VAL 70 0.307 5.537 -3.155 541 1HG2 VAL 70 1HG2 VAL 70 1.837 1.922 -3.018 542 2HG2 VAL 70 2HG2 VAL 70 3.358 2.810 -3.109 543 3HG2 VAL 70 3HG2 VAL 70 2.218 3.146 -1.806 544 H LEU 71 H LEU 71 -1.123 3.545 -5.930 545 HA LEU 71 HA LEU 71 -0.525 5.950 -7.591 546 1HB LEU 71 1HB LEU 71 -2.050 3.502 -8.071 547 2HB LEU 71 2HB LEU 71 -3.025 4.940 -8.367 548 HG LEU 71 HG LEU 71 -1.110 5.821 -9.774 549 1HD1 LEU 71 1HD1 LEU 71 -0.164 2.958 -9.440 550 2HD1 LEU 71 2HD1 LEU 71 0.514 4.126 -10.575 551 3HD1 LEU 71 3HD1 LEU 71 0.661 4.396 -8.839 552 1HD2 LEU 71 1HD2 LEU 71 -2.651 3.322 -10.458 553 2HD2 LEU 71 2HD2 LEU 71 -2.939 4.976 -10.998 554 3HD2 LEU 71 3HD2 LEU 71 -1.571 4.066 -11.638 555 H VAL 72 H VAL 72 -2.359 7.513 -7.710 556 HA VAL 72 HA VAL 72 -3.974 7.551 -5.199 557 HB VAL 72 HB VAL 72 -3.716 10.087 -5.412 558 1HG1 VAL 72 1HG1 VAL 72 -1.339 8.370 -4.677 559 2HG1 VAL 72 2HG1 VAL 72 -1.593 10.033 -4.146 560 3HG1 VAL 72 3HG1 VAL 72 -2.697 8.761 -3.622 561 1HG2 VAL 72 1HG2 VAL 72 -1.404 9.155 -7.131 562 2HG2 VAL 72 2HG2 VAL 72 -2.725 10.208 -7.629 563 3HG2 VAL 72 3HG2 VAL 72 -1.539 10.777 -6.456 564 H GLY 73 H GLY 73 -5.992 8.850 -5.407 565 1HA GLY 73 1HA GLY 73 -6.960 9.906 -7.832 566 2HA GLY 73 2HA GLY 73 -7.436 8.214 -7.769 567 H SER 74 H SER 74 -9.474 9.782 -7.795 568 HA SER 74 HA SER 74 -10.353 10.136 -4.985 569 1HB SER 74 1HB SER 74 -10.408 12.259 -6.094 570 2HB SER 74 2HB SER 74 -11.167 11.564 -7.517 571 HG SER 74 HG SER 74 -12.241 11.996 -4.938 572 H SER 75 H SER 75 -12.596 9.604 -4.582 573 HA SER 75 HA SER 75 -13.453 7.202 -5.995 574 1HB SER 75 1HB SER 75 -13.699 7.421 -3.529 575 2HB SER 75 2HB SER 75 -14.826 8.749 -3.780 576 HG SER 75 HG SER 75 -16.155 7.067 -3.694 577 H ALA 76 H ALA 76 -13.712 10.372 -6.821 578 HA ALA 76 HA ALA 76 -16.426 10.857 -7.362 579 1HB ALA 76 1HB ALA 76 -13.860 11.729 -8.642 580 2HB ALA 76 2HB ALA 76 -15.389 12.136 -9.421 581 3HB ALA 76 3HB ALA 76 -15.059 12.693 -7.781 582 H GLY 77 H GLY 77 -17.629 10.629 -9.392 583 1HA GLY 77 1HA GLY 77 -17.536 7.996 -10.490 584 2HA GLY 77 2HA GLY 77 -18.461 9.337 -11.165 585 H GLY 78 H GLY 78 -15.688 7.370 -11.552 586 1HA GLY 78 1HA GLY 78 -14.969 8.895 -14.004 587 2HA GLY 78 2HA GLY 78 -13.690 8.498 -12.854 588 H ALA 79 H ALA 79 -12.638 7.158 -14.438 589 HA ALA 79 HA ALA 79 -13.956 4.967 -15.762 590 1HB ALA 79 1HB ALA 79 -11.641 6.107 -16.247 591 2HB ALA 79 2HB ALA 79 -11.025 4.925 -15.092 592 3HB ALA 79 3HB ALA 79 -11.836 4.384 -16.561 593 H GLY 80 H GLY 80 -12.024 5.187 -12.775 594 1HA GLY 80 1HA GLY 80 -12.978 3.719 -10.911 595 2HA GLY 80 2HA GLY 80 -12.928 2.416 -12.098 596 H GLU 81 H GLU 81 -11.184 1.122 -11.893 597 HA GLU 81 HA GLU 81 -8.940 1.806 -10.213 598 1HB GLU 81 1HB GLU 81 -7.963 -0.328 -11.119 599 2HB GLU 81 2HB GLU 81 -9.581 -0.518 -10.446 600 1HG GLU 81 1HG GLU 81 -10.537 -0.916 -12.492 601 2HG GLU 81 2HG GLU 81 -9.423 0.159 -13.338 602 H GLN 82 H GLN 82 -9.599 2.178 -13.626 603 HA GLN 82 HA GLN 82 -6.745 2.785 -14.186 604 1HB GLN 82 1HB GLN 82 -9.145 2.124 -15.828 605 2HB GLN 82 2HB GLN 82 -7.940 3.186 -16.558 606 1HG GLN 82 1HG GLN 82 -6.239 1.388 -15.651 607 2HG GLN 82 2HG GLN 82 -7.656 0.337 -15.662 608 1HE2 GLN 82 2HE2 GLN 82 -8.841 0.171 -17.810 609 2HE2 GLN 82 1HE2 GLN 82 -7.949 0.352 -19.242 610 H ASP 83 H ASP 83 -8.291 4.565 -12.472 611 HA ASP 83 HA ASP 83 -8.153 7.025 -14.158 612 1HB ASP 83 1HB ASP 83 -10.539 6.208 -13.639 613 2HB ASP 83 2HB ASP 83 -10.200 6.656 -11.967 614 H TYR 84 H TYR 84 -6.134 5.922 -12.396 615 HA TYR 84 HA TYR 84 -6.182 7.896 -10.163 616 1HB TYR 84 1HB TYR 84 -4.900 5.176 -10.444 617 2HB TYR 84 2HB TYR 84 -4.304 6.341 -9.264 618 HD1 TYR 84 HD1 TYR 84 -7.725 5.284 -10.444 619 HD2 TYR 84 HD2 TYR 84 -5.073 5.909 -7.123 620 HE1 TYR 84 HE1 TYR 84 -9.538 4.653 -8.879 621 HE2 TYR 84 HE2 TYR 84 -6.889 5.278 -5.558 622 HH TYR 84 HH TYR 84 -10.045 5.219 -6.331 623 H GLU 85 H GLU 85 -3.669 8.193 -9.551 624 HA GLU 85 HA GLU 85 -2.171 8.810 -12.050 625 1HB GLU 85 1HB GLU 85 -1.418 10.730 -10.054 626 2HB GLU 85 2HB GLU 85 -2.154 11.027 -11.621 627 1HG GLU 85 1HG GLU 85 -3.842 10.224 -9.250 628 2HG GLU 85 2HG GLU 85 -3.379 11.903 -9.514 629 H VAL 86 H VAL 86 -0.095 8.100 -11.986 630 HA VAL 86 HA VAL 86 0.769 6.362 -9.907 631 HB VAL 86 HB VAL 86 2.496 7.776 -11.954 632 1HG1 VAL 86 1HG1 VAL 86 2.828 5.205 -10.378 633 2HG1 VAL 86 2HG1 VAL 86 3.884 5.705 -11.698 634 3HG1 VAL 86 3HG1 VAL 86 3.802 6.666 -10.221 635 1HG2 VAL 86 1HG2 VAL 86 0.574 5.491 -12.113 636 2HG2 VAL 86 2HG2 VAL 86 0.970 6.707 -13.327 637 3HG2 VAL 86 3HG2 VAL 86 2.075 5.365 -13.030 638 H LEU 87 H LEU 87 0.552 7.587 -7.931 639 HA LEU 87 HA LEU 87 1.898 10.049 -7.399 640 1HB LEU 87 1HB LEU 87 0.140 8.734 -5.973 641 2HB LEU 87 2HB LEU 87 1.549 7.912 -5.305 642 HG LEU 87 HG LEU 87 2.524 10.230 -4.854 643 1HD1 LEU 87 1HD1 LEU 87 0.517 11.125 -6.439 644 2HD1 LEU 87 2HD1 LEU 87 -0.243 11.316 -4.859 645 3HD1 LEU 87 3HD1 LEU 87 1.285 12.125 -5.206 646 1HD2 LEU 87 1HD2 LEU 87 0.218 8.933 -3.486 647 2HD2 LEU 87 2HD2 LEU 87 1.830 9.301 -2.869 648 3HD2 LEU 87 3HD2 LEU 87 0.613 10.574 -2.973 649 H LEU 88 H LEU 88 2.882 6.678 -6.748 650 HA LEU 88 HA LEU 88 5.692 7.493 -7.170 651 1HB LEU 88 1HB LEU 88 6.348 6.019 -5.181 652 2HB LEU 88 2HB LEU 88 5.723 7.622 -4.828 653 HG LEU 88 HG LEU 88 3.563 5.700 -5.038 654 1HD1 LEU 88 1HD1 LEU 88 5.892 5.091 -3.227 655 2HD1 LEU 88 2HD1 LEU 88 4.251 4.628 -2.771 656 3HD1 LEU 88 3HD1 LEU 88 4.971 3.987 -4.249 657 1HD2 LEU 88 1HD2 LEU 88 3.603 8.001 -3.962 658 2HD2 LEU 88 2HD2 LEU 88 2.908 6.727 -2.959 659 3HD2 LEU 88 3HD2 LEU 88 4.551 7.290 -2.656 660 H VAL 89 H VAL 89 6.562 6.105 -8.567 661 HA VAL 89 HA VAL 89 5.233 3.860 -9.647 662 HB VAL 89 HB VAL 89 7.451 3.256 -10.614 663 1HG1 VAL 89 1HG1 VAL 89 6.462 6.101 -10.646 664 2HG1 VAL 89 2HG1 VAL 89 7.864 5.629 -11.607 665 3HG1 VAL 89 3HG1 VAL 89 6.300 4.862 -11.889 666 1HG2 VAL 89 1HG2 VAL 89 8.326 5.127 -8.463 667 2HG2 VAL 89 2HG2 VAL 89 9.140 3.706 -9.116 668 3HG2 VAL 89 3HG2 VAL 89 9.181 5.231 -10.002 669 H THR 90 H THR 90 6.744 1.641 -9.660 670 HA THR 90 HA THR 90 6.198 0.462 -7.108 671 HB THR 90 HB THR 90 6.597 -0.531 -9.618 672 HG1 THR 90 HG1 THR 90 5.660 -2.001 -8.505 673 1HG2 THR 90 1HG2 THR 90 9.104 -0.284 -9.358 674 2HG2 THR 90 2HG2 THR 90 9.020 -1.480 -8.065 675 3HG2 THR 90 3HG2 THR 90 8.558 -1.925 -9.709 676 H SER 91 H SER 91 7.390 0.504 -5.304 677 HA SER 91 HA SER 91 10.127 1.618 -5.414 678 1HB SER 91 1HB SER 91 9.821 1.986 -2.996 679 2HB SER 91 2HB SER 91 8.489 2.694 -3.902 680 HG SER 91 HG SER 91 7.433 1.537 -2.438 681 H SER 92 H SER 92 11.771 0.236 -5.288 682 HA SER 92 HA SER 92 11.331 -2.562 -4.468 683 1HB SER 92 1HB SER 92 13.548 -2.968 -5.348 684 2HB SER 92 2HB SER 92 12.689 -1.945 -6.496 685 HG SER 92 HG SER 92 13.761 -0.159 -5.616 686 H PHE 93 H PHE 93 11.659 -3.175 -2.379 687 HA PHE 93 HA PHE 93 13.580 -1.571 -0.738 688 1HB PHE 93 1HB PHE 93 11.118 -3.033 0.218 689 2HB PHE 93 2HB PHE 93 12.217 -2.104 1.225 690 HD1 PHE 93 HD1 PHE 93 12.728 0.282 -0.475 691 HD2 PHE 93 HD2 PHE 93 9.084 -1.865 0.291 692 HE1 PHE 93 HE1 PHE 93 11.418 2.329 -0.960 693 HE2 PHE 93 HE2 PHE 93 7.778 0.185 -0.192 694 HZ PHE 93 HZ PHE 93 8.947 2.279 -0.815 695 H MET 94 H MET 94 12.163 -4.808 -1.212 696 HA MET 94 HA MET 94 14.639 -5.940 0.037 697 1HB MET 94 1HB MET 94 11.758 -6.649 0.304 698 2HB MET 94 2HB MET 94 12.912 -7.983 0.278 699 1HG MET 94 1HG MET 94 14.151 -7.015 2.129 700 2HG MET 94 2HG MET 94 13.143 -5.570 2.099 701 1HE MET 94 1HE MET 94 13.138 -9.169 1.846 702 2HE MET 94 2HE MET 94 12.412 -9.780 3.327 703 3HE MET 94 3HE MET 94 11.399 -9.485 1.917 704 H SER 95 H SER 95 14.701 -8.443 -0.699 705 HA SER 95 HA SER 95 14.511 -8.424 -3.685 706 1HB SER 95 1HB SER 95 16.542 -9.607 -3.793 707 2HB SER 95 2HB SER 95 16.823 -8.513 -2.447 708 HG SER 95 HG SER 95 17.284 -10.342 -1.481 709 HA PRO 96 HA PRO 96 12.154 -12.198 -3.331 710 1HB PRO 96 1HB PRO 96 13.057 -13.681 -5.437 711 2HB PRO 96 2HB PRO 96 12.084 -12.216 -5.623 712 1HG PRO 96 1HG PRO 96 14.921 -12.654 -6.229 713 2HG PRO 96 2HG PRO 96 13.833 -11.381 -6.797 714 1HD PRO 96 1HD PRO 96 15.818 -11.218 -4.710 715 2HD PRO 96 2HD PRO 96 14.745 -9.931 -5.301 716 H SER 97 H SER 97 15.207 -12.281 -2.226 717 HA SER 97 HA SER 97 15.186 -15.241 -1.796 718 1HB SER 97 1HB SER 97 17.732 -14.762 -1.335 719 2HB SER 97 2HB SER 97 17.162 -14.910 -2.995 720 HG SER 97 HG SER 97 18.489 -12.958 -2.194 721 H GLU 98 H GLU 98 16.373 -12.185 -0.354 722 HA GLU 98 HA GLU 98 16.687 -13.194 2.289 723 1HB GLU 98 1HB GLU 98 16.595 -10.801 2.977 724 2HB GLU 98 2HB GLU 98 17.673 -11.068 1.608 725 1HG GLU 98 1HG GLU 98 15.380 -10.588 0.268 726 2HG GLU 98 2HG GLU 98 15.072 -9.634 1.718 727 H SER 99 H SER 99 13.810 -12.420 0.522 728 HA SER 99 HA SER 99 12.027 -11.612 2.541 729 1HB SER 99 1HB SER 99 11.290 -11.620 0.260 730 2HB SER 99 2HB SER 99 11.595 -13.348 0.103 731 HG SER 99 HG SER 99 9.348 -12.311 0.699 732 H ARG 100 H ARG 100 13.175 -14.879 1.768 733 HA ARG 100 HA ARG 100 11.322 -16.205 3.553 734 1HB ARG 100 1HB ARG 100 13.901 -17.063 2.229 735 2HB ARG 100 2HB ARG 100 12.993 -18.131 3.301 736 1HG ARG 100 1HG ARG 100 10.977 -17.791 1.866 737 2HG ARG 100 2HG ARG 100 11.963 -16.838 0.758 738 1HD ARG 100 1HD ARG 100 12.637 -18.726 -0.258 739 2HD ARG 100 2HD ARG 100 13.347 -19.292 1.255 740 HE ARG 100 HE ARG 100 10.494 -19.718 1.245 741 1HH1 ARG 100 1HH1 ARG 100 13.505 -20.958 -0.031 742 2HH1 ARG 100 2HH1 ARG 100 12.888 -22.565 -0.201 743 1HH2 ARG 100 1HH2 ARG 100 9.737 -21.812 1.012 744 2HH2 ARG 100 2HH2 ARG 100 10.778 -23.045 0.385 745 H SER 101 H SER 101 14.850 -16.472 3.965 746 HA SER 101 HA SER 101 14.847 -15.152 6.551 747 1HB SER 101 1HB SER 101 13.797 -17.282 7.203 748 2HB SER 101 2HB SER 101 15.100 -18.176 6.427 749 HG SER 101 HG SER 101 15.463 -17.946 8.663 750 H GLY 102 H GLY 102 16.269 -14.950 4.082 751 1HA GLY 102 1HA GLY 102 18.909 -16.179 4.512 752 2HA GLY 102 2HA GLY 102 18.455 -15.138 3.161 753 H SER 103 H SER 103 17.259 -13.193 5.207 754 HA SER 103 HA SER 103 19.383 -12.246 6.870 755 1HB SER 103 1HB SER 103 19.547 -11.531 4.065 756 2HB SER 103 2HB SER 103 19.445 -10.106 5.092 757 HG SER 103 HG SER 103 21.177 -10.986 6.315 758 H ASN 104 H ASN 104 17.372 -10.334 4.755 759 HA ASN 104 HA ASN 104 15.846 -9.401 7.138 760 1HB ASN 104 1HB ASN 104 15.494 -7.285 5.807 761 2HB ASN 104 2HB ASN 104 17.173 -7.577 6.258 762 1HD2 ASN 104 2HD2 ASN 104 18.643 -8.382 4.537 763 2HD2 ASN 104 1HD2 ASN 104 18.251 -8.155 2.902 764 HA PRO 105 HA PRO 105 12.753 -11.444 4.393 765 1HB PRO 105 1HB PRO 105 11.301 -12.516 6.437 766 2HB PRO 105 2HB PRO 105 12.729 -13.291 5.748 767 1HG PRO 105 1HG PRO 105 12.427 -11.869 8.325 768 2HG PRO 105 2HG PRO 105 13.494 -13.214 7.894 769 1HD PRO 105 1HD PRO 105 14.263 -10.527 8.105 770 2HD PRO 105 2HD PRO 105 15.189 -11.809 7.296 771 H ASN 106 H ASN 106 12.567 -9.226 7.050 772 HA ASN 106 HA ASN 106 10.079 -8.088 5.902 773 1HB ASN 106 1HB ASN 106 10.510 -8.771 8.822 774 2HB ASN 106 2HB ASN 106 9.180 -7.791 8.215 775 1HD2 ASN 106 2HD2 ASN 106 8.508 -9.226 5.855 776 2HD2 ASN 106 1HD2 ASN 106 7.952 -10.767 6.282 777 H ARG 107 H ARG 107 10.117 -5.891 5.839 778 HA ARG 107 HA ARG 107 11.721 -4.301 7.694 779 1HB ARG 107 1HB ARG 107 13.281 -5.194 5.795 780 2HB ARG 107 2HB ARG 107 12.441 -4.019 4.781 781 1HG ARG 107 1HG ARG 107 14.099 -2.634 5.558 782 2HG ARG 107 2HG ARG 107 12.975 -2.446 6.903 783 1HD ARG 107 1HD ARG 107 14.669 -3.147 8.227 784 2HD ARG 107 2HD ARG 107 14.377 -4.755 7.566 785 HE ARG 107 HE ARG 107 16.113 -3.180 5.856 786 1HH1 ARG 107 1HH1 ARG 107 16.006 -5.169 8.731 787 2HH1 ARG 107 2HH1 ARG 107 17.672 -5.613 8.607 788 1HH2 ARG 107 1HH2 ARG 107 18.266 -3.780 5.736 789 2HH2 ARG 107 2HH2 ARG 107 18.940 -4.836 6.932 790 H VAL 108 H VAL 108 11.129 -2.045 7.555 791 HA VAL 108 HA VAL 108 8.690 -1.610 5.916 792 HB VAL 108 HB VAL 108 8.018 0.060 7.526 793 1HG1 VAL 108 1HG1 VAL 108 7.539 -2.302 8.051 794 2HG1 VAL 108 2HG1 VAL 108 9.088 -2.431 8.885 795 3HG1 VAL 108 3HG1 VAL 108 7.828 -1.376 9.525 796 1HG2 VAL 108 1HG2 VAL 108 10.835 -0.290 8.449 797 2HG2 VAL 108 2HG2 VAL 108 9.877 1.183 8.303 798 3HG2 VAL 108 3HG2 VAL 108 9.605 0.084 9.657 799 H ARG 109 H ARG 109 8.385 0.712 5.103 800 HA ARG 109 HA ARG 109 10.851 2.262 4.748 801 1HB ARG 109 1HB ARG 109 10.143 0.336 2.807 802 2HB ARG 109 2HB ARG 109 9.666 1.888 2.121 803 1HG ARG 109 1HG ARG 109 11.849 2.068 1.510 804 2HG ARG 109 2HG ARG 109 12.131 2.484 3.196 805 1HD ARG 109 1HD ARG 109 12.406 0.007 3.661 806 2HD ARG 109 2HD ARG 109 12.382 -0.247 1.917 807 HE ARG 109 HE ARG 109 14.566 0.633 1.801 808 1HH1 ARG 109 1HH1 ARG 109 13.109 1.405 4.887 809 2HH1 ARG 109 2HH1 ARG 109 14.580 2.040 5.536 810 1HH2 ARG 109 1HH2 ARG 109 16.447 1.461 2.682 811 2HH2 ARG 109 2HH2 ARG 109 16.452 2.071 4.304 812 H MET 110 H MET 110 10.398 4.379 3.846 813 HA MET 110 HA MET 110 7.497 5.113 3.885 814 1HB MET 110 1HB MET 110 9.762 6.811 4.963 815 2HB MET 110 2HB MET 110 8.038 7.155 5.072 816 1HG MET 110 1HG MET 110 7.751 5.775 6.849 817 2HG MET 110 2HG MET 110 8.772 4.521 6.163 818 1HE MET 110 1HE MET 110 8.738 8.069 7.268 819 2HE MET 110 2HE MET 110 8.635 7.397 8.895 820 3HE MET 110 3HE MET 110 10.079 8.286 8.391 821 H PHE 111 H PHE 111 7.102 7.263 2.829 822 HA PHE 111 HA PHE 111 9.027 7.878 0.632 823 1HB PHE 111 1HB PHE 111 6.042 8.002 0.223 824 2HB PHE 111 2HB PHE 111 7.309 8.012 -0.993 825 HD1 PHE 111 HD1 PHE 111 5.831 5.856 1.685 826 HD2 PHE 111 HD2 PHE 111 7.930 6.019 -2.057 827 HE1 PHE 111 HE1 PHE 111 5.640 3.404 1.470 828 HE2 PHE 111 HE2 PHE 111 7.741 3.557 -2.270 829 HZ PHE 111 HZ PHE 111 6.595 2.243 -0.504 830 H GLY 112 H GLY 112 8.747 10.142 -0.144 831 1HA GLY 112 1HA GLY 112 7.307 11.896 1.776 832 2HA GLY 112 2HA GLY 112 8.962 12.231 1.326 833 HA PRO 113 HA PRO 113 6.460 14.612 -1.719 834 1HB PRO 113 1HB PRO 113 8.204 16.711 -1.813 835 2HB PRO 113 2HB PRO 113 6.925 16.557 -0.599 836 1HG PRO 113 1HG PRO 113 9.848 16.095 -0.332 837 2HG PRO 113 2HG PRO 113 8.686 16.699 0.859 838 1HD PRO 113 1HD PRO 113 9.674 14.091 0.789 839 2HD PRO 113 2HD PRO 113 8.185 14.583 1.604 840 H ASP 114 H ASP 114 9.967 14.108 -1.644 841 HA ASP 114 HA ASP 114 10.444 14.538 -4.440 842 1HB ASP 114 1HB ASP 114 12.082 14.261 -2.332 843 2HB ASP 114 2HB ASP 114 12.143 12.604 -2.933 844 H LYS 115 H LYS 115 9.288 11.810 -2.586 845 HA LYS 115 HA LYS 115 9.639 9.981 -4.867 846 1HB LYS 115 1HB LYS 115 9.685 9.609 -2.134 847 2HB LYS 115 2HB LYS 115 8.078 9.024 -2.560 848 1HG LYS 115 1HG LYS 115 8.915 7.164 -3.529 849 2HG LYS 115 2HG LYS 115 10.087 8.091 -4.462 850 1HD LYS 115 1HD LYS 115 10.441 7.439 -1.525 851 2HD LYS 115 2HD LYS 115 11.110 6.455 -2.827 852 1HE LYS 115 1HE LYS 115 11.720 9.369 -2.263 853 2HE LYS 115 2HE LYS 115 12.823 8.005 -2.082 854 1HZ LYS 115 1HZ LYS 115 12.333 7.607 -4.547 855 2HZ LYS 115 2HZ LYS 115 11.760 9.205 -4.558 856 3HZ LYS 115 3HZ LYS 115 13.371 8.887 -4.137 857 H LEU 116 H LEU 116 7.403 12.338 -4.216 858 HA LEU 116 HA LEU 116 5.244 10.684 -5.477 859 1HB LEU 116 1HB LEU 116 3.610 12.311 -4.388 860 2HB LEU 116 2HB LEU 116 4.379 11.137 -3.326 861 HG LEU 116 HG LEU 116 6.143 13.016 -2.926 862 1HD1 LEU 116 1HD1 LEU 116 4.415 14.354 -4.732 863 2HD1 LEU 116 2HD1 LEU 116 4.146 15.087 -3.155 864 3HD1 LEU 116 3HD1 LEU 116 5.766 15.040 -3.842 865 1HD2 LEU 116 1HD2 LEU 116 3.305 13.085 -1.879 866 2HD2 LEU 116 2HD2 LEU 116 4.680 12.233 -1.175 867 3HD2 LEU 116 3HD2 LEU 116 4.633 13.996 -1.160 868 H VAL 117 H VAL 117 4.234 11.488 -7.209 869 HA VAL 117 HA VAL 117 5.490 13.507 -8.794 870 HB VAL 117 HB VAL 117 4.017 11.737 -9.734 871 1HG1 VAL 117 1HG1 VAL 117 2.388 11.850 -7.821 872 2HG1 VAL 117 2HG1 VAL 117 1.745 13.309 -8.550 873 3HG1 VAL 117 3HG1 VAL 117 1.640 11.779 -9.416 874 1HG2 VAL 117 1HG2 VAL 117 4.365 14.024 -10.863 875 2HG2 VAL 117 2HG2 VAL 117 2.976 13.081 -11.404 876 3HG2 VAL 117 3HG2 VAL 117 2.747 14.424 -10.284 877 H ARG 118 H ARG 118 5.277 15.728 -8.730 878 HA ARG 118 HA ARG 118 3.685 16.941 -6.620 879 1HB ARG 118 1HB ARG 118 5.434 18.015 -8.832 880 2HB ARG 118 2HB ARG 118 4.458 19.100 -7.839 881 1HG ARG 118 1HG ARG 118 6.456 19.039 -6.632 882 2HG ARG 118 2HG ARG 118 5.525 17.769 -5.838 883 1HD ARG 118 1HD ARG 118 6.689 16.046 -6.972 884 2HD ARG 118 2HD ARG 118 7.339 17.163 -8.173 885 HE ARG 118 HE ARG 118 8.516 16.587 -5.604 886 1HH1 ARG 118 1HH1 ARG 118 7.977 19.157 -7.914 887 2HH1 ARG 118 2HH1 ARG 118 9.366 20.047 -7.398 888 1HH2 ARG 118 1HH2 ARG 118 10.303 17.771 -4.970 889 2HH2 ARG 118 2HH2 ARG 118 10.673 19.271 -5.753 890 H ALA 119 H ALA 119 3.290 16.422 -10.072 891 HA ALA 119 HA ALA 119 1.141 18.280 -10.474 892 1HB ALA 119 1HB ALA 119 2.539 17.149 -12.274 893 2HB ALA 119 2HB ALA 119 1.574 15.700 -11.992 894 3HB ALA 119 3HB ALA 119 0.801 17.176 -12.572 895 H ALA 120 H ALA 120 1.282 15.143 -8.994 896 HA ALA 120 HA ALA 120 -1.698 15.020 -8.961 897 1HB ALA 120 1HB ALA 120 0.014 13.102 -9.893 898 2HB ALA 120 2HB ALA 120 -0.194 12.587 -8.219 899 3HB ALA 120 3HB ALA 120 -1.600 12.766 -9.268 900 H ALA 121 H ALA 121 1.226 14.354 -6.971 901 HA ALA 121 HA ALA 121 0.036 13.729 -4.533 902 1HB ALA 121 1HB ALA 121 2.500 13.833 -5.043 903 2HB ALA 121 2HB ALA 121 2.408 15.579 -4.817 904 3HB ALA 121 3HB ALA 121 2.049 14.495 -3.474 905 H GLU 122 H GLU 122 0.440 16.999 -5.907 906 HA GLU 122 HA GLU 122 -0.677 18.234 -3.489 907 1HB GLU 122 1HB GLU 122 -0.480 20.350 -4.718 908 2HB GLU 122 2HB GLU 122 1.016 19.428 -4.852 909 1HG GLU 122 1HG GLU 122 0.774 19.875 -7.081 910 2HG GLU 122 2HG GLU 122 -0.317 18.489 -7.026 911 H LYS 123 H LYS 123 -2.135 16.445 -5.825 912 HA LYS 123 HA LYS 123 -4.514 18.171 -6.097 913 1HB LYS 123 1HB LYS 123 -3.895 15.428 -7.214 914 2HB LYS 123 2HB LYS 123 -5.336 16.370 -7.590 915 1HG LYS 123 1HG LYS 123 -3.474 18.208 -8.163 916 2HG LYS 123 2HG LYS 123 -2.518 16.759 -8.462 917 1HD LYS 123 1HD LYS 123 -3.793 16.117 -10.262 918 2HD LYS 123 2HD LYS 123 -5.273 16.803 -9.590 919 1HE LYS 123 1HE LYS 123 -3.864 19.076 -9.967 920 2HE LYS 123 2HE LYS 123 -3.177 18.090 -11.259 921 1HZ LYS 123 1HZ LYS 123 -6.096 18.235 -10.867 922 2HZ LYS 123 2HZ LYS 123 -5.285 19.445 -11.735 923 3HZ LYS 123 3HZ LYS 123 -5.224 17.833 -12.269 924 H ARG 124 H ARG 124 -6.346 17.797 -4.888 925 HA ARG 124 HA ARG 124 -6.176 16.174 -2.537 926 1HB ARG 124 1HB ARG 124 -8.419 17.664 -3.884 927 2HB ARG 124 2HB ARG 124 -8.727 16.654 -2.473 928 1HG ARG 124 1HG ARG 124 -7.108 17.909 -1.158 929 2HG ARG 124 2HG ARG 124 -6.652 18.861 -2.572 930 1HD ARG 124 1HD ARG 124 -8.539 20.156 -2.480 931 2HD ARG 124 2HD ARG 124 -9.544 18.831 -1.893 932 HE ARG 124 HE ARG 124 -7.790 19.434 0.207 933 1HH1 ARG 124 1HH1 ARG 124 -10.239 21.112 -1.643 934 2HH1 ARG 124 2HH1 ARG 124 -10.652 22.161 -0.333 935 1HH2 ARG 124 1HH2 ARG 124 -8.358 20.812 1.875 936 2HH2 ARG 124 2HH2 ARG 124 -9.601 21.994 1.639 937 H TRP 125 H TRP 125 -6.214 14.022 -2.548 938 HA TRP 125 HA TRP 125 -8.084 12.594 -4.409 939 1HB TRP 125 1HB TRP 125 -5.505 11.568 -3.176 940 2HB TRP 125 2HB TRP 125 -6.529 10.703 -4.316 941 HD1 TRP 125 HD1 TRP 125 -3.549 12.777 -4.219 942 HE1 TRP 125 HE1 TRP 125 -2.984 13.717 -6.551 943 HE3 TRP 125 HE3 TRP 125 -7.924 11.812 -6.657 944 HZ2 TRP 125 HZ2 TRP 125 -4.195 13.998 -9.108 945 HZ3 TRP 125 HZ3 TRP 125 -8.190 12.404 -9.039 946 HH2 TRP 125 HH2 TRP 125 -6.339 13.507 -10.274 947 H ASP 126 H ASP 126 -8.945 10.531 -3.435 948 HA ASP 126 HA ASP 126 -8.904 10.542 -0.463 949 1HB ASP 126 1HB ASP 126 -11.353 10.257 -0.367 950 2HB ASP 126 2HB ASP 126 -10.906 11.801 -1.085 951 H ARG 127 H ARG 127 -8.052 8.803 -2.954 952 HA ARG 127 HA ARG 127 -8.673 6.232 -1.649 953 1HB ARG 127 1HB ARG 127 -9.336 6.852 -4.549 954 2HB ARG 127 2HB ARG 127 -9.281 5.224 -3.878 955 1HG ARG 127 1HG ARG 127 -10.906 6.431 -2.068 956 2HG ARG 127 2HG ARG 127 -11.319 7.350 -3.515 957 1HD ARG 127 1HD ARG 127 -11.922 5.352 -4.704 958 2HD ARG 127 2HD ARG 127 -11.243 4.331 -3.445 959 HE ARG 127 HE ARG 127 -13.144 5.699 -2.058 960 1HH1 ARG 127 1HH1 ARG 127 -13.269 4.025 -5.132 961 2HH1 ARG 127 2HH1 ARG 127 -14.948 3.656 -4.970 962 1HH2 ARG 127 1HH2 ARG 127 -15.310 5.189 -1.896 963 2HH2 ARG 127 2HH2 ARG 127 -16.092 4.303 -3.162 964 H VAL 128 H VAL 128 -7.037 4.634 -2.231 965 HA VAL 128 HA VAL 128 -4.876 5.627 -4.009 966 HB VAL 128 HB VAL 128 -4.420 6.297 -1.619 967 1HG1 VAL 128 1HG1 VAL 128 -5.159 3.625 -1.092 968 2HG1 VAL 128 2HG1 VAL 128 -3.428 3.714 -0.767 969 3HG1 VAL 128 3HG1 VAL 128 -4.539 4.806 0.058 970 1HG2 VAL 128 1HG2 VAL 128 -2.601 4.491 -3.189 971 2HG2 VAL 128 2HG2 VAL 128 -2.549 6.246 -3.030 972 3HG2 VAL 128 3HG2 VAL 128 -2.066 5.223 -1.677 973 H LYS 129 H LYS 129 -3.677 3.983 -5.011 974 HA LYS 129 HA LYS 129 -4.787 1.234 -4.650 975 1HB LYS 129 1HB LYS 129 -5.036 2.279 -6.902 976 2HB LYS 129 2HB LYS 129 -3.281 2.396 -7.008 977 1HG LYS 129 1HG LYS 129 -3.540 -0.228 -6.358 978 2HG LYS 129 2HG LYS 129 -5.034 0.018 -7.263 979 1HD LYS 129 1HD LYS 129 -3.385 1.277 -8.936 980 2HD LYS 129 2HD LYS 129 -2.203 0.198 -8.195 981 1HE LYS 129 1HE LYS 129 -3.179 -1.698 -9.066 982 2HE LYS 129 2HE LYS 129 -4.800 -1.002 -9.037 983 1HZ LYS 129 1HZ LYS 129 -2.650 -0.182 -10.913 984 2HZ LYS 129 2HZ LYS 129 -3.894 -1.271 -11.297 985 3HZ LYS 129 3HZ LYS 129 -4.265 0.346 -10.925 986 H ILE 130 H ILE 130 -3.476 -0.096 -3.518 987 HA ILE 130 HA ILE 130 -0.528 0.414 -3.563 988 HB ILE 130 HB ILE 130 -2.194 -1.187 -1.586 989 1HG1 ILE 130 1HG1 ILE 130 -2.694 1.232 -1.500 990 2HG1 ILE 130 2HG1 ILE 130 -1.824 0.714 -0.058 991 1HG2 ILE 130 1HG2 ILE 130 0.711 -0.306 -1.529 992 2HG2 ILE 130 2HG2 ILE 130 -0.133 -1.106 -0.204 993 3HG2 ILE 130 3HG2 ILE 130 0.132 -1.960 -1.724 994 1HD1 ILE 130 1HD1 ILE 130 0.127 1.462 -2.004 995 2HD1 ILE 130 2HD1 ILE 130 -1.084 2.741 -1.946 996 3HD1 ILE 130 3HD1 ILE 130 -0.242 2.259 -0.475 997 H VAL 131 H VAL 131 0.610 -1.005 -4.871 998 HA VAL 131 HA VAL 131 -0.441 -3.783 -5.117 999 HB VAL 131 HB VAL 131 0.845 -2.095 -7.276 1000 1HG1 VAL 131 1HG1 VAL 131 -0.317 -4.880 -7.243 1001 2HG1 VAL 131 2HG1 VAL 131 0.079 -3.998 -8.716 1002 3HG1 VAL 131 3HG1 VAL 131 1.354 -4.431 -7.576 1003 1HG2 VAL 131 1HG2 VAL 131 -1.989 -2.739 -6.536 1004 2HG2 VAL 131 2HG2 VAL 131 -1.305 -1.215 -7.103 1005 3HG2 VAL 131 3HG2 VAL 131 -1.570 -2.540 -8.237 1006 H CYS 132 H CYS 132 1.012 -5.202 -4.319 1007 HA CYS 132 HA CYS 132 3.879 -4.464 -4.079 1008 1HB CYS 132 1HB CYS 132 3.181 -5.462 -2.083 1009 2HB CYS 132 2HB CYS 132 2.098 -6.574 -2.890 1010 HG CYS 132 HG CYS 132 4.783 -7.451 -3.708 1011 H SER 133 H SER 133 5.526 -5.703 -5.171 1012 HA SER 133 HA SER 133 4.613 -7.718 -7.151 1013 1HB SER 133 1HB SER 133 5.199 -5.008 -7.812 1014 2HB SER 133 2HB SER 133 6.504 -5.995 -8.459 1015 HG SER 133 HG SER 133 4.042 -5.700 -9.389 1016 H GLN 134 H GLN 134 5.951 -9.386 -7.175 1017 HA GLN 134 HA GLN 134 8.539 -9.777 -7.608 1018 1HB GLN 134 1HB GLN 134 8.388 -8.559 -4.926 1019 2HB GLN 134 2HB GLN 134 9.394 -10.002 -5.044 1020 1HG GLN 134 1HG GLN 134 9.972 -8.465 -7.357 1021 2HG GLN 134 2HG GLN 134 9.952 -7.332 -6.016 1022 1HE2 GLN 134 2HE2 GLN 134 12.365 -8.130 -7.437 1023 2HE2 GLN 134 1HE2 GLN 134 13.359 -8.950 -6.333 1024 HA PRO 135 HA PRO 135 6.889 -13.779 -6.392 1025 1HB PRO 135 1HB PRO 135 8.793 -15.303 -7.612 1026 2HB PRO 135 2HB PRO 135 7.496 -14.488 -8.498 1027 1HG PRO 135 1HG PRO 135 10.369 -13.865 -8.400 1028 2HG PRO 135 2HG PRO 135 9.161 -13.427 -9.616 1029 1HD PRO 135 1HD PRO 135 10.224 -11.764 -7.536 1030 2HD PRO 135 2HD PRO 135 8.955 -11.356 -8.712 1031 H TYR 136 H TYR 136 7.284 -13.815 -4.120 1032 HA TYR 136 HA TYR 136 9.939 -14.938 -3.335 1033 1HB TYR 136 1HB TYR 136 9.558 -13.659 -1.123 1034 2HB TYR 136 2HB TYR 136 10.077 -12.728 -2.525 1035 HD1 TYR 136 HD1 TYR 136 7.147 -13.639 -0.429 1036 HD2 TYR 136 HD2 TYR 136 8.659 -11.063 -3.517 1037 HE1 TYR 136 HE1 TYR 136 5.127 -12.216 -0.233 1038 HE2 TYR 136 HE2 TYR 136 6.637 -9.642 -3.320 1039 HH TYR 136 HH TYR 136 4.770 -9.432 -0.930 1040 H SER 137 H SER 137 6.958 -15.952 -3.714 1041 HA SER 137 HA SER 137 7.080 -17.679 -1.306 1042 1HB SER 137 1HB SER 137 5.190 -15.578 -1.605 1043 2HB SER 137 2HB SER 137 4.315 -17.085 -1.844 1044 HG SER 137 HG SER 137 5.509 -16.048 0.407 1045 H LYS 138 H LYS 138 4.760 -19.123 -1.752 1046 HA LYS 138 HA LYS 138 4.304 -19.888 -4.473 1047 1HB LYS 138 1HB LYS 138 6.690 -20.664 -4.208 1048 2HB LYS 138 2HB LYS 138 6.134 -21.764 -2.947 1049 1HG LYS 138 1HG LYS 138 4.946 -23.096 -4.438 1050 2HG LYS 138 2HG LYS 138 4.755 -21.792 -5.609 1051 1HD LYS 138 1HD LYS 138 7.334 -21.911 -5.852 1052 2HD LYS 138 2HD LYS 138 7.189 -23.486 -5.071 1053 1HE LYS 138 1HE LYS 138 5.292 -23.854 -6.877 1054 2HE LYS 138 2HE LYS 138 6.174 -22.599 -7.747 1055 1HZ LYS 138 1HZ LYS 138 8.209 -23.941 -7.411 1056 2HZ LYS 138 2HZ LYS 138 7.248 -25.183 -6.760 1057 3HZ LYS 138 3HZ LYS 138 7.046 -24.709 -8.379 1058 H ASP 139 H ASP 139 4.544 -21.064 -1.125 1059 HA ASP 139 HA ASP 139 1.944 -22.458 -1.511 1060 1HB ASP 139 1HB ASP 139 2.644 -23.769 0.523 1061 2HB ASP 139 2HB ASP 139 3.657 -24.037 -0.889 1062 H SER 140 H SER 140 3.753 -20.249 0.485 1063 HA SER 140 HA SER 140 1.362 -19.766 2.177 1064 1HB SER 140 1HB SER 140 3.256 -18.329 3.383 1065 2HB SER 140 2HB SER 140 3.090 -20.055 3.670 1066 HG SER 140 HG SER 140 4.972 -18.638 2.157 1067 HA PRO 141 HA PRO 141 0.911 -15.796 0.154 1068 1HB PRO 141 1HB PRO 141 -0.828 -14.668 1.925 1069 2HB PRO 141 2HB PRO 141 -1.294 -15.940 0.790 1070 1HG PRO 141 1HG PRO 141 -0.959 -16.077 3.700 1071 2HG PRO 141 2HG PRO 141 -1.869 -17.139 2.617 1072 1HD PRO 141 1HD PRO 141 0.716 -17.618 3.773 1073 2HD PRO 141 2HD PRO 141 -0.182 -18.652 2.641 1074 H PHE 142 H PHE 142 0.825 -13.319 0.998 1075 HA PHE 142 HA PHE 142 2.191 -12.566 3.371 1076 1HB PHE 142 1HB PHE 142 3.909 -13.578 1.268 1077 2HB PHE 142 2HB PHE 142 4.277 -11.885 1.580 1078 HD1 PHE 142 HD1 PHE 142 4.299 -11.255 4.197 1079 HD2 PHE 142 HD2 PHE 142 4.959 -15.170 2.580 1080 HE1 PHE 142 HE1 PHE 142 5.491 -11.909 6.272 1081 HE2 PHE 142 HE2 PHE 142 6.154 -15.831 4.651 1082 HZ PHE 142 HZ PHE 142 6.418 -14.198 6.499 1083 H GLY 143 H GLY 143 3.586 -10.298 2.476 1084 1HA GLY 143 1HA GLY 143 2.703 -8.657 0.487 1085 2HA GLY 143 2HA GLY 143 1.350 -8.595 1.618 1086 H LEU 144 H LEU 144 1.474 -7.052 3.178 1087 HA LEU 144 HA LEU 144 4.174 -6.259 4.114 1088 1HB LEU 144 1HB LEU 144 3.096 -3.821 4.306 1089 2HB LEU 144 2HB LEU 144 4.042 -4.332 2.922 1090 HG LEU 144 HG LEU 144 1.960 -3.128 2.355 1091 1HD1 LEU 144 1HD1 LEU 144 3.082 -5.143 1.024 1092 2HD1 LEU 144 2HD1 LEU 144 1.519 -5.895 1.333 1093 3HD1 LEU 144 3HD1 LEU 144 1.603 -4.369 0.456 1094 1HD2 LEU 144 1HD2 LEU 144 0.728 -5.416 3.845 1095 2HD2 LEU 144 2HD2 LEU 144 0.385 -3.697 3.957 1096 3HD2 LEU 144 3HD2 LEU 144 -0.163 -4.616 2.557 1097 H SER 145 H SER 145 4.154 -5.039 6.133 1098 HA SER 145 HA SER 145 2.323 -6.344 7.997 1099 1HB SER 145 1HB SER 145 4.776 -4.656 8.210 1100 2HB SER 145 2HB SER 145 3.714 -4.760 9.611 1101 HG SER 145 HG SER 145 5.197 -6.754 8.309 1102 H PHE 146 H PHE 146 2.430 -3.262 6.374 1103 HA PHE 146 HA PHE 146 -0.116 -2.454 7.384 1104 1HB PHE 146 1HB PHE 146 0.539 -0.603 8.884 1105 2HB PHE 146 2HB PHE 146 1.145 -2.131 9.521 1106 HD1 PHE 146 HD1 PHE 146 3.546 -2.734 9.270 1107 HD2 PHE 146 HD2 PHE 146 2.019 1.079 8.035 1108 HE1 PHE 146 HE1 PHE 146 5.859 -1.876 9.063 1109 HE2 PHE 146 HE2 PHE 146 4.321 1.958 7.846 1110 HZ PHE 146 HZ PHE 146 6.267 0.462 8.345 1111 H VAL 147 H VAL 147 -0.649 -0.215 6.708 1112 HA VAL 147 HA VAL 147 1.257 1.008 4.806 1113 HB VAL 147 HB VAL 147 -0.502 1.262 3.093 1114 1HG1 VAL 147 1HG1 VAL 147 1.062 -0.659 3.019 1115 2HG1 VAL 147 2HG1 VAL 147 -0.092 -1.616 3.947 1116 3HG1 VAL 147 3HG1 VAL 147 -0.507 -1.064 2.325 1117 1HG2 VAL 147 1HG2 VAL 147 -2.245 0.610 5.183 1118 2HG2 VAL 147 2HG2 VAL 147 -2.681 0.766 3.483 1119 3HG2 VAL 147 3HG2 VAL 147 -2.276 -0.816 4.146 1120 H ARG 148 H ARG 148 1.052 3.248 4.740 1121 HA ARG 148 HA ARG 148 -1.198 4.535 6.178 1122 1HB ARG 148 1HB ARG 148 1.698 5.081 6.876 1123 2HB ARG 148 2HB ARG 148 0.278 5.731 7.681 1124 1HG ARG 148 1HG ARG 148 -0.336 3.255 8.134 1125 2HG ARG 148 2HG ARG 148 1.349 2.923 7.740 1126 1HD ARG 148 1HD ARG 148 1.209 5.166 9.551 1127 2HD ARG 148 2HD ARG 148 0.303 3.807 10.213 1128 HE ARG 148 HE ARG 148 2.697 2.695 9.319 1129 1HH1 ARG 148 1HH1 ARG 148 1.769 5.220 11.555 1130 2HH1 ARG 148 2HH1 ARG 148 3.156 4.978 12.558 1131 1HH2 ARG 148 1HH2 ARG 148 4.475 2.417 10.646 1132 2HH2 ARG 148 2HH2 ARG 148 4.671 3.408 12.053 1133 H PHE 149 H PHE 149 -1.098 6.925 5.945 1134 HA PHE 149 HA PHE 149 0.565 7.970 3.725 1135 1HB PHE 149 1HB PHE 149 -2.470 8.141 3.780 1136 2HB PHE 149 2HB PHE 149 -1.424 8.961 2.621 1137 HD1 PHE 149 HD1 PHE 149 0.392 7.288 1.495 1138 HD2 PHE 149 HD2 PHE 149 -3.435 6.153 3.080 1139 HE1 PHE 149 HE1 PHE 149 0.403 5.254 0.072 1140 HE2 PHE 149 HE2 PHE 149 -3.424 4.123 1.653 1141 HZ PHE 149 HZ PHE 149 -1.504 3.674 0.152 1142 H HIS 150 H HIS 150 0.657 10.365 3.805 1143 HA HIS 150 HA HIS 150 -0.803 11.741 5.933 1144 1HB HIS 150 1HB HIS 150 1.684 12.544 6.746 1145 2HB HIS 150 2HB HIS 150 0.723 11.325 7.563 1146 HD1 HIS 150 HD1 HIS 150 3.949 11.821 5.979 1147 HD2 HIS 150 HD2 HIS 150 1.431 8.563 6.616 1148 HE1 HIS 150 HE1 HIS 150 5.364 9.747 5.652 1149 H SER 151 H SER 151 -0.752 13.987 5.669 1150 HA SER 151 HA SER 151 0.708 14.934 3.241 1151 1HB SER 151 1HB SER 151 -1.256 16.621 3.146 1152 2HB SER 151 2HB SER 151 -1.563 14.962 2.641 1153 HG SER 151 HG SER 151 -2.703 16.355 4.610 Start of MODEL 23 1 H MET 1 H MET 1 -6.349 18.564 8.808 2 HA MET 1 HA MET 1 -5.536 17.943 11.118 3 1HB MET 1 1HB MET 1 -6.394 15.341 9.963 4 2HB MET 1 2HB MET 1 -4.847 15.344 10.811 5 1HG MET 1 1HG MET 1 -5.812 15.966 12.846 6 2HG MET 1 2HG MET 1 -7.235 16.663 12.072 7 1HE MET 1 1HE MET 1 -6.090 14.487 14.240 8 2HE MET 1 2HE MET 1 -7.051 13.012 14.251 9 3HE MET 1 3HE MET 1 -5.590 13.094 13.271 10 HA PRO 2 HA PRO 2 -1.657 17.987 8.907 11 1HB PRO 2 1HB PRO 2 0.063 17.215 10.879 12 2HB PRO 2 2HB PRO 2 -0.775 18.773 10.878 13 1HG PRO 2 1HG PRO 2 -1.182 16.453 12.616 14 2HG PRO 2 2HG PRO 2 -1.703 18.129 12.839 15 1HD PRO 2 1HD PRO 2 -3.273 15.870 11.923 16 2HD PRO 2 2HD PRO 2 -3.814 17.535 12.237 17 H GLU 3 H GLU 3 -3.134 15.207 9.040 18 HA GLU 3 HA GLU 3 -0.911 13.692 7.848 19 1HB GLU 3 1HB GLU 3 -2.402 12.711 10.305 20 2HB GLU 3 2HB GLU 3 -1.332 11.713 9.320 21 1HG GLU 3 1HG GLU 3 0.501 13.392 9.755 22 2HG GLU 3 2HG GLU 3 -0.579 14.180 10.906 23 H ILE 4 H ILE 4 -2.076 11.253 7.547 24 HA ILE 4 HA ILE 4 -4.641 11.889 6.145 25 HB ILE 4 HB ILE 4 -2.589 9.734 5.557 26 1HG1 ILE 4 1HG1 ILE 4 -1.831 12.016 4.978 27 2HG1 ILE 4 2HG1 ILE 4 -2.118 11.058 3.531 28 1HG2 ILE 4 1HG2 ILE 4 -5.224 10.448 4.262 29 2HG2 ILE 4 2HG2 ILE 4 -3.975 9.538 3.412 30 3HG2 ILE 4 3HG2 ILE 4 -4.704 8.878 4.877 31 1HD1 ILE 4 1HD1 ILE 4 -4.445 12.092 3.475 32 2HD1 ILE 4 2HD1 ILE 4 -3.882 13.210 4.714 33 3HD1 ILE 4 3HD1 ILE 4 -3.114 13.194 3.125 34 H ARG 5 H ARG 5 -6.315 10.238 6.256 35 HA ARG 5 HA ARG 5 -5.949 8.221 8.424 36 1HB ARG 5 1HB ARG 5 -7.288 10.500 8.930 37 2HB ARG 5 2HB ARG 5 -8.599 9.563 8.214 38 1HG ARG 5 1HG ARG 5 -8.767 8.962 10.463 39 2HG ARG 5 2HG ARG 5 -7.754 7.668 9.822 40 1HD ARG 5 1HD ARG 5 -5.734 9.003 10.506 41 2HD ARG 5 2HD ARG 5 -6.820 10.146 11.297 42 HE ARG 5 HE ARG 5 -6.103 7.495 12.279 43 1HH1 ARG 5 1HH1 ARG 5 -8.524 10.020 12.316 44 2HH1 ARG 5 2HH1 ARG 5 -9.185 9.504 13.829 45 1HH2 ARG 5 1HH2 ARG 5 -6.984 6.863 14.233 46 2HH2 ARG 5 2HH2 ARG 5 -8.322 7.734 14.906 47 H LEU 6 H LEU 6 -6.422 6.254 7.608 48 HA LEU 6 HA LEU 6 -7.910 5.990 5.095 49 1HB LEU 6 1HB LEU 6 -6.036 4.418 6.628 50 2HB LEU 6 2HB LEU 6 -7.458 3.440 6.282 51 HG LEU 6 HG LEU 6 -7.260 4.065 3.876 52 1HD1 LEU 6 1HD1 LEU 6 -4.661 5.332 4.807 53 2HD1 LEU 6 2HD1 LEU 6 -5.164 5.143 3.126 54 3HD1 LEU 6 3HD1 LEU 6 -6.071 6.205 4.203 55 1HD2 LEU 6 1HD2 LEU 6 -5.015 2.694 5.341 56 2HD2 LEU 6 2HD2 LEU 6 -6.299 1.979 4.365 57 3HD2 LEU 6 3HD2 LEU 6 -4.972 2.839 3.585 58 H ARG 7 H ARG 7 -9.892 4.821 4.876 59 HA ARG 7 HA ARG 7 -11.489 4.679 7.398 60 1HB ARG 7 1HB ARG 7 -12.282 6.298 5.649 61 2HB ARG 7 2HB ARG 7 -12.516 4.931 4.559 62 1HG ARG 7 1HG ARG 7 -13.979 3.906 6.395 63 2HG ARG 7 2HG ARG 7 -13.940 5.493 7.165 64 1HD ARG 7 1HD ARG 7 -14.612 6.288 4.704 65 2HD ARG 7 2HD ARG 7 -15.260 4.648 4.624 66 HE ARG 7 HE ARG 7 -16.046 6.061 7.050 67 1HH1 ARG 7 1HH1 ARG 7 -16.799 5.499 3.680 68 2HH1 ARG 7 2HH1 ARG 7 -18.468 5.904 3.882 69 1HH2 ARG 7 1HH2 ARG 7 -18.212 6.574 7.266 70 2HH2 ARG 7 2HH2 ARG 7 -19.262 6.507 5.891 71 H HIS 8 H HIS 8 -11.199 3.110 4.210 72 HA HIS 8 HA HIS 8 -11.241 0.460 5.439 73 1HB HIS 8 1HB HIS 8 -13.281 -0.290 4.212 74 2HB HIS 8 2HB HIS 8 -13.641 0.926 5.437 75 HD1 HIS 8 HD1 HIS 8 -15.327 2.522 4.539 76 HD2 HIS 8 HD2 HIS 8 -12.610 1.366 1.597 77 HE1 HIS 8 HE1 HIS 8 -15.948 3.804 2.443 78 H VAL 9 H VAL 9 -11.089 -1.256 3.689 79 HA VAL 9 HA VAL 9 -9.264 -0.333 1.598 80 HB VAL 9 HB VAL 9 -8.834 -2.454 2.762 81 1HG1 VAL 9 1HG1 VAL 9 -11.586 -2.823 2.575 82 2HG1 VAL 9 2HG1 VAL 9 -10.936 -4.012 1.447 83 3HG1 VAL 9 3HG1 VAL 9 -10.418 -4.020 3.133 84 1HG2 VAL 9 1HG2 VAL 9 -9.582 -2.808 -0.159 85 2HG2 VAL 9 2HG2 VAL 9 -8.024 -2.260 0.461 86 3HG2 VAL 9 3HG2 VAL 9 -8.561 -3.914 0.758 87 H VAL 10 H VAL 10 -10.615 0.972 0.267 88 HA VAL 10 HA VAL 10 -13.161 0.378 -0.720 89 HB VAL 10 HB VAL 10 -12.256 2.548 -1.178 90 1HG1 VAL 10 1HG1 VAL 10 -9.841 1.564 -1.384 91 2HG1 VAL 10 2HG1 VAL 10 -10.226 1.438 -3.097 92 3HG1 VAL 10 3HG1 VAL 10 -10.257 3.008 -2.300 93 1HG2 VAL 10 1HG2 VAL 10 -13.603 1.147 -3.055 94 2HG2 VAL 10 2HG2 VAL 10 -13.100 2.819 -3.301 95 3HG2 VAL 10 3HG2 VAL 10 -12.136 1.501 -3.966 96 H SER 11 H SER 11 -10.091 -0.439 -2.433 97 HA SER 11 HA SER 11 -11.648 -2.596 -3.773 98 1HB SER 11 1HB SER 11 -9.209 -1.563 -5.117 99 2HB SER 11 2HB SER 11 -10.733 -2.101 -5.812 100 HG SER 11 HG SER 11 -10.182 0.262 -5.804 101 H CYS 12 H CYS 12 -10.447 -4.594 -4.141 102 HA CYS 12 HA CYS 12 -7.788 -4.789 -2.841 103 1HB CYS 12 1HB CYS 12 -8.525 -6.814 -1.572 104 2HB CYS 12 2HB CYS 12 -9.322 -5.337 -1.035 105 HG CYS 12 HG CYS 12 -11.507 -6.100 -2.095 106 H SER 13 H SER 13 -6.487 -5.857 -4.221 107 HA SER 13 HA SER 13 -7.723 -7.875 -6.049 108 1HB SER 13 1HB SER 13 -6.438 -5.556 -6.789 109 2HB SER 13 2HB SER 13 -5.136 -6.737 -6.875 110 HG SER 13 HG SER 13 -6.115 -7.701 -8.487 111 H SER 14 H SER 14 -6.907 -8.670 -3.538 112 HA SER 14 HA SER 14 -5.583 -10.986 -3.676 113 1HB SER 14 1HB SER 14 -3.581 -8.824 -3.987 114 2HB SER 14 2HB SER 14 -3.163 -10.119 -2.873 115 HG SER 14 HG SER 14 -3.630 -11.595 -4.562 116 H GLN 15 H GLN 15 -7.199 -10.710 -1.896 117 HA GLN 15 HA GLN 15 -5.775 -10.134 0.649 118 1HB GLN 15 1HB GLN 15 -6.964 -8.245 0.950 119 2HB GLN 15 2HB GLN 15 -7.869 -8.532 -0.514 120 1HG GLN 15 1HG GLN 15 -8.683 -9.969 2.000 121 2HG GLN 15 2HG GLN 15 -9.109 -8.278 1.781 122 1HE2 GLN 15 2HE2 GLN 15 -8.893 -10.465 -1.019 123 2HE2 GLN 15 1HE2 GLN 15 -10.559 -10.480 -1.336 124 H ASP 16 H ASP 16 -6.345 -11.508 2.344 125 HA ASP 16 HA ASP 16 -7.892 -13.904 1.578 126 1HB ASP 16 1HB ASP 16 -5.620 -13.552 3.087 127 2HB ASP 16 2HB ASP 16 -6.853 -13.715 4.336 128 H SER 17 H SER 17 -8.891 -14.638 4.110 129 HA SER 17 HA SER 17 -11.154 -12.737 4.329 130 1HB SER 17 1HB SER 17 -10.762 -15.639 4.908 131 2HB SER 17 2HB SER 17 -11.951 -14.768 5.872 132 HG SER 17 HG SER 17 -12.851 -15.639 3.951 133 H THR 18 H THR 18 -9.132 -14.684 6.562 134 HA THR 18 HA THR 18 -9.831 -13.065 8.858 135 HB THR 18 HB THR 18 -7.426 -14.286 9.512 136 HG1 THR 18 HG1 THR 18 -8.824 -16.117 7.880 137 1HG2 THR 18 1HG2 THR 18 -10.304 -15.156 9.686 138 2HG2 THR 18 2HG2 THR 18 -9.014 -16.158 10.350 139 3HG2 THR 18 3HG2 THR 18 -9.264 -14.522 10.960 140 H HIS 19 H HIS 19 -6.640 -13.468 7.280 141 HA HIS 19 HA HIS 19 -5.854 -10.787 8.239 142 1HB HIS 19 1HB HIS 19 -4.364 -12.972 6.754 143 2HB HIS 19 2HB HIS 19 -3.648 -11.410 7.156 144 HD1 HIS 19 HD1 HIS 19 -2.604 -11.238 9.422 145 HD2 HIS 19 HD2 HIS 19 -5.333 -14.383 9.218 146 HE1 HIS 19 HE1 HIS 19 -2.469 -12.450 11.642 147 H CYS 20 H CYS 20 -7.705 -9.997 6.748 148 HA CYS 20 HA CYS 20 -7.035 -9.933 3.882 149 1HB CYS 20 1HB CYS 20 -9.111 -8.569 3.686 150 2HB CYS 20 2HB CYS 20 -9.389 -10.114 4.474 151 HG CYS 20 HG CYS 20 -10.387 -8.729 6.281 152 H ALA 21 H ALA 21 -7.201 -7.707 2.807 153 HA ALA 21 HA ALA 21 -5.060 -6.060 3.723 154 1HB ALA 21 1HB ALA 21 -7.072 -5.987 1.549 155 2HB ALA 21 2HB ALA 21 -6.411 -4.422 2.023 156 3HB ALA 21 3HB ALA 21 -5.332 -5.708 1.483 157 H GLU 22 H GLU 22 -8.483 -6.054 4.431 158 HA GLU 22 HA GLU 22 -8.773 -3.349 5.295 159 1HB GLU 22 1HB GLU 22 -10.449 -5.507 5.117 160 2HB GLU 22 2HB GLU 22 -10.230 -5.392 6.864 161 1HG GLU 22 1HG GLU 22 -10.782 -2.937 6.694 162 2HG GLU 22 2HG GLU 22 -11.193 -3.205 5.000 163 H ASN 23 H ASN 23 -7.025 -6.007 6.694 164 HA ASN 23 HA ASN 23 -7.091 -5.167 9.446 165 1HB ASN 23 1HB ASN 23 -5.244 -6.868 7.804 166 2HB ASN 23 2HB ASN 23 -4.811 -6.435 9.458 167 1HD2 ASN 23 2HD2 ASN 23 -7.118 -8.253 7.487 168 2HD2 ASN 23 1HD2 ASN 23 -7.829 -9.099 8.777 169 H LEU 24 H LEU 24 -5.590 -3.861 6.660 170 HA LEU 24 HA LEU 24 -3.304 -2.605 7.827 171 1HB LEU 24 1HB LEU 24 -4.975 -1.654 5.478 172 2HB LEU 24 2HB LEU 24 -3.299 -1.227 5.820 173 HG LEU 24 HG LEU 24 -4.050 -4.123 5.522 174 1HD1 LEU 24 1HD1 LEU 24 -4.899 -2.636 3.561 175 2HD1 LEU 24 2HD1 LEU 24 -3.189 -2.474 3.161 176 3HD1 LEU 24 3HD1 LEU 24 -3.941 -4.069 3.185 177 1HD2 LEU 24 1HD2 LEU 24 -1.621 -2.436 5.560 178 2HD2 LEU 24 2HD2 LEU 24 -1.839 -4.114 6.054 179 3HD2 LEU 24 3HD2 LEU 24 -1.621 -3.719 4.350 180 H LEU 25 H LEU 25 -6.737 -1.905 7.829 181 HA LEU 25 HA LEU 25 -6.719 0.852 8.476 182 1HB LEU 25 1HB LEU 25 -8.547 -1.472 8.988 183 2HB LEU 25 2HB LEU 25 -8.846 0.030 9.841 184 HG LEU 25 HG LEU 25 -10.130 -0.137 7.714 185 1HD1 LEU 25 1HD1 LEU 25 -8.262 2.024 8.417 186 2HD1 LEU 25 2HD1 LEU 25 -8.800 2.062 6.739 187 3HD1 LEU 25 3HD1 LEU 25 -9.981 2.093 8.044 188 1HD2 LEU 25 1HD2 LEU 25 -7.368 -0.089 6.452 189 2HD2 LEU 25 2HD2 LEU 25 -8.499 -1.443 6.416 190 3HD2 LEU 25 3HD2 LEU 25 -8.890 0.056 5.573 191 H LYS 26 H LYS 26 -5.780 -1.967 10.300 192 HA LYS 26 HA LYS 26 -5.512 -0.279 12.758 193 1HB LYS 26 1HB LYS 26 -5.556 -3.311 12.652 194 2HB LYS 26 2HB LYS 26 -5.677 -2.284 14.078 195 1HG LYS 26 1HG LYS 26 -7.920 -2.570 13.827 196 2HG LYS 26 2HG LYS 26 -7.762 -1.339 12.574 197 1HD LYS 26 1HD LYS 26 -8.745 -2.952 11.278 198 2HD LYS 26 2HD LYS 26 -7.084 -3.529 11.140 199 1HE LYS 26 1HE LYS 26 -7.789 -4.734 13.458 200 2HE LYS 26 2HE LYS 26 -9.362 -4.671 12.664 201 1HZ LYS 26 1HZ LYS 26 -6.898 -5.722 11.388 202 2HZ LYS 26 2HZ LYS 26 -8.056 -6.695 12.157 203 3HZ LYS 26 3HZ LYS 26 -8.482 -5.800 10.777 204 H ALA 27 H ALA 27 -3.540 0.360 11.315 205 HA ALA 27 HA ALA 27 -1.349 -1.316 10.797 206 1HB ALA 27 1HB ALA 27 -1.596 1.600 11.468 207 2HB ALA 27 2HB ALA 27 0.006 0.874 11.323 208 3HB ALA 27 3HB ALA 27 -1.105 0.842 9.953 209 H ASP 28 H ASP 28 -2.490 -0.128 13.881 210 HA ASP 28 HA ASP 28 -0.098 -1.371 15.184 211 1HB ASP 28 1HB ASP 28 -1.856 0.838 16.296 212 2HB ASP 28 2HB ASP 28 -0.383 0.197 17.025 213 H THR 29 H THR 29 -1.301 -3.428 15.110 214 HA THR 29 HA THR 29 -2.954 -3.762 17.510 215 HB THR 29 HB THR 29 -4.664 -5.076 15.963 216 HG1 THR 29 HG1 THR 29 -4.542 -4.574 13.941 217 1HG2 THR 29 1HG2 THR 29 -5.000 -3.019 17.465 218 2HG2 THR 29 2HG2 THR 29 -4.797 -2.061 15.999 219 3HG2 THR 29 3HG2 THR 29 -6.125 -3.215 16.122 220 H TYR 30 H TYR 30 -2.998 -5.961 14.716 221 HA TYR 30 HA TYR 30 -0.733 -7.535 15.458 222 1HB TYR 30 1HB TYR 30 -1.923 -9.455 16.520 223 2HB TYR 30 2HB TYR 30 -1.983 -7.993 17.506 224 HD1 TYR 30 HD1 TYR 30 -4.056 -6.639 17.635 225 HD2 TYR 30 HD2 TYR 30 -3.916 -10.362 15.498 226 HE1 TYR 30 HE1 TYR 30 -6.533 -6.716 17.607 227 HE2 TYR 30 HE2 TYR 30 -6.395 -10.439 15.470 228 HH TYR 30 HH TYR 30 -8.307 -8.132 15.754 229 H ARG 31 H ARG 31 -2.170 -6.619 13.068 230 HA ARG 31 HA ARG 31 -2.176 -9.161 11.607 231 1HB ARG 31 1HB ARG 31 -4.691 -7.531 12.005 232 2HB ARG 31 2HB ARG 31 -4.482 -8.585 10.605 233 1HG ARG 31 1HG ARG 31 -3.763 -10.329 12.500 234 2HG ARG 31 2HG ARG 31 -4.799 -9.300 13.488 235 1HD ARG 31 1HD ARG 31 -6.013 -9.921 10.899 236 2HD ARG 31 2HD ARG 31 -5.654 -11.370 11.836 237 HE ARG 31 HE ARG 31 -6.961 -9.297 13.413 238 1HH1 ARG 31 1HH1 ARG 31 -7.451 -11.988 11.234 239 2HH1 ARG 31 2HH1 ARG 31 -9.044 -12.304 11.822 240 1HH2 ARG 31 1HH2 ARG 31 -9.027 -9.740 14.142 241 2HH2 ARG 31 2HH2 ARG 31 -9.930 -11.047 13.451 242 H LYS 32 H LYS 32 -1.697 -8.820 9.422 243 HA LYS 32 HA LYS 32 -1.518 -5.965 8.537 244 1HB LYS 32 1HB LYS 32 0.453 -8.094 7.690 245 2HB LYS 32 2HB LYS 32 0.604 -6.345 7.556 246 1HG LYS 32 1HG LYS 32 1.685 -6.316 9.539 247 2HG LYS 32 2HG LYS 32 0.218 -6.896 10.316 248 1HD LYS 32 1HD LYS 32 1.898 -8.910 8.896 249 2HD LYS 32 2HD LYS 32 2.510 -8.275 10.423 250 1HE LYS 32 1HE LYS 32 -0.004 -8.745 11.194 251 2HE LYS 32 2HE LYS 32 0.085 -9.935 9.896 252 1HZ LYS 32 1HZ LYS 32 2.292 -10.585 10.984 253 2HZ LYS 32 2HZ LYS 32 1.714 -9.752 12.347 254 3HZ LYS 32 3HZ LYS 32 0.853 -11.080 11.738 255 H TRP 33 H TRP 33 -0.589 -6.630 5.871 256 HA TRP 33 HA TRP 33 -3.150 -7.686 4.793 257 1HB TRP 33 1HB TRP 33 -2.217 -5.546 3.845 258 2HB TRP 33 2HB TRP 33 -0.822 -6.452 3.294 259 HD1 TRP 33 HD1 TRP 33 -4.340 -7.927 3.076 260 HE1 TRP 33 HE1 TRP 33 -4.950 -8.235 0.572 261 HE3 TRP 33 HE3 TRP 33 -0.392 -5.573 0.970 262 HZ2 TRP 33 HZ2 TRP 33 -3.854 -7.529 -1.996 263 HZ3 TRP 33 HZ3 TRP 33 -0.165 -5.407 -1.503 264 HH2 TRP 33 HH2 TRP 33 -1.897 -6.374 -2.975 265 H ARG 34 H ARG 34 -3.274 -9.557 3.626 266 HA ARG 34 HA ARG 34 -0.783 -10.951 2.867 267 1HB ARG 34 1HB ARG 34 -2.967 -12.247 4.542 268 2HB ARG 34 2HB ARG 34 -1.533 -13.058 3.907 269 1HG ARG 34 1HG ARG 34 -0.119 -11.427 5.183 270 2HG ARG 34 2HG ARG 34 -1.591 -10.788 5.913 271 1HD ARG 34 1HD ARG 34 -2.101 -12.992 6.866 272 2HD ARG 34 2HD ARG 34 -0.664 -13.670 6.099 273 HE ARG 34 HE ARG 34 -0.709 -12.064 8.525 274 1HH1 ARG 34 1HH1 ARG 34 1.188 -12.988 5.734 275 2HH1 ARG 34 2HH1 ARG 34 2.690 -12.616 6.507 276 1HH2 ARG 34 1HH2 ARG 34 1.257 -11.599 9.487 277 2HH2 ARG 34 2HH2 ARG 34 2.732 -11.838 8.610 278 H ALA 35 H ALA 35 -1.068 -11.797 0.841 279 HA ALA 35 HA ALA 35 -3.313 -11.301 -0.761 280 1HB ALA 35 1HB ALA 35 -0.969 -12.132 -1.448 281 2HB ALA 35 2HB ALA 35 -1.585 -13.754 -1.145 282 3HB ALA 35 3HB ALA 35 -2.336 -12.741 -2.378 283 H ALA 36 H ALA 36 -4.959 -12.709 -1.598 284 HA ALA 36 HA ALA 36 -6.329 -14.211 0.424 285 1HB ALA 36 1HB ALA 36 -7.127 -12.983 -1.815 286 2HB ALA 36 2HB ALA 36 -6.990 -14.622 -2.452 287 3HB ALA 36 3HB ALA 36 -8.060 -14.291 -1.089 288 H LYS 37 H LYS 37 -3.987 -15.106 -2.002 289 HA LYS 37 HA LYS 37 -4.205 -17.920 -1.082 290 1HB LYS 37 1HB LYS 37 -3.754 -18.641 -3.440 291 2HB LYS 37 2HB LYS 37 -5.319 -17.855 -3.247 292 1HG LYS 37 1HG LYS 37 -4.333 -15.721 -4.028 293 2HG LYS 37 2HG LYS 37 -2.782 -16.531 -4.253 294 1HD LYS 37 1HD LYS 37 -4.235 -18.206 -5.703 295 2HD LYS 37 2HD LYS 37 -5.312 -16.815 -5.830 296 1HE LYS 37 1HE LYS 37 -2.969 -15.588 -6.339 297 2HE LYS 37 2HE LYS 37 -2.578 -17.201 -6.938 298 1HZ LYS 37 1HZ LYS 37 -4.643 -17.117 -8.254 299 2HZ LYS 37 2HZ LYS 37 -4.880 -15.513 -7.755 300 3HZ LYS 37 3HZ LYS 37 -3.527 -15.915 -8.701 301 H ALA 38 H ALA 38 -2.142 -19.030 -2.334 302 HA ALA 38 HA ALA 38 0.194 -17.524 -1.296 303 1HB ALA 38 1HB ALA 38 -0.223 -19.962 -0.711 304 2HB ALA 38 2HB ALA 38 0.126 -20.347 -2.396 305 3HB ALA 38 3HB ALA 38 1.372 -19.620 -1.382 306 H GLY 39 H GLY 39 2.199 -18.597 -2.913 307 1HA GLY 39 1HA GLY 39 3.277 -18.239 -4.972 308 2HA GLY 39 2HA GLY 39 1.682 -18.300 -5.729 309 H GLU 40 H GLU 40 2.964 -16.116 -3.255 310 HA GLU 40 HA GLU 40 1.726 -13.774 -4.159 311 1HB GLU 40 1HB GLU 40 4.213 -14.272 -2.549 312 2HB GLU 40 2HB GLU 40 3.731 -12.630 -2.967 313 1HG GLU 40 1HG GLU 40 1.390 -13.950 -2.042 314 2HG GLU 40 2HG GLU 40 2.679 -14.351 -0.914 315 H LYS 41 H LYS 41 1.964 -13.795 -6.440 316 HA LYS 41 HA LYS 41 4.648 -13.255 -7.574 317 1HB LYS 41 1HB LYS 41 2.998 -14.754 -8.761 318 2HB LYS 41 2HB LYS 41 1.964 -13.342 -8.989 319 1HG LYS 41 1HG LYS 41 3.450 -12.325 -10.470 320 2HG LYS 41 2HG LYS 41 4.840 -13.208 -9.839 321 1HD LYS 41 1HD LYS 41 4.026 -15.281 -10.850 322 2HD LYS 41 2HD LYS 41 2.572 -14.458 -11.417 323 1HE LYS 41 1HE LYS 41 5.331 -13.504 -12.189 324 2HE LYS 41 2HE LYS 41 4.488 -14.745 -13.116 325 1HZ LYS 41 1HZ LYS 41 2.585 -13.154 -13.250 326 2HZ LYS 41 2HZ LYS 41 3.607 -11.962 -12.597 327 3HZ LYS 41 3HZ LYS 41 3.974 -12.674 -14.097 328 H THR 42 H THR 42 1.429 -11.749 -7.479 329 HA THR 42 HA THR 42 2.585 -9.102 -7.032 330 HB THR 42 HB THR 42 1.342 -8.159 -9.067 331 HG1 THR 42 HG1 THR 42 0.120 -9.798 -9.759 332 1HG2 THR 42 1HG2 THR 42 3.907 -8.803 -8.788 333 2HG2 THR 42 2HG2 THR 42 3.504 -9.976 -10.041 334 3HG2 THR 42 3HG2 THR 42 3.268 -8.254 -10.337 335 H ILE 43 H ILE 43 1.184 -8.217 -5.563 336 HA ILE 43 HA ILE 43 -1.708 -9.004 -5.773 337 HB ILE 43 HB ILE 43 -1.782 -8.539 -3.280 338 1HG1 ILE 43 1HG1 ILE 43 1.221 -8.732 -3.513 339 2HG1 ILE 43 2HG1 ILE 43 0.330 -7.231 -3.254 340 1HG2 ILE 43 1HG2 ILE 43 -1.311 -10.835 -4.575 341 2HG2 ILE 43 2HG2 ILE 43 0.189 -10.725 -3.661 342 3HG2 ILE 43 3HG2 ILE 43 -1.354 -10.740 -2.816 343 1HD1 ILE 43 1HD1 ILE 43 -0.783 -8.738 -1.307 344 2HD1 ILE 43 2HD1 ILE 43 0.812 -9.485 -1.376 345 3HD1 ILE 43 3HD1 ILE 43 0.660 -7.760 -1.044 346 H SER 44 H SER 44 -3.263 -7.344 -5.293 347 HA SER 44 HA SER 44 -2.086 -4.598 -5.126 348 1HB SER 44 1HB SER 44 -4.615 -4.721 -6.593 349 2HB SER 44 2HB SER 44 -3.134 -3.870 -6.988 350 HG SER 44 HG SER 44 -2.801 -5.399 -8.375 351 H VAL 45 H VAL 45 -3.369 -3.068 -3.986 352 HA VAL 45 HA VAL 45 -5.904 -3.928 -2.779 353 HB VAL 45 HB VAL 45 -4.260 -4.936 -1.248 354 1HG1 VAL 45 1HG1 VAL 45 -2.507 -3.100 -1.847 355 2HG1 VAL 45 2HG1 VAL 45 -3.268 -2.186 -0.546 356 3HG1 VAL 45 3HG1 VAL 45 -2.527 -3.750 -0.209 357 1HG2 VAL 45 1HG2 VAL 45 -5.700 -2.488 -0.204 358 2HG2 VAL 45 2HG2 VAL 45 -6.286 -4.152 -0.213 359 3HG2 VAL 45 3HG2 VAL 45 -4.951 -3.692 0.844 360 H VAL 46 H VAL 46 -7.044 -2.117 -3.333 361 HA VAL 46 HA VAL 46 -5.746 0.529 -3.135 362 HB VAL 46 HB VAL 46 -8.589 -0.046 -3.984 363 1HG1 VAL 46 1HG1 VAL 46 -7.806 2.305 -3.410 364 2HG1 VAL 46 2HG1 VAL 46 -6.717 2.184 -4.792 365 3HG1 VAL 46 3HG1 VAL 46 -8.462 2.098 -5.034 366 1HG2 VAL 46 1HG2 VAL 46 -6.015 -0.134 -5.575 367 2HG2 VAL 46 2HG2 VAL 46 -7.256 -1.380 -5.464 368 3HG2 VAL 46 3HG2 VAL 46 -7.585 0.116 -6.337 369 H LEU 47 H LEU 47 -5.857 1.598 -1.251 370 HA LEU 47 HA LEU 47 -7.962 0.859 0.702 371 1HB LEU 47 1HB LEU 47 -5.690 2.796 1.161 372 2HB LEU 47 2HB LEU 47 -6.620 1.904 2.361 373 HG LEU 47 HG LEU 47 -5.517 -0.057 0.630 374 1HD1 LEU 47 1HD1 LEU 47 -3.480 2.028 1.472 375 2HD1 LEU 47 2HD1 LEU 47 -3.090 0.433 0.826 376 3HD1 LEU 47 3HD1 LEU 47 -3.924 1.616 -0.184 377 1HD2 LEU 47 1HD2 LEU 47 -5.950 -0.206 3.093 378 2HD2 LEU 47 2HD2 LEU 47 -4.338 -0.764 2.644 379 3HD2 LEU 47 3HD2 LEU 47 -4.549 0.830 3.368 380 H GLN 48 H GLN 48 -9.276 2.496 1.696 381 HA GLN 48 HA GLN 48 -9.738 4.831 -0.098 382 1HB GLN 48 1HB GLN 48 -11.535 2.998 0.718 383 2HB GLN 48 2HB GLN 48 -11.676 4.140 2.055 384 1HG GLN 48 1HG GLN 48 -11.679 5.195 -0.751 385 2HG GLN 48 2HG GLN 48 -13.148 4.452 -0.120 386 1HE2 GLN 48 2HE2 GLN 48 -11.927 7.431 -0.538 387 2HE2 GLN 48 1HE2 GLN 48 -12.512 8.216 0.847 388 H LEU 49 H LEU 49 -9.456 6.875 0.674 389 HA LEU 49 HA LEU 49 -8.397 7.210 3.402 390 1HB LEU 49 1HB LEU 49 -8.785 9.347 1.283 391 2HB LEU 49 2HB LEU 49 -7.717 9.401 2.685 392 HG LEU 49 HG LEU 49 -7.433 7.467 0.364 393 1HD1 LEU 49 1HD1 LEU 49 -6.951 10.025 0.048 394 2HD1 LEU 49 2HD1 LEU 49 -5.523 9.694 1.029 395 3HD1 LEU 49 3HD1 LEU 49 -5.755 8.852 -0.502 396 1HD2 LEU 49 1HD2 LEU 49 -6.101 7.803 3.004 397 2HD2 LEU 49 2HD2 LEU 49 -6.321 6.348 2.032 398 3HD2 LEU 49 3HD2 LEU 49 -5.039 7.490 1.630 399 H GLU 50 H GLU 50 -9.606 8.146 4.986 400 HA GLU 50 HA GLU 50 -12.462 8.577 4.507 401 1HB GLU 50 1HB GLU 50 -11.169 7.628 6.640 402 2HB GLU 50 2HB GLU 50 -11.188 9.330 7.102 403 1HG GLU 50 1HG GLU 50 -13.598 9.421 6.921 404 2HG GLU 50 2HG GLU 50 -13.653 7.795 6.240 405 H LYS 51 H LYS 51 -10.970 10.467 3.026 406 HA LYS 51 HA LYS 51 -12.214 12.898 3.465 407 1HB LYS 51 1HB LYS 51 -10.301 14.266 4.448 408 2HB LYS 51 2HB LYS 51 -11.127 13.224 5.600 409 1HG LYS 51 1HG LYS 51 -9.343 11.485 5.184 410 2HG LYS 51 2HG LYS 51 -8.488 12.681 4.216 411 1HD LYS 51 1HD LYS 51 -8.981 14.119 6.485 412 2HD LYS 51 2HD LYS 51 -8.791 12.497 7.152 413 1HE LYS 51 1HE LYS 51 -6.623 12.272 5.977 414 2HE LYS 51 2HE LYS 51 -6.810 13.904 5.332 415 1HZ LYS 51 1HZ LYS 51 -6.761 13.228 8.222 416 2HZ LYS 51 2HZ LYS 51 -5.431 13.821 7.347 417 3HZ LYS 51 3HZ LYS 51 -6.816 14.784 7.550 418 H GLU 52 H GLU 52 -11.895 13.928 1.527 419 HA GLU 52 HA GLU 52 -9.810 13.010 -0.285 420 1HB GLU 52 1HB GLU 52 -12.229 14.031 -0.771 421 2HB GLU 52 2HB GLU 52 -11.314 15.534 -0.781 422 1HG GLU 52 1HG GLU 52 -10.049 14.928 -2.631 423 2HG GLU 52 2HG GLU 52 -10.271 13.206 -2.343 424 H GLU 53 H GLU 53 -7.777 13.609 0.263 425 HA GLU 53 HA GLU 53 -7.233 16.506 0.692 426 1HB GLU 53 1HB GLU 53 -5.339 15.582 2.291 427 2HB GLU 53 2HB GLU 53 -6.967 15.831 2.906 428 1HG GLU 53 1HG GLU 53 -5.941 13.617 3.561 429 2HG GLU 53 2HG GLU 53 -7.477 13.475 2.716 430 H GLN 54 H GLN 54 -4.640 16.664 0.732 431 HA GLN 54 HA GLN 54 -3.773 15.429 -1.828 432 1HB GLN 54 1HB GLN 54 -2.562 17.684 -0.190 433 2HB GLN 54 2HB GLN 54 -1.914 17.089 -1.719 434 1HG GLN 54 1HG GLN 54 -3.784 17.839 -2.943 435 2HG GLN 54 2HG GLN 54 -4.766 18.012 -1.499 436 1HE2 GLN 54 2HE2 GLN 54 -1.400 19.176 -1.785 437 2HE2 GLN 54 1HE2 GLN 54 -1.789 20.822 -1.654 438 H ILE 55 H ILE 55 -1.235 14.938 -1.759 439 HA ILE 55 HA ILE 55 -0.648 13.525 0.814 440 HB ILE 55 HB ILE 55 -0.051 12.513 -1.986 441 1HG1 ILE 55 1HG1 ILE 55 -1.695 10.668 -0.857 442 2HG1 ILE 55 2HG1 ILE 55 -2.318 12.132 -0.098 443 1HG2 ILE 55 1HG2 ILE 55 0.698 11.645 0.767 444 2HG2 ILE 55 2HG2 ILE 55 0.251 10.379 -0.376 445 3HG2 ILE 55 3HG2 ILE 55 1.586 11.470 -0.747 446 1HD1 ILE 55 1HD1 ILE 55 -1.828 12.025 -3.071 447 2HD1 ILE 55 2HD1 ILE 55 -3.332 11.416 -2.379 448 3HD1 ILE 55 3HD1 ILE 55 -2.885 13.110 -2.167 449 H HIS 56 H HIS 56 1.170 14.308 1.705 450 HA HIS 56 HA HIS 56 3.223 15.564 -0.068 451 1HB HIS 56 1HB HIS 56 2.199 16.991 1.730 452 2HB HIS 56 2HB HIS 56 2.870 15.886 2.927 453 HD1 HIS 56 HD1 HIS 56 4.003 18.213 0.144 454 HD2 HIS 56 HD2 HIS 56 5.554 16.336 3.527 455 HE1 HIS 56 HE1 HIS 56 6.340 19.135 0.467 456 H SER 57 H SER 57 2.645 13.146 2.415 457 HA SER 57 HA SER 57 5.254 11.906 1.761 458 1HB SER 57 1HB SER 57 4.430 12.871 4.496 459 2HB SER 57 2HB SER 57 5.530 11.510 4.315 460 HG SER 57 HG SER 57 5.842 14.197 3.510 461 H VAL 58 H VAL 58 5.264 9.633 2.348 462 HA VAL 58 HA VAL 58 2.604 8.528 3.120 463 HB VAL 58 HB VAL 58 4.249 7.842 0.670 464 1HG1 VAL 58 1HG1 VAL 58 2.066 6.316 2.054 465 2HG1 VAL 58 2HG1 VAL 58 2.185 6.260 0.296 466 3HG1 VAL 58 3HG1 VAL 58 3.536 5.717 1.287 467 1HG2 VAL 58 1HG2 VAL 58 1.657 9.212 1.218 468 2HG2 VAL 58 2HG2 VAL 58 2.884 9.575 0.006 469 3HG2 VAL 58 3HG2 VAL 58 1.772 8.229 -0.242 470 H ASP 59 H ASP 59 2.749 6.298 3.909 471 HA ASP 59 HA ASP 59 5.498 5.351 4.560 472 1HB ASP 59 1HB ASP 59 3.364 6.203 6.449 473 2HB ASP 59 2HB ASP 59 4.227 4.723 6.861 474 H ILE 60 H ILE 60 5.643 3.115 4.461 475 HA ILE 60 HA ILE 60 3.281 1.404 4.655 476 HB ILE 60 HB ILE 60 4.577 2.019 1.993 477 1HG1 ILE 60 1HG1 ILE 60 1.924 1.440 1.576 478 2HG1 ILE 60 2HG1 ILE 60 1.890 2.093 3.211 479 1HG2 ILE 60 1HG2 ILE 60 3.553 -0.645 2.905 480 2HG2 ILE 60 2HG2 ILE 60 3.181 -0.127 1.260 481 3HG2 ILE 60 3HG2 ILE 60 4.860 -0.272 1.781 482 1HD1 ILE 60 1HD1 ILE 60 3.534 3.889 2.024 483 2HD1 ILE 60 2HD1 ILE 60 2.520 3.444 0.652 484 3HD1 ILE 60 3HD1 ILE 60 1.785 4.091 2.118 485 H GLY 61 H GLY 61 3.957 -0.600 5.369 486 1HA GLY 61 1HA GLY 61 6.890 -1.089 5.254 487 2HA GLY 61 2HA GLY 61 5.912 -1.616 6.604 488 H ASN 62 H ASN 62 7.541 -2.948 4.378 489 HA ASN 62 HA ASN 62 5.410 -4.796 3.408 490 1HB ASN 62 1HB ASN 62 7.887 -3.722 2.212 491 2HB ASN 62 2HB ASN 62 7.503 -5.400 1.831 492 1HD2 ASN 62 2HD2 ASN 62 5.331 -2.570 2.363 493 2HD2 ASN 62 1HD2 ASN 62 4.550 -2.695 0.863 494 H ASP 63 H ASP 63 5.805 -7.093 3.491 495 HA ASP 63 HA ASP 63 7.603 -7.864 5.706 496 1HB ASP 63 1HB ASP 63 5.324 -9.131 4.239 497 2HB ASP 63 2HB ASP 63 6.498 -10.202 5.001 498 H GLY 64 H GLY 64 7.198 -10.236 3.164 499 1HA GLY 64 1HA GLY 64 10.097 -10.017 2.573 500 2HA GLY 64 2HA GLY 64 9.085 -11.423 2.229 501 H SER 65 H SER 65 7.890 -8.236 1.482 502 HA SER 65 HA SER 65 7.608 -8.896 -1.341 503 1HB SER 65 1HB SER 65 7.113 -6.330 0.159 504 2HB SER 65 2HB SER 65 6.614 -6.648 -1.491 505 HG SER 65 HG SER 65 5.770 -7.917 0.901 506 H ALA 66 H ALA 66 8.141 -6.778 -2.764 507 HA ALA 66 HA ALA 66 10.873 -5.828 -2.173 508 1HB ALA 66 1HB ALA 66 11.119 -7.953 -3.456 509 2HB ALA 66 2HB ALA 66 10.153 -7.242 -4.750 510 3HB ALA 66 3HB ALA 66 11.724 -6.555 -4.344 511 H PHE 67 H PHE 67 8.441 -5.949 -4.791 512 HA PHE 67 HA PHE 67 8.978 -3.057 -5.283 513 1HB PHE 67 1HB PHE 67 7.299 -4.951 -6.943 514 2HB PHE 67 2HB PHE 67 7.874 -3.359 -7.411 515 HD1 PHE 67 HD1 PHE 67 10.652 -3.300 -6.570 516 HD2 PHE 67 HD2 PHE 67 8.392 -6.536 -8.264 517 HE1 PHE 67 HE1 PHE 67 12.744 -4.313 -7.425 518 HE2 PHE 67 HE2 PHE 67 10.478 -7.554 -9.112 519 HZ PHE 67 HZ PHE 67 12.662 -6.443 -8.697 520 H VAL 68 H VAL 68 7.497 -1.488 -4.876 521 HA VAL 68 HA VAL 68 4.684 -2.287 -4.326 522 HB VAL 68 HB VAL 68 6.389 -0.666 -2.410 523 1HG1 VAL 68 1HG1 VAL 68 3.425 -1.334 -2.379 524 2HG1 VAL 68 2HG1 VAL 68 4.307 -0.654 -1.011 525 3HG1 VAL 68 3HG1 VAL 68 4.135 0.275 -2.500 526 1HG2 VAL 68 1HG2 VAL 68 5.350 -3.459 -2.526 527 2HG2 VAL 68 2HG2 VAL 68 6.857 -2.849 -1.843 528 3HG2 VAL 68 3HG2 VAL 68 5.344 -2.654 -0.958 529 H GLU 69 H GLU 69 3.642 -1.137 -5.837 530 HA GLU 69 HA GLU 69 4.534 1.636 -6.462 531 1HB GLU 69 1HB GLU 69 4.202 0.045 -8.351 532 2HB GLU 69 2HB GLU 69 2.513 -0.131 -7.880 533 1HG GLU 69 1HG GLU 69 1.937 1.963 -8.643 534 2HG GLU 69 2HG GLU 69 3.525 2.644 -8.292 535 H VAL 70 H VAL 70 3.220 3.398 -6.034 536 HA VAL 70 HA VAL 70 0.572 2.802 -4.778 537 HB VAL 70 HB VAL 70 2.386 5.092 -4.003 538 1HG1 VAL 70 1HG1 VAL 70 -0.313 4.131 -3.232 539 2HG1 VAL 70 2HG1 VAL 70 0.729 4.661 -1.911 540 3HG1 VAL 70 3HG1 VAL 70 0.343 5.768 -3.229 541 1HG2 VAL 70 1HG2 VAL 70 2.045 2.333 -2.814 542 2HG2 VAL 70 2HG2 VAL 70 3.545 3.120 -3.304 543 3HG2 VAL 70 3HG2 VAL 70 2.675 3.688 -1.879 544 H LEU 71 H LEU 71 -1.071 3.716 -5.843 545 HA LEU 71 HA LEU 71 -0.510 6.041 -7.627 546 1HB LEU 71 1HB LEU 71 -1.964 3.543 -8.025 547 2HB LEU 71 2HB LEU 71 -2.986 4.937 -8.365 548 HG LEU 71 HG LEU 71 -1.106 5.832 -9.807 549 1HD1 LEU 71 1HD1 LEU 71 0.590 4.275 -8.652 550 2HD1 LEU 71 2HD1 LEU 71 -0.058 3.000 -9.684 551 3HD1 LEU 71 3HD1 LEU 71 0.708 4.416 -10.406 552 1HD2 LEU 71 1HD2 LEU 71 -2.631 3.307 -10.367 553 2HD2 LEU 71 2HD2 LEU 71 -2.841 4.913 -11.065 554 3HD2 LEU 71 3HD2 LEU 71 -1.486 3.903 -11.569 555 H VAL 72 H VAL 72 -2.408 7.541 -7.823 556 HA VAL 72 HA VAL 72 -4.013 7.647 -5.307 557 HB VAL 72 HB VAL 72 -3.780 10.162 -5.562 558 1HG1 VAL 72 1HG1 VAL 72 -1.397 8.436 -4.873 559 2HG1 VAL 72 2HG1 VAL 72 -1.526 10.145 -4.455 560 3HG1 VAL 72 3HG1 VAL 72 -2.663 8.983 -3.774 561 1HG2 VAL 72 1HG2 VAL 72 -2.547 9.512 -7.935 562 2HG2 VAL 72 2HG2 VAL 72 -2.391 11.067 -7.121 563 3HG2 VAL 72 3HG2 VAL 72 -1.171 9.821 -6.881 564 H GLY 73 H GLY 73 -6.037 8.927 -5.550 565 1HA GLY 73 1HA GLY 73 -7.029 9.934 -7.975 566 2HA GLY 73 2HA GLY 73 -7.470 8.234 -7.915 567 H SER 74 H SER 74 -9.525 9.811 -7.947 568 HA SER 74 HA SER 74 -10.426 10.129 -5.142 569 1HB SER 74 1HB SER 74 -10.552 12.248 -6.246 570 2HB SER 74 2HB SER 74 -11.253 11.528 -7.687 571 HG SER 74 HG SER 74 -12.465 12.439 -5.471 572 H SER 75 H SER 75 -12.654 9.526 -4.748 573 HA SER 75 HA SER 75 -13.453 7.158 -6.310 574 1HB SER 75 1HB SER 75 -13.455 7.454 -3.676 575 2HB SER 75 2HB SER 75 -15.028 8.187 -3.976 576 HG SER 75 HG SER 75 -15.711 6.207 -4.088 577 H ALA 76 H ALA 76 -13.827 10.288 -6.917 578 HA ALA 76 HA ALA 76 -16.610 10.784 -7.047 579 1HB ALA 76 1HB ALA 76 -14.641 12.397 -7.473 580 2HB ALA 76 2HB ALA 76 -14.653 11.766 -9.120 581 3HB ALA 76 3HB ALA 76 -16.075 12.590 -8.481 582 H GLY 77 H GLY 77 -17.999 9.349 -7.996 583 1HA GLY 77 1HA GLY 77 -18.990 8.736 -10.191 584 2HA GLY 77 2HA GLY 77 -17.349 8.446 -10.774 585 H GLY 78 H GLY 78 -16.211 6.566 -9.984 586 1HA GLY 78 1HA GLY 78 -16.541 4.643 -8.238 587 2HA GLY 78 2HA GLY 78 -18.064 4.407 -9.097 588 H ALA 79 H ALA 79 -16.133 2.371 -8.982 589 HA ALA 79 HA ALA 79 -15.014 0.860 -10.381 590 1HB ALA 79 1HB ALA 79 -17.120 1.260 -11.745 591 2HB ALA 79 2HB ALA 79 -16.205 2.455 -12.663 592 3HB ALA 79 3HB ALA 79 -15.709 0.762 -12.680 593 H GLY 80 H GLY 80 -13.633 3.256 -9.515 594 1HA GLY 80 1HA GLY 80 -12.033 4.128 -11.838 595 2HA GLY 80 2HA GLY 80 -11.875 4.731 -10.187 596 H GLU 81 H GLU 81 -10.753 2.395 -12.475 597 HA GLU 81 HA GLU 81 -8.952 1.226 -10.389 598 1HB GLU 81 1HB GLU 81 -9.977 0.032 -12.982 599 2HB GLU 81 2HB GLU 81 -8.750 -0.721 -11.963 600 1HG GLU 81 1HG GLU 81 -11.274 0.135 -10.629 601 2HG GLU 81 2HG GLU 81 -11.363 -1.273 -11.687 602 H GLN 82 H GLN 82 -9.029 1.817 -13.925 603 HA GLN 82 HA GLN 82 -6.102 2.343 -13.831 604 1HB GLN 82 1HB GLN 82 -6.286 2.250 -16.332 605 2HB GLN 82 2HB GLN 82 -6.805 0.761 -15.541 606 1HG GLN 82 1HG GLN 82 -9.087 1.218 -15.901 607 2HG GLN 82 2HG GLN 82 -8.792 2.934 -16.185 608 1HE2 GLN 82 2HE2 GLN 82 -8.007 3.580 -18.305 609 2HE2 GLN 82 1HE2 GLN 82 -8.008 2.509 -19.622 610 H ASP 83 H ASP 83 -8.075 4.263 -12.789 611 HA ASP 83 HA ASP 83 -7.529 6.524 -14.673 612 1HB ASP 83 1HB ASP 83 -9.983 5.782 -14.423 613 2HB ASP 83 2HB ASP 83 -9.884 6.424 -12.783 614 H TYR 84 H TYR 84 -5.793 5.663 -12.548 615 HA TYR 84 HA TYR 84 -6.167 7.804 -10.512 616 1HB TYR 84 1HB TYR 84 -4.756 5.141 -10.497 617 2HB TYR 84 2HB TYR 84 -4.238 6.408 -9.390 618 HD1 TYR 84 HD1 TYR 84 -7.641 5.379 -10.629 619 HD2 TYR 84 HD2 TYR 84 -5.037 5.929 -7.257 620 HE1 TYR 84 HE1 TYR 84 -9.506 4.817 -9.098 621 HE2 TYR 84 HE2 TYR 84 -6.905 5.369 -5.726 622 HH TYR 84 HH TYR 84 -9.031 4.133 -5.799 623 H GLU 85 H GLU 85 -3.724 8.288 -9.686 624 HA GLU 85 HA GLU 85 -2.127 8.983 -12.110 625 1HB GLU 85 1HB GLU 85 -1.450 10.797 -9.995 626 2HB GLU 85 2HB GLU 85 -2.166 11.172 -11.554 627 1HG GLU 85 1HG GLU 85 -3.861 10.215 -9.243 628 2HG GLU 85 2HG GLU 85 -3.446 11.914 -9.442 629 H VAL 86 H VAL 86 -0.100 8.173 -12.059 630 HA VAL 86 HA VAL 86 0.752 6.426 -9.980 631 HB VAL 86 HB VAL 86 2.485 7.808 -12.045 632 1HG1 VAL 86 1HG1 VAL 86 3.680 6.630 -10.191 633 2HG1 VAL 86 2HG1 VAL 86 2.811 5.154 -10.609 634 3HG1 VAL 86 3HG1 VAL 86 3.941 5.869 -11.760 635 1HG2 VAL 86 1HG2 VAL 86 0.557 5.518 -12.173 636 2HG2 VAL 86 2HG2 VAL 86 0.905 6.753 -13.382 637 3HG2 VAL 86 3HG2 VAL 86 2.034 5.422 -13.129 638 H LEU 87 H LEU 87 0.552 7.673 -8.013 639 HA LEU 87 HA LEU 87 1.892 10.122 -7.482 640 1HB LEU 87 1HB LEU 87 0.201 8.705 -6.035 641 2HB LEU 87 2HB LEU 87 1.670 7.989 -5.378 642 HG LEU 87 HG LEU 87 2.512 10.317 -4.907 643 1HD1 LEU 87 1HD1 LEU 87 0.401 11.074 -6.565 644 2HD1 LEU 87 2HD1 LEU 87 -0.164 11.509 -4.953 645 3HD1 LEU 87 3HD1 LEU 87 1.361 12.153 -5.556 646 1HD2 LEU 87 1HD2 LEU 87 0.181 9.003 -3.617 647 2HD2 LEU 87 2HD2 LEU 87 1.738 9.463 -2.928 648 3HD2 LEU 87 3HD2 LEU 87 0.478 10.676 -3.145 649 H LEU 88 H LEU 88 2.958 6.773 -6.801 650 HA LEU 88 HA LEU 88 5.737 7.625 -7.328 651 1HB LEU 88 1HB LEU 88 6.583 6.526 -5.293 652 2HB LEU 88 2HB LEU 88 5.549 7.901 -4.928 653 HG LEU 88 HG LEU 88 3.879 5.593 -5.136 654 1HD1 LEU 88 1HD1 LEU 88 6.488 5.194 -3.741 655 2HD1 LEU 88 2HD1 LEU 88 5.039 4.569 -2.955 656 3HD1 LEU 88 3HD1 LEU 88 5.470 4.018 -4.574 657 1HD2 LEU 88 1HD2 LEU 88 4.699 7.614 -3.087 658 2HD2 LEU 88 2HD2 LEU 88 3.097 7.268 -3.738 659 3HD2 LEU 88 3HD2 LEU 88 3.811 6.192 -2.537 660 H VAL 89 H VAL 89 6.591 6.191 -8.708 661 HA VAL 89 HA VAL 89 5.310 3.881 -9.659 662 HB VAL 89 HB VAL 89 7.558 3.233 -10.552 663 1HG1 VAL 89 1HG1 VAL 89 5.976 5.118 -11.457 664 2HG1 VAL 89 2HG1 VAL 89 7.236 6.206 -10.874 665 3HG1 VAL 89 3HG1 VAL 89 7.613 4.992 -12.097 666 1HG2 VAL 89 1HG2 VAL 89 8.735 4.138 -8.451 667 2HG2 VAL 89 2HG2 VAL 89 9.503 4.492 -9.999 668 3HG2 VAL 89 3HG2 VAL 89 8.558 5.735 -9.179 669 H THR 90 H THR 90 6.611 1.618 -9.552 670 HA THR 90 HA THR 90 6.157 0.626 -6.920 671 HB THR 90 HB THR 90 6.264 -0.582 -9.300 672 HG1 THR 90 HG1 THR 90 5.993 -2.379 -8.157 673 1HG2 THR 90 1HG2 THR 90 8.822 -0.265 -9.347 674 2HG2 THR 90 2HG2 THR 90 8.877 -1.507 -8.097 675 3HG2 THR 90 3HG2 THR 90 8.209 -1.884 -9.684 676 H SER 91 H SER 91 7.444 0.539 -5.188 677 HA SER 91 HA SER 91 10.199 1.581 -5.424 678 1HB SER 91 1HB SER 91 9.942 1.590 -2.840 679 2HB SER 91 2HB SER 91 9.017 2.773 -3.760 680 HG SER 91 HG SER 91 8.076 0.228 -2.921 681 H SER 92 H SER 92 11.863 0.233 -5.217 682 HA SER 92 HA SER 92 11.380 -2.619 -4.649 683 1HB SER 92 1HB SER 92 13.868 -2.759 -5.250 684 2HB SER 92 2HB SER 92 12.775 -2.254 -6.535 685 HG SER 92 HG SER 92 14.767 -0.958 -6.110 686 H PHE 93 H PHE 93 11.022 -2.556 -2.339 687 HA PHE 93 HA PHE 93 12.938 -1.316 -0.543 688 1HB PHE 93 1HB PHE 93 11.065 -3.558 0.184 689 2HB PHE 93 2HB PHE 93 11.722 -2.323 1.242 690 HD1 PHE 93 HD1 PHE 93 11.252 0.080 -0.621 691 HD2 PHE 93 HD2 PHE 93 8.743 -3.214 0.554 692 HE1 PHE 93 HE1 PHE 93 9.234 1.470 -1.002 693 HE2 PHE 93 HE2 PHE 93 6.744 -1.812 0.175 694 HZ PHE 93 HZ PHE 93 6.982 0.510 -0.610 695 H MET 94 H MET 94 12.139 -4.724 -1.185 696 HA MET 94 HA MET 94 14.960 -5.418 -0.452 697 1HB MET 94 1HB MET 94 12.649 -7.340 -0.163 698 2HB MET 94 2HB MET 94 14.223 -7.388 0.624 699 1HG MET 94 1HG MET 94 13.325 -5.008 1.556 700 2HG MET 94 2HG MET 94 11.787 -5.844 1.349 701 1HE MET 94 1HE MET 94 11.941 -8.377 1.557 702 2HE MET 94 2HE MET 94 13.278 -9.203 2.354 703 3HE MET 94 3HE MET 94 11.787 -8.865 3.243 704 H SER 95 H SER 95 14.885 -8.090 -1.218 705 HA SER 95 HA SER 95 14.259 -8.018 -4.136 706 1HB SER 95 1HB SER 95 16.415 -8.733 -4.708 707 2HB SER 95 2HB SER 95 16.770 -7.682 -3.346 708 HG SER 95 HG SER 95 17.482 -10.130 -3.554 709 HA PRO 96 HA PRO 96 12.794 -12.192 -3.391 710 1HB PRO 96 1HB PRO 96 13.745 -13.655 -5.489 711 2HB PRO 96 2HB PRO 96 12.487 -12.424 -5.650 712 1HG PRO 96 1HG PRO 96 15.284 -12.360 -6.544 713 2HG PRO 96 2HG PRO 96 13.905 -11.401 -7.095 714 1HD PRO 96 1HD PRO 96 15.995 -10.590 -5.301 715 2HD PRO 96 2HD PRO 96 14.577 -9.649 -5.814 716 H SER 97 H SER 97 15.773 -11.620 -2.452 717 HA SER 97 HA SER 97 16.493 -14.491 -2.044 718 1HB SER 97 1HB SER 97 18.099 -13.096 -3.455 719 2HB SER 97 2HB SER 97 18.423 -12.157 -2.000 720 HG SER 97 HG SER 97 18.668 -14.980 -2.204 721 H GLU 98 H GLU 98 16.458 -11.233 -0.621 722 HA GLU 98 HA GLU 98 17.104 -12.289 2.045 723 1HB GLU 98 1HB GLU 98 16.868 -9.932 2.765 724 2HB GLU 98 2HB GLU 98 17.957 -10.079 1.388 725 1HG GLU 98 1HG GLU 98 15.466 -9.742 0.195 726 2HG GLU 98 2HG GLU 98 15.390 -8.679 1.598 727 H SER 99 H SER 99 14.273 -11.398 0.192 728 HA SER 99 HA SER 99 12.384 -10.977 2.251 729 1HB SER 99 1HB SER 99 10.762 -12.009 0.501 730 2HB SER 99 2HB SER 99 11.618 -10.530 0.079 731 HG SER 99 HG SER 99 11.660 -12.831 -1.187 732 H ARG 100 H ARG 100 13.954 -13.927 1.260 733 HA ARG 100 HA ARG 100 11.940 -15.652 2.513 734 1HB ARG 100 1HB ARG 100 14.667 -16.214 1.316 735 2HB ARG 100 2HB ARG 100 13.630 -17.463 2.004 736 1HG ARG 100 1HG ARG 100 11.868 -16.949 0.404 737 2HG ARG 100 2HG ARG 100 12.794 -15.589 -0.228 738 1HD ARG 100 1HD ARG 100 14.029 -16.931 -1.562 739 2HD ARG 100 2HD ARG 100 14.344 -18.069 -0.252 740 HE ARG 100 HE ARG 100 11.720 -18.590 -0.920 741 1HH1 ARG 100 1HH1 ARG 100 14.697 -18.390 -2.747 742 2HH1 ARG 100 2HH1 ARG 100 14.167 -19.539 -3.924 743 1HH2 ARG 100 1HH2 ARG 100 11.078 -20.071 -2.466 744 2HH2 ARG 100 2HH2 ARG 100 12.141 -20.482 -3.770 745 H SER 101 H SER 101 15.432 -15.960 3.142 746 HA SER 101 HA SER 101 15.223 -15.067 5.898 747 1HB SER 101 1HB SER 101 14.150 -17.439 5.777 748 2HB SER 101 2HB SER 101 15.800 -18.008 5.542 749 HG SER 101 HG SER 101 14.903 -16.361 7.678 750 H GLY 102 H GLY 102 16.857 -14.479 3.632 751 1HA GLY 102 1HA GLY 102 19.465 -15.761 4.217 752 2HA GLY 102 2HA GLY 102 19.122 -14.707 2.845 753 H SER 103 H SER 103 17.704 -12.802 4.774 754 HA SER 103 HA SER 103 19.758 -11.848 6.578 755 1HB SER 103 1HB SER 103 19.707 -10.867 3.814 756 2HB SER 103 2HB SER 103 19.721 -9.600 5.035 757 HG SER 103 HG SER 103 21.733 -10.062 5.372 758 H ASN 104 H ASN 104 17.580 -9.964 4.610 759 HA ASN 104 HA ASN 104 15.997 -9.331 7.050 760 1HB ASN 104 1HB ASN 104 15.526 -7.126 5.914 761 2HB ASN 104 2HB ASN 104 17.213 -7.358 6.371 762 1HD2 ASN 104 2HD2 ASN 104 18.757 -7.909 4.613 763 2HD2 ASN 104 1HD2 ASN 104 18.377 -7.547 2.999 764 HA PRO 105 HA PRO 105 12.970 -11.189 4.133 765 1HB PRO 105 1HB PRO 105 11.533 -12.473 6.055 766 2HB PRO 105 2HB PRO 105 13.003 -13.135 5.341 767 1HG PRO 105 1HG PRO 105 12.581 -12.003 8.025 768 2HG PRO 105 2HG PRO 105 13.778 -13.183 7.474 769 1HD PRO 105 1HD PRO 105 14.210 -10.414 7.942 770 2HD PRO 105 2HD PRO 105 15.342 -11.558 7.189 771 H ASN 106 H ASN 106 12.701 -9.170 6.922 772 HA ASN 106 HA ASN 106 10.096 -8.129 5.907 773 1HB ASN 106 1HB ASN 106 10.634 -9.389 8.497 774 2HB ASN 106 2HB ASN 106 9.925 -7.783 8.659 775 1HD2 ASN 106 2HD2 ASN 106 9.404 -10.475 6.299 776 2HD2 ASN 106 1HD2 ASN 106 7.721 -10.511 6.501 777 H ARG 107 H ARG 107 10.142 -5.956 5.676 778 HA ARG 107 HA ARG 107 11.654 -4.232 7.489 779 1HB ARG 107 1HB ARG 107 12.668 -4.928 4.770 780 2HB ARG 107 2HB ARG 107 12.769 -3.235 5.252 781 1HG ARG 107 1HG ARG 107 13.668 -4.490 7.519 782 2HG ARG 107 2HG ARG 107 14.267 -5.573 6.263 783 1HD ARG 107 1HD ARG 107 14.716 -2.839 5.455 784 2HD ARG 107 2HD ARG 107 15.374 -3.092 7.071 785 HE ARG 107 HE ARG 107 16.088 -5.229 5.231 786 1HH1 ARG 107 1HH1 ARG 107 16.916 -2.020 6.352 787 2HH1 ARG 107 2HH1 ARG 107 18.574 -2.176 5.886 788 1HH2 ARG 107 1HH2 ARG 107 18.243 -5.385 4.643 789 2HH2 ARG 107 2HH2 ARG 107 19.318 -4.059 4.931 790 H VAL 108 H VAL 108 10.904 -2.068 7.344 791 HA VAL 108 HA VAL 108 8.508 -1.751 5.635 792 HB VAL 108 HB VAL 108 7.860 0.058 7.107 793 1HG1 VAL 108 1HG1 VAL 108 7.393 -2.278 7.797 794 2HG1 VAL 108 2HG1 VAL 108 8.926 -2.315 8.668 795 3HG1 VAL 108 3HG1 VAL 108 7.641 -1.226 9.190 796 1HG2 VAL 108 1HG2 VAL 108 10.690 -0.202 7.982 797 2HG2 VAL 108 2HG2 VAL 108 9.687 1.238 7.833 798 3HG2 VAL 108 3HG2 VAL 108 9.502 0.177 9.229 799 H ARG 109 H ARG 109 8.230 0.808 5.060 800 HA ARG 109 HA ARG 109 10.731 2.104 4.286 801 1HB ARG 109 1HB ARG 109 10.036 0.242 2.520 802 2HB ARG 109 2HB ARG 109 8.926 1.502 1.976 803 1HG ARG 109 1HG ARG 109 10.998 1.735 0.736 804 2HG ARG 109 2HG ARG 109 10.873 3.084 1.864 805 1HD ARG 109 1HD ARG 109 12.845 2.499 2.772 806 2HD ARG 109 2HD ARG 109 12.168 0.938 3.236 807 HE ARG 109 HE ARG 109 12.920 0.966 0.443 808 1HH1 ARG 109 1HH1 ARG 109 14.183 0.683 3.693 809 2HH1 ARG 109 2HH1 ARG 109 15.561 -0.227 3.185 810 1HH2 ARG 109 1HH2 ARG 109 14.719 -0.216 -0.168 811 2HH2 ARG 109 2HH2 ARG 109 15.864 -0.732 1.025 812 H MET 110 H MET 110 10.378 4.286 3.690 813 HA MET 110 HA MET 110 7.543 5.225 3.881 814 1HB MET 110 1HB MET 110 9.988 6.607 5.023 815 2HB MET 110 2HB MET 110 8.319 7.161 5.156 816 1HG MET 110 1HG MET 110 7.802 5.644 6.781 817 2HG MET 110 2HG MET 110 8.800 4.383 6.065 818 1HE MET 110 1HE MET 110 8.784 4.166 8.767 819 2HE MET 110 2HE MET 110 10.218 3.440 8.048 820 3HE MET 110 3HE MET 110 10.373 4.426 9.500 821 H PHE 111 H PHE 111 7.117 7.252 2.792 822 HA PHE 111 HA PHE 111 9.109 7.996 0.693 823 1HB PHE 111 1HB PHE 111 6.139 8.123 0.195 824 2HB PHE 111 2HB PHE 111 7.449 8.132 -0.977 825 HD1 PHE 111 HD1 PHE 111 5.870 5.958 1.633 826 HD2 PHE 111 HD2 PHE 111 8.064 6.147 -2.056 827 HE1 PHE 111 HE1 PHE 111 5.635 3.515 1.365 828 HE2 PHE 111 HE2 PHE 111 7.832 3.691 -2.317 829 HZ PHE 111 HZ PHE 111 6.611 2.376 -0.605 830 H GLY 112 H GLY 112 8.603 10.247 -0.167 831 1HA GLY 112 1HA GLY 112 7.206 11.963 1.808 832 2HA GLY 112 2HA GLY 112 8.846 12.346 1.335 833 HA PRO 113 HA PRO 113 6.222 14.615 -1.700 834 1HB PRO 113 1HB PRO 113 7.841 16.810 -1.770 835 2HB PRO 113 2HB PRO 113 6.564 16.576 -0.566 836 1HG PRO 113 1HG PRO 113 9.507 16.299 -0.278 837 2HG PRO 113 2HG PRO 113 8.297 16.804 0.911 838 1HD PRO 113 1HD PRO 113 9.465 14.265 0.794 839 2HD PRO 113 2HD PRO 113 7.960 14.652 1.635 840 H ASP 114 H ASP 114 9.740 14.255 -1.605 841 HA ASP 114 HA ASP 114 10.234 14.777 -4.380 842 1HB ASP 114 1HB ASP 114 11.819 13.086 -2.421 843 2HB ASP 114 2HB ASP 114 12.409 13.677 -3.976 844 H LYS 115 H LYS 115 9.127 11.961 -2.631 845 HA LYS 115 HA LYS 115 9.573 10.215 -4.963 846 1HB LYS 115 1HB LYS 115 8.867 9.830 -2.103 847 2HB LYS 115 2HB LYS 115 8.217 8.646 -3.239 848 1HG LYS 115 1HG LYS 115 10.251 7.647 -2.900 849 2HG LYS 115 2HG LYS 115 10.756 8.786 -4.149 850 1HD LYS 115 1HD LYS 115 12.324 9.326 -2.558 851 2HD LYS 115 2HD LYS 115 11.025 10.386 -2.007 852 1HE LYS 115 1HE LYS 115 10.581 9.107 -0.160 853 2HE LYS 115 2HE LYS 115 10.952 7.596 -0.989 854 1HZ LYS 115 1HZ LYS 115 13.040 9.567 -0.267 855 2HZ LYS 115 2HZ LYS 115 12.563 8.320 0.785 856 3HZ LYS 115 3HZ LYS 115 13.244 7.942 -0.722 857 H LEU 116 H LEU 116 7.241 12.471 -4.238 858 HA LEU 116 HA LEU 116 5.163 10.796 -5.604 859 1HB LEU 116 1HB LEU 116 3.469 12.373 -4.493 860 2HB LEU 116 2HB LEU 116 4.202 11.127 -3.493 861 HG LEU 116 HG LEU 116 5.949 12.984 -2.908 862 1HD1 LEU 116 1HD1 LEU 116 4.310 14.434 -4.675 863 2HD1 LEU 116 2HD1 LEU 116 3.877 15.013 -3.071 864 3HD1 LEU 116 3HD1 LEU 116 5.548 15.091 -3.614 865 1HD2 LEU 116 1HD2 LEU 116 3.099 12.802 -1.941 866 2HD2 LEU 116 2HD2 LEU 116 4.550 12.127 -1.199 867 3HD2 LEU 116 3HD2 LEU 116 4.271 13.868 -1.168 868 H VAL 117 H VAL 117 4.163 11.610 -7.325 869 HA VAL 117 HA VAL 117 5.374 13.677 -8.859 870 HB VAL 117 HB VAL 117 3.919 11.913 -9.828 871 1HG1 VAL 117 1HG1 VAL 117 2.292 11.961 -7.916 872 2HG1 VAL 117 2HG1 VAL 117 1.635 13.435 -8.602 873 3HG1 VAL 117 3HG1 VAL 117 1.538 11.931 -9.511 874 1HG2 VAL 117 1HG2 VAL 117 4.181 14.386 -10.774 875 2HG2 VAL 117 2HG2 VAL 117 3.070 13.245 -11.532 876 3HG2 VAL 117 3HG2 VAL 117 2.457 14.461 -10.411 877 H ARG 118 H ARG 118 5.150 15.895 -8.764 878 HA ARG 118 HA ARG 118 3.550 17.072 -6.641 879 1HB ARG 118 1HB ARG 118 5.473 18.037 -8.695 880 2HB ARG 118 2HB ARG 118 4.288 19.213 -8.130 881 1HG ARG 118 1HG ARG 118 5.346 17.736 -5.875 882 2HG ARG 118 2HG ARG 118 6.670 18.410 -6.821 883 1HD ARG 118 1HD ARG 118 4.462 20.305 -6.465 884 2HD ARG 118 2HD ARG 118 5.175 19.788 -4.938 885 HE ARG 118 HE ARG 118 7.333 20.391 -6.631 886 1HH1 ARG 118 1HH1 ARG 118 4.586 22.068 -5.257 887 2HH1 ARG 118 2HH1 ARG 118 5.401 23.593 -5.239 888 1HH2 ARG 118 1HH2 ARG 118 8.347 22.385 -6.588 889 2HH2 ARG 118 2HH2 ARG 118 7.505 23.773 -5.983 890 H ALA 119 H ALA 119 3.169 16.610 -10.107 891 HA ALA 119 HA ALA 119 1.000 18.443 -10.484 892 1HB ALA 119 1HB ALA 119 2.448 17.254 -12.263 893 2HB ALA 119 2HB ALA 119 1.348 15.891 -12.050 894 3HB ALA 119 3HB ALA 119 0.729 17.446 -12.608 895 H ALA 120 H ALA 120 1.163 15.281 -9.048 896 HA ALA 120 HA ALA 120 -1.816 15.146 -9.021 897 1HB ALA 120 1HB ALA 120 -0.094 13.251 -9.984 898 2HB ALA 120 2HB ALA 120 -0.299 12.708 -8.318 899 3HB ALA 120 3HB ALA 120 -1.707 12.896 -9.364 900 H ALA 121 H ALA 121 1.107 14.467 -7.033 901 HA ALA 121 HA ALA 121 -0.079 13.782 -4.612 902 1HB ALA 121 1HB ALA 121 2.382 13.926 -5.110 903 2HB ALA 121 2HB ALA 121 2.270 15.669 -4.863 904 3HB ALA 121 3HB ALA 121 1.922 14.566 -3.534 905 H GLU 122 H GLU 122 0.349 17.100 -5.876 906 HA GLU 122 HA GLU 122 -0.811 18.268 -3.453 907 1HB GLU 122 1HB GLU 122 -0.659 20.408 -4.660 908 2HB GLU 122 2HB GLU 122 0.858 19.517 -4.781 909 1HG GLU 122 1HG GLU 122 0.642 19.964 -7.009 910 2HG GLU 122 2HG GLU 122 -0.438 18.571 -6.978 911 H LYS 123 H LYS 123 -2.233 16.551 -5.906 912 HA LYS 123 HA LYS 123 -4.641 18.240 -6.093 913 1HB LYS 123 1HB LYS 123 -4.072 15.507 -7.264 914 2HB LYS 123 2HB LYS 123 -5.448 16.532 -7.660 915 1HG LYS 123 1HG LYS 123 -3.575 18.296 -8.218 916 2HG LYS 123 2HG LYS 123 -2.557 16.866 -8.372 917 1HD LYS 123 1HD LYS 123 -3.355 16.943 -10.531 918 2HD LYS 123 2HD LYS 123 -4.665 16.016 -9.801 919 1HE LYS 123 1HE LYS 123 -5.813 17.721 -10.937 920 2HE LYS 123 2HE LYS 123 -5.715 18.347 -9.291 921 1HZ LYS 123 1HZ LYS 123 -3.777 18.983 -11.448 922 2HZ LYS 123 2HZ LYS 123 -5.075 19.983 -10.997 923 3HZ LYS 123 3HZ LYS 123 -3.822 19.660 -9.894 924 H ARG 124 H ARG 124 -6.444 17.839 -4.866 925 HA ARG 124 HA ARG 124 -6.250 16.138 -2.572 926 1HB ARG 124 1HB ARG 124 -8.501 17.695 -3.831 927 2HB ARG 124 2HB ARG 124 -8.795 16.644 -2.446 928 1HG ARG 124 1HG ARG 124 -7.149 17.847 -1.119 929 2HG ARG 124 2HG ARG 124 -6.698 18.832 -2.511 930 1HD ARG 124 1HD ARG 124 -8.200 20.166 -1.199 931 2HD ARG 124 2HD ARG 124 -9.118 19.612 -2.599 932 HE ARG 124 HE ARG 124 -9.436 17.745 -0.446 933 1HH1 ARG 124 1HH1 ARG 124 -10.390 20.957 -1.452 934 2HH1 ARG 124 2HH1 ARG 124 -11.869 20.906 -0.556 935 1HH2 ARG 124 1HH2 ARG 124 -11.357 17.724 0.697 936 2HH2 ARG 124 2HH2 ARG 124 -12.412 19.098 0.647 937 H TRP 125 H TRP 125 -6.290 13.991 -2.674 938 HA TRP 125 HA TRP 125 -8.199 12.621 -4.534 939 1HB TRP 125 1HB TRP 125 -5.626 11.556 -3.313 940 2HB TRP 125 2HB TRP 125 -6.653 10.715 -4.469 941 HD1 TRP 125 HD1 TRP 125 -3.680 12.811 -4.320 942 HE1 TRP 125 HE1 TRP 125 -3.104 13.782 -6.638 943 HE3 TRP 125 HE3 TRP 125 -8.020 11.817 -6.808 944 HZ2 TRP 125 HZ2 TRP 125 -4.298 14.075 -9.205 945 HZ3 TRP 125 HZ3 TRP 125 -8.274 12.430 -9.187 946 HH2 TRP 125 HH2 TRP 125 -6.426 13.569 -10.393 947 H ASP 126 H ASP 126 -9.027 10.499 -3.555 948 HA ASP 126 HA ASP 126 -9.038 10.600 -0.582 949 1HB ASP 126 1HB ASP 126 -11.460 10.215 -0.504 950 2HB ASP 126 2HB ASP 126 -11.080 11.736 -1.304 951 H ARG 127 H ARG 127 -8.139 8.785 -3.061 952 HA ARG 127 HA ARG 127 -8.651 6.259 -1.619 953 1HB ARG 127 1HB ARG 127 -9.161 6.659 -4.586 954 2HB ARG 127 2HB ARG 127 -9.227 5.114 -3.736 955 1HG ARG 127 1HG ARG 127 -10.917 6.423 -2.171 956 2HG ARG 127 2HG ARG 127 -11.116 7.430 -3.606 957 1HD ARG 127 1HD ARG 127 -11.431 4.416 -3.518 958 2HD ARG 127 2HD ARG 127 -12.746 5.585 -3.586 959 HE ARG 127 HE ARG 127 -10.849 5.919 -5.764 960 1HH1 ARG 127 1HH1 ARG 127 -13.663 4.156 -4.666 961 2HH1 ARG 127 2HH1 ARG 127 -14.182 3.788 -6.273 962 1HH2 ARG 127 1HH2 ARG 127 -11.560 5.421 -7.825 963 2HH2 ARG 127 2HH2 ARG 127 -13.008 4.496 -8.043 964 H VAL 128 H VAL 128 -6.938 4.732 -2.004 965 HA VAL 128 HA VAL 128 -4.733 5.738 -3.730 966 HB VAL 128 HB VAL 128 -4.448 6.304 -1.260 967 1HG1 VAL 128 1HG1 VAL 128 -5.087 3.628 -0.878 968 2HG1 VAL 128 2HG1 VAL 128 -3.340 3.668 -0.642 969 3HG1 VAL 128 3HG1 VAL 128 -4.387 4.704 0.328 970 1HG2 VAL 128 1HG2 VAL 128 -2.523 4.892 -3.030 971 2HG2 VAL 128 2HG2 VAL 128 -2.491 6.545 -2.416 972 3HG2 VAL 128 3HG2 VAL 128 -2.023 5.208 -1.368 973 H LYS 129 H LYS 129 -3.559 4.143 -4.781 974 HA LYS 129 HA LYS 129 -4.633 1.371 -4.492 975 1HB LYS 129 1HB LYS 129 -4.969 2.477 -6.699 976 2HB LYS 129 2HB LYS 129 -3.222 2.627 -6.854 977 1HG LYS 129 1HG LYS 129 -3.483 -0.039 -6.254 978 2HG LYS 129 2HG LYS 129 -4.941 0.255 -7.202 979 1HD LYS 129 1HD LYS 129 -3.254 1.533 -8.795 980 2HD LYS 129 2HD LYS 129 -2.071 0.476 -8.025 981 1HE LYS 129 1HE LYS 129 -3.034 -1.458 -8.883 982 2HE LYS 129 2HE LYS 129 -4.627 -0.718 -9.035 983 1HZ LYS 129 1HZ LYS 129 -2.292 0.073 -10.681 984 2HZ LYS 129 2HZ LYS 129 -3.433 -1.080 -11.173 985 3HZ LYS 129 3HZ LYS 129 -3.913 0.527 -10.902 986 H ILE 130 H ILE 130 -3.278 0.112 -3.331 987 HA ILE 130 HA ILE 130 -0.333 0.582 -3.553 988 HB ILE 130 HB ILE 130 -1.936 -0.924 -1.451 989 1HG1 ILE 130 1HG1 ILE 130 -2.299 1.517 -1.372 990 2HG1 ILE 130 2HG1 ILE 130 -1.354 0.981 0.015 991 1HG2 ILE 130 1HG2 ILE 130 1.003 -0.453 -1.871 992 2HG2 ILE 130 2HG2 ILE 130 0.369 -0.598 -0.232 993 3HG2 ILE 130 3HG2 ILE 130 0.171 -1.926 -1.375 994 1HD1 ILE 130 1HD1 ILE 130 0.728 1.647 -1.194 995 2HD1 ILE 130 2HD1 ILE 130 -0.268 2.276 -2.504 996 3HD1 ILE 130 3HD1 ILE 130 -0.353 3.010 -0.903 997 H VAL 131 H VAL 131 0.790 -0.920 -4.770 998 HA VAL 131 HA VAL 131 -0.385 -3.643 -5.011 999 HB VAL 131 HB VAL 131 1.017 -2.063 -7.183 1000 1HG1 VAL 131 1HG1 VAL 131 1.252 -4.549 -7.234 1001 2HG1 VAL 131 2HG1 VAL 131 -0.507 -4.670 -7.282 1002 3HG1 VAL 131 3HG1 VAL 131 0.360 -3.899 -8.611 1003 1HG2 VAL 131 1HG2 VAL 131 -1.846 -2.414 -6.400 1004 2HG2 VAL 131 2HG2 VAL 131 -1.047 -1.024 -7.137 1005 3HG2 VAL 131 3HG2 VAL 131 -1.462 -2.427 -8.122 1006 H CYS 132 H CYS 132 0.997 -5.142 -4.242 1007 HA CYS 132 HA CYS 132 3.895 -4.511 -3.987 1008 1HB CYS 132 1HB CYS 132 3.057 -5.392 -1.961 1009 2HB CYS 132 2HB CYS 132 2.049 -6.567 -2.775 1010 HG CYS 132 HG CYS 132 5.107 -6.995 -3.030 1011 H SER 133 H SER 133 5.477 -5.765 -5.099 1012 HA SER 133 HA SER 133 4.509 -7.867 -6.958 1013 1HB SER 133 1HB SER 133 5.083 -5.182 -7.736 1014 2HB SER 133 2HB SER 133 6.365 -6.196 -8.387 1015 HG SER 133 HG SER 133 4.343 -5.946 -9.657 1016 H GLN 134 H GLN 134 5.796 -9.535 -6.888 1017 HA GLN 134 HA GLN 134 8.465 -9.828 -7.375 1018 1HB GLN 134 1HB GLN 134 8.478 -8.445 -4.995 1019 2HB GLN 134 2HB GLN 134 8.531 -10.095 -4.442 1020 1HG GLN 134 1HG GLN 134 10.455 -8.782 -6.368 1021 2HG GLN 134 2HG GLN 134 10.805 -9.354 -4.743 1022 1HE2 GLN 134 2HE2 GLN 134 11.827 -10.189 -7.545 1023 2HE2 GLN 134 1HE2 GLN 134 11.672 -11.877 -7.528 1024 HA PRO 135 HA PRO 135 6.342 -13.815 -6.708 1025 1HB PRO 135 1HB PRO 135 7.923 -15.270 -8.397 1026 2HB PRO 135 2HB PRO 135 6.580 -14.259 -8.950 1027 1HG PRO 135 1HG PRO 135 9.501 -13.767 -9.104 1028 2HG PRO 135 2HG PRO 135 8.208 -13.242 -10.192 1029 1HD PRO 135 1HD PRO 135 9.461 -11.634 -8.276 1030 2HD PRO 135 2HD PRO 135 7.904 -11.282 -9.054 1031 H TYR 136 H TYR 136 6.943 -14.375 -4.599 1032 HA TYR 136 HA TYR 136 9.588 -15.720 -4.310 1033 1HB TYR 136 1HB TYR 136 9.521 -14.763 -1.882 1034 2HB TYR 136 2HB TYR 136 10.062 -13.724 -3.197 1035 HD1 TYR 136 HD1 TYR 136 6.853 -14.730 -1.499 1036 HD2 TYR 136 HD2 TYR 136 9.127 -11.615 -3.377 1037 HE1 TYR 136 HE1 TYR 136 5.042 -13.112 -1.001 1038 HE2 TYR 136 HE2 TYR 136 7.310 -10.001 -2.890 1039 HH TYR 136 HH TYR 136 4.269 -10.829 -2.108 1040 H SER 137 H SER 137 6.231 -15.983 -3.829 1041 HA SER 137 HA SER 137 6.687 -18.160 -1.832 1042 1HB SER 137 1HB SER 137 4.852 -15.989 -1.801 1043 2HB SER 137 2HB SER 137 3.909 -17.458 -2.008 1044 HG SER 137 HG SER 137 5.745 -16.777 0.033 1045 H LYS 138 H LYS 138 4.448 -19.604 -2.034 1046 HA LYS 138 HA LYS 138 3.579 -20.184 -4.720 1047 1HB LYS 138 1HB LYS 138 4.699 -22.413 -4.913 1048 2HB LYS 138 2HB LYS 138 5.840 -21.071 -4.980 1049 1HG LYS 138 1HG LYS 138 5.968 -21.432 -2.371 1050 2HG LYS 138 2HG LYS 138 5.366 -23.043 -2.766 1051 1HD LYS 138 1HD LYS 138 7.253 -23.103 -4.532 1052 2HD LYS 138 2HD LYS 138 7.934 -21.732 -3.655 1053 1HE LYS 138 1HE LYS 138 8.965 -23.595 -2.643 1054 2HE LYS 138 2HE LYS 138 7.643 -23.209 -1.542 1055 1HZ LYS 138 1HZ LYS 138 7.189 -25.097 -3.750 1056 2HZ LYS 138 2HZ LYS 138 7.982 -25.632 -2.349 1057 3HZ LYS 138 3HZ LYS 138 6.410 -24.994 -2.244 1058 H ASP 139 H ASP 139 4.171 -21.476 -1.461 1059 HA ASP 139 HA ASP 139 1.528 -22.830 -1.588 1060 1HB ASP 139 1HB ASP 139 2.410 -24.150 0.365 1061 2HB ASP 139 2HB ASP 139 3.296 -24.412 -1.131 1062 H SER 140 H SER 140 3.518 -20.600 0.198 1063 HA SER 140 HA SER 140 1.287 -20.093 2.092 1064 1HB SER 140 1HB SER 140 3.299 -18.736 3.180 1065 2HB SER 140 2HB SER 140 3.117 -20.465 3.444 1066 HG SER 140 HG SER 140 5.216 -20.037 2.781 1067 HA PRO 141 HA PRO 141 0.846 -16.086 0.111 1068 1HB PRO 141 1HB PRO 141 -0.833 -14.962 1.939 1069 2HB PRO 141 2HB PRO 141 -1.345 -16.215 0.799 1070 1HG PRO 141 1HG PRO 141 -0.942 -16.391 3.702 1071 2HG PRO 141 2HG PRO 141 -1.888 -17.432 2.631 1072 1HD PRO 141 1HD PRO 141 0.726 -17.944 3.714 1073 2HD PRO 141 2HD PRO 141 -0.218 -18.964 2.609 1074 H PHE 142 H PHE 142 0.782 -13.633 1.016 1075 HA PHE 142 HA PHE 142 2.231 -12.936 3.365 1076 1HB PHE 142 1HB PHE 142 3.872 -13.874 1.177 1077 2HB PHE 142 2HB PHE 142 4.201 -12.167 1.454 1078 HD1 PHE 142 HD1 PHE 142 4.501 -11.451 3.970 1079 HD2 PHE 142 HD2 PHE 142 4.922 -15.474 2.522 1080 HE1 PHE 142 HE1 PHE 142 5.842 -12.031 5.973 1081 HE2 PHE 142 HE2 PHE 142 6.265 -16.054 4.525 1082 HZ PHE 142 HZ PHE 142 6.725 -14.332 6.250 1083 H GLY 143 H GLY 143 3.533 -10.595 2.441 1084 1HA GLY 143 1HA GLY 143 2.448 -8.968 0.535 1085 2HA GLY 143 2HA GLY 143 1.187 -8.963 1.766 1086 H LEU 144 H LEU 144 1.327 -7.092 2.894 1087 HA LEU 144 HA LEU 144 4.054 -6.194 3.711 1088 1HB LEU 144 1HB LEU 144 2.546 -3.908 3.986 1089 2HB LEU 144 2HB LEU 144 3.653 -4.260 2.668 1090 HG LEU 144 HG LEU 144 0.764 -5.085 2.636 1091 1HD1 LEU 144 1HD1 LEU 144 1.359 -2.543 2.854 1092 2HD1 LEU 144 2HD1 LEU 144 1.856 -2.708 1.171 1093 3HD1 LEU 144 3HD1 LEU 144 0.190 -3.058 1.638 1094 1HD2 LEU 144 1HD2 LEU 144 3.107 -5.214 0.804 1095 2HD2 LEU 144 2HD2 LEU 144 1.682 -6.252 0.871 1096 3HD2 LEU 144 3HD2 LEU 144 1.598 -4.693 0.053 1097 H SER 145 H SER 145 4.125 -4.949 5.728 1098 HA SER 145 HA SER 145 2.543 -6.318 7.774 1099 1HB SER 145 1HB SER 145 4.914 -4.487 7.768 1100 2HB SER 145 2HB SER 145 4.008 -4.725 9.260 1101 HG SER 145 HG SER 145 5.241 -6.698 7.631 1102 H PHE 146 H PHE 146 2.302 -3.327 6.035 1103 HA PHE 146 HA PHE 146 -0.148 -2.526 7.184 1104 1HB PHE 146 1HB PHE 146 0.530 -0.634 8.657 1105 2HB PHE 146 2HB PHE 146 1.073 -2.169 9.320 1106 HD1 PHE 146 HD1 PHE 146 3.463 -2.809 9.222 1107 HD2 PHE 146 HD2 PHE 146 2.082 0.965 7.724 1108 HE1 PHE 146 HE1 PHE 146 5.800 -2.007 9.094 1109 HE2 PHE 146 HE2 PHE 146 4.415 1.787 7.607 1110 HZ PHE 146 HZ PHE 146 6.291 0.285 8.271 1111 H VAL 147 H VAL 147 -0.638 -0.164 6.707 1112 HA VAL 147 HA VAL 147 1.160 1.050 4.689 1113 HB VAL 147 HB VAL 147 -0.701 1.425 3.124 1114 1HG1 VAL 147 1HG1 VAL 147 0.674 -0.607 2.877 1115 2HG1 VAL 147 2HG1 VAL 147 -0.425 -1.483 3.943 1116 3HG1 VAL 147 3HG1 VAL 147 -0.989 -0.909 2.374 1117 1HG2 VAL 147 1HG2 VAL 147 -2.255 0.404 5.407 1118 2HG2 VAL 147 2HG2 VAL 147 -2.774 1.415 4.061 1119 3HG2 VAL 147 3HG2 VAL 147 -2.707 -0.337 3.872 1120 H ARG 148 H ARG 148 1.027 3.317 4.703 1121 HA ARG 148 HA ARG 148 -1.047 4.632 6.356 1122 1HB ARG 148 1HB ARG 148 1.905 5.011 6.908 1123 2HB ARG 148 2HB ARG 148 0.566 5.706 7.811 1124 1HG ARG 148 1HG ARG 148 -0.166 3.300 8.276 1125 2HG ARG 148 2HG ARG 148 1.419 2.820 7.669 1126 1HD ARG 148 1HD ARG 148 1.235 4.955 9.770 1127 2HD ARG 148 2HD ARG 148 1.083 3.262 10.240 1128 HE ARG 148 HE ARG 148 3.363 3.409 8.607 1129 1HH1 ARG 148 1HH1 ARG 148 2.271 4.762 11.642 1130 2HH1 ARG 148 2HH1 ARG 148 3.874 4.889 12.276 1131 1HH2 ARG 148 1HH2 ARG 148 5.419 3.592 9.468 1132 2HH2 ARG 148 2HH2 ARG 148 5.639 4.234 11.062 1133 H PHE 149 H PHE 149 -0.783 7.048 6.257 1134 HA PHE 149 HA PHE 149 0.772 8.114 3.982 1135 1HB PHE 149 1HB PHE 149 -2.249 8.363 4.153 1136 2HB PHE 149 2HB PHE 149 -1.221 9.170 2.970 1137 HD1 PHE 149 HD1 PHE 149 0.479 7.483 1.721 1138 HD2 PHE 149 HD2 PHE 149 -3.279 6.391 3.490 1139 HE1 PHE 149 HE1 PHE 149 0.372 5.477 0.264 1140 HE2 PHE 149 HE2 PHE 149 -3.384 4.390 2.029 1141 HZ PHE 149 HZ PHE 149 -1.557 3.932 0.419 1142 H HIS 150 H HIS 150 0.804 10.521 4.041 1143 HA HIS 150 HA HIS 150 -0.432 11.839 6.346 1144 1HB HIS 150 1HB HIS 150 2.332 12.610 6.541 1145 2HB HIS 150 2HB HIS 150 1.289 11.927 7.778 1146 HD1 HIS 150 HD1 HIS 150 1.576 9.461 8.346 1147 HD2 HIS 150 HD2 HIS 150 3.930 10.658 5.127 1148 HE1 HIS 150 HE1 HIS 150 3.187 7.563 7.894 1149 H SER 151 H SER 151 -1.069 13.771 5.672 1150 HA SER 151 HA SER 151 -0.080 14.877 3.146 1151 1HB SER 151 1HB SER 151 -1.755 16.770 4.426 1152 2HB SER 151 2HB SER 151 -2.196 15.666 3.131 1153 HG SER 151 HG SER 151 -2.599 15.486 5.888
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